Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001_Al__MO_049243498555_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.081654928624631
cohesive_energy=3.5802802150217286
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.9605194599604399e-19, 2.6648202865004994e-19, 3.15763379735256e-19, 3.5697136276173596e-19, 3.9336160064977796e-19, 4.2421631826734995e-19, 4.49468224195824e-19, 4.70064204825894e-19, 4.87034459733222e-19, 5.01172066351638e-19, 5.130570126226499e-19, 5.2313470365051e-19, 5.31756016118064e-19, 5.39207739642798e-19, 5.457109746002039e-19, 5.51425938653682e-19, 5.564583754610759e-19, 5.60859554674674e-19, 5.64642293707548e-19, 5.6780659255969795e-19, 5.70323612051712e-19, 5.721372760014e-19, 5.732219495826179e-19, 5.735792349719999e-19, 5.73196314756474e-19, 5.71973853984732e-19, 5.698061089989299e-19, 5.665921426711259e-19, 5.62210189577136e-19, 5.56509645113364e-19, 5.49344711206116e-19, 5.405391484256519e-19, 5.29876662926382e-19, 5.1707847597399e-19, 5.0177448476602195e-19, 4.834519927795979e-19, 4.6141084882566e-19, 4.347089730434159e-19, 4.0213672207419596e-19, 3.62167221585798e-19, 3.1287465526415395e-19, 2.51748412323786e-19, 1.75411104420222e-19, 7.91989555895514e-20]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 2.2204e-16 eV

========================================
theta = 0.0
========================================

Energy: 0.01083083928926621
Energy: 0.011145005102033093
Energy: 0.011191285836526137
Energy: 0.012312109221189079
Energy: 0.16277205972553918
Energy: 0.011178838908080451
Energy: 0.011145005101049103
Energy: 0.056244784077248276
Energy: 0.05629879628101603
Energy: 0.05644693699317078
Energy: 0.056356586040987526
Energy: 0.05631325489786984
Energy: 0.011191285837728793
Energy: 0.05629879628317534
Energy: 0.056335145705714025
Energy: 0.011272406334866973
Energy: 0.05617459658617424
Energy: 0.05723363992924324
Energy: 0.012312109221435077
Energy: 0.05644693699317078
Energy: 0.011272406332707659
Energy: 0.011030340340616115
Energy: 0.056346352428363715
Energy: 0.011104273178456624
Energy: 0.16277205972720651
Energy: 0.056356586041452196
Energy: 0.05617459658688491
Energy: 0.05634635242787171
Energy: 0.05618323962690789
Energy: 0.05624012857608023
Energy: 0.01117883890974777
Energy: 0.056313254897623836
Energy: 0.05723363992924324
Energy: 0.01110427317941328
Energy: 0.05624012857561557
Energy: 0.011227426265243298

minimum gb energy = 0.01083083928926621 eV
minimum distance =  2.8790232109586 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.5072198562804273
Energy: 0.359549784715748
Energy: 0.3802910879624319
Energy: 0.37160900167500194
Energy: 0.3675206361518653
Energy: 0.377192000121144
Energy: 0.4810466378823035
Energy: 0.3717351809986369
Energy: 0.3614168980224255
Energy: 0.3745841513649255
Energy: 0.3766999991130125
Energy: 0.36172490659336637
Energy: 0.4694576578674884
Energy: 0.3580276692670362
Energy: 0.35673205921753975
Energy: 0.3628444371440413
Energy: 0.3620364198961131
Energy: 0.35564188769469146
Energy: 0.508713901645657
Energy: 0.35750367324936416
Energy: 0.35530061477074293
Energy: 0.3557757098191204
Energy: 0.3577136110769559
Energy: 0.3555653804938833
Energy: 0.4684671611781241
Energy: 0.3692052571481884
Energy: 0.3691672250017543
Energy: 0.36646808991481766
Energy: 0.3701403516732212
Energy: 0.3630137784646495
Energy: 0.4602366878298393
Energy: 0.3624824634593121
Energy: 0.3620594412605612
Energy: 0.3614229458819192
Energy: 0.3647121068369007
Energy: 0.3627670485266027
Energy: 0.46005340809819056
Energy: 0.3628401160231572
Energy: 0.3631175649606699
Energy: 0.3615977921007566
Energy: 0.3619614050240749
Energy: 0.36252779933641754
Energy: 0.3866972159193984
Energy: 0.36384232796909055
Energy: 0.36278408722270367
Energy: 0.37463355481490695
Energy: 0.36088514582040737
Energy: 0.3620739176894334
Energy: 0.389472486973984
Energy: 0.36241609303341743
Energy: 0.3632276211277166
Energy: 0.36437428608230665
Energy: 0.3616473072890095
Energy: 0.36177402285578425
Energy: 0.3874372746353397
Energy: 0.3688486955749516
Energy: 0.3670987107613529
Energy: 0.36915031082725086
Energy: 0.36631605682669477
Energy: 0.3625830536733172
Energy: 0.41926912754464185
Energy: 0.35631313260789516
Energy: 0.35615970231489036
Energy: 0.36828936873499946
Energy: 0.3563478283721329
Energy: 0.35304033233853055
Energy: 0.3819665887537214
Energy: 0.35160211854849377
Energy: 0.3565643106779177
Energy: 0.3585876601383591
Energy: 0.36241326231372967
Energy: 0.3568979338783071
Energy: 0.37912265765192277
Energy: 0.3576751199698769
Energy: 0.36275201164314796
Energy: 0.3716100529162805
Energy: 0.3626324601397231
Energy: 0.3663265635394994
Energy: 0.41041831969168
Energy: 0.3555406525770138
Energy: 0.35547271333650754
Energy: 0.3676395810019537
Energy: 0.3557916398560731
Energy: 0.3504344461163048
Energy: 0.3817692466221248
Energy: 0.36790917596476697
Energy: 0.3670534586133673
Energy: 0.37936299706206356
Energy: 0.36844446979347556
Energy: 0.3657983627046151
Energy: 0.3818270970793047
Energy: 0.3557373582178143
Energy: 0.355857529806572
Energy: 0.3565855706298273
Energy: 0.35178757102440195
Energy: 0.3567791604414631
Energy: 0.4195804927608923
Energy: 0.36050113001465783
Energy: 0.3618972765155603
Energy: 0.3502898941321931
Energy: 0.3606471052108612
Energy: 0.3501207562479039
Energy: 0.42083628269948503
Energy: 0.3641079909764935
Energy: 0.3626285683308386
Energy: 0.36335076920520987
Energy: 0.36495593433862494
Energy: 0.36248567300127815
Energy: 0.4203894250143241
Energy: 0.3641652196580566
Energy: 0.3621605409697204
Energy: 0.36394576563713055
Energy: 0.3661000202659884
Energy: 0.3622840249693205
Energy: 0.42123997308319205
Energy: 0.36461865358192175
Energy: 0.3625925780974159
Energy: 0.3659343169716857
Energy: 0.36571908222414046
Energy: 0.3618994123313984
Energy: 0.4838667288016423
Energy: 0.3462883251363866
Energy: 0.35640800930224265
Energy: 0.35636896994583706
Energy: 0.3806539503143909
Energy: 0.35657128044778114
Energy: 0.4834678211568323
Energy: 0.35825195170374324
Energy: 0.3567864927743751
Energy: 0.3538791780961347
Energy: 0.35589671085533464
Energy: 0.3558942850604168
Energy: 0.4811533209022996
Energy: 0.3777507194493616
Energy: 0.37104278028205673
Energy: 0.3675679609053823
Energy: 0.37772103948729097
Energy: 0.3678088074409851

minimum gb energy = 0.3462883251363866 eV
minimum distance =  2.61168499118535 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 0.6326163189058488
Energy: 0.3772433650858876
Energy: 0.3627642105735858
Energy: 0.37963664312239115
Energy: 0.35972742317317685
Energy: 0.37584285641554427
Energy: 0.44739712272971455
Energy: 0.3684111720387341
Energy: 0.3577577619668179
Energy: 0.3676452273014277
Energy: 0.3663515113961238
Energy: 0.3611384137466022
Energy: 0.4610383987452471
Energy: 0.37555237496415333
Energy: 0.37807335011335613
Energy: 0.37758537128615566
Energy: 0.38076945994681155
Energy: 0.3746518169474989
Energy: 0.4901250619065098
Energy: 0.37666740484509204
Energy: 0.3745512037061362
Energy: 0.35965657723857014
Energy: 0.36272955614535085
Energy: 0.36195816436949735
Energy: 0.4611406807935633
Energy: 0.3889987729373593
Energy: 0.3829710032106738
Energy: 0.3759022948505996
Energy: 0.3895086173458541
Energy: 0.3600148149273052
Energy: 0.4924126886357561
Energy: 0.3878296210640061
Energy: 0.3874542622589835
Energy: 0.3873744861528312
Energy: 0.39094421897612497
Energy: 0.3888444690863652
Energy: 0.4897833139226336
Energy: 0.38600605395023857
Energy: 0.3884169629461942
Energy: 0.3903062907909065
Energy: 0.3809994800980551
Energy: 0.38686166618620155
Energy: 0.4613378366321998
Energy: 0.3767704846378191
Energy: 0.3769245869874148
Energy: 0.3975069623863401
Energy: 0.376407248139636
Energy: 0.3787570671353458
Energy: 0.4170104946665903
Energy: 0.37468772095535874
Energy: 0.39093360472189115
Energy: 0.3971487122358053
Energy: 0.3738910093994676
Energy: 0.38944439402416214
Energy: 0.4174219607749418
Energy: 0.39500789358621147
Energy: 0.3938866079105791
Energy: 0.3979700977655462
Energy: 0.39680729562760025
Energy: 0.3949222771924919
Energy: 0.43335239689810895
Energy: 0.34712759022473433
Energy: 0.3473512829969033
Energy: 0.4030342927556059
Energy: 0.3468278139460577
Energy: 0.3470808851427809
Energy: 0.39874987378340104
Energy: 0.3606346075539348
Energy: 0.37597203714225763
Energy: 0.37697504974831436
Energy: 0.3605093010668758
Energy: 0.370213635594709
Energy: 0.3975122767885481
Energy: 0.3891759099787816
Energy: 0.39063415617795677
Energy: 0.3948900339718166
Energy: 0.3900129535209133
Energy: 0.392707284285015
Energy: 0.41160294407697634
Energy: 0.3619965261019718
Energy: 0.36180695668495955
Energy: 0.3926812795135938
Energy: 0.36228201273019767
Energy: 0.3766317331458928
Energy: 0.425495881643885
Energy: 0.3958722851717199
Energy: 0.3955474101750813
Energy: 0.40876414684977197
Energy: 0.3975301872869288
Energy: 0.4049493462714615
Energy: 0.42282020858996505
Energy: 0.3849604651390128
Energy: 0.3860538923306007
Energy: 0.3854530958471514
Energy: 0.38246244481436426
Energy: 0.3861742024244033
Energy: 0.43893926026400937
Energy: 0.38232725991752536
Energy: 0.3852045204052942
Energy: 0.3770631733711574
Energy: 0.3838513047469879
Energy: 0.38523274188365053
Energy: 0.43391887539968704
Energy: 0.3910418898003188
Energy: 0.3905235677786567
Energy: 0.3739969118011217
Energy: 0.39087752133969333
Energy: 0.3784438168078074
Energy: 0.4365358339982803
Energy: 0.3978019341803473
Energy: 0.38998119674099546
Energy: 0.37428420995658346
Energy: 0.399675044510246
Energy: 0.39074502039135994
Energy: 0.4389599067056333
Energy: 0.39124749162007083
Energy: 0.38555480130747016
Energy: 0.3929900924496137
Energy: 0.39257922681842006
Energy: 0.3846345173110971
Energy: 0.5104420856991778
Energy: 0.37234514959655185
Energy: 0.3313294771861874
Energy: 0.3316332798281713
Energy: 0.39342410415983053
Energy: 0.3312959513664183
Energy: 0.39421716938842327
Energy: 0.3647112121304725
Energy: 0.3654033202340883
Energy: 0.34410056599265576
Energy: 0.3675107682366564
Energy: 0.3607786643302839
Energy: 0.4386085197227917
Energy: 0.39926110411244614
Energy: 0.39673606527966393
Energy: 0.38972503567336825
Energy: 0.3949708021596203
Energy: 0.3713988941467942
Energy: 0.515781006297661
Energy: 0.37477630300288206
Energy: 0.3767997695972983
Energy: 0.3625847859705948
Energy: 0.38390448417564055
Energy: 0.38155526962288727
Energy: 0.4382727538306692
Energy: 0.4049148547606371
Energy: 0.40335126442595
Energy: 0.3913382418915992
Energy: 0.4046415712757738
Energy: 0.3923088745119487
Energy: 0.49579603765446234
Energy: 0.3839695461377257
Energy: 0.38526864676473926
Energy: 0.38365588161466485
Energy: 0.37988186822285896
Energy: 0.3844137924592261
Energy: 0.49299038667982875
Energy: 0.3857139584210796
Energy: 0.38539911329025284
Energy: 0.3860969220402507
Energy: 0.3935012144402772
Energy: 0.38516504435571197
Energy: 0.4632728363008213
Energy: 0.3766102491104094
Energy: 0.3784784244285337
Energy: 0.41064676096180275
Energy: 0.37650321460076
Energy: 0.3928860828503387
Energy: 0.4084526276418295
Energy: 0.37453166506625246
Energy: 0.37839046722465147
Energy: 0.3912629154082331
Energy: 0.37408284811939135
Energy: 0.38939223056227956
Energy: 0.4124458092478863
Energy: 0.39438225969382307
Energy: 0.3862356027499272
Energy: 0.3958859932411618
Energy: 0.3951073512711204
Energy: 0.3886216146343737
Energy: 0.43303764136876544
Energy: 0.34730149730996673
Energy: 0.3472820680631736
Energy: 0.37961022091330304
Energy: 0.34901909123287983
Energy: 0.34795310663133644
Energy: 0.40730476393334025
Energy: 0.34764593379037123
Energy: 0.34765639484165606
Energy: 0.3829135623645826
Energy: 0.34742494748807806
Energy: 0.37490399439469
Energy: 0.4057732086482725
Energy: 0.39016869375874624
Energy: 0.3913936865172512
Energy: 0.4014689341583972
Energy: 0.3948839470671451
Energy: 0.3924665152260363
Energy: 0.40796008999202055
Energy: 0.3619944711168593
Energy: 0.38049798952629865
Energy: 0.38271180569529667
Energy: 0.3624338431240039
Energy: 0.3810118717001701
Energy: 0.4209030821095563
Energy: 0.39840970637073375
Energy: 0.39590218360789114
Energy: 0.40221683864757823
Energy: 0.3905514019496792
Energy: 0.40361466916939676
Energy: 0.41932496614984344
Energy: 0.3827600829642793
Energy: 0.3823663312216805
Energy: 0.3813745708678741
Energy: 0.3818996367635432
Energy: 0.3831625653812357
Energy: 0.4205958537231286
Energy: 0.3817657906179189
Energy: 0.3559703384851713
Energy: 0.36494221812397065
Energy: 0.36981873748582544
Energy: 0.36531109957692776
Energy: 0.4374568198494079
Energy: 0.4014632882161846
Energy: 0.3705506396550176
Energy: 0.3739979270010033
Energy: 0.3781721652262915
Energy: 0.39375523957049763
Energy: 0.4332161607191116
Energy: 0.3745055559949383
Energy: 0.37498446687641357
Energy: 0.3756723061160323
Energy: 0.3737293090729292
Energy: 0.37843169870452464
Energy: 0.461516450035969
Energy: 0.38578766174517626
Energy: 0.3695138623923342
Energy: 0.38453496652343006
Energy: 0.38651484776768097
Energy: 0.36377170445018825
Energy: 0.5053712633313353
Energy: 0.3680703126257955
Energy: 0.34313924811444163
Energy: 0.335776666776529
Energy: 0.3695269793266584
Energy: 0.35677261136273947

minimum gb energy = 0.3312959513664183 eV
minimum distance =  2.58590883991755 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.5313558592760104
Energy: 0.3305817324894165
Energy: 0.33042127813369676
Energy: 0.3589401448056109
Energy: 0.5632369872662261
Energy: 0.36142382457218164
Energy: 0.4362595088579222
Energy: 0.35109768641881167
Energy: 0.35120710040539976
Energy: 0.3610287256264272
Energy: 0.3523617029456891
Energy: 0.3476943683554644
Energy: 0.4731911695637164
Energy: 0.35189728671354
Energy: 0.3452034769486727
Energy: 0.348048665250484
Energy: 0.35514021634471515
Energy: 0.34468405916953837
Energy: 0.4726090769735923
Energy: 0.34431377099025623
Energy: 0.3439452523561946
Energy: 0.34689404475470526
Energy: 0.34452358847511283
Energy: 0.34671034856148236
Energy: 0.410180382398485
Energy: 0.36171201408815
Energy: 0.36116424249493917
Energy: 0.3612467928865926
Energy: 0.3609024085791603
Energy: 0.3609345740623569
Energy: 0.4125636419880457
Energy: 0.3632694743360762
Energy: 0.36151186104997246
Energy: 0.3624910900085952
Energy: 0.3608018673764986
Energy: 0.3606627627173428
Energy: 0.4122944854494732
Energy: 0.3616333872015775
Energy: 0.3608935794625815
Energy: 0.3607653983963513
Energy: 0.3653187963538811
Energy: 0.3604741638136384
Energy: 0.4295236878563524
Energy: 0.3363476598546867
Energy: 0.3362290974163685
Energy: 0.34402165278669494
Energy: 0.3370376440263469
Energy: 0.3362662781886165
Energy: 0.37522125684550234
Energy: 0.3357768871810402
Energy: 0.3370148731209013
Energy: 0.3547631014703728
Energy: 0.33603820755664693
Energy: 0.34452511237868433
Energy: 0.37608303083239064
Energy: 0.3501584892564455
Energy: 0.3322799328648112
Energy: 0.35189171583314954
Energy: 0.37559827931550976
Energy: 0.3454877378884661
Energy: 0.37512488245649867
Energy: 0.33181033490595097
Energy: 0.3432023478916994
Energy: 0.3621628469613622
Energy: 0.34663312112778405
Energy: 0.34348968087673387
Energy: 0.3784369482135995
Energy: 0.3612825156881813
Energy: 0.33547391862745324
Energy: 0.3554710243892659
Energy: 0.3603400406383573
Energy: 0.34134112458991234
Energy: 0.37777423907374735
Energy: 0.34771262237072187
Energy: 0.3479662606912692
Energy: 0.3550881597276435
Energy: 0.34795056444549527
Energy: 0.34775567029273147
Energy: 0.3787275845570234
Energy: 0.34848042206864127
Energy: 0.3482046027838739
Energy: 0.35584026909171396
Energy: 0.3482885528045914
Energy: 0.3482011576102986
Energy: 0.4385103642689806
Energy: 0.3479589213772479
Energy: 0.34742825056225674
Energy: 0.3551414137177227
Energy: 0.3524757492317455
Energy: 0.34733711125027783
Energy: 0.4350975056464607
Energy: 0.35555244927502566
Energy: 0.34773572562394606
Energy: 0.3554539729452065
Energy: 0.3555886402060197
Energy: 0.3552100235302859
Energy: 0.44284685151960007
Energy: 0.35708101984478685
Energy: 0.35560220256624314
Energy: 0.3737420872727471
Energy: 0.3560284204232404
Energy: 0.34776807593847897
Energy: 0.5089966968184224
Energy: 0.3631302872789507
Energy: 0.3475735898017994
Energy: 0.33577396959800115
Energy: 0.3630476151612841
Energy: 0.35267421990796716

