Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_AlAgAuCuNiPdPt__MO_115316750986_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.487144187092781
cohesive_energy=4.453657130216031
mass=58.6934
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=[2.06898681808224e-19, 2.92584690371178e-19, 3.5753052240700195e-19, 4.1003224852654793e-19, 4.544093369350799e-19, 4.924434080496059e-19, 5.249275393039559e-19, 5.531258480623559e-19, 5.777448942204e-19, 5.99298976477602e-19, 6.1818383246256e-19, 6.34723101855342e-19, 6.492131873332379e-19, 6.6191524368759e-19, 6.729270036930719e-19, 6.82322167474848e-19, 6.9024973745988e-19, 6.9684269430879e-19, 7.022115882093239e-19, 7.06446141052986e-19, 7.096248594948419e-19, 7.11818239306788e-19, 7.1308876537755e-19, 7.134989225958539e-19, 7.130679370813079e-19, 7.117028825891399e-19, 7.092819936951659e-19, 7.055985896135999e-19, 7.00324224134472e-19, 6.931272466945439e-19, 6.836984372034539e-19, 6.716741015652839e-19, 6.56602425969246e-19, 6.379258529467079e-19, 6.149602530749519e-19, 5.86898129330442e-19, 5.52728508257124e-19, 5.11068711419856e-19, 4.60252475119278e-19, 3.9828508944605997e-19, 3.2272643938661995e-19, 2.3085763119306e-19, 1.17659045471058e-19, -2.3177087187444e-20, -1.98844539869106e-19, -4.19627684387574e-19, -6.996977730705779e-19, -1.0580245772646779e-18, -1.523907101075832e-18, -2.13675888970044e-18, -2.9523629270044796e-18, -4.041490559265e-18, -5.4701674855691395e-18, -7.097754640984379e-18]
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: -8.48587586902969e-25 eV

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

Energy: 0.01845842474512945
Energy: 0.7136054215970566
Energy: 0.018827082031162807
Energy: 0.018758037581948918
Energy: 0.7136013924983029
Energy: 0.018787749692169266
Energy: 0.7136054215967197
Energy: 0.17528187762298664
Energy: 0.17517022317367806
Energy: 0.1751893543084029
Energy: 0.17631458756040497
Energy: 0.17529494514124058
Energy: 0.018827082031162807
Energy: 0.17517022317401512
Energy: 0.1752814464398585
Energy: 0.01871882175571553
Energy: 0.17628210137264386
Energy: 0.17611962770234613
Energy: 0.018758037581948918
Energy: 0.1751893543084029
Energy: 0.01871882175571553
Energy: 0.018812107612417202
Energy: 0.17490051004212281
Energy: 0.01886455512361805
Energy: 0.7136013924983029
Energy: 0.17631458756074198
Energy: 0.17628210137298092
Energy: 0.17490051004212281
Energy: 0.17628394040413847
Energy: 0.17603570724421141
Energy: 0.018787749692169266
Energy: 0.17529494514090355
Energy: 0.17611962770234613
Energy: 0.018864555123917628
Energy: 0.17603570724421141
Energy: 0.018842712151405875

minimum gb energy = 0.01845842474512945 eV
minimum distance =  2.46391864140424 Angstroms
sigma value = 1