minimum gb energy = 0.33042127813369676 eV
minimum distance =  2.53539494872066 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.4404770667966864
Energy: 0.31331398756899553
Energy: 0.3123864822788067
Energy: 0.3140291981959743
Energy: 0.33720829565055205
Energy: 0.3124936052319615
Energy: 0.4362018862382918
Energy: 0.3372512614283578
Energy: 0.3192242323403395
Energy: 0.31466436470519443
Energy: 0.3380179352679482
Energy: 0.3219387594530911
Energy: 0.45762425426661857
Energy: 0.3385825182836713
Energy: 0.33624004239011623
Energy: 0.30221097243453243
Energy: 0.3381799365637198
Energy: 0.3350631350304301
Energy: 0.3831008217370037
Energy: 0.33820861200916996
Energy: 0.3363558440383203
Energy: 0.3111061149640634
Energy: 0.3360133319901885
Energy: 0.3141671897303917
Energy: 0.4576817866893599
Energy: 0.33526198683930875
Energy: 0.33449165789598456
Energy: 0.3339852698492707
Energy: 0.3341303967132254
Energy: 0.34430518965696455
Energy: 0.38725030366849594
Energy: 0.289519994287491
Energy: 0.3143878437554085
Energy: 0.33399585961142036
Energy: 0.2889572567214628
Energy: 0.33150951951799873
Energy: 0.3882494915609609
Energy: 0.33351265434063415
Energy: 0.3331017733692541
Energy: 0.33363380903623663
Energy: 0.31329348712938376
Energy: 0.3340339915343235
Energy: 0.39002680968467435
Energy: 0.2889864908159309
Energy: 0.28912843048883297
Energy: 0.3905859449883647
Energy: 0.28906808490511765
Energy: 0.2891048184483919
Energy: 0.33888674618892084
Energy: 0.2888790121273066
Energy: 0.28885391062942484
Energy: 0.33835899991783175
Energy: 0.2888637768890788
Energy: 0.28881309099849334
Energy: 0.3384360254103899
Energy: 0.3023031175076676
Energy: 0.32047702730406724
Energy: 0.33791179499152746
Energy: 0.3338902176182434
Energy: 0.33730515076638157
Energy: 0.33816221057795726
Energy: 0.3108767636482067
Energy: 0.3109869127714554
Energy: 0.33848188814501684
Energy: 0.3109839283736597
Energy: 0.32132865950966283
Energy: 0.38666476291917334
Energy: 0.3338250812451686
Energy: 0.35072892163500446
Energy: 0.33723755946129086
Energy: 0.3340121033786568
Energy: 0.3321145320415305
Energy: 0.32528764004775196
Energy: 0.33369583885437415
Energy: 0.3144026171158599
Energy: 0.2887819552930802
Energy: 0.3340667577355943
Energy: 0.31473382885628765
Energy: 0.38670917539607585
Energy: 0.33405294397068547
Energy: 0.3342772697237031
Energy: 0.3378123377851653
Energy: 0.3335575193830574
Energy: 0.33337184735322223
Energy: 0.436329183209955
Energy: 0.3202530790934658
Energy: 0.31946256234557013
Energy: 0.28895475922918307
Energy: 0.3205935836863286
Energy: 0.2886990940331318
Energy: 0.439688290567553
Energy: 0.3211854569140362
Energy: 0.28899684004863735
Energy: 0.2896550051195069
Energy: 0.3393794972020765
Energy: 0.2891545721646971
Energy: 0.45834738913447715
Energy: 0.3377038926766343
Energy: 0.3373168506357735
Energy: 0.3338212170295769
Energy: 0.3378083957624249
Energy: 0.3216353771001065
Energy: 0.382953610493955
Energy: 0.3366821573470453
Energy: 0.33626480812760096
Energy: 0.31103714113780123
Energy: 0.33754090882488297
Energy: 0.3210029637235421
Energy: 0.38452087263844514
Energy: 0.3373595863443484
Energy: 0.33669053839174085
Energy: 0.311123001697162
Energy: 0.3363638800756532
Energy: 0.31870278388278755
Energy: 0.3868312332521008
Energy: 0.28930461646840205
Energy: 0.3322868475683569
Energy: 0.33364843203353794
Energy: 0.2888837564984239
Energy: 0.3294541177444462
Energy: 0.38605311135819287
Energy: 0.31543756631374176
Energy: 0.31485822107235517
Energy: 0.3341530746087673
Energy: 0.3344483615090051
Energy: 0.33329186927699306
Energy: 0.3866981769561901
Energy: 0.349112931385106
Energy: 0.3341001204497674
Energy: 0.3338148296165709
Energy: 0.33243987755615906
Energy: 0.3329663056260921
Energy: 0.39110635290657564
Energy: 0.28901997817751485
Energy: 0.2888712960265678
Energy: 0.3902869581281949
Energy: 0.288891380162437
Energy: 0.3122251552577636
Energy: 0.3391547425121333
Energy: 0.32147759633053147
Energy: 0.3205067531503482
Energy: 0.33871386656944585
Energy: 0.28904747321163776
Energy: 0.32055362283620087
Energy: 0.33896572916589573
Energy: 0.3021690402408072
Energy: 0.3198233399750704
Energy: 0.33839390473743236
Energy: 0.3019843592417324
Energy: 0.33582414133239386
Energy: 0.3912116160205997
Energy: 0.3111225331940484
Energy: 0.31201955047668833
Energy: 0.39089812125862633
Energy: 0.3110850656196407
Energy: 0.33324012134134334
Energy: 0.38691801685948884
Energy: 0.3342161357733767
Energy: 0.33302783525052326
Energy: 0.33402642470108607
Energy: 0.333808815484078
Energy: 0.33329001668788655
Energy: 0.3253551797963384
Energy: 0.3339092533836151
Energy: 0.3329817694237515
Energy: 0.2887916711706052
Energy: 0.334367279893029
Energy: 0.328343993548478
Energy: 0.38730542982525595
Energy: 0.334452941603653
Energy: 0.3344458035991061
Energy: 0.31369810692216743
Energy: 0.3336126511305879
Energy: 0.3335312690168593
Energy: 0.4378393714692375
Energy: 0.32166858087920236
Energy: 0.28899239632241236
Energy: 0.28951023454166547
Energy: 0.32187788985879917
Energy: 0.2890801013968255

minimum gb energy = 0.2886990940331318 eV
minimum distance =  2.72812585602053 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.3862440695703708
Energy: 0.36368878284185957
Energy: 0.36036914873994064
Energy: 0.3027708056218194
Energy: 0.5957341884796258
Energy: 0.36027121952891267
Energy: 0.32079283955845783
Energy: 0.3323770894428867
Energy: 0.31624889121298566
Energy: 0.3167953362373775
Energy: 0.3324133857033237
Energy: 0.3162842586977091
Energy: 0.3556607538800222
Energy: 0.3305570871437774
Energy: 0.3294643529789768
Energy: 0.3161256165417926
Energy: 0.32906812254886686
Energy: 0.31727194359992605
Energy: 0.3199426464355775
Energy: 0.3293353862924978
Energy: 0.33007635793839435
Energy: 0.3159106931159534
Energy: 0.3289830625209752
Energy: 0.3204350958470689
Energy: 0.3950711375611531
Energy: 0.2917428758945567
Energy: 0.3175579304498302
Energy: 0.32933724796824204
Energy: 0.2923808921566131
Energy: 0.31703626070544255
Energy: 0.34333178429222244
Energy: 0.2916608028810981
Energy: 0.2913320979828844
Energy: 0.32930130958703185
Energy: 0.2923117765366196
Energy: 0.2913679195236432
Energy: 0.34732095791192097
Energy: 0.3173647580378887
Energy: 0.3169973293199219
Energy: 0.33249917619172936
Energy: 0.3164525190305393
Energy: 0.3168758111690975
Energy: 0.34704531614404927
Energy: 0.3189213280609859
Energy: 0.31880917098272815
Energy: 0.3468926378721636
Energy: 0.3203195026458795
Energy: 0.3081873351381187
Energy: 0.35675632325650286
Energy: 0.3169204027462727
Energy: 0.3282971722315832
Energy: 0.33118013524038054
Energy: 0.31446732688734425
Energy: 0.31630612368690975
Energy: 0.3573933947305661
Energy: 0.3098095864649534
Energy: 0.30890746898540067
Energy: 0.3097059354774246
Energy: 0.3103997527237372
Energy: 0.3092220528366758
Energy: 0.35633427575764604
Energy: 0.3094413745132556
Energy: 0.31056901036500034
Energy: 0.31086063575884126
Energy: 0.3096177403283428
Energy: 0.3101381943397143
Energy: 0.39543282498140736
Energy: 0.31700946993866735
Energy: 0.3176028064226
Energy: 0.31669283411959653
Energy: 0.3118097552368221
Energy: 0.31605645747058453

minimum gb energy = 0.2913320979828844 eV
minimum distance =  2.63158128938221 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.6644187635652463
Energy: 0.3149200167292336
Energy: 0.2997680693450541
Energy: 0.32284551519376614
Energy: 0.29959757344691906
Energy: 0.3008120460946548
Energy: 0.3228745495631308
Energy: 0.2995159243761482
Energy: 0.29854410787029423
Energy: 0.3005880155373587
Energy: 0.301492647540016
Energy: 0.29818370826072615
Energy: 0.312489648911512
Energy: 0.2997190301325068
Energy: 0.29632737969361217
Energy: 0.3104825571357625
Energy: 0.297734488775128
Energy: 0.2922443075375987
Energy: 0.31412456910905384
Energy: 0.2900789032777417
Energy: 0.2901600540719402
Energy: 0.3043674877258942
Energy: 0.3083319439726208
Energy: 0.30499580850248614
Energy: 0.3384721737367297
Energy: 0.30745047351030286
Energy: 0.29216028655418247
Energy: 0.31484626098919943
Energy: 0.30712915432343285
Energy: 0.2908859308649654
Energy: 0.3171214114616061
Energy: 0.29774252204723556
Energy: 0.2933325547346216
Energy: 0.3174046811211742
Energy: 0.29435786668363056
Energy: 0.30375681688271994
Energy: 0.3148724637327901
Energy: 0.29093160314626193
Energy: 0.29046056237892065
Energy: 0.31465136663124743
Energy: 0.30085843956884756
Energy: 0.31074777415937055
Energy: 0.30914877606576846
Energy: 0.30440996723522445
Energy: 0.3068731086046657
Energy: 0.30851155373691047
Energy: 0.3031824034089269
Energy: 0.2975933742984676
Energy: 0.30317779415451007
Energy: 0.3103024717602812
Energy: 0.29070520665605104
Energy: 0.323896057843536
Energy: 0.313068635611774
Energy: 0.3070784197428846
Energy: 0.29387908622111525
Energy: 0.30388752893221044
Energy: 0.3098042381728509
Energy: 0.293871293546609
Energy: 0.3167759608528339
Energy: 0.3103891252417662
Energy: 0.2938795311105003
Energy: 0.3142271111134744
Energy: 0.309427055061237
Energy: 0.3051391330923222
Energy: 0.3155687011661229
Energy: 0.3028474362200591
Energy: 0.3038286206814105
Energy: 0.31477953104510303
Energy: 0.3140197778553311
Energy: 0.29970606059872223
Energy: 0.3151180068982351
Energy: 0.2905918209234873
Energy: 0.4012248001816524
Energy: 0.3147089749320235
Energy: 0.3249011473213965
Energy: 0.3107534044308776
Energy: 0.3113379411923729
Energy: 0.31793546509486176
Energy: 0.342460702499066
Energy: 0.314160659148883
Energy: 0.29121678105374066
Energy: 0.3014458624168416
Energy: 0.31525473420901495
Energy: 0.29088896883506343
Energy: 0.30854037703935366
Energy: 0.31357093574332484
Energy: 0.31010839684412056
Energy: 0.3005912196294889
Energy: 0.3150419197725656
Energy: 0.30833416032092165
Energy: 0.3079370629548354
Energy: 0.29490248788195367
Energy: 0.29429161233801104
Energy: 0.2992710118042017
Energy: 0.31358482238419444
Energy: 0.29886664219471537
Energy: 0.3069050305257315
Energy: 0.2987704746579017
Energy: 0.2898751462730479
Energy: 0.2980807202265946
Energy: 0.2985680836855949
Energy: 0.3008576554524808
Energy: 0.3331318907207261
Energy: 0.3077477129580804
Energy: 0.2905156581555087
Energy: 0.2979567964527446
Energy: 0.30913034927558347
Energy: 0.31800876602060374
Energy: 0.3123684162564494
Energy: 0.30257832199016726
Energy: 0.30344152533062463
Energy: 0.30165963611857444
Energy: 0.3011632492694354
Energy: 0.29612913153344883
Energy: 0.3127095145571893
Energy: 0.2963684661566903
Energy: 0.2912520527053026
Energy: 0.295250628177126
Energy: 0.2950385839155087
Energy: 0.29025256360701557
Energy: 0.31246183943013317
Energy: 0.2973698282772115
Energy: 0.29966320091086257
Energy: 0.31200723297828037
Energy: 0.3011377109951188
Energy: 0.29620407661074205
Energy: 0.3208854097064047
Energy: 0.30318123348408454
Energy: 0.31308710294973535
Energy: 0.3174310939857302
Energy: 0.29812297218148814
Energy: 0.30060972229458377
Energy: 0.31822436858579145
Energy: 0.2987154031551759
Energy: 0.29988322994815614
Energy: 0.30678527159633534
Energy: 0.2994722722473288
Energy: 0.2865690873061915
Energy: 0.3121974311998883
Energy: 0.3018436079488325
Energy: 0.2978334251820849
Energy: 0.3121783339452326
Energy: 0.2991753155872681
Energy: 0.2976757024133202
Energy: 0.408903574172392
Energy: 0.2975359133085181
Energy: 0.30474215541491945
Energy: 0.31716656294367845
Energy: 0.29923660006041647
Energy: 0.2962683800552771
Energy: 0.3117608929858554
Energy: 0.29465989751206895
Energy: 0.2908545483084638
Energy: 0.31583217361654853
Energy: 0.29980883228872485
Energy: 0.2945080896105639
Energy: 0.3076049223889575
Energy: 0.2990097119004967
Energy: 0.2949268937284591
Energy: 0.30776562409771147
Energy: 0.3174602025270752
Energy: 0.2786438226220686
Energy: 0.316436308765937
Energy: 0.29069768879407665
Energy: 0.29055506875084713
Energy: 0.3151349134168842
Energy: 0.29989717997022536
Energy: 0.30499608408053547
Energy: 0.3153178984545692
Energy: 0.30616266488837224
Energy: 0.2891141453152366
Energy: 0.3154154342455981
Energy: 0.31006946517381767
Energy: 0.31120006951862056
Energy: 0.3034598620861298
Energy: 0.3043750787819179
Energy: 0.2975866887518428
Energy: 0.3137419805330682
Energy: 0.30353142438598163
Energy: 0.3090623938413922
Energy: 0.2941235331968226
Energy: 0.30363153931775266
Energy: 0.3073322579540621
Energy: 0.3047375471119907
Energy: 0.31055570797250226
Energy: 0.2887981091458346
Energy: 0.39079804835087006
Energy: 0.3146580849384037
Energy: 0.29831380196314333
Energy: 0.2935072521553747
Energy: 0.3144531033463006
Energy: 0.3004132131370596
Energy: 0.3742845178976418
Energy: 0.3146809543500973
Energy: 0.31407035356678514
Energy: 0.3214333977837586
Energy: 0.3151335510468221
Energy: 0.2905653947343345
Energy: 0.30986952849713734
Energy: 0.3144816620871538
Energy: 0.3146284123927444
Energy: 0.3088786327965656
Energy: 0.3143788256495705
Energy: 0.3031312893771357
Energy: 0.30607945548359083
Energy: 0.31472726477441015
Energy: 0.30782477415974363
Energy: 0.308693754966046
Energy: 0.31509313684675055
Energy: 0.29080298971242463
Energy: 0.30706703414874176
Energy: 0.3115349428263955
Energy: 0.29915743233838166
Energy: 0.3136074046516932
Energy: 0.31276232976927754
Energy: 0.2851216347057487
Energy: 0.30718688927455085
Energy: 0.299500570006257
Energy: 0.2954028903036736
Energy: 0.2986967847487462
Energy: 0.31053451530380605
Energy: 0.2976367719238911
Energy: 0.30706420655341077
Energy: 0.29611968693659735
Energy: 0.29729935388093814
Energy: 0.2995260521763802
Energy: 0.3009443591996226
Energy: 0.2867125014235966
Energy: 0.3005887573836145
Energy: 0.29651130985699775
Energy: 0.3130802040750004
Energy: 0.30066493111951076
Energy: 0.31169033689128317
Energy: 0.3052452807929988
Energy: 0.3118116134054463
Energy: 0.29651925323666223
Energy: 0.29794943683493263
Energy: 0.29920157332846803
Energy: 0.29916517206645754
Energy: 0.2963458388765871
Energy: 0.3122320746087514
Energy: 0.2923455588305404
Energy: 0.29801495217106394
Energy: 0.29523950619653166
Energy: 0.29755547538083327
Energy: 0.2962644360428635
Energy: 0.311755783492111
Energy: 0.29586812244220106
Energy: 0.29766594945521
Energy: 0.29940522435633765
Energy: 0.2962328839314774
Energy: 0.29003170638019027
Energy: 0.3182202541481593
Energy: 0.29826911131425143
Energy: 0.29167615433495675
Energy: 0.30699665220328815
Energy: 0.2991065619062216
Energy: 0.28648951138310175

minimum gb energy = 0.2786438226220686 eV
minimum distance =  2.63878177528133 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.1370554935291
Energy: 0.14272659872480306
Energy: 0.1658844424873589
Energy: 0.13856326972937594
Energy: 0.15925340104903607
Energy: 0.1377545345678213
Energy: 0.13763430526092285
Energy: 0.1451955706292426
Energy: 0.1452177602112333
Energy: 0.16024713150994016
Energy: 0.1607452419018674
Energy: 0.15559589115993436
Energy: 0.18390490148660676
Energy: 0.16104895069889646
Energy: 0.14488031854799946
Energy: 0.16051533840634483
Energy: 0.1595302400879338
Energy: 0.14545215752089058
Energy: 0.18395322672778308
Energy: 0.16136299534864565
Energy: 0.1448537493747749
Energy: 0.15975222619217946
Energy: 0.1612080815783272
Energy: 0.1459058913070164
Energy: 0.18382321481443947
Energy: 0.1392836199184236
Energy: 0.15353393148360395
Energy: 0.1610729552049073
Energy: 0.13784325417487603
Energy: 0.14657950568347036
Energy: 0.1595360732333307
Energy: 0.13786010164547743
Energy: 0.13829291814435016
Energy: 0.14474306490039185
Energy: 0.1373973938492047
Energy: 0.15248896857318178
Energy: 0.15877058215579487
Energy: 0.1450031400446902
Energy: 0.14525834804616566
Energy: 0.15935485818716563
Energy: 0.14645820685940242
Energy: 0.1558105785754283
Energy: 0.15956207869116884
Energy: 0.14569338555407343
Energy: 0.14503787834553009
Energy: 0.15954605621423118
Energy: 0.14644282799202957
Energy: 0.1452562521561051
Energy: 0.18323003719618494
Energy: 0.16565970047115633
Energy: 0.15669009540861578
Energy: 0.15966315205767287
Energy: 0.16100619846803163
Energy: 0.14482873970885898
Energy: 0.13728889372965405
Energy: 0.16612321362192004
Energy: 0.1558796579733483
Energy: 0.13732242586468965
Energy: 0.1615856939214157
Energy: 0.15280244250133637
Energy: 0.13732561106770902
Energy: 0.1452500577916328
Energy: 0.1453852302575525
Energy: 0.1374393272793025
Energy: 0.145886887019358
Energy: 0.14010790317258756
Energy: 0.1838457012720205
Energy: 0.1603247651514121
Energy: 0.15683203553401212
Energy: 0.16101088747502404
Energy: 0.15982146678220324
Energy: 0.1563695376853515
Energy: 0.2564589620950036
Energy: 0.1848177476932168
Energy: 0.16762675271287872
Energy: 0.14648262939762266
Energy: 0.18391886440294863
Energy: 0.16705357280814465
Energy: 0.18415977520800667
Energy: 0.16002603109873154
Energy: 0.15855890827950078
Energy: 0.16044326098411832
Energy: 0.1604400465847574
Energy: 0.14610533178022278
Energy: 0.18411683482095184
Energy: 0.13749867205994915
Energy: 0.13760774400947534
Energy: 0.1610229254764539
Energy: 0.140237001934828
Energy: 0.13862636664333627
Energy: 0.1594211944488975
Energy: 0.14590646233235013
Energy: 0.1561018204485463
Energy: 0.15981858765677853
Energy: 0.13788523287110796
Energy: 0.1462327982508592
Energy: 0.15947608971810967
Energy: 0.15631869255735686
Energy: 0.1545564199215822
Energy: 0.15957352637607033
Energy: 0.15994384375201945
Energy: 0.14492182515927507
Energy: 0.18478791946345893
Energy: 0.14602177107950687
Energy: 0.1454649488009402
Energy: 0.18404507454272367
Energy: 0.16081614496789556
Energy: 0.14503970060992422
Energy: 0.13739576508643392
Energy: 0.1451327531923613
Energy: 0.14500423380274335
Energy: 0.13756183046998002
Energy: 0.14679090890625193
Energy: 0.15963378196704417

minimum gb energy = 0.1370554935291 eV
minimum distance =  2.7035840928969 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.40680686308412817
Energy: 0.274728434897936
Energy: 0.2669270217270776
Energy: 0.2724265207092022
Energy: 0.2727285465219593
Energy: 0.266776823255039
Energy: 0.2774175216734408
Energy: 0.2805978153294016
Energy: 0.27916802095921567
Energy: 0.2718197376838984
Energy: 0.2804578844770764
Energy: 0.28032916203931035
Energy: 0.2680776327198445
Energy: 0.2726419182983381
Energy: 0.2740538478591315
Energy: 0.2685409687985728
Energy: 0.2713574064816581
Energy: 0.27676721755389644
Energy: 0.2683383589559359
Energy: 0.2742647518597682
Energy: 0.2769724677905677
Energy: 0.2688906938418884
Energy: 0.27226850975880107
Energy: 0.28239939987899754
Energy: 0.2697527557859154
Energy: 0.26599331763804945
Energy: 0.2658349247590698
Energy: 0.27765521998858395
Energy: 0.26780353364270815
Energy: 0.27613218847907584
Energy: 0.2966371105491368
Energy: 0.27484884495344697
Energy: 0.27067489005673756
Energy: 0.27145770578627143
Energy: 0.26852351398626967
Energy: 0.26725809948342444
Energy: 0.29342307676743
Energy: 0.2751844362192477
Energy: 0.27383675308729455
Energy: 0.27041861557555114
Energy: 0.26954179636225
Energy: 0.2738258589104912
Energy: 0.2823031885415607
Energy: 0.2668165679257234
Energy: 0.271010114122383
Energy: 0.283438299298566
Energy: 0.2896767682815749
Energy: 0.27518092888251916
Energy: 0.2954907911730915
Energy: 0.2668687195390216
Energy: 0.2764319322126434
Energy: 0.2762576922747993
Energy: 0.2649255106816611
Energy: 0.27579843958662204
Energy: 0.36155841963170077
Energy: 0.26628852051455154
Energy: 0.2672184797308438
Energy: 0.2684880767213363
Energy: 0.27477813899894477
Energy: 0.2743546358983675
Energy: 0.31897815943271235
Energy: 0.27130567741234
Energy: 0.26575061059624966
Energy: 0.27259103874789975
Energy: 0.27082217883005544
Energy: 0.2662464023190033
Energy: 0.29344654724623254
Energy: 0.26345020267480224
Energy: 0.2797665131351122
Energy: 0.27243903886351484
Energy: 0.26059336552601303
Energy: 0.27980920225183736
Energy: 0.2965477613051863
Energy: 0.2641157821772319
Energy: 0.2833916371619798
Energy: 0.27227429699236555
Energy: 0.26034809542435
Energy: 0.2791299948006618
Energy: 0.29425126632599774
Energy: 0.26495200864146323
Energy: 0.2664687909045479
Energy: 0.27136328626849404
Energy: 0.271252075591988
Energy: 0.2662375085415009
Energy: 0.33276620626516085
Energy: 0.2794867115488251
Energy: 0.3242009411791096
Energy: 0.2722666563688381
Energy: 0.26902681005696505
Energy: 0.2699853610292003
Energy: 0.370249528729149
Energy: 0.266336941350535
Energy: 0.2669821744062915
Energy: 0.268889137673573
Energy: 0.2661796562910137
Energy: 0.2673352393905276
Energy: 0.3921960510708961
Energy: 0.27276104960686737
Energy: 0.2747039332205294
Energy: 0.2601850051625859
Energy: 0.2747106852454591
Energy: 0.26214676816159554
Energy: 0.32285446623280656
Energy: 0.2701170693922128
Energy: 0.27011540167056
Energy: 0.27077369857188094
Energy: 0.26770905059414096
Energy: 0.2685681479270414
Energy: 0.31669194271609846
Energy: 0.2749859499406161
Energy: 0.2738548170829068
Energy: 0.26714058147964864
Energy: 0.2719546151601339
Energy: 0.2723133969354086
Energy: 0.3356957505232317
Energy: 0.2763831099100577
Energy: 0.27716779483321724
Energy: 0.26995709563454995
Energy: 0.27174253186356573
Energy: 0.27987988972216055
Energy: 0.37060462908650965
Energy: 0.2666517291082947
Energy: 0.2662090343247683
Energy: 0.26959348511786524
Energy: 0.26412374122931187
Energy: 0.266699279263794
Energy: 0.314449141573155
Energy: 0.27938224782357146
Energy: 0.2645178019121657
Energy: 0.28295484287910255
Energy: 0.2692344419343266
Energy: 0.2680831984529769
Energy: 0.26862532606166784
Energy: 0.2680134075552837
Energy: 0.26800996721330245
Energy: 0.26628696630034754
Energy: 0.2750842689234553
Energy: 0.27003944146598374
Energy: 0.2879774122254289
Energy: 0.27162658962572517
Energy: 0.2763300910201054
Energy: 0.2888319283580527
Energy: 0.2696579131103287
Energy: 0.27549023886703417
Energy: 0.2702410727383114
Energy: 0.27323423783383893
Energy: 0.28411709680891584
Energy: 0.2690053697912583
Energy: 0.2694614711857561
Energy: 0.2771405454347808
Energy: 0.3110002791017353
Energy: 0.2778880571797124
Energy: 0.2755016854125464
Energy: 0.2707341126140986
Energy: 0.28215282724642765
Energy: 0.2656605828065814

minimum gb energy = 0.2601850051625859 eV
minimum distance =  2.65306595664257 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.5372057889659917
Energy: 0.2894855940480723
Energy: 0.2901505897946285
Energy: 0.28812350968235173
Energy: 0.31714825610590747
Energy: 0.3055729335508643
Energy: 0.3029140950981054
Energy: 0.299934605400203
Energy: 0.29996067269069004
Energy: 0.2975972935270165
Energy: 0.2961331171859866
Energy: 0.29498398669060166
Energy: 0.289767611465877
Energy: 0.291232834252961
Energy: 0.29121564828646673
Energy: 0.2906991555536614
Energy: 0.2917037785846966
Energy: 0.2921213376979914
Energy: 0.28925263358392367
Energy: 0.29436927755893366
Energy: 0.29645576617247654
Energy: 0.2901488870785055
Energy: 0.29721558998893816
Energy: 0.29175037858929626
Energy: 0.29091401474752904
Energy: 0.2938550657761908
Energy: 0.2952458155551874
Energy: 0.3010046634432888
Energy: 0.2996525881365411
Energy: 0.30213473838091376
Energy: 0.3333875617240828
Energy: 0.2899520111936816
Energy: 0.29523518327428244
Energy: 0.3054540036056729
Energy: 0.2899649751077809
Energy: 0.296717981025421
Energy: 0.32919675111699515
Energy: 0.2951910002985612
Energy: 0.2913004434184297
Energy: 0.29605876575742973
Energy: 0.29511669007214314
Energy: 0.2910882749178048
Energy: 0.31091709368960235
Energy: 0.2926081558803139
Energy: 0.290341781305892
Energy: 0.3116922246544952
Energy: 0.29246509617926264
Energy: 0.2746691605199477
Energy: 0.3296788545605645
Energy: 0.29441922087256156
Energy: 0.2962582753522636
Energy: 0.2973709674390449
Energy: 0.2963580345410576
Energy: 0.2981541613463776
Energy: 0.3293840807348959
Energy: 0.2993592828605963
Energy: 0.29487770651223816
Energy: 0.29000627446157035
Energy: 0.2985076197780263
Energy: 0.295490915080662
Energy: 0.32956965987192105
Energy: 0.2985779724408135
Energy: 0.2979939032080313
Energy: 0.2893123023882877
Energy: 0.299033946646689
Energy: 0.2973760683072054
Energy: 0.3289634021103874
Energy: 0.28562918468722853
Energy: 0.2788056994882332
Energy: 0.299137125644237
Energy: 0.2737090318924707
Energy: 0.2977804118207421
Energy: 0.29217041513831365
Energy: 0.2857537071025908
Energy: 0.2961641230339389
Energy: 0.2982823774003444
Energy: 0.2753360543551815
Energy: 0.2989010800248942
Energy: 0.30101193913617585
Energy: 0.2985567789140716
Energy: 0.2984744365788248
Energy: 0.2981074982984613
Energy: 0.2979823501022892
Energy: 0.29649980106489215
Energy: 0.29275927427828247
Energy: 0.2917859802644423
Energy: 0.2912109347032424
Energy: 0.29267342020727294
Energy: 0.2962878196789983
Energy: 0.29345898771878787
Energy: 0.29034153934843726
Energy: 0.29235451005093105
Energy: 0.2913289752184902
Energy: 0.294604077821063
Energy: 0.29590251743475726
Energy: 0.29313452099927717
Energy: 0.3577710838214731
Energy: 0.2991433067661116
Energy: 0.27873597423930585
Energy: 0.2741294940489907
Energy: 0.2977053840267358
Energy: 0.30050601197925275
Energy: 0.30317639840947347
Energy: 0.3005740169483761
Energy: 0.3004941525464902
Energy: 0.29301381514268715
Energy: 0.3057289828250211
Energy: 0.29276805405809725
Energy: 0.2897463279720949
Energy: 0.2903522852505802
Energy: 0.2913954758442252
Energy: 0.28935970979543146
Energy: 0.2909284173747686
Energy: 0.29063610754238345
Energy: 0.29099807082524104
Energy: 0.2888735981538031
Energy: 0.2921008679514279
Energy: 0.29127395691244806
Energy: 0.2915102023279726
Energy: 0.29156918422982825
Energy: 0.2907293660467816
Energy: 0.2955731026238974
Energy: 0.2953144478458068
Energy: 0.2995559854435355
Energy: 0.29658843693372794
Energy: 0.3009470477663869
Energy: 0.3500282237918001
Energy: 0.29738682271780836
Energy: 0.2929346486327862
Energy: 0.3496506446963969
Energy: 0.2982049658531852
Energy: 0.29584024935032427
Energy: 0.32933103440581213
Energy: 0.2948154008657326
Energy: 0.29431666415691987
Energy: 0.29942307633585225
Energy: 0.29685945314947254
Energy: 0.29468947459075473
Energy: 0.3106251987054012
Energy: 0.28943184957237
Energy: 0.2919917632094793
Energy: 0.3110544510944246
Energy: 0.2880412325207293
Energy: 0.28050684370199064
Energy: 0.3290660590339662
Energy: 0.2924474681830299
Energy: 0.29246160462228005
Energy: 0.29645006568721166
Energy: 0.29223522634754634
Energy: 0.2985174462515439
Energy: 0.33003775277074243
Energy: 0.29862823731415816
Energy: 0.2978639872287852
Energy: 0.28935822666445
Energy: 0.298130833390553
Energy: 0.29697882513072116
Energy: 0.3311218500769342
Energy: 0.29907476068600747
Energy: 0.29792037344435157
Energy: 0.28958748142125124
Energy: 0.29727307874677045
Energy: 0.2956401840096569
Energy: 0.38709427592152856
Energy: 0.2790740223321821
Energy: 0.2960541226116203
Energy: 0.2984026637624068
Energy: 0.28813907641710435
Energy: 0.296947642091818
Energy: 0.2922264361829883
Energy: 0.2738575324126819
Energy: 0.30202767809069203
Energy: 0.2949086937716757
Energy: 0.2731296572602766
Energy: 0.2805537643300686
Energy: 0.3025997650181819
Energy: 0.300003130305432
Energy: 0.29788390097906875
Energy: 0.2968799687525882
Energy: 0.2989887801115183
Energy: 0.29651009407448026
Energy: 0.28996242579760734
Energy: 0.2986852393968983
Energy: 0.2926189972334536
Energy: 0.29019477561259976
Energy: 0.29073293256583
Energy: 0.2916690207997732
Energy: 0.2895141748807429
Energy: 0.29955610486346756
Energy: 0.290602133431961
Energy: 0.29207068183657126
Energy: 0.29025457275415123
Energy: 0.29123898224560196
Energy: 0.353012526795216
Energy: 0.3006489093929424
Energy: 0.2943486710392548
Energy: 0.2742650314485985
Energy: 0.3004674234431108
Energy: 0.2806101737022324

minimum gb energy = 0.2731296572602766 eV
minimum distance =  2.66046879412737 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.34772226939225476
Energy: 0.2941803741448939
Energy: 0.29490024386917346
Energy: 0.34824185127053536
Energy: 0.3381609711073368
Energy: 0.293790092399671
Energy: 0.3382067620376085
Energy: 0.31197398157197254
Energy: 0.311775497667771
Energy: 0.30329857777164054
Energy: 0.3193679017791109
Energy: 0.31236821589944136
Energy: 0.3152451319843767
Energy: 0.3054160585784547
Energy: 0.3037809698722537
Energy: 0.31535373597909805
Energy: 0.31292725641938646
Energy: 0.30315819626513413
Energy: 0.3143854893588592
Energy: 0.3107201493166638
Energy: 0.31086629159294843
Energy: 0.31481002627826954
Energy: 0.3129617995524454
Energy: 0.3108009873131217
Energy: 0.33964239892293646
Energy: 0.30330256560241853
Energy: 0.2989069344696264
Energy: 0.334907193081368
Energy: 0.3148065769083494
Energy: 0.29861609536004285
Energy: 0.339988924561751
Energy: 0.30342702188322246
Energy: 0.3029170046350191
Energy: 0.3371976028982044
Energy: 0.3109743220283065
Energy: 0.30340858857046804
Energy: 0.3375388406058877
Energy: 0.3223268898394923
Energy: 0.312084537432059
Energy: 0.3220874102485622
Energy: 0.3111451120616739
Energy: 0.3103961038683296
Energy: 0.34767784928566936
Energy: 0.3076205496380127
Energy: 0.29284433874374205
Energy: 0.34797901666852094
Energy: 0.3216682701257192
Energy: 0.2923604830799019
Energy: 0.33682009435910487
Energy: 0.3056041313066156
Energy: 0.3181670258491248
Energy: 0.3401976258135885
Energy: 0.30009177947567794
Energy: 0.321515641160198
Energy: 0.3409093893002517
Energy: 0.30546432242111093
Energy: 0.3046601710521455
Energy: 0.3161095656576847
Energy: 0.3054666717296705
Energy: 0.3034280452952212
Energy: 0.33880029605378065
Energy: 0.3105512776039852
Energy: 0.3102145169417472
Energy: 0.3156774727899848
Energy: 0.31775616053606864
Energy: 0.3107192056398596
Energy: 0.33945175740025024
Energy: 0.29560053890917626
Energy: 0.3150239312233187
Energy: 0.3293033986307648
Energy: 0.2943329848060599
Energy: 0.2925753813209024
Energy: 0.34175778831023057
Energy: 0.2966180099283775
Energy: 0.2924270964616584
Energy: 0.33584256242683164
Energy: 0.2936019829581872
Energy: 0.29213746809652963
Energy: 0.31509101322654476
Energy: 0.311276026765943
Energy: 0.31095046249379216
Energy: 0.3158359332452514
Energy: 0.3194777374444499
Energy: 0.30492898909262883
Energy: 0.2923490765616856
Energy: 0.30633685685963985
Energy: 0.3045670930220336
Energy: 0.3141375636246361
Energy: 0.3071846719193556
Energy: 0.30415423148963905
Energy: 0.3188873315430919
Energy: 0.31978274380242827
Energy: 0.310035111826318
Energy: 0.3245909467028663
Energy: 0.31823364258989295
Energy: 0.3114565208990191
Energy: 0.3369897650181635
Energy: 0.3048613022956304
Energy: 0.304856473921614
Energy: 0.3122890359138759
Energy: 0.3299886328400942
Energy: 0.30368139997546084
Energy: 0.33831444370954256
Energy: 0.32729774769838743
Energy: 0.2986066770609686
Energy: 0.3199556837517384
Energy: 0.33711426371517567
Energy: 0.30277862917673837
Energy: 0.3144172002363941
Energy: 0.29291015919584173
Energy: 0.2928796850362978
Energy: 0.31746263652647877
Energy: 0.3369776229737298
Energy: 0.30370135171516643
Energy: 0.3175230659314058
Energy: 0.29283270526515176
Energy: 0.29151580085742257
Energy: 0.31731945745254414
Energy: 0.33662091423448454
Energy: 0.3038431719213101
Energy: 0.2993808005527584
Energy: 0.3101310538051786
Energy: 0.3101049795776397
Energy: 0.3003430107147221
Energy: 0.31743646249903407
Energy: 0.3240486384796612
Energy: 0.3238642936550021
Energy: 0.3031478481804049
Energy: 0.30349152407324065
Energy: 0.32365776252844913
Energy: 0.3058921798670349
Energy: 0.30447877460347783
Energy: 0.31980355820808887
Energy: 0.31119227675873096
Energy: 0.3110534290610285
Energy: 0.3049980883293526
Energy: 0.32363367420257244
Energy: 0.30379018665229074
Energy: 0.34720132540933535
Energy: 0.33923063338240095
Energy: 0.2919675619227423
Energy: 0.2934391698457081
Energy: 0.3410729497500261
Energy: 0.29201515059082206
Energy: 0.34015922613285554
Energy: 0.3124193471162961
Energy: 0.30389895082011714
Energy: 0.30072083009465284
Energy: 0.312590643851099
Energy: 0.30345737301350956
Energy: 0.31448244066975356
Energy: 0.30581924482620854
Energy: 0.3040035065842006
Energy: 0.3151232764192481
Energy: 0.31442846927328727
Energy: 0.31037622197057696
Energy: 0.31510980928534177
Energy: 0.3052504339330794
Energy: 0.303442937386547
Energy: 0.31527245653350455
Energy: 0.3148507202242385
Energy: 0.30431165874211397
Energy: 0.34707142525517687
Energy: 0.3030649901323192
Energy: 0.3032094203822952
Energy: 0.3224522827403415
Energy: 0.3118314107923269
Energy: 0.30275105086481346
Energy: 0.3406173055376902
Energy: 0.3026245665686771
Energy: 0.3025321662491704
Energy: 0.34377095365224947
Energy: 0.30504048261202155
Energy: 0.3037499415104265
Energy: 0.3365718847840515
Energy: 0.30397374462094434
Energy: 0.30396354252004093
Energy: 0.3221924645575804
Energy: 0.31194066739200677
Energy: 0.31136638277298395
Energy: 0.3478289208559742
Energy: 0.32246160460295603
Energy: 0.29206749346650385
Energy: 0.3482480146257433
Energy: 0.3228892466287024
Energy: 0.29210427582078047
Energy: 0.33769814692566613
Energy: 0.3033496422138622
Energy: 0.30454724675931344
Energy: 0.30722581738305355
Energy: 0.3045859245892647
Energy: 0.3104458101145414
Energy: 0.3406202283049274
Energy: 0.31102901339562883
Energy: 0.3042110249041222
Energy: 0.315781567954353
Energy: 0.3059923349392557
Energy: 0.3033501583035884
Energy: 0.3384906890686515
Energy: 0.3103153224013574
Energy: 0.3041462267672982
Energy: 0.3154843301911909
Energy: 0.3125026348768384
Energy: 0.30346259551851185
Energy: 0.33774280693905523
Energy: 0.3071860909577989
Energy: 0.3149145052557071
Energy: 0.3343753886058456
Energy: 0.3007381871139283
Energy: 0.2983104858553804
Energy: 0.33791692962692416
Energy: 0.29690316255099075
Energy: 0.2920968447515696
Energy: 0.3363606987992681
Energy: 0.29368079903521677
Energy: 0.2924519100055597
Energy: 0.31654354045062244
Energy: 0.31323842511046235
Energy: 0.31241769475408593
Energy: 0.31722771870345495
Energy: 0.3164626636530499
Energy: 0.31250610356366043
Energy: 0.29327276122253737
Energy: 0.306431366472443
Energy: 0.30443565645956977
Energy: 0.294482385666309
Energy: 0.3068274786970016
Energy: 0.3041354366183666
Energy: 0.31677823540433225
Energy: 0.3137775241219847
Energy: 0.30437467595494194
Energy: 0.3195030286156449
Energy: 0.3167386575595464
Energy: 0.3114350320860126
Energy: 0.3386027007776101
Energy: 0.30560568467929394
Energy: 0.2990649166179377
Energy: 0.3149932657116391
Energy: 0.33745209683952115
Energy: 0.3028768299839412
Energy: 0.3383327472958805
Energy: 0.3281458497491473
Energy: 0.29914626627002544
Energy: 0.3146609343395463
Energy: 0.3352064113363613
Energy: 0.2996673076819157
Energy: 0.31483439325104934
Energy: 0.2925443115040691
Energy: 0.2933212172452545
Energy: 0.3179083061839664
Energy: 0.3361281207236191
Energy: 0.31063954648431114
Energy: 0.3182525847223821
Energy: 0.2927016547619905
Energy: 0.292792344728243
Energy: 0.31834726377679473
Energy: 0.29430142405796095
Energy: 0.2931716721488467
Energy: 0.298808499052931
Energy: 0.3030477757251686
Energy: 0.30278370882429967
Energy: 0.2995110993885263
Energy: 0.2998890012395823
Energy: 0.3182542422985017
Energy: 0.3226404020307214
Energy: 0.30415951303779587
Energy: 0.30442450148150557
Energy: 0.3223398598377694
Energy: 0.3050162909670224
Energy: 0.3060698217995016
Energy: 0.31789100778902096
Energy: 0.31052128859577804
Energy: 0.31073114665148055
Energy: 0.31046740275795265
Energy: 0.3224032946410232
Energy: 0.31228795472481347
Energy: 0.33441041788470244
Energy: 0.32607540105151317
Energy: 0.2927125887567068
Energy: 0.2929366213407865
Energy: 0.34217818726093185
Energy: 0.2925780210042283

minimum gb energy = 0.29151580085742257 eV
minimum distance =  2.64897032285854 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.39762566606712235
Energy: 0.2961591188216793
Energy: 0.29579478589280306
Energy: 0.29521990851292107
Energy: 0.5635223510984673
Energy: 0.29606676370434765
Energy: 0.3611726929894077
Energy: 0.3147312431353507
Energy: 0.31547905721559494
Energy: 0.31390830115403984
Energy: 0.332100244826938
Energy: 0.31612655748254376
Energy: 0.3311520545266024
Energy: 0.28819928047626775
Energy: 0.30614082412097715
Energy: 0.30474251546618836
Energy: 0.28815668186321375
Energy: 0.30562264302259123
Energy: 0.33059586540764524
Energy: 0.30603153016633233
Energy: 0.3058203029250953
Energy: 0.33168664409962934
Energy: 0.30593772130373237
Energy: 0.3060384435117777
Energy: 0.32883175894365374
Energy: 0.3155941507353116
Energy: 0.3193020630288827
Energy: 0.32916244318406834
Energy: 0.3148857358998919
Energy: 0.3177868861471548
Energy: 0.3288339453327984
Energy: 0.3030104335503724
Energy: 0.3152383994533168
Energy: 0.3291136877539567
Energy: 0.3021575385723121
Energy: 0.31555739573874486
Energy: 0.3621290149036382
Energy: 0.315218709842606
Energy: 0.31601418216043087
Energy: 0.28843095786984935
Energy: 0.33142529830969375
Energy: 0.3153159845153802