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

Energy: 1.998109626666836
Energy: 1.2530028534133621
Energy: 1.3212123569523637
Energy: 1.1530602600498632
Energy: 1.2698593230339017
Energy: 1.3237646455525465
Energy: 1.833492526542997
Energy: 1.214179058783122
Energy: 1.2088138839918483
Energy: 1.1787848678809816
Energy: 1.2431659669468171
Energy: 1.2133040034463574
Energy: 1.8647070589386212
Energy: 1.2289209047935452
Energy: 1.2152109499921073
Energy: 1.2125625424666344
Energy: 1.2278152601418515
Energy: 1.2231772510196013
Energy: 2.0049412440143386
Energy: 1.219232880463438
Energy: 1.2292480188782684
Energy: 1.2136174541786409
Energy: 1.2183442224258312
Energy: 1.229363168265871
Energy: 1.8345182979644692
Energy: 1.217419299407722
Energy: 1.2399964805944537
Energy: 1.207634185785983
Energy: 1.13043439851746
Energy: 1.2120781930793376
Energy: 1.8241739411532403
Energy: 1.2185068653548103
Energy: 1.258428824537175
Energy: 1.2355703518566854
Energy: 1.2210239296938243
Energy: 1.21777812786325
Energy: 1.8256364330520307
Energy: 1.1417717013250999
Energy: 1.146030484596799
Energy: 1.2105838197842045
Energy: 1.130260030744606
Energy: 1.2425311443904437
Energy: 1.7504982178778337
Energy: 1.2070860752588413
Energy: 1.2465938365846856
Energy: 1.1301009328672944
Energy: 1.2072833915182641
Energy: 1.1459145576331895
Energy: 1.4751527303593992
Energy: 1.2163950298845851
Energy: 1.2155563548291946
Energy: 1.2205061419396117
Energy: 1.2182284190796597
Energy: 1.2136590748588048
Energy: 1.46638742912365
Energy: 1.208659426095254
Energy: 1.238472340153895
Energy: 1.2178464628969645
Energy: 1.2092470841589968
Energy: 1.2151028156180228
Energy: 1.433072672707717
Energy: 1.208695206657202
Energy: 1.214737791815959
Energy: 1.2752467541418135
Energy: 1.2078349393881609
Energy: 1.2352623126279874
Energy: 1.2919878733255974
Energy: 1.2108843039207946
Energy: 1.2155107717529658
Energy: 1.226527157732798
Energy: 1.156194055728368
Energy: 1.2093511813412454
Energy: 1.28909907953641
Energy: 1.2018271587355405
Energy: 1.2000295427959464
Energy: 1.2404224552113414
Energy: 1.1355090302364361
Energy: 1.2185978008066243
Energy: 1.4411299114113645
Energy: 1.2306521795815015
Energy: 1.2286624090583202
Energy: 1.2334473948180045
Energy: 1.2111733897468207
Energy: 1.2238896854130195
Energy: 1.3468646661723536
Energy: 1.2087413576540236
Energy: 1.2381097671513386
Energy: 1.2193606089143836
Energy: 1.2070917485172377
Energy: 1.219135243414157
Energy: 1.3483145297899415
Energy: 1.2102890957074612
Energy: 1.2290284100583826
Energy: 1.2454038299932797
Energy: 1.2124666594301714
Energy: 1.2439204582089927
Energy: 1.687313241696875
Energy: 1.2115705901440423
Energy: 1.2157537688751774
Energy: 1.2160133210511537
Energy: 1.2113149021896397
Energy: 1.2314391462815544
Energy: 1.646045379077642
Energy: 1.2169514876085537
Energy: 1.1363799972517983
Energy: 1.2197218816653652
Energy: 1.2156443705378885
Energy: 1.26972135391992
Energy: 1.6482968139733007
Energy: 1.1351132922528715
Energy: 1.271209668143154
Energy: 1.2148480115661449
Energy: 1.2183533589244582
Energy: 1.2685971903505664
Energy: 1.7503948697982779
Energy: 1.2185116894763834
Energy: 1.2710303685736664
Energy: 1.2157269323719133
Energy: 1.2154603886511164
Energy: 1.2700603042631382
Energy: 1.9004053833049563
Energy: 1.2283800891109558
Energy: 1.2139979273175954
Energy: 1.2059179928926436
Energy: 1.2143806247553286
Energy: 1.2144915348338754
Energy: 1.9025793377102924
Energy: 1.2691973206727096
Energy: 1.244374499543383
Energy: 1.2072165272765758
Energy: 1.244885819066145
Energy: 1.2276845390337063
Energy: 1.895174550528777
Energy: 1.2222947623482319
Energy: 1.2126217454937667
Energy: 1.2043597579718082
Energy: 1.212636846580095
Energy: 1.200877275542196

minimum gb energy = 1.1301009328672944 eV
minimum distance =  2.30005810231582 Angstroms
sigma value = 33