minimum gb energy = 0.28815668186321375 eV
minimum distance =  2.70605555250429 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.521654275329422
Energy: 0.38615839561476695
Energy: 0.3584891326599004
Energy: 0.36299454383613017
Energy: 0.41791963422495515
Energy: 0.3589422720172828
Energy: 0.34244708186760586
Energy: 0.36907019826699816
Energy: 0.3453814976591386
Energy: 0.35803289329593474
Energy: 0.3649143711540715
Energy: 0.3467277419181359
Energy: 0.34466620340378046
Energy: 0.3439353528770525
Energy: 0.34357192877180026
Energy: 0.34481258905728224
Energy: 0.34458013905873625
Energy: 0.3462784300244235
Energy: 0.34857499178720863
Energy: 0.34658782341395394
Energy: 0.34607959704025165
Energy: 0.3491734079023372
Energy: 0.3434705789447483
Energy: 0.34649418592843206
Energy: 0.3487296693038786
Energy: 0.3526748015289058
Energy: 0.35473226818730025
Energy: 0.3472648334362389
Energy: 0.3510991530037826
Energy: 0.34447912338437736
Energy: 0.34384660675532436
Energy: 0.3539772422963179
Energy: 0.35510290062255756
Energy: 0.34404015117596504
Energy: 0.34819081035015625
Energy: 0.358970417755884
Energy: 0.3440123064867299
Energy: 0.3638034128032481
Energy: 0.36862226746884014
Energy: 0.36185451393701146
Energy: 0.3555539662822282
Energy: 0.363491720779296
Energy: 0.5086671178626745
Energy: 0.3465613382852384
Energy: 0.3581403200673164
Energy: 0.34949842386124463
Energy: 0.34565007467532993
Energy: 0.3502608525239948
Energy: 0.34517826624985176
Energy: 0.35738035121852757
Energy: 0.3611516642705646
Energy: 0.36174784527116643
Energy: 0.3617296170657993
Energy: 0.35277785086310776
Energy: 0.3673142142725088
Energy: 0.34728437220483044
Energy: 0.34660581219538644
Energy: 0.3555958352497965
Energy: 0.3471986516574929
Energy: 0.35774482221542486
Energy: 0.3636987154757317
Energy: 0.3474631495076127
Energy: 0.34262288530449353
Energy: 0.35124706719512516
Energy: 0.35468257002328474
Energy: 0.3589252238310765
Energy: 0.37138441834176156
Energy: 0.36813625700073455
Energy: 0.3593702427338732
Energy: 0.3673191570817691
Energy: 0.3480493402687333
Energy: 0.3582722661793813
Energy: 0.37297868813553126
Energy: 0.3445462480830481
Energy: 0.34453718918207965
Energy: 0.35480239994042323
Energy: 0.3514197701866908
Energy: 0.35906791379785263
Energy: 0.37187001825082683
Energy: 0.3464869649745183
Energy: 0.34624082471169865
Energy: 0.3488229597643954
Energy: 0.34877571760335346
Energy: 0.34555526712543616
Energy: 0.4420756092027761
Energy: 0.34749909026666165
Energy: 0.3464183748500187
Energy: 0.35339807868210793
Energy: 0.3464976806226341
Energy: 0.36150127202406296
Energy: 0.3692097751701803
Energy: 0.35205411140961806
Energy: 0.34749868522827637
Energy: 0.35156628184103295
Energy: 0.3548757257020946
Energy: 0.3464686546211517
Energy: 0.42224624306827807
Energy: 0.34408313822136494
Energy: 0.3435978819932879
Energy: 0.4216062798402731
Energy: 0.34377058292838375
Energy: 0.3448598208942348
Energy: 0.36426668670995177
Energy: 0.3572801631716094
Energy: 0.3619064609068385
Energy: 0.3739246072933122
Energy: 0.3612626145090858
Energy: 0.365221123018981
Energy: 0.40365591686245966
Energy: 0.35994773350662185
Energy: 0.349502185339987
Energy: 0.3459450054167718
Energy: 0.3599483917988599
Energy: 0.34555682644452934
Energy: 0.4070308008620945
Energy: 0.348720355217421
Energy: 0.3467248967080614
Energy: 0.3470318682250382
Energy: 0.3635198541497291
Energy: 0.3459177056590243
Energy: 0.36338094814447175
Energy: 0.36134113555134173
Energy: 0.3609019797272619
Energy: 0.3700965897763464
Energy: 0.3612898947486658
Energy: 0.36641243881053065
Energy: 0.35843791751705506
Energy: 0.37492626778393573
Energy: 0.37415062562280044
Energy: 0.36471662540938304
Energy: 0.36590731926118636
Energy: 0.3705431379230284
Energy: 0.3591510300508303
Energy: 0.3639044080548961
Energy: 0.36889287007896104
Energy: 0.3602477819910263
Energy: 0.35184792372616724
Energy: 0.3697302751481294
Energy: 0.36632272913814357
Energy: 0.36881194165244513
Energy: 0.36861934965213267
Energy: 0.3452514748523219
Energy: 0.3490507192869549
Energy: 0.3418415068642887
Energy: 0.34312332851137345
Energy: 0.342620758935383
Energy: 0.34204712487495925
Energy: 0.3652461504573544
Energy: 0.35659834994229356
Energy: 0.34143548288030323
Energy: 0.4332073270620613
Energy: 0.36464116303891636
Energy: 0.3656047924613958
Energy: 0.34143637098780916
Energy: 0.3647459711313403
Energy: 0.3407711787858411
Energy: 0.34821321128900024
Energy: 0.3640937697987873
Energy: 0.3654685586145831
Energy: 0.34089688406045493
Energy: 0.3638002856144412
Energy: 0.3406353830979908
Energy: 0.3446849640351456
Energy: 0.3407734210116395
Energy: 0.34213301274306196
Energy: 0.3568494952592582
Energy: 0.34129428857253685
Energy: 0.3414049829478052
Energy: 0.34905248631172736
Energy: 0.34387924749094917
Energy: 0.3444703066418685
Energy: 0.34388696987157547
Energy: 0.34447924227078774
Energy: 0.3413161046219587
Energy: 0.3461743491151236
Energy: 0.35954482842832286
Energy: 0.35028467600592095
Energy: 0.3471911158310491
Energy: 0.3533956541812518
Energy: 0.34846903016254216
Energy: 0.3464565552065636
Energy: 0.3602276604586291
Energy: 0.3601996828138461
Energy: 0.3494067075616229
Energy: 0.3603535801323981
Energy: 0.3467287373766083
Energy: 0.34863187393285283
Energy: 0.358952367434688
Energy: 0.35908061014645565
Energy: 0.35923690647950735
Energy: 0.35293193280474044
Energy: 0.3589410670944828
Energy: 0.42499763707563976
Energy: 0.3633688906655686
Energy: 0.34567674554003286
Energy: 0.3476103499688199
Energy: 0.38846847917010613
Energy: 0.34323257340901014
Energy: 0.35520594511114717
Energy: 0.3646649618297942
Energy: 0.36678729826669365
Energy: 0.3430390958525242
Energy: 0.36810596420917735
Energy: 0.36693465263892455
Energy: 0.35253575088080613
Energy: 0.342077859244279
Energy: 0.34289197890106377
Energy: 0.3639417443192195
Energy: 0.3596698642143795
Energy: 0.35906028215802444
Energy: 0.3880448250164019
Energy: 0.347792172593564
Energy: 0.3474928307031928
Energy: 0.38651601348254205
Energy: 0.34751657284039683
Energy: 0.357675235374207
Energy: 0.3599978901529399
Energy: 0.35689586918383825
Energy: 0.3575580988038911
Energy: 0.36302904780190504
Energy: 0.3591920039433569
Energy: 0.36099601246003865
Energy: 0.41431605299493074
Energy: 0.37745170722068044
Energy: 0.3759046305354082
Energy: 0.364391604495385
Energy: 0.3760580443420675
Energy: 0.3621487952846586
Energy: 0.37033522930706525
Energy: 0.34900532717538507
Energy: 0.34490924469216344
Energy: 0.3647069732798937
Energy: 0.34685440381600996
Energy: 0.34482825900724395
Energy: 0.3886711845508473
Energy: 0.34544595251279003
Energy: 0.3461298832179237
Energy: 0.3508599018766978
Energy: 0.3448061549596845
Energy: 0.34665921568832275
Energy: 0.3742486085276272
Energy: 0.3483764399196954
Energy: 0.34591146476661555
Energy: 0.3458838905784451
Energy: 0.3748220784023562
Energy: 0.3457569845700662
Energy: 0.3679215882095781
Energy: 0.35537559055150786
Energy: 0.3664334585945864
Energy: 0.3700717800022798
Energy: 0.34313781022212647
Energy: 0.36504238180804205
Energy: 0.42866170758514743
Energy: 0.3445644284344941
Energy: 0.343426120845233
Energy: 0.40528085059181274
Energy: 0.34474903716241395
Energy: 0.3449370763814349
Energy: 0.36258154023883554
Energy: 0.34785525117467814
Energy: 0.34718957233556264
Energy: 0.34790541969153177
Energy: 0.3520405347050312
Energy: 0.3474050338039899
Energy: 0.4743681573579991
Energy: 0.3463993839790788
Energy: 0.35543256034972265
Energy: 0.3681698850969446
Energy: 0.34677772004071256
Energy: 0.356217907309365
Energy: 0.35689268629638815
Energy: 0.3616537794285027
Energy: 0.3647962405915037
Energy: 0.36179678733582205
Energy: 0.3583792864316281
Energy: 0.3613321749535727
Energy: 0.38615577862020856
Energy: 0.36369051470730696
Energy: 0.37014954742138495
Energy: 0.36445813626053797
Energy: 0.3623320056835637
Energy: 0.36981713213749895
Energy: 0.3605793202554135
Energy: 0.369245087670507
Energy: 0.3686331854253557
Energy: 0.36159438085458306
Energy: 0.36872591084849493
Energy: 0.3666934854403642
Energy: 0.362423838609525
Energy: 0.3455876478930319
Energy: 0.3462571384468968
Energy: 0.3609000064249344
Energy: 0.346366753630033
Energy: 0.3463279492214397
Energy: 0.3449545378123714
Energy: 0.3462421770827619
Energy: 0.3461304486985107
Energy: 0.34501754702202286
Energy: 0.34643469218623774
Energy: 0.3459746994605136
Energy: 0.342146154236774
Energy: 0.369363755380921
Energy: 0.3626027426247316
Energy: 0.3524232110298534
Energy: 0.36608403461968525
Energy: 0.3637173519371612

minimum gb energy = 0.3406353830979908 eV
minimum distance =  2.6127060729802 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 0.6515962186070161
Energy: 0.40933947812957683
Energy: 0.357830856037409
Energy: 0.3570175229270829
Energy: 0.35072468129109896
Energy: 0.4032859371378525
Energy: 0.3527801802521787
Energy: 0.3330532368297223
Energy: 0.34684185594084993
Energy: 0.3570243777239952
Energy: 0.3334551336533228
Energy: 0.3366665649174446
Energy: 0.37342322911515513
Energy: 0.36632155117761067
Energy: 0.3664666130311456
Energy: 0.3467038218762814
Energy: 0.36551717317403704
Energy: 0.4227158389634567
Energy: 0.3677753264575863
Energy: 0.3672358903155568
Energy: 0.32666580422177144
Energy: 0.3753752176650747
Energy: 0.3682887326855389
Energy: 0.32696329957293624
Energy: 0.3738498370296407
Energy: 0.32785390855350605
Energy: 0.3288033101479974
Energy: 0.3797120198200437
Energy: 0.36031621070625003
Energy: 0.32764062419044876
Energy: 0.3696342444395398
Energy: 0.38278198889653076
Energy: 0.38976817645031764
Energy: 0.37368579162975957
Energy: 0.40454277101567737
Energy: 0.3895109455282548
Energy: 0.3764564351385577
Energy: 0.3624159396134633
Energy: 0.3733931141736238
Energy: 0.369214506078904
Energy: 0.3532332338235327
Energy: 0.3740922841261942
Energy: 0.5106028652066705
Energy: 0.42258761217415813
Energy: 0.42265833803392605
Energy: 0.35492329239919485
Energy: 0.39206079872159155
Energy: 0.36964014415852053
Energy: 0.37504698729752706
Energy: 0.36959567954557154
Energy: 0.3715194808174445
Energy: 0.36175644388262
Energy: 0.3560518582260914
Energy: 0.3681892752137079
Energy: 0.40613916650224813
Energy: 0.3644147024611254
Energy: 0.3629986102263287
Energy: 0.40703782491004376
Energy: 0.3473519068163698
Energy: 0.3479966193676839
Energy: 0.36668101279278115
Energy: 0.36393267376604715
Energy: 0.36928538271210454
Energy: 0.37174856629961067
Energy: 0.34652068633046346
Energy: 0.3639062609792028
Energy: 0.3824859525130299
Energy: 0.3765391006329794
Energy: 0.37876544448865906
Energy: 0.36555572204861875
Energy: 0.3705215558530525
Energy: 0.37600995759131756
Energy: 0.38601327675789376
Energy: 0.3735307274735491
Energy: 0.37754225982611744
Energy: 0.36572173271685077
Energy: 0.35817853010315964
Energy: 0.3670140695945867
Energy: 0.3705067693026355
Energy: 0.3564467959566357
Energy: 0.3565568816520269
Energy: 0.37762173189650067
Energy: 0.39503492346969643
Energy: 0.3562598231266745
Energy: 0.41796555778595007
Energy: 0.4166956279011067
Energy: 0.41568807690091647
Energy: 0.40499835401490586
Energy: 0.407824899402422
Energy: 0.40252877121773367
Energy: 0.36815065529418517
Energy: 0.403115273344638
Energy: 0.4038067873053186
Energy: 0.3686815666834021
Energy: 0.3902834861622844
Energy: 0.37675186983893316
Energy: 0.41595195275721847
Energy: 0.35491804183207365
Energy: 0.37302209549281756
Energy: 0.42727345416250345
Energy: 0.3547101556730053
Energy: 0.3716976756292724
Energy: 0.38702786011749657
Energy: 0.4054486461180398
Energy: 0.3714606178566487
Energy: 0.3978068573598542
Energy: 0.3729467305425954
Energy: 0.40201702104320364
Energy: 0.3982323256795847
Energy: 0.38218785868593164
Energy: 0.36740943402914306
Energy: 0.3632841805928363
Energy: 0.39351109244242016
Energy: 0.36400831818990226
Energy: 0.3486072110380926
Energy: 0.3999691731031813
Energy: 0.36741864438717486
Energy: 0.36092568621055404
Energy: 0.36940349688631885
Energy: 0.3639786340718568
Energy: 0.3869763734821507
Energy: 0.37263956401955584
Energy: 0.40637009186566386
Energy: 0.3973816402431898
Energy: 0.37232419632301944
Energy: 0.4033989834290691
Energy: 0.36811622069593164
Energy: 0.3681875030696691
Energy: 0.3691364341107633
Energy: 0.39060472772175725
Energy: 0.36820290839297354
Energy: 0.3737169312008262
Energy: 0.36789814734188736
Energy: 0.38559663895942076
Energy: 0.35657530949781435
Energy: 0.3681946507624086
Energy: 0.39189845636668486
Energy: 0.3687595417352182
Energy: 0.3727480030128638
Energy: 0.4040997258709717
Energy: 0.40443591641988424
Energy: 0.4050828266386649
Energy: 0.40034860714974474
Energy: 0.36860041895157225
Energy: 0.3667523100598416
Energy: 0.39541505559824547
Energy: 0.39525549918077346
Energy: 0.3697930324127461
Energy: 0.3558854034592688
Energy: 0.36938098718398854
Energy: 0.4235504363925774
Energy: 0.3695787845886213
Energy: 0.3724950605207604
Energy: 0.35392536804710334
Energy: 0.3562196551781307
Energy: 0.37883253840836384
Energy: 0.38546750409788133
Energy: 0.37633546611011426
Energy: 0.3764136400230005
Energy: 0.35401108531778364
Energy: 0.3982479756864981
Energy: 0.3753963101386198
Energy: 0.3681513984462554
Energy: 0.3530697838214757
Energy: 0.36034150335857357
Energy: 0.37238029989292215
Energy: 0.3661562934520893
Energy: 0.3651370991379141
Energy: 0.37249730491957966
Energy: 0.3475359500068318
Energy: 0.348040715540179
Energy: 0.3722989960884352
Energy: 0.36331286665953333
Energy: 0.3647358256221003
Energy: 0.37315923276465435
Energy: 0.35632379216425897
Energy: 0.3732706041897949
Energy: 0.3760445119175103
Energy: 0.35663006197413055
Energy: 0.36809768708877394
Energy: 0.37788640779127175
Energy: 0.37720660099486836
Energy: 0.3757918388533688
Energy: 0.3661074732779348
Energy: 0.4116948836036151
Energy: 0.36741801584859
Energy: 0.3732348779544354
Energy: 0.36231761657328165
Energy: 0.3690943101481708
Energy: 0.3708222231370455
Energy: 0.35128269320222644
Energy: 0.3577607004652393
Energy: 0.41629171911411683
Energy: 0.3773957482290757
Energy: 0.3732977135144684
Energy: 0.3752060648985788
Energy: 0.3615812610243707
Energy: 0.36187044362201215
Energy: 0.3718039898007093
Energy: 0.3278540340095335
Energy: 0.3397808032715241
Energy: 0.3864974520614662
Energy: 0.3740005580921754
Energy: 0.3400986412066898
Energy: 0.3701547569397749
Energy: 0.34267256947326963
Energy: 0.34399131880985806
Energy: 0.3778964272601051
Energy: 0.35351515869179767
Energy: 0.3404083621270762
Energy: 0.4528368488992636
Energy: 0.3545031045921253
Energy: 0.3544963071039731
Energy: 0.37783245904856955
Energy: 0.3546067886916056
Energy: 0.42741276150046253
Energy: 0.3670769688805313
Energy: 0.33410934240266704
Energy: 0.3351380217847537
Energy: 0.3573207920207354
Energy: 0.3334154269219427
Energy: 0.3457379522938199
Energy: 0.40292398660308265
Energy: 0.3665982847448624
Energy: 0.35790510047059754
Energy: 0.33455293379942197
Energy: 0.3798711859186704
Energy: 0.38780211386688124

minimum gb energy = 0.32666580422177144 eV
minimum distance =  2.53966037515693 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.5724760099714419
Energy: 0.41126811803466706
Energy: 0.3905142771870094
Energy: 0.39296544174334813
Energy: 0.4072917434526708
Energy: 0.3698790327354864
Energy: 0.33259469166027883
Energy: 0.33272503070176856
Energy: 0.33267570888906495
Energy: 0.35786419344353027
Energy: 0.33925419303948506
Energy: 0.347929684133598
Energy: 0.34309664048750077
Energy: 0.33171351617550177
Energy: 0.3319538076064578
Energy: 0.35083025809074364
Energy: 0.33385390655976066
Energy: 0.34290687357744054
Energy: 0.343490311862447
Energy: 0.3319676512731478
Energy: 0.3428388367305255
Energy: 0.34344058073706324
Energy: 0.33258319118383267
Energy: 0.34299647209953876
Energy: 0.3415297940605115
Energy: 0.36594685934142546
Energy: 0.3557618663945165
Energy: 0.34157189395075715
Energy: 0.3477366566632333
Energy: 0.34196545576074744
Energy: 0.3422889391665132
Energy: 0.34785092480222884
Energy: 0.36678548161716595
Energy: 0.3646962751012059
Energy: 0.34249254905557097
Energy: 0.36725089699885205
Energy: 0.3420718034781687
Energy: 0.34201509200958047
Energy: 0.342149220418332
Energy: 0.3393658908622596
Energy: 0.34351849898738157
Energy: 0.34167055603716023
Energy: 0.3549420641523937
Energy: 0.34290732895980025
Energy: 0.3429897580169246
Energy: 0.33062640800835746
Energy: 0.3429043644601531
Energy: 0.3562953213216637
Energy: 0.3392341029825814
Energy: 0.3430326917780283
Energy: 0.342594159568861
Energy: 0.33924273539733435
Energy: 0.3605356166622712
Energy: 0.34194191892882114
Energy: 0.3387496471409512
Energy: 0.34116836450834204
Energy: 0.34089517105088285
Energy: 0.3336708963870633
Energy: 0.3409134148092343
Energy: 0.3407335227827599
Energy: 0.3317179672872699
Energy: 0.34699067512151477
Energy: 0.33100068111028036
Energy: 0.3388778820385044
Energy: 0.34874363671433106
Energy: 0.347289474786607
Energy: 0.34353951430997837
Energy: 0.34313021618856804
Energy: 0.3425430000017727
Energy: 0.3319980307581171
Energy: 0.3432737800619026
Energy: 0.34284811746164745
Energy: 0.34309837753273875
Energy: 0.3429784128337354
Energy: 0.3510821853904288
Energy: 0.3328997159973937
Energy: 0.3430664805868499
Energy: 0.3513524820881476
Energy: 0.3318970351368122
Energy: 0.3419607530170136
Energy: 0.36827318996577085
Energy: 0.33918072866507804
Energy: 0.3429220469168252
Energy: 0.35336383322864956
Energy: 0.3320453425899584
Energy: 0.3572843341608753
Energy: 0.3319522668829831
Energy: 0.33233250219799015
Energy: 0.3668312088787754
Energy: 0.33190116720203
Energy: 0.3313422915544831
Energy: 0.33188460405611186
Energy: 0.3317940255364892
Energy: 0.33236640941313844
Energy: 0.34401474850006447
Energy: 0.3315433366419253
Energy: 0.3324865077180299
Energy: 0.3336907294517113
Energy: 0.3331753592944816
Energy: 0.3327333734806142
Energy: 0.35528592365753725
Energy: 0.332825133842097
Energy: 0.3325693639998887
Energy: 0.33198167442187104
Energy: 0.3323519604323506
Energy: 0.35935500342259846
Energy: 0.33155699343952544
Energy: 0.33232756958647935
Energy: 0.33730228833993936
Energy: 0.3330816076057247
Energy: 0.33235082659533033
Energy: 0.33028486951713265
Energy: 0.35507374970600103
Energy: 0.3415549383495835
Energy: 0.337391114952557
Energy: 0.33196135787535996
Energy: 0.3322660508491459
Energy: 0.3303180126018207
Energy: 0.3332672589624355
Energy: 0.3415585700490536
Energy: 0.33251192927337214
Energy: 0.33191594052225915
Energy: 0.3320079305204448
Energy: 0.3527198327713374
Energy: 0.34454407018958466
Energy: 0.3324147506441916
Energy: 0.3936342554856402
Energy: 0.3509983849676558
Energy: 0.3748380646847874
Energy: 0.3935751361893918
Energy: 0.33107427022751656
Energy: 0.3744326131688336
Energy: 0.3561383219409768
Energy: 0.33241971845734697
Energy: 0.3323946415205599
Energy: 0.3409588280845129
Energy: 0.35759215476509665
Energy: 0.3527572138851271
Energy: 0.36441999987202817
Energy: 0.3328434513373021
Energy: 0.33210172967900575
Energy: 0.33009734029865245
Energy: 0.39251785571948655
Energy: 0.33340838997507294
Energy: 0.35895109374672096
Energy: 0.33296415807274915
Energy: 0.3327514427731613
Energy: 0.33990319421478354
Energy: 0.33268225510492877
Energy: 0.33300801306888883
Energy: 0.3628117939764223
Energy: 0.3319603165766665
Energy: 0.3323372845129554
Energy: 0.3544212600454614
Energy: 0.3316743705029807
Energy: 0.3320325793732453
Energy: 0.3652724029714242
Energy: 0.3697673188393577
Energy: 0.33257133298767494
Energy: 0.3680932337234371
Energy: 0.3337481149641766
Energy: 0.3324867568114993
Energy: 0.35904572364211046
Energy: 0.3331139566369244
Energy: 0.34762461387917354
Energy: 0.3604438710260983
Energy: 0.33863901193314444
Energy: 0.34181550260995147
Energy: 0.3434825801518985
Energy: 0.34181358912602494
Energy: 0.3418469788470321
Energy: 0.3437356529948786
Energy: 0.3319401882748759
Energy: 0.3414723648640628
Energy: 0.3427216464303203
Energy: 0.3326465562207832
Energy: 0.35230105867444517
Energy: 0.3591843919430503
Energy: 0.33918454911387136
Energy: 0.3418208749403922
Energy: 0.3327584332251722
Energy: 0.3337123882277603
Energy: 0.332036165123273
Energy: 0.3499882544102269
Energy: 0.37575669239330006
Energy: 0.3321832652705239

minimum gb energy = 0.33009734029865245 eV
minimum distance =  2.67211061297349 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.42144562697926374
Energy: 0.37020487223293763
Energy: 0.3684122249253129
Energy: 0.36691063229189524
Energy: 0.5687014361037905
Energy: 0.3684060224636275
Energy: 0.30817369631625624
Energy: 0.33797614559202
Energy: 0.3696658373963972
Energy: 0.33653929966621066
Energy: 0.33735395947348223
Energy: 0.32239521777796115
Energy: 0.41460374354903323
Energy: 0.3065065592353851
Energy: 0.30692655958651716
Energy: 0.36794543158090093
Energy: 0.3064163806186292
Energy: 0.3068813971394548
Energy: 0.33568093143911637
Energy: 0.3062918078217038
Energy: 0.3060765763357959
Energy: 0.33652571952973
Energy: 0.34628473092091216
Energy: 0.33515732386537367
Energy: 0.33971121316478303
Energy: 0.3237033815420159
Energy: 0.32332359319894977
Energy: 0.33366941463893673
Energy: 0.32218558789390533
Energy: 0.3229347012065096
Energy: 0.36978937809086787
Energy: 0.32139327735628886
Energy: 0.32258089533900086
Energy: 0.3224104729592158
Energy: 0.33421234021044255
Energy: 0.32150187820049286
Energy: 0.33630067022827703
Energy: 0.3343888436293037
Energy: 0.33441665861691455
Energy: 0.3368480067325323
Energy: 0.3349171049239235
Energy: 0.34274826754537563
Energy: 0.3948953969656496
Energy: 0.37288711249842305
Energy: 0.37012790241839744
Energy: 0.3354128311478312
Energy: 0.37182376126702804
Energy: 0.3699289242504885
Energy: 0.33632787800592145
Energy: 0.3353370825539603
Energy: 0.33416405906794777
Energy: 0.33699663376466665
Energy: 0.3368854447075671
Energy: 0.32323255771847625
Energy: 0.3397189393202426
Energy: 0.3323822465312797
Energy: 0.3322029007668641
Energy: 0.36875267015524643
Energy: 0.3330008845723291
Energy: 0.3322248847609919
Energy: 0.3615892415600366
Energy: 0.33204624932584276
Energy: 0.3219913148659437
Energy: 0.3396744607453177
Energy: 0.33460991879997165
Energy: 0.334439425191164
Energy: 0.30592550020743
Energy: 0.3376305099267522
Energy: 0.33565064991549093
Energy: 0.3069711420159791
Energy: 0.3403798223645488
Energy: 0.35860075341293507
Energy: 0.3070780436831851
Energy: 0.3679597619795066
Energy: 0.3587414445664631
Energy: 0.3089273742392382
Energy: 0.3677303949889558
Energy: 0.35875013350556034
Energy: 0.36228482633283904
Energy: 0.3363883808710542
Energy: 0.3223514688619526
Energy: 0.33711069630446217
Energy: 0.33696104816082667
Energy: 0.3341954934387036
Energy: 0.33468904017399115
Energy: 0.3665957394114757
Energy: 0.3695261892884409
Energy: 0.3346847042590137
Energy: 0.36696606808420756
Energy: 0.3681208840965126
Energy: 0.33327933213771566
Energy: 0.3221681901139567
Energy: 0.3226629827597637
Energy: 0.3341180817129025
Energy: 0.34167306170715
Energy: 0.34375436284457617
Energy: 0.3340528063877776
Energy: 0.3228553754695437
Energy: 0.32257316520437307
Energy: 0.3347052053815531
Energy: 0.32591187453195963
Energy: 0.32190747356267474
Energy: 0.3349874297954282
Energy: 0.3340971130994209
Energy: 0.32281741036077793
Energy: 0.33418360045301687
Energy: 0.3337900820749922
Energy: 0.3221198372920481
Energy: 0.3362622210039453
Energy: 0.3355360333877698
Energy: 0.3348610478530216
Energy: 0.34283900478811985
Energy: 0.33657530882152115
Energy: 0.3348930946526614
Energy: 0.33634281264530497
Energy: 0.3361670589491599
Energy: 0.3354452441218186
Energy: 0.33641011017041567
Energy: 0.33590250545681904
Energy: 0.3348596032751961
Energy: 0.33837888335261923
Energy: 0.33500794893855257
Energy: 0.32212014568586966
Energy: 0.3384206514301571
Energy: 0.3367868907393416
Energy: 0.3231281458623468
Energy: 0.3820732922341281
Energy: 0.3333076755929953
Energy: 0.36671908309582046
Energy: 0.3719862672885671
Energy: 0.33382786391164126
Energy: 0.3678151560032846
Energy: 0.36226592945965713
Energy: 0.336690781272985
Energy: 0.33413223213829246
Energy: 0.33766410733145186
Energy: 0.3371860239775086
Energy: 0.3427539690721305
Energy: 0.307351055283278
Energy: 0.36793945146795654
Energy: 0.3587195380858349
Energy: 0.3739248445672378
Energy: 0.3401464803052536
Energy: 0.3586293481204905

minimum gb energy = 0.30592550020743 eV
minimum distance =  2.64218390483844 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.5008784159624553
Energy: 0.3818316950428841
Energy: 0.38146438260221766
Energy: 0.33085241084512923
Energy: 0.3483605665451486
Energy: 0.331312943936232
Energy: 0.3105585106919891
Energy: 0.35205629508234704
Energy: 0.3295132446654079
Energy: 0.3556383117079221
Energy: 0.35436907101345866
Energy: 0.3271749413449768
Energy: 0.3911387435556148
Energy: 0.3107929078014447
Energy: 0.31096051651514844
Energy: 0.35495940548015253
Energy: 0.31098472287159207
Energy: 0.3110402339098026
Energy: 0.35549072487079103
Energy: 0.31085160751674656
Energy: 0.31064085817601894
Energy: 0.35181465536614726
Energy: 0.30656055267579463
Energy: 0.3402898203253231
Energy: 0.30427197888004714
Energy: 0.29980007180027646
Energy: 0.2995692681890966
Energy: 0.304423728066757
Energy: 0.3325645052669064
Energy: 0.29872763023824206
Energy: 0.31072470377400163
Energy: 0.2994439410314533
Energy: 0.2989912532865492
Energy: 0.348481567321126
Energy: 0.2994441188695383
Energy: 0.28554261922821134
Energy: 0.2988869977839823
Energy: 0.29837224449137534
Energy: 0.29852113258300295
Energy: 0.2990870949725466
Energy: 0.3007507433177509
Energy: 0.2988999308533612
Energy: 0.2994896714538305
Energy: 0.31341492297473644
Energy: 0.34860644774265065
Energy: 0.31258904234961704
Energy: 0.3135342411275626
Energy: 0.3482378088049741
Energy: 0.299524229723319
Energy: 0.3015674649072782
Energy: 0.3008161256435922
Energy: 0.3004204644938179
Energy: 0.2987174787834276
Energy: 0.298901873421946
Energy: 0.29875216626060913
Energy: 0.29891503735105995
Energy: 0.2988231439983489
Energy: 0.29893969879763616
Energy: 0.2995422283633105
Energy: 0.29927062701471613
Energy: 0.2997425582134813
Energy: 0.3280954171979118
Energy: 0.2987053709405866
Energy: 0.3328819457744974
Energy: 0.3555281449322
Energy: 0.29950783208380816
Energy: 0.30368921013279093
Energy: 0.3518617438671301
Energy: 0.3516844412198029
Energy: 0.3037179185374322
Energy: 0.351242790188227
Energy: 0.34177782464027373
Energy: 0.30361838602226715
Energy: 0.35536871684483046
Energy: 0.3552325695275615
Energy: 0.31648921032246996
Energy: 0.35539429974789055
Energy: 0.3550181748865624
Energy: 0.35620788831094474
Energy: 0.35257432996779137
Energy: 0.32663277944425384
Energy: 0.3553335297077009
Energy: 0.35399504966006295
Energy: 0.3269616568608516
Energy: 0.3579225416193923
Energy: 0.35535994094483253
Energy: 0.355393205115297
Energy: 0.3482604043756338
Energy: 0.35518464002392447
Energy: 0.35244489263554696
Energy: 0.3713569821736932
Energy: 0.37464783104109706
Energy: 0.32830630692362445
Energy: 0.3555106861653461
Energy: 0.35611929492506755
Energy: 0.35219615209591437
Energy: 0.2849766260399181
Energy: 0.35777994360606385
Energy: 0.3897894271824902
Energy: 0.3758596878883309
Energy: 0.3576267543260642
Energy: 0.3898246762095494

minimum gb energy = 0.2849766260399181 eV
minimum distance =  2.65606775541917 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.5391784371665936
Energy: 0.395101919563073
Energy: 0.3424111992448901
Energy: 0.34051884047183306
Energy: 0.4943298140207667
Energy: 0.3413990134124025
Energy: 0.32278531518998266
Energy: 0.30466687597209013
Energy: 0.30409187428053697
Energy: 0.36372937131850874
Energy: 0.3606224654227261
Energy: 0.3358894914536998
Energy: 0.42108909669081884
Energy: 0.28323478075821945
Energy: 0.3230974927832751
Energy: 0.359126974994755
Energy: 0.28320224624181534
Energy: 0.3230538181916412
Energy: 0.310447855019379
Energy: 0.3227365946414505
Energy: 0.3228664903093077
Energy: 0.3079419987515715
Energy: 0.28656350419763665
Energy: 0.3229222012996797
Energy: 0.3094153560568266
Energy: 0.30784023876811256
Energy: 0.3048689966191972
Energy: 0.3098007405872581
Energy: 0.3045822901333438
Energy: 0.30495414101199725
Energy: 0.27118815095241533
Energy: 0.30354192724532525
Energy: 0.28410487214211194
Energy: 0.2856698768031372
Energy: 0.3035633672414337
Energy: 0.2838818267077668
Energy: 0.2775119533709735
Energy: 0.3076730323143324
Energy: 0.30330047959966533
Energy: 0.2780500018482284
Energy: 0.30514274825239646
Energy: 0.2967995616757496
Energy: 0.27845729010907194
Energy: 0.2929429522479856
Energy: 0.28125508188855847
Energy: 0.2783195052651717
Energy: 0.274897503660784
Energy: 0.2799657410004119
Energy: 0.2784255389224322
Energy: 0.27837531213322025
Energy: 0.27771745402774395
Energy: 0.27906116040926926
Energy: 0.28552196575911626
Energy: 0.27775874588472965
Energy: 0.2777459754818943
Energy: 0.3063973435878878
Energy: 0.29397272727152673
Energy: 0.2775094418627739
Energy: 0.3119999379520262
Energy: 0.31247561417599395
Energy: 0.27792347495322567
Energy: 0.2773012734910629
Energy: 0.3035036122268703
Energy: 0.3122200799116991
Energy: 0.27761664004567776
Energy: 0.32629750991456935
Energy: 0.279711537530866
Energy: 0.2778788488535478
Energy: 0.2777454689708614
Energy: 0.28498989596907914
Energy: 0.2807072350664178
Energy: 0.2775250650347367
Energy: 0.2857381240300628
Energy: 0.2804067761523273
Energy: 0.278119427972865
Energy: 0.2892534685260034
Energy: 0.27833584934914885
Energy: 0.27816501218936196
Energy: 0.303973987402424
Energy: 0.3093159005817268
Energy: 0.2964521067650063
Energy: 0.3050503387810293
Energy: 0.27792177621710457
Energy: 0.3033384726065485
Energy: 0.3034996898400707
Energy: 0.2885617686452047
Energy: 0.28904051779750395
Energy: 0.3035431693126043
Energy: 0.3172389377525681
Energy: 0.30434850188323354
Energy: 0.35447089344263377
Energy: 0.3049830486667513
Energy: 0.30531879891646324
Energy: 0.3089644375931226
Energy: 0.31004157736837135
Energy: 0.3048076473290442
Energy: 0.27834074799472824
Energy: 0.3595092958605979
Energy: 0.35943098123410067
Energy: 0.2787654829763041
Energy: 0.3596906548729077
Energy: 0.30324573104928315
Energy: 0.31575125054839165
Energy: 0.35986271504356826
Energy: 0.3597293175792655
Energy: 0.31040404760590934
Energy: 0.359654916792656
Energy: 0.303820301000591
Energy: 0.3541273314534662
Energy: 0.35058366180966327
Energy: 0.336470308727442
Energy: 0.3230844627406828
Energy: 0.306569457108055
Energy: 0.3045625491513421
Energy: 0.4172107448965981
Energy: 0.30405272113985216
Energy: 0.303367550959525
Energy: 0.3594173339440101
Energy: 0.3062750030057136
Energy: 0.3572276022475321
Energy: 0.3866115131627641
Energy: 0.3505852346761364
Energy: 0.30593298810572356
Energy: 0.3600681550591706
Energy: 0.34899025780284454
Energy: 0.3045050812984974
Energy: 0.2835260983013699
Energy: 0.36426359784907364
Energy: 0.3946021631952857
Energy: 0.32353515624904844
Energy: 0.36372722290671566
Energy: 0.3227649994360853
Energy: 0.2856732261475295
Energy: 0.3650050987057124
Energy: 0.3038852455934738
Energy: 0.28643693023971945
Energy: 0.364228952960382
Energy: 0.3397701226551512
Energy: 0.41605455842150607
Energy: 0.33267776195870064
Energy: 0.3056917142149977
Energy: 0.36068292881730474
Energy: 0.2834619181060388
Energy: 0.349312644159127
Energy: 0.35865324271021315
Energy: 0.28675784611214866
Energy: 0.32327234917686737
Energy: 0.3587708241734016
Energy: 0.2852689591299197
Energy: 0.32302922473726436
Energy: 0.31064995372873927
Energy: 0.30519928606997404
Energy: 0.3059210784580603
Energy: 0.3110760141761578
Energy: 0.30467676079432104
Energy: 0.33516970815676783
Energy: 0.27125721870993325
Energy: 0.30759999618868955
Energy: 0.30413066716164067
Energy: 0.3087635529813149
Energy: 0.3039991087823374
Energy: 0.28441852501414644
Energy: 0.2744433799024408
Energy: 0.30726761430614924
Energy: 0.30420702058012633
Energy: 0.2711159778716326
Energy: 0.30506376116035533
Energy: 0.303764391189578
Energy: 0.37744883849284105
Energy: 0.3048233191283505
Energy: 0.27798492244538303
Energy: 0.28219428094435645
Energy: 0.30369669966678936
Energy: 0.27934517006491655
Energy: 0.2778848066020059
Energy: 0.2733293443144786
Energy: 0.2786477917409688
Energy: 0.2777045315293301
Energy: 0.2935351797862057
Energy: 0.2777645123816724
Energy: 0.2805266242642867
Energy: 0.2842455442094192
Energy: 0.3036404330078178
Energy: 0.281227793490153
Energy: 0.284288761625245
Energy: 0.27831161081690287
Energy: 0.2783461063082543
Energy: 0.3024569497081547
Energy: 0.3249646868572728
Energy: 0.28867619140219875
Energy: 0.3119241325650676
Energy: 0.3018966830855274
Energy: 0.2835999784275742
Energy: 0.28090414744804754
Energy: 0.27829501102487747
Energy: 0.28412707697487816
Energy: 0.2798530806897278
Energy: 0.27782843832181925
Energy: 0.2835613974925017
Energy: 0.27852838211021624
Energy: 0.27979268039343963
Energy: 0.3181913973581589
Energy: 0.27802535965859243
Energy: 0.30954463125344517
Energy: 0.3070548823755703
Energy: 0.2787852530351665
Energy: 0.2779633226465916
Energy: 0.3076548062845472
Energy: 0.30647813960963544
Energy: 0.2966423447982995
Energy: 0.30388984019549137
Energy: 0.2782945751796676
Energy: 0.3040369833920201
Energy: 0.30390642781827754
Energy: 0.27821813851169
Energy: 0.3037211154461087
Energy: 0.38625918227327016
Energy: 0.3041774655886744
Energy: 0.3049151224924661
Energy: 0.3075800078636936
Energy: 0.31086717410766423
Energy: 0.3044367421046926
Energy: 0.277447813634474
Energy: 0.3357759546401557
Energy: 0.30428854001561356
Energy: 0.30981044478302877
Energy: 0.3609083493266055
Energy: 0.3051351978212482
Energy: 0.2771084208993273
Energy: 0.36055574742528923
Energy: 0.31540186395440817
Energy: 0.30442902782802217
Energy: 0.36318455100452895
Energy: 0.3152113977691744
Energy: 0.3038831343769768
Energy: 0.3489721475704084
Energy: 0.3517288700410861
Energy: 0.31020196102706493
Energy: 0.3609365318378129
Energy: 0.3352550432518026
Energy: 0.401752902347302
Energy: 0.3037332970778775
Energy: 0.35713391855848614
Energy: 0.3649136505009625
Energy: 0.30387064624197485
Energy: 0.3580503914258303
Energy: 0.4158133349051347
Energy: 0.3388765271016413
Energy: 0.30377875671143056
Energy: 0.36409691762664737
Energy: 0.3096531592415817
Energy: 0.3467069867335898
Energy: 0.2867391664559833
Energy: 0.36465629387983584
Energy: 0.359521297046403
Energy: 0.28721346492273087
Energy: 0.3642178681483511
Energy: 0.33947105078336925

minimum gb energy = 0.2711159778716326 eV
minimum distance =  2.62869336659678 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.4863234520667001
Energy: 0.38813656967688864
Energy: 0.3429911816390984
Energy: 0.31707685835936855
Energy: 0.40070457511495294
Energy: 0.35047598192052065
Energy: 0.3274941974213843
Energy: 0.3117633462335972
Energy: 0.3135695969640918
Energy: 0.348401990231661
Energy: 0.31982806526506313
Energy: 0.334807211847327
Energy: 0.404561053646166
Energy: 0.2875066443742927
Energy: 0.2880957534621415
Energy: 0.35478842757815804
Energy: 0.30187554723675897
Energy: 0.3266114126189256
Energy: 0.3482160185159397
Energy: 0.28806764655130984
Energy: 0.3264401399021858
Energy: 0.3100248721599107
Energy: 0.30263196475449017
Energy: 0.3268037743146804
Energy: 0.3026001164778968
Energy: 0.31086864662155356
Energy: 0.31370541644906075
Energy: 0.30269307405836127
Energy: 0.30900320423936034
Energy: 0.3080619957628328
Energy: 0.2605439391876559
Energy: 0.3070595666430835
Energy: 0.2880710089316758
Energy: 0.2829318718235886
Energy: 0.30691477308998627
Energy: 0.28743029323592856
Energy: 0.27674905732800986
Energy: 0.3107279130043346
Energy: 0.3139377797095143
Energy: 0.30553023889278763
Energy: 0.30999116688363104
Energy: 0.2981332528301901
Energy: 0.3593856758621855
Energy: 0.32090054068261636
Energy: 0.2665610291968796
Energy: 0.2908845763038725
Energy: 0.31360810949092516
Energy: 0.2789262077142238
Energy: 0.27915742283948114
Energy: 0.2770470930341059
Energy: 0.27671778408125963
Energy: 0.2798746095908798
Energy: 0.2803713822256039
Energy: 0.27713648583416306
Energy: 0.2768599820586008
Energy: 0.27570905807521623
Energy: 0.27266965869060017
Energy: 0.2769372775761724
Energy: 0.2813133621446825
Energy: 0.2725498974533674
Energy: 0.26665141899395933
Energy: 0.2625770572391789
Energy: 0.2635240859886262
Energy: 0.28970008345384923
Energy: 0.26281978510615894
Energy: 0.26424633978124895
Energy: 0.27916754643294306
Energy: 0.2674106596686006
Energy: 0.27073903480726735
Energy: 0.2936656687289412
Energy: 0.2673941471823908
Energy: 0.26433484812079894
Energy: 0.2626301624632522
Energy: 0.2943593113026044
Energy: 0.3045355122454318
Energy: 0.2975145701589249
Energy: 0.29329465666120486
Energy: 0.30549436822652054
Energy: 0.2630481057143599
Energy: 0.31012819684766785
Energy: 0.2627775321727201
Energy: 0.2640085835901303
Energy: 0.2695059618135787
Energy: 0.2705760357509995
Energy: 0.26265283432666264
Energy: 0.2970488679892563
Energy: 0.2975558547940041
Energy: 0.2625300148171875
Energy: 0.2933156709816216
Energy: 0.3161261935784452
Energy: 0.2853947941778861
Energy: 0.2768504470663873
Energy: 0.28835102996355794
Energy: 0.2833659890451625
Energy: 0.28280796025457977
Energy: 0.3166977950009734
Energy: 0.2639186838251786
Energy: 0.2831639823453546
Energy: 0.2769159461182661
Energy: 0.3096115126257196
Energy: 0.281158442600021
Energy: 0.2766246430478003
Energy: 0.2650451538589561
Energy: 0.2832580019210276
Energy: 0.27771811766299287
Energy: 0.28527466026364595
Energy: 0.28155819729807896
Energy: 0.2780140112395913
Energy: 0.30772123225681436
Energy: 0.29995423821934336
Energy: 0.30869741656051347
Energy: 0.3082339286998673
Energy: 0.2855789457859433
Energy: 0.30749435027799094
Energy: 0.30720107973653416
Energy: 0.2868029427824366
Energy: 0.2864509198318337
Energy: 0.3075503827937842
Energy: 0.28565843549030195
Energy: 0.31590107041594395
Energy: 0.380349538695177
Energy: 0.3127444241027954
Energy: 0.31791142508602305
Energy: 0.3081629775462262
Energy: 0.31532594683841575
Energy: 0.30844646942922244
Energy: 0.2632101284874906
Energy: 0.3579025673014292
Energy: 0.30695963674143517
Energy: 0.2917588684367471
Energy: 0.3642337746536705
Energy: 0.30694855963242573
Energy: 0.2803636271213422
Energy: 0.3623415540067615
Energy: 0.3532245574810914
Energy: 0.2805251669953933
Energy: 0.36144881132286744
Energy: 0.34645864548984673
Energy: 0.3778009191150987
Energy: 0.3072238456526043
Energy: 0.30881830997263054
Energy: 0.31250415385136016
Energy: 0.3200258385078541
Energy: 0.312286521977192
Energy: 0.40932912938384786
Energy: 0.3119029978771583
Energy: 0.30744737260561333
Energy: 0.35543526625146543
Energy: 0.3159805588070808
Energy: 0.3539589329913126
Energy: 0.37487808458293975
Energy: 0.3503265086584551
Energy: 0.3531303931993768
Energy: 0.3466556235105709
Energy: 0.34779790214845446
Energy: 0.33710641001647684
Energy: 0.26601466320338746
Energy: 0.35661535543296147
Energy: 0.3264571129456323
Energy: 0.2874018218373932
Energy: 0.35577106133428343
Energy: 0.3265768668729252