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

Energy: 2.4060311288956946
Energy: 1.4187577568729575
Energy: 1.3216921855634443
Energy: 1.3200973832369722
Energy: 1.3060682826700407
Energy: 1.3509976293516173
Energy: 1.8196078423965545
Energy: 1.2908548272950322
Energy: 1.2610550241242746
Energy: 1.3182128021894277
Energy: 1.3332791648695275
Energy: 1.2473739737824128
Energy: 1.8213896400473255
Energy: 1.312223634303144
Energy: 1.2771891209122148
Energy: 1.2966836659013123
Energy: 1.311986087335067
Energy: 1.3130608677735474
Energy: 1.95720685955528
Energy: 1.407833972174165
Energy: 1.3363772895892803
Energy: 1.288443689399404
Energy: 1.3366224970642628
Energy: 1.3098015506725773
Energy: 1.8152329561798843
Energy: 1.423948520150791
Energy: 1.3044705803574608
Energy: 1.2231842023538382
Energy: 1.3335589598841535
Energy: 1.3744613292371832
Energy: 1.9437520605161116
Energy: 1.4292812443060778
Energy: 1.2892027738300165
Energy: 1.2853628660672047
Energy: 1.2993122625605253
Energy: 1.416757655014974
Energy: 1.9418879463961183
Energy: 1.378455978656474
Energy: 1.3674118833401698
Energy: 1.4201774138693437
Energy: 1.3659599307288741
Energy: 1.3647260671952683
Energy: 1.7708325323790366
Energy: 1.3429034492017102
Energy: 1.2943722677611074
Energy: 1.241363387759402
Energy: 1.3415345906688148
Energy: 1.2944933042538511
Energy: 1.5668294841373076
Energy: 1.3080551967740133
Energy: 1.3835485414519484
Energy: 1.4439685739974015
Energy: 1.3079042833239993
Energy: 1.41814953242246
Energy: 1.5662977727072946
Energy: 1.414621168215685
Energy: 1.4208422504096427
Energy: 1.377627343262152
Energy: 1.3660989609605605
Energy: 1.3407668736160936
Energy: 1.5508188119654789
Energy: 1.2940592954492138
Energy: 1.2933746509908435
Energy: 1.3054697515116211
Energy: 1.292312241011561
Energy: 1.2921219697445374
Energy: 1.4504773653027458
Energy: 1.2444144162321495
Energy: 1.3545995248166605
Energy: 1.3858122215107527
Energy: 1.2449199302954634
Energy: 1.3483906198636413
Energy: 1.449075441518639
Energy: 1.3847545567769515
Energy: 1.3838734654394436
Energy: 1.4265246747805798
Energy: 1.3807470257884216
Energy: 1.3596121342651868
Energy: 1.5955518345591235
Energy: 1.2922165126501126
Energy: 1.2888680878504917
Energy: 1.4164203596065892
Energy: 1.2887898734079786
Energy: 1.2979078954570566
Energy: 1.5608597681425926
Energy: 1.3515568917039524
Energy: 1.3707015511674563
Energy: 1.4308177455313065
Energy: 1.349396409130952
Energy: 1.371805426134621
Energy: 1.5598569951246277
Energy: 1.3729643704193069
Energy: 1.387530332470069
Energy: 1.4406591479906623
Energy: 1.352167188612715
Energy: 1.3865962358646993
Energy: 1.9467701509063664
Energy: 1.3930295444844327
Energy: 1.3747635906478357
Energy: 1.345959781897736
Energy: 1.3803764594916734
Energy: 1.3803372246493992
Energy: 1.7254193284359842
Energy: 1.3741720181093549
Energy: 1.3742192620231473
Energy: 1.3150284779534314
Energy: 1.373427531887813
Energy: 1.2658312653527917
Energy: 1.7237044526321221
Energy: 1.4226739156330852
Energy: 1.4274760701869824
Energy: 1.3173174415889894
Energy: 1.3453913692522683
Energy: 1.417767724489078
Energy: 1.762275433389121
Energy: 1.3436362693799035
Energy: 1.337758471193185
Energy: 1.3061224446954234
Energy: 1.34162415873919
Energy: 1.413236315151061
Energy: 2.057059551051316
Energy: 1.367419367759222