minimum gb energy = 0.2605439391876559 eV
minimum distance =  2.63078386819389 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.23876867463131207
Energy: 0.33549798482059784
Energy: 0.32505681490362626
Energy: 0.2756096415944167
Energy: 0.3228051211895166
Energy: 0.3030250965780029
Energy: 0.3478363025359638
Energy: 0.29561447613700537
Energy: 0.29560161021192255
Energy: 0.3222277758480735
Energy: 0.29746826590016323
Energy: 0.30573892924389345
Energy: 0.3589618646446762
Energy: 0.26372253455475464
Energy: 0.2753819832898162
Energy: 0.31751535229451017
Energy: 0.2818486798602556
Energy: 0.27285432878056626
Energy: 0.3209186110196386
Energy: 0.2849244223793192
Energy: 0.2729526218482084
Energy: 0.29117115616500355
Energy: 0.2727371306405094
Energy: 0.30496713859156505
Energy: 0.2509930828335336
Energy: 0.2891870938766286
Energy: 0.28963094016781865
Energy: 0.2877570571451786
Energy: 0.29108541125931786
Energy: 0.2917326911061919
Energy: 0.22885933882436452
Energy: 0.2890396308187359
Energy: 0.27294667503489545
Energy: 0.2727250358893273
Energy: 0.28900882004148226
Energy: 0.25144724414571684
Energy: 0.32640559663011415
Energy: 0.28940056861125685
Energy: 0.2890055072657032
Energy: 0.2680200468681342
Energy: 0.2916125293458886
Energy: 0.2808160527781708
Energy: 0.32650155627970184
Energy: 0.2724076468129878
Energy: 0.2843596618522184
Energy: 0.2669978930563328
Energy: 0.2749498184762658
Energy: 0.25667561601196826
Energy: 0.26314789667804134
Energy: 0.2683589700114597
Energy: 0.2618041391633109
Energy: 0.26391423321390034
Energy: 0.23656987659520579
Energy: 0.2620576806928865
Energy: 0.2552087643859145
Energy: 0.24475637271144174
Energy: 0.2538025010783189
Energy: 0.26243087427624406
Energy: 0.2507157238202126
Energy: 0.28195515694405937
Energy: 0.22632391120393286
Energy: 0.24379378049533904
Energy: 0.2442142744879953
Energy: 0.2680781997844144
Energy: 0.243820779929141
Energy: 0.25990669631489566
Energy: 0.26377760833836283
Energy: 0.24413264380996802
Energy: 0.24383926017117677
Energy: 0.24268248939061732
Energy: 0.2442599402544379
Energy: 0.257947072179452
Energy: 0.3060984406167244
Energy: 0.2686382168566259
Energy: 0.2725826398286069
Energy: 0.24366782485190017
Energy: 0.2691711949412342
Energy: 0.27184512676189043
Energy: 0.23318926876831922
Energy: 0.2336479993603058
Energy: 0.2329355136540304
Energy: 0.23390304989916785
Energy: 0.22794150962569276
Energy: 0.23325451155106836
Energy: 0.2330067487121751
Energy: 0.2288752343181221
Energy: 0.22883038235812803
Energy: 0.23299553579508825
Energy: 0.22927440530308998
Energy: 0.2707961539698818
Energy: 0.22946913841688277
Energy: 0.22763805461453826
Energy: 0.228100977163921
Energy: 0.2681766224939788
Energy: 0.22780872465005356
Energy: 0.2705042689326032
Energy: 0.23435896830921463
Energy: 0.22759026749642652
Energy: 0.22779751689697897
Energy: 0.267805579609426
Energy: 0.22795174772760055
Energy: 0.26909905063930806
Energy: 0.22779801943376535
Energy: 0.2691758481981884
Energy: 0.2693251398214945
Energy: 0.22809450210872811
Energy: 0.2556733102455494
Energy: 0.2693479608885656
Energy: 0.22801766443264787
Energy: 0.2282342280635089
Energy: 0.22752802881478854
Energy: 0.2286267499617535
Energy: 0.2539203368924976
Energy: 0.22783919175151957
Energy: 0.22787997637596094
Energy: 0.26778625225115193
Energy: 0.2714107720268943
Energy: 0.22805281990237977
Energy: 0.2677469913573767
Energy: 0.27215209162252424
Energy: 0.24516257352022308
Energy: 0.23298503072550886
Energy: 0.23303579197083776
Energy: 0.2568354844316145
Energy: 0.2331586651540582
Energy: 0.2726047628941606
Energy: 0.22979929367465057
Energy: 0.23285112849894254
Energy: 0.2331003007724497
Energy: 0.272153077455571
Energy: 0.23289482839951123
Energy: 0.2542604061349808
Energy: 0.24420381780318268
Energy: 0.23401521559257674
Energy: 0.23402262825321155
Energy: 0.24387119255869627
Energy: 0.2344109489914583
Energy: 0.2701343405358262
Energy: 0.24395648864793337
Energy: 0.2445301267249691
Energy: 0.2438647004666471
Energy: 0.24478644710405148
Energy: 0.23316074868514047
Energy: 0.2442086515120479
Energy: 0.3151567517973566
Energy: 0.27188363792565157
Energy: 0.2811289554001152
Energy: 0.2536190449732689
Energy: 0.27205305303611577
Energy: 0.26845379425210175
Energy: 0.29729066188595027
Energy: 0.26217771809808194
Energy: 0.2618548042155961
Energy: 0.25362455753304536
Energy: 0.2624229043252497
Energy: 0.25001145239385264
Energy: 0.2276447034468955
Energy: 0.26179725013074806
Energy: 0.26184899753894403
Energy: 0.27076074329897853
Energy: 0.2617142713686705
Energy: 0.25383627005527587
Energy: 0.24521689613743752
Energy: 0.26284658169506486
Energy: 0.26935388494249046
Energy: 0.2735761685027088
Energy: 0.263847573785227
Energy: 0.2787715297908042
Energy: 0.2903740353263361
Energy: 0.26191988217745665
Energy: 0.28909880467239946
Energy: 0.2912208175086958
Energy: 0.24372715071695844
Energy: 0.289223722305349
Energy: 0.3436804072857323
Energy: 0.24994276416416802
Energy: 0.2616784948179842
Energy: 0.2891357917332742
Energy: 0.2772114262928765
Energy: 0.26199135717577154
Energy: 0.3396699333957175
Energy: 0.29563474728628675
Energy: 0.2893928694152841
Energy: 0.29136119495634444
Energy: 0.29565019903019796
Energy: 0.29171274495285626
Energy: 0.2330000077112073
Energy: 0.3213896449565102
Energy: 0.2888879129531786
Energy: 0.27809229913866595
Energy: 0.32071978757626146
Energy: 0.27271830096603483
Energy: 0.26182135416484664
Energy: 0.3223492782847159
Energy: 0.3196553771111516
Energy: 0.29041073382099886
Energy: 0.32072070605868813
Energy: 0.2901021620344067
Energy: 0.3421954036639627
Energy: 0.28953363475178756
Energy: 0.28909643042335337
Energy: 0.2914568263885775
Energy: 0.2639389294486994
Energy: 0.3189787270940038
Energy: 0.35686821379599454
Energy: 0.26838649064876435
Energy: 0.29167696178868685
Energy: 0.317289722300262
Energy: 0.2687636429808571
Energy: 0.28907105847060965
Energy: 0.33480189885416645
Energy: 0.3222901909647486
Energy: 0.31959770120087194
Energy: 0.322015446869451
Energy: 0.32037651061365374
Energy: 0.2958051654158445

minimum gb energy = 0.22632391120393286 eV
minimum distance =  2.62478923887011 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.03839026178924199
Energy: 0.06027508294664848
Energy: 0.038572103358634806
Energy: 0.03982253329891875
Energy: 0.04230129879187964
Energy: 0.03878504034875408
Energy: 0.060622606105291806
Energy: 0.04053678665497879
Energy: 0.04060757320898536
Energy: 0.0627655464563489
Energy: 0.042790493325637204
Energy: 0.0405357122429743
Energy: 0.06186842262796127
Energy: 0.038783513813090614
Energy: 0.038731210357655706
Energy: 0.06154887971553259
Energy: 0.03859826099756195
Energy: 0.060538455881543114
Energy: 0.042049989669163935
Energy: 0.03924438709521213
Energy: 0.03860233673560894
Energy: 0.04328609675039195
Energy: 0.038670504439700895
Energy: 0.06042531537793747
Energy: 0.06025011264517765
Energy: 0.061832910753817055
Energy: 0.06201202344071179
Energy: 0.06079092234088554
Energy: 0.0613763884294723
Energy: 0.06178641893795781
Energy: 0.03898824951264074
Energy: 0.04063889101998642
Energy: 0.03863769788246701
Energy: 0.040372387684058236
Energy: 0.04048590831150959
Energy: 0.038761670942995693
Energy: 0.06219228496906384
Energy: 0.04042090146401955
Energy: 0.040452080665759296
Energy: 0.06224008252382295
Energy: 0.04005345717174203
Energy: 0.040343112232389476
Energy: 0.06183337584501151
Energy: 0.038640596285669765
Energy: 0.038638716529287354
Energy: 0.061669951266286896
Energy: 0.03862729961355115
Energy: 0.060414836633070526
Energy: 0.04078427411175131
Energy: 0.0384663241558565
Energy: 0.06106212936335958
Energy: 0.04177912856880083
Energy: 0.038879106432339564
Energy: 0.06118462870653875
Energy: 0.03905935800671587
Energy: 0.06205034413480204
Energy: 0.06138484874762393
Energy: 0.03898384442762949
Energy: 0.06150204890686876
Energy: 0.06187044025099332

minimum gb energy = 0.03839026178924199 eV
minimum distance =  2.86145935038212 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.3068693272372895
Energy: 0.3307415754419725
Energy: 0.3246067262502533
Energy: 0.25627933221442367
Energy: 0.29727127595613045
Energy: 0.28459099229960527
Energy: 0.30625773485981567
Energy: 0.2955542900182021
Energy: 0.26961716576617584
Energy: 0.2961039781040454
Energy: 0.29527603727053076
Energy: 0.2698542927758347
Energy: 0.31490672644580264
Energy: 0.265745748138593
Energy: 0.2657385271188301
Energy: 0.2952316908923733
Energy: 0.26855196005976656
Energy: 0.2679228313279522
Energy: 0.29629768350399227
Energy: 0.2452587972668061
Energy: 0.24525051543661894
Energy: 0.294848341527817
Energy: 0.26527785670260096
Energy: 0.26803973245288965
Energy: 0.2666562609149889
Energy: 0.26954432852532706
Energy: 0.27004430306730165
Energy: 0.26663917995413794
Energy: 0.29552868170119323
Energy: 0.26979776390604543
Energy: 0.24551617236230827
Energy: 0.2869121459755339
Energy: 0.26753799119037375
Energy: 0.24679821081301218
Energy: 0.28643776265561566
Energy: 0.265642458087315
Energy: 0.29656973825679145
Energy: 0.26913643485643557
Energy: 0.2695019279603294
Energy: 0.2944131958263387
Energy: 0.270751136580351
Energy: 0.2980253885559386
Energy: 0.29441864868665146
Energy: 0.24624301764967546
Energy: 0.27562744636816383
Energy: 0.2944860630292801
Energy: 0.23322874042340894
Energy: 0.26781137747133416
Energy: 0.249185620788525
Energy: 0.2473963745330046
Energy: 0.2799029744129709
Energy: 0.24902056318653562
Energy: 0.2462527205728169
Energy: 0.2699920630303902
Energy: 0.2472264086173393
Energy: 0.26879821649037866
Energy: 0.2692589597648217
Energy: 0.24727107937336562
Energy: 0.27033001756047764
Energy: 0.269320029083085
Energy: 0.23301206513872244
Energy: 0.2706288450203662
Energy: 0.26966797633252293
Energy: 0.23361553453890746
Energy: 0.23442531233346448
Energy: 0.24778610508870164
Energy: 0.2472400959267591
Energy: 0.24857527704335602
Energy: 0.2705364288301255
Energy: 0.24721278762083043
Energy: 0.2489055101309242
Energy: 0.2474067175379877
Energy: 0.2562713781993434
Energy: 0.22526592764490422
Energy: 0.2341304095150841
Energy: 0.24842878348678496
Energy: 0.22635369333315594
Energy: 0.2484972354265855
Energy: 0.22628209011995373
Energy: 0.2339882423160948
Energy: 0.2495734889007305
Energy: 0.2493450221999765
Energy: 0.23345156987726207
Energy: 0.24871666539843648
Energy: 0.22656051711141142
Energy: 0.23313141649175767
Energy: 0.2331432371801204
Energy: 0.22656631286768142
Energy: 0.23561795396872556
Energy: 0.23358656163061164
Energy: 0.2270863674734342
Energy: 0.23430040153332338
Energy: 0.2340956195207831
Energy: 0.22798406698069842
Energy: 0.22696041688619306
Energy: 0.24698191517765478
Energy: 0.22888428789790233
Energy: 0.23369961401622694
Energy: 0.22668954276691422
Energy: 0.2264415217601835
Energy: 0.23429949256176374
Energy: 0.2265471640374646
Energy: 0.22633819858402426
Energy: 0.2268045354783642
Energy: 0.2279072395630465
Energy: 0.22654786001351163
Energy: 0.22657390158093835
Energy: 0.22701767059003428
Energy: 0.23343368181266064
Energy: 0.2274216487302361
Energy: 0.23818580651239937
Energy: 0.22687731372132508
Energy: 0.22725826442419303
Energy: 0.24663066833318653
Energy: 0.22680255332520982
Energy: 0.22619373128593834
Energy: 0.2261827630569513
Energy: 0.28405303962321116
Energy: 0.22853043572054488
Energy: 0.22657767907959586
Energy: 0.28287985886638506
Energy: 0.22652517527981833
Energy: 0.2771286550594948
Energy: 0.2882063471253646
Energy: 0.22641390221975116
Energy: 0.23414796346631597
Energy: 0.2363042324416217
Energy: 0.226607405357859
Energy: 0.23429741241803745
Energy: 0.23705448950838537
Energy: 0.22683190459202793
Energy: 0.23353883136727627
Energy: 0.23330889378610203
Energy: 0.24823319542797517
Energy: 0.2835329345707775
Energy: 0.2333745175976238
Energy: 0.24828192577167457
Energy: 0.28538499015896274
Energy: 0.22982722499722155
Energy: 0.2489986854959377
Energy: 0.2488004728600467
Energy: 0.22778722536190565
Energy: 0.24876926604603078
Energy: 0.2383334174624719
Energy: 0.23359472918277405
Energy: 0.24727951777910123
Energy: 0.24739948103122572
Energy: 0.23559982315585534
Energy: 0.2493921911057113
Energy: 0.24772466438021762
Energy: 0.23375479779659167
Energy: 0.2378525668767115
Energy: 0.25678992577314463
Energy: 0.23475848039268438
Energy: 0.2266025058098644
Energy: 0.2698417871367188
Energy: 0.27079053470890707
Energy: 0.2633084698084014
Energy: 0.2566225047632434
Energy: 0.27055856467623884
Energy: 0.23853944500202884
Energy: 0.26952027644226634
Energy: 0.25546509945626134
Energy: 0.2799223134603658
Energy: 0.2801823022430762
Energy: 0.25548387629033037
Energy: 0.26887154780681555
Energy: 0.2699173447640008
Energy: 0.23702642813848462
Energy: 0.2957722720786595
Energy: 0.2814716232792108
Energy: 0.23833298985982887
Energy: 0.29406409748013235
Energy: 0.2551733132772982
Energy: 0.268696599579263
Energy: 0.269558677672779
Energy: 0.26981318135588533
Energy: 0.26872037599063303
Energy: 0.29452245844807873
Energy: 0.30279238388576174
Energy: 0.2694074995601095
Energy: 0.2543753935706252
Energy: 0.28960952685052455
Energy: 0.2689392160604863
Energy: 0.23804164297228658
Energy: 0.278257837284731
Energy: 0.32699217412128084
Energy: 0.23787733047776874
Energy: 0.2564657219530776
Energy: 0.29515229766705636
Energy: 0.2542998365431876
Energy: 0.26973346753484573
Energy: 0.27741377537091394
Energy: 0.2945968826954147
Energy: 0.269801433254914
Energy: 0.27748247790320313
Energy: 0.2962287472926363
Energy: 0.28201812235481655

minimum gb energy = 0.22526592764490422 eV
minimum distance =  2.59872578797727 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.3220675507267159
Energy: 0.38208684851348307
Energy: 0.3632889715466613
Energy: 0.2802526851601519
Energy: 0.4197696135476636
Energy: 0.3715842815860214
Energy: 0.3506961749716201
Energy: 0.32565321285400456
Energy: 0.29424462315279976
Energy: 0.32826828848832534
Energy: 0.3615413984719419
Energy: 0.2991281205741744
Energy: 0.3661699078633277
Energy: 0.29312555250027317
Energy: 0.31372857346983113
Energy: 0.32564928386552056
Energy: 0.29044847363066156
Energy: 0.2912369379737059
Energy: 0.3270921243662691
Energy: 0.31374155304358775
Energy: 0.29301740473471655
Energy: 0.3274700036693914
Energy: 0.2915943191416363
Energy: 0.2930057195123345
Energy: 0.3252454349373261
Energy: 0.33006088567226316
Energy: 0.2949401483990164
Energy: 0.3254775173842918
Energy: 0.36101223624662354
Energy: 0.2975627662999024
Energy: 0.2744339915779608
Energy: 0.2912442975171244
Energy: 0.2899569539485184
Energy: 0.2924635473105148
Energy: 0.293554586045972
Energy: 0.30577155965159597
Energy: 0.3287174516093588
Energy: 0.29545915738124434
Energy: 0.2910322012333527
Energy: 0.3287133911858519
Energy: 0.293540760989253
Energy: 0.29434278439703637
Energy: 0.32903147354237794
Energy: 0.27533144005786025
Energy: 0.27209393869657517
Energy: 0.32960097796134863
Energy: 0.2736057709003581
Energy: 0.29559963538458683
Energy: 0.33971734180958313
Energy: 0.29824031665054596
Energy: 0.28659163358054907
Energy: 0.30611663887176205
Energy: 0.2905078333052396
Energy: 0.29564288708283354
Energy: 0.2724300226087532
Energy: 0.29340522894755344
Energy: 0.2902654074338897
Energy: 0.27235146486032497
Energy: 0.2914674815025192
Energy: 0.29051865459505033
Energy: 0.2719040794997203
Energy: 0.29464761489055635
Energy: 0.2912523764888927
Energy: 0.2737166741743038
Energy: 0.2902880975065523
Energy: 0.2723512004259879
Energy: 0.2751330746263357
Energy: 0.29452468421331496
Energy: 0.2727976239682247
Energy: 0.2753524929187727
Energy: 0.3049714896172893
Energy: 0.2715757727496694
Energy: 0.2768473949872646
Energy: 0.27662792834203076
Energy: 0.2780918724982072
Energy: 0.27744393333739736
Energy: 0.27420267709508817
Energy: 0.2717374305649668
Energy: 0.2890640035563876
Energy: 0.2839709681003748
Energy: 0.2736677890497628
Energy: 0.2733628413738245
Energy: 0.27222399705368183
Energy: 0.27229676109709083
Energy: 0.304291153510224
Energy: 0.2750351321235642
Energy: 0.2722428548812976
Energy: 0.3029530094416279
Energy: 0.2743907551499504
Energy: 0.27167258738920763
Energy: 0.27298657309200014
Energy: 0.2768749011047316
Energy: 0.2721994414927279
Energy: 0.3044111928276318
Energy: 0.2723126239023312
Energy: 0.2906623259392941
Energy: 0.29427998100761904
Energy: 0.2711238525807989
Energy: 0.2683947967787104
Energy: 0.2945853340313625
Energy: 0.26918147644892343
Energy: 0.290300052438737
Energy: 0.2912409778864474
Energy: 0.29529449716453
Energy: 0.29399771255865725
Energy: 0.2909300656995732
Energy: 0.2933551452764142
Energy: 0.290086991150469
Energy: 0.26710333084297433
Energy: 0.27424659780660093
Energy: 0.3039901688795737
Energy: 0.2796416200463529
Energy: 0.3096053780614545
Energy: 0.2757941824689024
Energy: 0.2905462000959002
Energy: 0.33225186792702255
Energy: 0.295197461056124
Energy: 0.29060283040263973
Energy: 0.32659713198115453
Energy: 0.2965916667567713
Energy: 0.294096195112559
Energy: 0.30856678144533095
Energy: 0.3033176170859695
Energy: 0.2940892207074486
Energy: 0.2802656077175147
Energy: 0.282326106799368
Energy: 0.3658804398481888
Energy: 0.27968249451457494
Energy: 0.30345432598292205
Energy: 0.32539438547818283
Energy: 0.27805954323506876
Energy: 0.27580663224412566
Energy: 0.351196915304338
Energy: 0.33083828642605023
Energy: 0.29279347883407697
Energy: 0.34565970206580365
Energy: 0.3277722494518261
Energy: 0.2989679086308244