Energy: 1.2324298222034247
Energy: 1.2337227917443985
Energy: 1.373070634545347
Energy: 1.2324754767055457
Energy: 1.5842060413827088
Energy: 1.3891875832925218
Energy: 1.3487540870981198
Energy: 1.3099107867208284
Energy: 1.3893951836436984
Energy: 1.348108319866937
Energy: 1.7625321994838088
Energy: 1.4122288993095793
Energy: 1.3683953275870753
Energy: 1.3382288535894682
Energy: 1.3904418411515442
Energy: 1.3794459453379437
Energy: 2.0204384231718864
Energy: 1.45075258738362
Energy: 1.4003843919469547
Energy: 1.3033697050226554
Energy: 1.444234197847371
Energy: 1.3365287361030092
Energy: 1.7625543167750815
Energy: 1.4321133951233012
Energy: 1.3774496331491572
Energy: 1.3272998306879102
Energy: 1.43019020554523
Energy: 1.3795794917645683
Energy: 1.942214448590872
Energy: 1.432097167052227
Energy: 1.400672619957353
Energy: 1.3814802587454789
Energy: 1.4402329684916841
Energy: 1.4019277094029152
Energy: 1.938696214536097
Energy: 1.390891535755547
Energy: 1.3869918115277013
Energy: 1.3853861144632684
Energy: 1.3413159933602024
Energy: 1.3868047785220716
Energy: 1.8115933837170017
Energy: 1.2844818531334863
Energy: 1.3490906634540618
Energy: 1.3752959793959696
Energy: 1.3161989076125187
Energy: 1.4204828437328398
Energy: 1.5958040961998183
Energy: 1.287711040585385
Energy: 1.3486289489835215
Energy: 1.3552133986403607
Energy: 1.305962625062766
Energy: 1.4185179958595253
Energy: 1.5889964059551105
Energy: 1.3831110515446094
Energy: 1.371221365892048
Energy: 1.3379474772754454
Energy: 1.3809729811129874
Energy: 1.3946083339001856
Energy: 1.5774838538465625
Energy: 1.2940693814375548
Energy: 1.291913305379472
Energy: 1.3669860211664873
Energy: 1.2961078821430116
Energy: 1.292350445541866
Energy: 1.4281596455993721
Energy: 1.2455349580968182
Energy: 1.2637591402918915
Energy: 1.4229678832389863
Energy: 1.2470221219278461
Energy: 1.3699125165245376
Energy: 1.4275485099935914
Energy: 1.3532624872290984
Energy: 1.4094869644352952
Energy: 1.4226833731988648
Energy: 1.350735444333955
Energy: 1.3398220627797426
Energy: 1.4292758624007935
Energy: 1.2995231295818717
Energy: 1.3032846408089964
Energy: 1.416446095853856
Energy: 1.289106476671866
Energy: 1.2986866811534228
Energy: 1.562449922199205
Energy: 1.3487411800947424
Energy: 1.3392325294291831
Energy: 1.401769881546415
Energy: 1.3497082884360352
Energy: 1.376297943043924
Energy: 1.559816856021065
Energy: 1.3899324102472528
Energy: 1.2450914275438627
Energy: 1.2788888209788973
Energy: 1.285576701068685
Energy: 1.4042503473434573
Energy: 1.5603756901245747
Energy: 1.301418745588005
Energy: 1.2537820132206503
Energy: 1.2653680462141108
Energy: 1.2499914634256584
Energy: 1.402515953397001
Energy: 1.723813050911887
Energy: 1.3710078565187145
Energy: 1.3237127014680505
Energy: 1.3160260045745547
Energy: 1.279982730682579
Energy: 1.4105118833160306
Energy: 1.723494844206366
Energy: 1.2638258354172938
Energy: 1.244509213125135
Energy: 1.308750979272341
Energy: 1.2655573010824237
Energy: 1.2883145314056257
Energy: 1.8156651145317189
Energy: 1.3562308656752284
Energy: 1.3234229313359667
Energy: 1.22155486562664
Energy: 1.333501133394134
Energy: 1.2870465386231125
Energy: 2.032443305320808
Energy: 1.2670222946764809
Energy: 1.252002914178302
Energy: 1.2521313843288766
Energy: 1.2425749570098281
Energy: 1.3084021820214469