minimum gb energy = 0.26710333084297433 eV
minimum distance =  2.58488568334779 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.5010922233387635
Energy: 0.35275720275404937
Energy: 0.31816570018756596
Energy: 0.31236350191381673
Energy: 0.3431245278744984
Energy: 0.36924465551721714
Energy: 0.3556986588735976
Energy: 0.3347042716960188
Energy: 0.3388965645007756
Energy: 0.3741615903345062
Energy: 0.37555528323994836
Energy: 0.32047304010106065
Energy: 0.3957976336695213
Energy: 0.33098059018497383
Energy: 0.3178216543790195
Energy: 0.33751501983562565
Energy: 0.29900779364467994
Energy: 0.3000223886459417
Energy: 0.3341904595265986
Energy: 0.3324189913913581
Energy: 0.3175284412088939
Energy: 0.33483272464513664
Energy: 0.3657072739331832
Energy: 0.3003153467006774
Energy: 0.3334756752463944
Energy: 0.33451027962067703
Energy: 0.3019650182382693
Energy: 0.33370647685519605
Energy: 0.37606098341838673
Energy: 0.31979748478599807
Energy: 0.29785720075139144
Energy: 0.3082110454255202
Energy: 0.30851351157271595
Energy: 0.30067387038976684
Energy: 0.29953590688675236
Energy: 0.297822119353396
Energy: 0.3336336403798434
Energy: 0.33832040152758597
Energy: 0.32465244380783737
Energy: 0.33337300316818325
Energy: 0.33519651726527766
Energy: 0.3030340450821743
Energy: 0.3336788339616524
Energy: 0.2990796512084903
Energy: 0.2993209900767211
Energy: 0.3337995037078107
Energy: 0.3015072021450941
Energy: 0.3016232041066542
Energy: 0.32592161701860317
Energy: 0.309398836159065
Energy: 0.3005372324156001
Energy: 0.30435167102202365
Energy: 0.2991264219835101
Energy: 0.30293846186144385
Energy: 0.32696769039542756
Energy: 0.29952339812256806
Energy: 0.29899300228737496
Energy: 0.3035963362481208
Energy: 0.29980180259375744
Energy: 0.30962361603953586
Energy: 0.3245900647134941
Energy: 0.31939029931407287
Energy: 0.30182919169841027
Energy: 0.300708782368707
Energy: 0.2990604523323335
Energy: 0.2993115478025632
Energy: 0.29895016696484256
Energy: 0.2990795870096697
Energy: 0.30157430686933717
Energy: 0.29898653876895664
Energy: 0.3099634094520229
Energy: 0.2988937208075074
Energy: 0.2989925183826388
Energy: 0.30385098026571633
Energy: 0.29922721717538997
Energy: 0.2990074867856532
Energy: 0.30413564657111286
Energy: 0.29882639781749193
Energy: 0.28972690386810207
Energy: 0.3006414783449268
Energy: 0.3039506803554988
Energy: 0.29117274788456726
Energy: 0.3254061669885386
Energy: 0.28966901291067887
Energy: 0.2893450101435549
Energy: 0.33743920578846964
Energy: 0.3027171407867323
Energy: 0.2899134971771625
Energy: 0.33432383428342616
Energy: 0.31924322400231625
Energy: 0.3328506774815648
Energy: 0.3071222920521808
Energy: 0.30701590291903846
Energy: 0.33333280694402834
Energy: 0.3068197648710911
Energy: 0.30124064377558196
Energy: 0.39404986771795547
Energy: 0.30700379342565315
Energy: 0.3072765990277429
Energy: 0.33755230019059074
Energy: 0.3098265944471384
Energy: 0.3097918369344626
Energy: 0.37587786329002926
Energy: 0.3395916548449823
Energy: 0.3368261936408738
Energy: 0.3366483418551684
Energy: 0.3367813951800597
Energy: 0.3002162634503683
Energy: 0.3064989230394832
Energy: 0.33818672078196865
Energy: 0.30800597510938726
Energy: 0.3062514250754499
Energy: 0.3355319712938971
Energy: 0.30631271143290456
Energy: 0.35554172045827626
Energy: 0.33399903761380545
Energy: 0.33839933926122556
Energy: 0.35618902208236114
Energy: 0.37561403951622957
Energy: 0.320462681502144
Energy: 0.39110627172623713
Energy: 0.3199021577099149
Energy: 0.31753333457542954
Energy: 0.33840816708714094
Energy: 0.33845379193348285
Energy: 0.31972738986989296
Energy: 0.33508095733565324
Energy: 0.3379983850052554
Energy: 0.3211126402283323
Energy: 0.33495937084455824
Energy: 0.3327559867755291
Energy: 0.3615958459167081
Energy: 0.3333615755299871
Energy: 0.33513642228299995
Energy: 0.33796500903456905
Energy: 0.33352377707254893
Energy: 0.3751750934981094
Energy: 0.3205142027401846
Energy: 0.2975237854661498
Energy: 0.29898836931246153
Energy: 0.3077151546986217
Energy: 0.2979277317520558
Energy: 0.35983645131763553
Energy: 0.30015477778576116
Energy: 0.3336374507667107
Energy: 0.33724466676417275
Energy: 0.3001368225532308
Energy: 0.3333397282544383
Energy: 0.33485794357379567
Energy: 0.30280402873462736
Energy: 0.33566499254343646
Energy: 0.29916860473760853
Energy: 0.29932384629753883
Energy: 0.3336584388869456
Energy: 0.3011142451977043
Energy: 0.3015586838668689
Energy: 0.32642565488886066
Energy: 0.29918859248522467
Energy: 0.2991330562976609
Energy: 0.30351573387080183
Energy: 0.3085860154988999
Energy: 0.3035045534429871
Energy: 0.32634194141038636
Energy: 0.2994677429131312
Energy: 0.298984943913517
Energy: 0.3036543123572933
Energy: 0.30011809453651944
Energy: 0.29930710743647365
Energy: 0.32437164580485583
Energy: 0.2993386106020261
Energy: 0.3087601643841814
Energy: 0.30143325170693136
Energy: 0.2996808226538192
Energy: 0.29957101641570594
Energy: 0.299021197622786
Energy: 0.29889269966749543
Energy: 0.30211180584263325
Energy: 0.2991978642118503
Energy: 0.3077591805399589
Energy: 0.2991841235207017
Energy: 0.30137266189983136
Energy: 0.3016618213728438
Energy: 0.2995218947408082
Energy: 0.30149448033317855
Energy: 0.3043228783550231
Energy: 0.2986798064033001
Energy: 0.28976517571631794
Energy: 0.3017974089598572
Energy: 0.3042666858389375
Energy: 0.2906866576333678
Energy: 0.35773280648003236
Energy: 0.28967556340604594
Energy: 0.29009660967053336
Energy: 0.3328527180479223
Energy: 0.30172119223816674
Energy: 0.28948053798346945
Energy: 0.33450986325204163
Energy: 0.2999197675768072
Energy: 0.3037164867253011
Energy: 0.3077272159297621
Energy: 0.300509793491088
Energy: 0.33290971794365254
Energy: 0.306718766597116
Energy: 0.3004501917753814
Energy: 0.3988044151491889
Energy: 0.30684649511916556
Energy: 0.30728503936993823
Energy: 0.3361411038525314
Energy: 0.2917718824585029
Energy: 0.31040760275178264
Energy: 0.37538308043715035
Energy: 0.3334296322612328
Energy: 0.30388903860436023
Energy: 0.3751977944431972
Energy: 0.3336076355876654
Energy: 0.3660687506066964
Energy: 0.30632645378629014
Energy: 0.3371167951027704
Energy: 0.3067341288125767
Energy: 0.3089773929220539
Energy: 0.3359143164948572
Energy: 0.306123466526093

minimum gb energy = 0.2893450101435549 eV
minimum distance =  2.59638107602957 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.45304439121854434
Energy: 0.43082637782308697
Energy: 0.333635913483365
Energy: 0.3343094882997717
Energy: 0.3724382004433779
Energy: 0.33214471460286915
Energy: 0.3649543133786597
Energy: 0.38716858653090813
Energy: 0.3453735235159259
Energy: 0.3526118383652901
Energy: 0.38618120878621487
Energy: 0.3377002654107833
Energy: 0.4123608909650929
Energy: 0.3371495639780979
Energy: 0.33516741407172035
Energy: 0.34740915986107795
Energy: 0.3478674388795137
Energy: 0.33490695056482966
Energy: 0.35457205762449595
Energy: 0.33717189115932933
Energy: 0.3351665661096567
Energy: 0.3521355291347998
Energy: 0.33598390233399733
Energy: 0.33641382078735
Energy: 0.3470644681382788
Energy: 0.3442661554458284
Energy: 0.33728306139033165
Energy: 0.3476372641324479
Energy: 0.35427852806595367
Energy: 0.33665484108616395
Energy: 0.3585708770110665
Energy: 0.35647632521312267
Energy: 0.3370470281344357
Energy: 0.3528822401879497
Energy: 0.3982583874916144
Energy: 0.33698799416474484
Energy: 0.34770964140656635
Energy: 0.3452564793271383
Energy: 0.3380805071490087
Energy: 0.34685921848457085
Energy: 0.3907491485595792
Energy: 0.33796674206192784
Energy: 0.34919431397266637
Energy: 0.33755617767544327
Energy: 0.33650841802594705
Energy: 0.350047910842272
Energy: 0.3487563507462713
Energy: 0.33809626560138
Energy: 0.37785495508084593
Energy: 0.3372477838721778
Energy: 0.3361537371185624
Energy: 0.37728793079949197
Energy: 0.3431313098322042
Energy: 0.33614291689546627
Energy: 0.3612158168417127
Energy: 0.3494012901868066
Energy: 0.33814096513093206
Energy: 0.33699555138850823
Energy: 0.3475780038648925
Energy: 0.3359770482221195
Energy: 0.3541195022129164
Energy: 0.3473033505637311
Energy: 0.3363757599978129
Energy: 0.34796286178027447
Energy: 0.3260045263390939
Energy: 0.33767999300953566
Energy: 0.4109723927563598
Energy: 0.3255812367263859
Energy: 0.32546298251498407
Energy: 0.4109898434678433
Energy: 0.325601325903503
Energy: 0.327277725494567
Energy: 0.40050625084432395
Energy: 0.34489923466981137
Energy: 0.3439521934215878
Energy: 0.352830545475458
Energy: 0.3876154167213149
Energy: 0.338234288612912
Energy: 0.3262511168828917
Energy: 0.3488610826036345
Energy: 0.32537932694154587
Energy: 0.32781416754275433
Energy: 0.3523758835372328
Energy: 0.32549421528156613

minimum gb energy = 0.32537932694154587 eV
minimum distance =  2.61683879618617 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.567706489329584
Energy: 0.3962340891467399
Energy: 0.3945575673444681
Energy: 0.3986329658839648
Energy: 0.4207309425217831
Energy: 0.40472870400495026
Energy: 0.423520558340202
Energy: 0.38512668838651326
Energy: 0.38467809800817065
Energy: 0.3980304306295331
Energy: 0.3805421838993837
Energy: 0.3841240828124331
Energy: 0.45068008119008574
Energy: 0.3774444914099305
Energy: 0.38060213230408835
Energy: 0.3829679489956255
Energy: 0.3780651344618083
Energy: 0.3802562003245158
Energy: 0.3931174019099152
Energy: 0.3822981147701207
Energy: 0.3809824369558355
Energy: 0.3830664951175128
Energy: 0.3791439626845603
Energy: 0.3803559694945345
Energy: 0.3967665892145227
Energy: 0.3855012867803946
Energy: 0.38478534693912986
Energy: 0.3975117640622698
Energy: 0.38095235605488525
Energy: 0.38368250903231993
Energy: 0.4055565199789207
Energy: 0.3862076471389934
Energy: 0.38087982377496815
Energy: 0.38479070220243244
Energy: 0.3856580594476295
Energy: 0.3836595622010212
Energy: 0.3857067145694341
Energy: 0.3851219569613824
Energy: 0.38802334001885974
Energy: 0.3856382939197899
Energy: 0.3840491941858407
Energy: 0.38586884551104006
Energy: 0.3861937466346125
Energy: 0.38447970136928805
Energy: 0.3840437875883732
Energy: 0.38114615532125173
Energy: 0.3980803570605321
Energy: 0.384383840177984
Energy: 0.3752035625225154
Energy: 0.38264358805244675
Energy: 0.3821305657380906
Energy: 0.38816314646581834
Energy: 0.38285750690872694
Energy: 0.38318116111784684
Energy: 0.37682650739030543
Energy: 0.38251440979610424
Energy: 0.38176588609431517
Energy: 0.3879438539577383
Energy: 0.3831953051345527
Energy: 0.3834612541331319
Energy: 0.3866332539418924
Energy: 0.38603701295486337
Energy: 0.38437454821856637
Energy: 0.3811363646079109
Energy: 0.3836730783281726
Energy: 0.38452534159116114
Energy: 0.3815494032240945
Energy: 0.3761975898811777
Energy: 0.37818668878114586
Energy: 0.3819258689747359
Energy: 0.3776949522628021
Energy: 0.3786488914587449
Energy: 0.37971764328702834
Energy: 0.3814837431077025
Energy: 0.38114051706527086
Energy: 0.38037429621797453
Energy: 0.40050095501183125
Energy: 0.3812430251829372
Energy: 0.3858014142535129
Energy: 0.38203387742540684
Energy: 0.3817170194892168
Energy: 0.38144853333010487
Energy: 0.4538282242462082
Energy: 0.3826683237897874
Energy: 0.3765029033782075
Energy: 0.3806525289583451
Energy: 0.37978448639727114
Energy: 0.37675037343933554
Energy: 0.3820687807180897
Energy: 0.3801114556001153
Energy: 0.37668111367716245
Energy: 0.3809240029560697
Energy: 0.380239702269069
Energy: 0.37711672867589535
Energy: 0.3821079156997468
Energy: 0.38158763150417024
Energy: 0.37545021921256955
Energy: 0.38096045420961716
Energy: 0.3806696869106279
Energy: 0.3762866811841761
Energy: 0.38736348008486016
Energy: 0.3810301406268168
Energy: 0.44939650413180254
Energy: 0.39903267417969535
Energy: 0.4004234846130066
Energy: 0.3841693734580536
Energy: 0.41195777064753514
Energy: 0.37917930886774215
Energy: 0.3838792327008612
Energy: 0.38057365071530935
Energy: 0.3809529317931702
Energy: 0.38467111078038235
Energy: 0.3803482581396125
Energy: 0.3806794322338921
Energy: 0.3913726691847577
Energy: 0.3754345302840372
Energy: 0.3790510730574641
Energy: 0.3817929390561495
Energy: 0.37517158918220694
Energy: 0.3764522723059637
Energy: 0.41002717951027773
Energy: 0.3850558850679306
Energy: 0.3766446106919158
Energy: 0.3801222270094658
Energy: 0.3819745975798127
Energy: 0.3802852057537278
Energy: 0.38530036565730197
Energy: 0.38155350923078846
Energy: 0.3813768882629106
Energy: 0.3789098569843845
Energy: 0.38016083840773235
Energy: 0.38008787750291523
Energy: 0.38903521316627854
Energy: 0.38181383637505323
Energy: 0.38056585085427425
Energy: 0.3768430296590018
Energy: 0.3833851232465191
Energy: 0.3798676195750428
Energy: 0.40932720620396507
Energy: 0.385808060159242
Energy: 0.3802094194328321
Energy: 0.38607232614871456
Energy: 0.38482854812319783
Energy: 0.38099822023130997
Energy: 0.4116239368178687
Energy: 0.383758155032071
Energy: 0.3812794788891295
Energy: 0.41158639320738755
Energy: 0.38363044217065667
Energy: 0.38074774293081526
Energy: 0.41042643950383534
Energy: 0.39150680970946267
Energy: 0.3809461856312469
Energy: 0.3863536403359321
Energy: 0.37645461912220357
Energy: 0.38040754935444465
Energy: 0.4105144133310731
Energy: 0.3762028319777559
Energy: 0.3840992842679386
Energy: 0.3815452173746268
Energy: 0.37777488037393003
Energy: 0.37996340595796774
Energy: 0.40627474920412276
Energy: 0.38213393183359495
Energy: 0.3805224314440287
Energy: 0.3950460765272332
Energy: 0.37714755647172105
Energy: 0.3799753686067816
Energy: 0.4061727652611818
Energy: 0.3790961512835141
Energy: 0.3765890925146043
Energy: 0.39408303664529487
Energy: 0.3828956434214804
Energy: 0.3781557107306969
Energy: 0.446309635506112
Energy: 0.3841039260523529
Energy: 0.38752640329251525
Energy: 0.39483893839188405
Energy: 0.3798896282814408
Energy: 0.38051021767020693
Energy: 0.37850437492750544
Energy: 0.3834921759864787
Energy: 0.37627142147632264
Energy: 0.37500439189860285
Energy: 0.38205227331593206
Energy: 0.37553239527704785

minimum gb energy = 0.37500439189860285 eV
minimum distance =  2.632252061373 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.5061404009036521
Energy: 0.42559832351465604
Energy: 0.425936166943408
Energy: 0.42319991270174967
Energy: 0.56467619928703
Energy: 0.37703965701973646
Energy: 0.3659470594815064
Energy: 0.3791821914013452
Energy: 0.38141764537793843
Energy: 0.37905792717487063
Energy: 0.3800228828780439
Energy: 0.38188516738755757
Energy: 0.4037843501827595
Energy: 0.3776264537430019
Energy: 0.3780529560089973
Energy: 0.4046266590264079
Energy: 0.3769500684154698
Energy: 0.38168229285265604
Energy: 0.37295339396009225
Energy: 0.38024205447226633
Energy: 0.3808077174959669
Energy: 0.3756988775890462
Energy: 0.36967542415146093
Energy: 0.38077556460758066
Energy: 0.3776672468651943
Energy: 0.37853621118500896
Energy: 0.38105450617303577
Energy: 0.3743134242461025
Energy: 0.37822357318812155
Energy: 0.38078232015168395
Energy: 0.37716409643769494
Energy: 0.379986665862502
Energy: 0.3809914386658005
Energy: 0.37996628429923396
Energy: 0.3790074324278541
Energy: 0.3821755016584647
Energy: 0.4011455054171662
Energy: 0.3776076916389596
Energy: 0.3806304330315277
Energy: 0.4017679438038423
Energy: 0.3741484029608949
Energy: 0.392566643945381
Energy: 0.4097673856093232
Energy: 0.3788026907930668
Energy: 0.38139809549836784
Energy: 0.37926375668488493
Energy: 0.37344939777855035
Energy: 0.38115260033562826
Energy: 0.3664205448300434
Energy: 0.380101703362358
Energy: 0.3772200249247972
Energy: 0.36654434237010575
Energy: 0.3746526028804016
Energy: 0.37677465887785955
Energy: 0.3675701032547541
Energy: 0.37955986022804217
Energy: 0.3777846464431502
Energy: 0.3665181040280608
Energy: 0.3765193662068476
Energy: 0.3768018984180733
Energy: 0.4100074840207347
Energy: 0.3779716481803413
Energy: 0.38107289709586056
Energy: 0.379686334253124
Energy: 0.3744941635420986
Energy: 0.3814022324188233
Energy: 0.3973299890897836
Energy: 0.3769489601305969
Energy: 0.3840757219019055
Energy: 0.3977876572534881
Energy: 0.37596832713517714
Energy: 0.3799145601030359
Energy: 0.3783216210441381
Energy: 0.37974902376735
Energy: 0.38261811700536064
Energy: 0.37928718330070765
Energy: 0.38069978652957603
Energy: 0.3806372601329644
Energy: 0.4420587842237869
Energy: 0.40675890817825006
Energy: 0.3768503204995732
Energy: 0.37858216691998464
Energy: 0.40325856384440006
Energy: 0.38114646714720823
Energy: 0.37805481575943095
Energy: 0.37666792162957957
Energy: 0.3806284696822762
Energy: 0.3782039204396909
Energy: 0.3801804811899764
Energy: 0.3804519542618626
Energy: 0.4044403170146447
Energy: 0.3806854427826092
Energy: 0.37798483508118813
Energy: 0.40684426533542806
Energy: 0.3797828987790971
Energy: 0.3814667519498962
Energy: 0.36589638749192993
Energy: 0.3795597880413914
Energy: 0.3814390036184846
Energy: 0.366151572099116
Energy: 0.3793958577695061
Energy: 0.3832874296071226

minimum gb energy = 0.36589638749192993 eV
minimum distance =  2.59411483186595 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.6237796745773887
Energy: 0.40392108685526273
Energy: 0.40817724554246027
Energy: 0.4190994766370347
Energy: 0.4168100750618669
Energy: 0.40226704875590746
Energy: 0.4217133950957356
Energy: 0.40396287935483627
Energy: 0.4053099973132771
Energy: 0.40857332043642214
Energy: 0.4165764027574512
Energy: 0.40534720978517974
Energy: 0.4330709849115945
Energy: 0.406953617078591
Energy: 0.4057080402074581
Energy: 0.40233641343435733
Energy: 0.40706336862839365
Energy: 0.40514383325485254
Energy: 0.40480187220203684
Energy: 0.40375496852123155
Energy: 0.4030240523787992
Energy: 0.4054139103342496
Energy: 0.40538753021160795
Energy: 0.40271252009136116
Energy: 0.40951047820140385
Energy: 0.39948428526159163
Energy: 0.4026737065808125
Energy: 0.40712157272687843
Energy: 0.41033104109526475
Energy: 0.40349234287793423
Energy: 0.3988826110203686
Energy: 0.4030858208292603
Energy: 0.4035910211975395
Energy: 0.40006558030689876
Energy: 0.40232339905133807
Energy: 0.4038056065327543
Energy: 0.40235190671392157
Energy: 0.39882930033101494
Energy: 0.40590668658071044
Energy: 0.3959935070759954
Energy: 0.3981320776763001
Energy: 0.405364044921246
Energy: 0.42035433506244624
Energy: 0.4044197584684991
Energy: 0.40092104783238436
Energy: 0.4008449337806528
Energy: 0.4061811402368752
Energy: 0.40007574815909464
Energy: 0.4526760133034833
Energy: 0.4016951304066279
Energy: 0.3987794072345752
Energy: 0.4070119671908565
Energy: 0.40204329385219384
Energy: 0.4033623030416359
Energy: 0.41586587204513253
Energy: 0.4008186909549192
Energy: 0.3988867725448235
Energy: 0.4079849667866628
Energy: 0.40143590204379404
Energy: 0.39948995555700656
Energy: 0.4198469235953778
Energy: 0.4013468279877019
Energy: 0.3995074964519174
Energy: 0.40062498088951276
Energy: 0.40302563397924124
Energy: 0.4002056408159603
Energy: 0.41717254809838306
Energy: 0.40748779083491665
Energy: 0.4070262821008429
Energy: 0.41109787802400694
Energy: 0.4082963450537054
Energy: 0.4066047550008058
Energy: 0.470592655479297
Energy: 0.40426796527611225
Energy: 0.40510690372697883
Energy: 0.3997079346494543
Energy: 0.4023831632530291
Energy: 0.4029002654410103
Energy: 0.42246260036238265
Energy: 0.4037999459688499
Energy: 0.40310865260559675
Energy: 0.4030461705408394
Energy: 0.405201554273132
Energy: 0.4029548904240331
Energy: 0.41591516362511893
Energy: 0.4007988521550134
Energy: 0.3988421100909923
Energy: 0.4102598216130195
Energy: 0.40235756755152635
Energy: 0.4047702988502158
Energy: 0.41083711634085185
Energy: 0.40433143943521194
Energy: 0.39915327981275717
Energy: 0.4105588982011169
Energy: 0.4063877433715682
Energy: 0.3979971152733861
Energy: 0.4121577144527425
Energy: 0.4046133763528405
Energy: 0.40372236237652015
Energy: 0.4051407615200438
Energy: 0.40637785662102677
Energy: 0.403469319619032
Energy: 0.44128067274852206
Energy: 0.40729494975374925
Energy: 0.40850118456671186
Energy: 0.40678944068414397
Energy: 0.41091131242743495
Energy: 0.40832400461636104
Energy: 0.4148618009668357
Energy: 0.40705074761448384
Energy: 0.40552898293575507
Energy: 0.4158413918888471
Energy: 0.40256341651754535
Energy: 0.4050078049099356
Energy: 0.4108246614012248
Energy: 0.40599372568996406
Energy: 0.4044999141504874
Energy: 0.3964198254789029
Energy: 0.4080018836317927
Energy: 0.40401888645995193
Energy: 0.40852666172258173
Energy: 0.4115947027812338
Energy: 0.4087046625138412
Energy: 0.4075696799890545
Energy: 0.4104051793789287
Energy: 0.4080723381711852

minimum gb energy = 0.3959935070759954 eV
minimum distance =  2.54188536945112 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.554596373502892
Energy: 0.4062905987135552
Energy: 0.39617996595433774
Energy: 0.39475328652786335
Energy: 0.541769112640211
Energy: 0.3998249394196931
Energy: 0.4178784563226967
Energy: 0.39145640700368667
Energy: 0.4164773587337415
Energy: 0.41738652177795516
Energy: 0.3919889631571052
Energy: 0.41459263662170315
Energy: 0.4442736697792264
Energy: 0.38975915571838343
Energy: 0.4109983208007682
Energy: 0.4213677966943224
Energy: 0.39328433700768756
Energy: 0.4356189647498538
Energy: 0.4533666332999801
Energy: 0.38669816053193684
Energy: 0.3919219710433642
Energy: 0.42025372788263476
Energy: 0.3848823231039742
Energy: 0.4103497719609563
Energy: 0.3960883135896088
Energy: 0.41682859867350147
Energy: 0.3917913559413509
Energy: 0.3962954088913857
Energy: 0.42590292092051335
Energy: 0.4224827781254704
Energy: 0.44573385587069453
Energy: 0.392651012941059
Energy: 0.42934345423042447
Energy: 0.42288690830742454
Energy: 0.42103469762651735
Energy: 0.39060669518461527
Energy: 0.4458773291626704
Energy: 0.3980972126498564
Energy: 0.4068295147553429
Energy: 0.3911816057562675
Energy: 0.39642455831710444
Energy: 0.40983502999066607
Energy: 0.4411920741144849
Energy: 0.39944352564662416
Energy: 0.43287341408500407
Energy: 0.4306157887154318
Energy: 0.40111825412929397
Energy: 0.430953312563908
Energy: 0.45619846699286287
Energy: 0.42700991433919855
Energy: 0.4256506841701409
Energy: 0.4122954113077539
Energy: 0.41663819544417047
Energy: 0.42446054853680854
Energy: 0.4588125184773246
Energy: 0.4039983612342481
Energy: 0.4056546317789659
Energy: 0.414691638768082
Energy: 0.3983155075464125
Energy: 0.40946844237874847
Energy: 0.4405640337155438
Energy: 0.4056825355139446
Energy: 0.43400858996492075
Energy: 0.4269015842490058
Energy: 0.40111676948076536
Energy: 0.4277761765135737
Energy: 0.42249004403352275
Energy: 0.40057105106942853
Energy: 0.40620552703589313
Energy: 0.4141788325650864
Energy: 0.3984188962936447
Energy: 0.4077321904642157
Energy: 0.45589536460914365
Energy: 0.42192838650544195
Energy: 0.406890612805871
Energy: 0.3895890901589233
Energy: 0.42069561061568495
Energy: 0.4166409459638093
Energy: 0.4446513773836623
Energy: 0.4047760150898255
Energy: 0.40289590472908976
Energy: 0.40414770448144527
Energy: 0.40842324669787666
Energy: 0.4025996298549087
Energy: 0.41673581339941446
Energy: 0.3995080450106556
Energy: 0.4045370611645691
Energy: 0.40659711346620603
Energy: 0.39668774851899585
Energy: 0.40825392187105347
Energy: 0.4195076483484278
Energy: 0.39379748461031455
Energy: 0.4101412597819124
Energy: 0.4179388072767622
Energy: 0.39131057108759887
Energy: 0.4089827196988387
Energy: 0.398694562400743
Energy: 0.4056005913399764
Energy: 0.4035321541712302
Energy: 0.39949535952079407
Energy: 0.4077491302392303
Energy: 0.403473321463652
Energy: 0.41889571649390844
Energy: 0.43245990527640676
Energy: 0.42953971576025796
Energy: 0.4188768752401316
Energy: 0.3901884371873792
Energy: 0.41182617350296985
Energy: 0.4308146068780789
Energy: 0.39910953523570314
Energy: 0.3991097960149218
Energy: 0.4302054080478765
Energy: 0.40493986534503096
Energy: 0.4068272232266362
Energy: 0.44519011148053894
Energy: 0.40522681997918497
Energy: 0.4039919131678856
Energy: 0.39183185264030906
Energy: 0.4092457921471703
Energy: 0.4033109372686551
Energy: 0.44744958267252066
Energy: 0.43004158010863813
Energy: 0.4300496302958882
Energy: 0.4156841191696853
Energy: 0.42260817232813774
Energy: 0.4277339044803119
Energy: 0.39306050883755933
Energy: 0.3878379287478634
Energy: 0.41202972061321963
Energy: 0.39423128111977834
Energy: 0.39294946024475685
Energy: 0.39301150907785826
Energy: 0.44742291638083914
Energy: 0.39713304680435774
Energy: 0.3981105650624633
Energy: 0.38952708299926625
Energy: 0.394579465293464
Energy: 0.38961406814711785
Energy: 0.43951192796591326
Energy: 0.40366901794472243
Energy: 0.3885359001435257
Energy: 0.4280980854974856
Energy: 0.3954660456889483
Energy: 0.39879998199759303
Energy: 0.4338432737355902
Energy: 0.3904282161877137
Energy: 0.39061183232611985
Energy: 0.39410179687233343
Energy: 0.39494911005759425
Energy: 0.4024780686342605

minimum gb energy = 0.3848823231039742 eV
minimum distance =  2.545828381219 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.4070017094885405
Energy: 0.41733658975822086
Energy: 0.42728301114961426
Energy: 0.3890507399699963
Energy: 0.4268023890112228
Energy: 0.41504204000583417
Energy: 0.43988287118821506
Energy: 0.3957911137092797
Energy: 0.3941253963069373
Energy: 0.38901873338516263
Energy: 0.3832759920892973
Energy: 0.39327966124769154
Energy: 0.40578088345577357
Energy: 0.38555906044634985
Energy: 0.38919822019182176
Energy: 0.39881963537625914
Energy: 0.3830967989315397
Energy: 0.3850345700732431
Energy: 0.4031254301477778
Energy: 0.3933336573905404
Energy: 0.39182866825534923
Energy: 0.3947378411861339
Energy: 0.39236148355623385
Energy: 0.39140665288624266
Energy: 0.38590956787751673
Energy: 0.39047157027727186
Energy: 0.3861884577008909
Energy: 0.3882695959882497
Energy: 0.3918025198791343
Energy: 0.38603130151676046
Energy: 0.38970952299204953
Energy: 0.39245278982904663
Energy: 0.392431505167754
Energy: 0.3862868398368305
Energy: 0.39272587578285484
Energy: 0.39233479069607174
Energy: 0.39883853395250735
Energy: 0.38447708543055664
Energy: 0.386904348760368
Energy: 0.3865078287455279
Energy: 0.3836308067215134
Energy: 0.38945809718372865
Energy: 0.3783410403838221
Energy: 0.38765156393449635
Energy: 0.3939515429298643
Energy: 0.3823930714541669
Energy: 0.38664545047620846
Energy: 0.39540054933563323
Energy: 0.37854156446091125
Energy: 0.3957901370289578
Energy: 0.3953237634216878
Energy: 0.38420324851916293
Energy: 0.40177806544476385
Energy: 0.38283407384914364
Energy: 0.3791417909635862
Energy: 0.39041036998687206
Energy: 0.38790930601686713
Energy: 0.3853148754939496
Energy: 0.3943481540059834
Energy: 0.38794842608414337
Energy: 0.40484680616476504
Energy: 0.3778441403337124
Energy: 0.38049712148714093
Energy: 0.4039685914669299
Energy: 0.37320057657728106
Energy: 0.3779051863487579
Energy: 0.40124678875193937
Energy: 0.38571100523610957
Energy: 0.38598983759170385
Energy: 0.38479570733397916
Energy: 0.3786978260901368
Energy: 0.386756736558112
Energy: 0.39453465002898624
Energy: 0.3797658543031217
Energy: 0.3876709752451904
Energy: 0.3808522273050192
Energy: 0.3850505242132663
Energy: 0.38766855945363693
Energy: 0.406610117277833
Energy: 0.38034553714250124
Energy: 0.3809418813969071
Energy: 0.378595034393142
Energy: 0.38074508526270284
Energy: 0.39080458462298884
Energy: 0.40114498015594846
Energy: 0.37276776579713833
Energy: 0.3829178635972
Energy: 0.3946649715952377
Energy: 0.3723865348096509
Energy: 0.3861845418544244
Energy: 0.4018059794751523
Energy: 0.3796284805157519
Energy: 0.3805099634227411
Energy: 0.3806626639471293
Energy: 0.37438555387669104
Energy: 0.381706059188168
Energy: 0.37976470013984365
Energy: 0.39314803532994025
Energy: 0.3989923894917524
Energy: 0.36969211732466284
Energy: 0.39467698811241303
Energy: 0.39728269018450846
Energy: 0.398103025367623
Energy: 0.38531473542670297
Energy: 0.3828032662678733
Energy: 0.36884508800810994
Energy: 0.38034742698749263
Energy: 0.38096990395739416
Energy: 0.4025140646280889
Energy: 0.3779130899957944
Energy: 0.3810855642371625
Energy: 0.3927822289022627
Energy: 0.3704085262295309
Energy: 0.38087238621520014
Energy: 0.3911730797421901
Energy: 0.37952509702500664
Energy: 0.3827182186424766
Energy: 0.3865794537791088
Energy: 0.37029621906831167
Energy: 0.38053239558509094
Energy: 0.3716604945239465
Energy: 0.38647769619609385
Energy: 0.38306445118153704
Energy: 0.3730606676411785
Energy: 0.3894501522207205
Energy: 0.3802670309606418
Energy: 0.36934087715444086
Energy: 0.3895146898464269
Energy: 0.38672932509336705
Energy: 0.3737390950468235
Energy: 0.38466414559035345
Energy: 0.3851439857770631
Energy: 0.3710599296021909
Energy: 0.37612213938914896
Energy: 0.39071212417353934
Energy: 0.3764990847167731
Energy: 0.36448007145426253
Energy: 0.3799393227481776
Energy: 0.38507426288358154
Energy: 0.3768747359938578
Energy: 0.38153389880337074
Energy: 0.3708844042135043
Energy: 0.36711490676081976
Energy: 0.3690737174276713
Energy: 0.3962473800692706
Energy: 0.39053488511635
Energy: 0.38689108364102937
Energy: 0.37266737378325565
Energy: 0.3874859222138489
Energy: 0.38604372187787955
Energy: 0.38565497677249555
Energy: 0.39678607801790877
Energy: 0.3955836477063805
Energy: 0.38090877159493464
Energy: 0.39694989441841577
Energy: 0.3916291927409556
Energy: 0.4058341895150458
Energy: 0.38694793032901126
Energy: 0.3886418691198244
Energy: 0.39719297945472526
Energy: 0.3862385796608308
Energy: 0.3909401947434697
Energy: 0.40609603310846537
Energy: 0.3876795353747482
Energy: 0.3908668855707462
Energy: 0.3983765636541642
Energy: 0.3829125491256541
Energy: 0.3930704262440171
Energy: 0.39597589554941615
Energy: 0.37991633607991576
Energy: 0.4094582182282119
Energy: 0.3638089334678719
Energy: 0.37970651913469
Energy: 0.37677812984228065

minimum gb energy = 0.3638089334678719 eV
minimum distance =  2.56890673568408 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.5750922749074032
Energy: 0.393581421912853
Energy: 0.3918022751331817
Energy: 0.34901976018374453
Energy: 0.3767322095006676
Energy: 0.34908544620514004
Energy: 0.41167657993725704
Energy: 0.3772415484163925
Energy: 0.37673019672812
Energy: 0.36706946358277376
Energy: 0.3673113935306263
Energy: 0.37652751125910333
Energy: 0.4034202909183546
Energy: 0.3664766380307395
Energy: 0.36525473774715694
Energy: 0.39640311223117364
Energy: 0.36449348084335953
Energy: 0.36543565159711194
Energy: 0.3811522426540133
Energy: 0.37717161429067353
Energy: 0.3756391754234258
Energy: 0.3775527390747161
Energy: 0.37047788527293435
Energy: 0.375759222956073
Energy: 0.36836810003283693
Energy: 0.3766429490488596
Energy: 0.3673314936632198
Energy: 0.37019892681466304
Energy: 0.38844849813929366
Energy: 0.37305738462824795
Energy: 0.3699127284898478
Energy: 0.37645278739904936
Energy: 0.37617182061954996
Energy: 0.3704654399477371
Energy: 0.37199983213101034
Energy: 0.37635575167989144
Energy: 0.39614393580810264
Energy: 0.3649269648768055
Energy: 0.36321378073574095
Energy: 0.37934957154476734
Energy: 0.3629461995141133
Energy: 0.3653242944440411
Energy: 0.36144435682841397
Energy: 0.3687490028233678
Energy: 0.377542865329193
Energy: 0.3797921197686358
Energy: 0.3651858228276035
Energy: 0.375772188997549
Energy: 0.36145067449250373
Energy: 0.3673054056933834
Energy: 0.36633370360394574
Energy: 0.3641146225749942
Energy: 0.3839883225760359
Energy: 0.36562618449647344
Energy: 0.36246431598026296
Energy: 0.379093633792689
Energy: 0.3774404408554116
Energy: 0.36682088405887875
Energy: 0.37744766130463997
Energy: 0.3771804542078538
Energy: 0.39553635828864825
Energy: 0.3481422556613673
Energy: 0.34847553423721006
Energy: 0.3933677780390526
Energy: 0.35103190245188515
Energy: 0.3489161684919013
Energy: 0.4021368802081974
Energy: 0.36591982676042656
Energy: 0.3780254470225086
Energy: 0.37782332903075827
Energy: 0.36521547013977745
Energy: 0.37808094074906506
Energy: 0.3680806554552991
Energy: 0.38252214748096836
Energy: 0.3697044705093314
Energy: 0.3601796179123853
Energy: 0.3838915331623826
Energy: 0.37087643100536766
Energy: 0.37409664700957834
Energy: 0.3669316231209814
Energy: 0.38011854524165134
Energy: 0.36448665363494936
Energy: 0.36666003302538047
Energy: 0.37937291345254565
Energy: 0.4014597293615996
Energy: 0.36815430033286534
Energy: 0.37127758077871215
Energy: 0.3889108194621506
Energy: 0.365284727540964
Energy: 0.36709937638884704
Energy: 0.40121797453144914
Energy: 0.36594956278765606
Energy: 0.37645923998859593
Energy: 0.3761967750389638
Energy: 0.36705513629596265
Energy: 0.37611171652814507
Energy: 0.36486040954783466
Energy: 0.39141578355862355
Energy: 0.3760151691951429
Energy: 0.3486074666827411
Energy: 0.3791758217962975
Energy: 0.34720671887710886
Energy: 0.41019541884920924
Energy: 0.3768002090092633
Energy: 0.3704525732172997
Energy: 0.3781889692033897
Energy: 0.36324360524316707
Energy: 0.3790790903188256
Energy: 0.4010288401475203
Energy: 0.36897800498590694
Energy: 0.3704090192737193
Energy: 0.38353372178748873
Energy: 0.366999883332373
Energy: 0.3784030773119285
Energy: 0.3916171471387458
Energy: 0.3693593521328786
Energy: 0.3766680957944941
Energy: 0.37459095872614945
Energy: 0.36697860987399566
Energy: 0.37705857536227605
Energy: 0.3698197668782584
Energy: 0.3841322515329136
Energy: 0.3656831135561806
Energy: 0.37204945607559975
Energy: 0.36986200698358174
Energy: 0.3800755186535305
Energy: 0.3707326207816404
Energy: 0.3765346459537359
Energy: 0.3766569908063807
Energy: 0.3664538586172591
Energy: 0.3769969819517561
Energy: 0.3763960397144366
Energy: 0.3726033109446188
Energy: 0.36628124645193416
Energy: 0.36862829797472996
Energy: 0.3769509740236709
Energy: 0.3646932766767231
Energy: 0.36721115927436776
Energy: 0.3871837228121536
Energy: 0.3644735606484627
Energy: 0.3654300175186904
Energy: 0.3756722248489311
Energy: 0.36761493458952216
Energy: 0.38127009177217974
Energy: 0.3630841636339759
Energy: 0.3782635935990805
Energy: 0.3780703702333036
Energy: 0.36638573157937926
Energy: 0.3698376316939972
Energy: 0.3701160523184456
Energy: 0.36133119494353516
Energy: 0.3816822762368525
Energy: 0.3792645524711625
Energy: 0.3645158759568011
Energy: 0.37852403315217314
Energy: 0.3779846180108561
Energy: 0.38981576900916093
Energy: 0.34818536016356333
Energy: 0.3482879353776016
Energy: 0.3757527805806449
Energy: 0.35043571814597285
Energy: 0.34857677059114944
Energy: 0.4011345171287221
Energy: 0.35349026594566746
Energy: 0.3725293451086053
Energy: 0.3777223045561128
Energy: 0.35221293646418533
Energy: 0.38051220566447197
Energy: 0.3665133803689562
Energy: 0.3668063915416037
Energy: 0.37803607110573245
Energy: 0.3635350608387842
Energy: 0.3666577304968433
Energy: 0.36439342996038054
Energy: 0.37045319875643706
Energy: 0.3758759358699678
Energy: 0.3773112938826213
Energy: 0.3637450780475301
Energy: 0.3678555114772737
Energy: 0.3712281284049408
Energy: 0.4021350955662885
Energy: 0.3654182945085629
Energy: 0.3681185752651311
Energy: 0.37842994167934985
Energy: 0.3645343591321686
Energy: 0.378852718645779
Energy: 0.4013694725047187
Energy: 0.3678771876759046
Energy: 0.3696652887707986
Energy: 0.3754057439229362
Energy: 0.36631571369795396
Energy: 0.37656558003617835
Energy: 0.36797610550775506
Energy: 0.3646728215757846
Energy: 0.3750287230948647
Energy: 0.3496222378876404
Energy: 0.3628652931579363
Energy: 0.3742800416826681

minimum gb energy = 0.34720671887710886 eV
minimum distance =  2.60798846102357 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.012253695841463018
Energy: 0.013159072360468914
Energy: 0.012538426333758948
Energy: 0.013525163030301818
Energy: 0.38153571770172595
Energy: 0.012590409320887936
Energy: 0.012558193884278765
Energy: 0.06644935608957317
Energy: 0.06603053157919295
Energy: 0.06533976726843427
Energy: 0.065577114140497
Energy: 0.06600486249414568
Energy: 0.518646198540923
Energy: 0.3824029380313181
Energy: 0.38094551901388585
Energy: 0.379265775178846
Energy: 0.3813705518339195
Energy: 0.3809785714727123
Energy: 0.012558193882249385
Energy: 0.06644935608992106
Energy: 0.06603053157986939
Energy: 0.06533976726773848
Energy: 0.06557711413982054
Energy: 0.06600486249381712

minimum gb energy = 0.012253695841463018 eV
minimum distance =  2.84751953154026 Angstroms
sigma value = 1