minimum gb energy = 1.22155486562664 eV
minimum distance =  2.27491386401992 Angstroms
sigma value = 51


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

Energy: 2.0660338777566407
Energy: 1.324847577514303
Energy: 1.2914530250566338
Energy: 1.2567331132187554
Energy: 1.34985264350505
Energy: 1.3630676061869993
Energy: 1.600474894235533
Energy: 1.3107544901297288
Energy: 1.2868383384790558
Energy: 1.208375286697344
Energy: 1.342868810900952
Energy: 1.245864170539907
Energy: 1.8812225416754418
Energy: 1.3101806385401549
Energy: 1.2866027309120154
Energy: 1.284727682842367
Energy: 1.3439493491276036
Energy: 1.2617242489483855
Energy: 1.8796551793349339
Energy: 1.2829488088463181
Energy: 1.2793593051732144
Energy: 1.2307384131127772
Energy: 1.2804081768150433
Energy: 1.2576835289876231
Energy: 1.6015099247152598
Energy: 1.3180996342627276
Energy: 1.207331475055539
Energy: 1.2074563810099517
Energy: 1.2291458818160839
Energy: 1.2086939027205688
Energy: 1.6016999716952705
Energy: 1.34817478478333
Energy: 1.3470926814408373
Energy: 1.3168574556569128
Energy: 1.3198689256897598
Energy: 1.346711713512345
Energy: 1.6013837821950447
Energy: 1.2079840326097795
Energy: 1.2118845101484306
Energy: 1.31721981801516
Energy: 1.208545610146201
Energy: 1.208471579166379
Energy: 1.5838294337228866
Energy: 1.2758318291019928
Energy: 1.2826582675212113
Energy: 1.2798186146715418
Energy: 1.27559199613733
Energy: 1.2753796888415578
Energy: 1.343827378602819
Energy: 1.276453357606111
Energy: 1.2810238159200449
Energy: 1.3440278780272334
Energy: 1.2766267981193666
Energy: 1.260019384962439
Energy: 1.344585930730707
Energy: 1.2804365493376904
Energy: 1.3158820834940168
Energy: 1.3448139406689172
Energy: 1.2282232583489239
Energy: 1.2875425306805182
Energy: 1.3625917392271412
Energy: 1.2746184119226833
Energy: 1.2847104908116447
Energy: 1.268453357562455
Energy: 1.2820890726898373
Energy: 1.3006834306225776
Energy: 1.4120468673789952
Energy: 1.2278480147021766
Energy: 1.277359926257614
Energy: 1.3095341141635315
Energy: 1.3181825616864753
Energy: 1.3359811638235348
Energy: 1.4086372293348493
Energy: 1.3057543106787504
Energy: 1.302582195090636
Energy: 1.3525692627077315
Energy: 1.3088739772603697
Energy: 1.3248673826342934
Energy: 1.409868486608665
Energy: 1.233824861765238
Energy: 1.2340441416351977
Energy: 1.2858087632567408
Energy: 1.2341865593661339
Energy: 1.2342902095975936
Energy: 1.7089024791181886
Energy: 1.2691456693437602
Energy: 1.3108705467741675
Energy: 1.2238917964360723
Energy: 1.2687726273397746
Energy: 1.3114667165231293
Energy: 1.7095820167669848
Energy: 1.3050746194428369
Energy: 1.268441791008644
Energy: 1.2244689828784492
Energy: 1.3058848766677438
Energy: 1.2281405294327439
Energy: 1.7440903951778304
Energy: 1.3043618823954597
Energy: 1.3070284103286551
Energy: 1.302363406034549
Energy: 1.3048486294346175
Energy: 1.2869102974774809
Energy: 2.0438655132477295
Energy: 1.2870850609361824
Energy: 1.2256874643247986
Energy: 1.2747090434934019
Energy: 1.309418950158542
Energy: 1.2932629299654754

minimum gb energy = 1.207331475055539 eV
minimum distance =  2.30499878796862 Angstroms
sigma value = 19


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

Energy: 1.7609442044701682
Energy: 1.2440641457907406
Energy: 1.277121306877794
Energy: 1.403719131130309
Energy: 1.2445652700484717
Energy: 1.2780100188394103
Energy: 1.5094791740465257
Energy: 1.2682046418225557
Energy: 1.2678148710112331
Energy: 1.3095345299360979
Energy: 1.2680308259920199
Energy: 1.2682585223306178
Energy: 1.5055929907615395
Energy: 1.268527287754737
Energy: 1.267515808922813
Energy: 1.3138692760757988
Energy: 1.2686343482868767
Energy: 1.2678837516137247
Energy: 1.497017932501871
Energy: 1.2685828230113996
Energy: 1.2686689475623965
Energy: 1.2930165039981143
Energy: 1.268540736460089
Energy: 1.2692667664638562
Energy: 1.5091692489374129
Energy: 1.267402417675758
Energy: 1.3195216745721978
Energy: 1.3137240901539895
Energy: 1.2668142641324867
Energy: 1.3181482831336206
Energy: 1.5085549269674898
Energy: 1.2301225556779019
Energy: 1.3167098365739847
Energy: 1.3123367416613
Energy: 1.2299905060564484
Energy: 1.3066550098226093
Energy: 1.5087607461195178
Energy: 1.3191777517278371
Energy: 1.308777769253208
Energy: 1.3113096313931543
Energy: 1.245087840196801
Energy: 1.3069657692492844
Energy: 1.4314307929636587
Energy: 1.2100886652941352
Energy: 1.2098072654841714
Energy: 1.2689431177612966
Energy: 1.2105646103514751
Energy: 1.2088957087160686
Energy: 1.2679496394542624
Energy: 1.209005578479689
Energy: 1.2091596805589262
Energy: 1.2679466290999257
Energy: 1.209382931960776
Energy: 1.223228652552666
Energy: 1.267556422931106
Energy: 1.269986863722623
Energy: 1.2680811911877925
Energy: 1.2676052479402995
Energy: 1.3123460444092618
Energy: 1.2682757476344675
Energy: 1.2683776597348346
Energy: 1.2949258478201573
Energy: 1.2960309800337442
Energy: 1.2680644686878253
Energy: 1.2948639769281236
Energy: 1.2679648957084757
Energy: 1.507212155343627
Energy: 1.312640058319869
Energy: 1.318104586843416
Energy: 1.268748827828092
Energy: 1.3125369581404842
Energy: 1.2679150213312314
Energy: 1.2295871603188362
Energy: 1.3105804323013235
Energy: 1.3182284493631287
Energy: 1.2297421836523172
Energy: 1.311254498075974
Energy: 1.313701688058976
Energy: 1.507902352301045
Energy: 1.3135756748063894
Energy: 1.3132629923426482
Energy: 1.268409691656597
Energy: 1.313207614981682
Energy: 1.3122259632740827
Energy: 1.769472982372341
Energy: 1.2682450027563352
Energy: 1.2687989253655294
Energy: 1.2097413041972498
Energy: 1.2676112983604668
Energy: 1.2241299722631502
Energy: 1.7684629281260198
Energy: 1.2689954603825704
Energy: 1.209247086544045
Energy: 1.208698295768888
Energy: 1.2675605612397356
Energy: 1.2093860610292633
Energy: 1.5097140712685306
Energy: 1.2674494752665353
Energy: 1.2681174521247487
Energy: 1.3108897504267578
Energy: 1.2666682769504172
Energy: 1.2682782211925858
Energy: 1.4944808716722837
Energy: 1.2683342191029967
Energy: 1.2687984693101713
Energy: 1.2930398245962071
Energy: 1.2681629932321972
Energy: 1.2684855727188968
Energy: 1.4945645495621012
Energy: 1.2686163371325405
Energy: 1.2682803057595424
Energy: 1.292766958211721
Energy: 1.2680205793869777
Energy: 1.26781491691478
Energy: 1.5082326614090642
Energy: 1.2299035542598205
Energy: 1.3179177750614717
Energy: 1.3107557254013267
Energy: 1.2296382344574797
Energy: 1.3167301450928761
Energy: 1.503523617172643
Energy: 1.3114016033441833
Energy: 1.3108922453242817
Energy: 1.3141641658398175
Energy: 1.2671931358477693
Energy: 1.3132350897552019
Energy: 1.5075013406556341
Energy: 1.318656460875443
Energy: 1.3179890335576443
Energy: 1.3197079490774353
Energy: 1.246153900217862
Energy: 1.3189093281444486
Energy: 1.4334780672955116
Energy: 1.2074604001934968
Energy: 1.2089657746932854
Energy: 1.4335775327004816
Energy: 1.2084658593772653
Energy: 1.212115808339701
Energy: 1.2680223460770215
Energy: 1.2690644508168283
Energy: 1.2688425955226532
Energy: 1.2679611678997147
Energy: 1.2836800110534285
Energy: 1.267943239493205
Energy: 1.2683995276390163
Energy: 1.2692921713721723
Energy: 1.2679724139623336
Energy: 1.2684074528389766
Energy: 1.3110440542836277
Energy: 1.2678035410109525
Energy: 1.4356776284448975
Energy: 1.2933363745833377
Energy: 1.293190347569961
Energy: 1.4326326448611646
Energy: 1.2929571118096785
Energy: 1.2684619324575088
Energy: 1.5079356888936144
Energy: 1.312146810000059
Energy: 1.318082579266685
Energy: 1.2667636654222
Energy: 1.3132727418686532
Energy: 1.3178847958011892
Energy: 1.2296848953392074
Energy: 1.3103743535112145
Energy: 1.3057227278728747
Energy: 1.2298301865184533
Energy: 1.3118295208598763
Energy: 1.3185284674594797
Energy: 1.434156457669308
Energy: 1.3102819343586731
Energy: 1.3066015194613554
Energy: 1.2460906106476897
Energy: 1.3114769077105224
Energy: 1.3073452553054492
Energy: 1.7688681908455528
Energy: 1.2659321599767266
Energy: 1.2231690104123754
Energy: 1.2105479259008725
Energy: 1.2661715290875646
Energy: 1.2093128342625332

minimum gb energy = 1.2074604001934968 eV
minimum distance =  2.36209713765412 Angstroms
sigma value = 27


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

Energy: 1.4912502765163054
Energy: 1.2085272886635554
Energy: 1.6504340673170685
Energy: 1.23000531762269
Energy: 1.2080627274409528
Energy: 1.1609035939735912
Energy: 1.470170623264286
Energy: 1.2742812774712144
Energy: 1.1447288219907803
Energy: 1.162843022670915
Energy: 1.2739415695452387
Energy: 1.1019600617714063
Energy: 1.3368305855411364
Energy: 1.2693657778191554
Energy: 1.2287535608115447
Energy: 1.1023159100736886
Energy: 1.2686009714051607
Energy: 1.1662654402615908
Energy: 1.3382082372124608
Energy: 1.1617966700277198
Energy: 1.104554391332754
Energy: 1.144824309518659
Energy: 1.1614735644111627
Energy: 1.1029226285340172
Energy: 1.4699482788968823
Energy: 1.124841717034176
Energy: 1.1438961058387742
Energy: 1.2047592392246802
Energy: 1.1283148564039387
Energy: 1.1438490248718507
Energy: 1.2670541830388091
Energy: 1.126292880832007
Energy: 1.1253175409161316
Energy: 1.267205705915625
Energy: 1.1235827202971937
Energy: 1.0848107798116358
Energy: 1.2729318460424353
Energy: 1.158832922356299
Energy: 1.1433464569189888
Energy: 1.2731707310946967
Energy: 1.1593167515837985
Energy: 1.1674614854541454
Energy: 1.2755812395813038
Energy: 1.13702968911696
Energy: 1.1368210605140325
Energy: 1.275655883785594
Energy: 1.1373255677889877
Energy: 1.1372916831204156
Energy: 1.3371349375444617
Energy: 1.1374581886845043
Energy: 1.1030729211378396
Energy: 1.2747649957056302
Energy: 1.1387585453393045
Energy: 1.1656437340426713
Energy: 1.1691476060846353
Energy: 1.1448152255414563
Energy: 1.1445916606447049
Energy: 1.2282405358785358
Energy: 1.1448426345350668
Energy: 1.1673346405864466
Energy: 1.3378163136823902
Energy: 1.2234275303501807
Energy: 1.225902312899163
Energy: 1.1674172437909185
Energy: 1.2248185276584085
Energy: 1.2267363958027016
Energy: 1.3141556319030434
Energy: 1.1653434610677023
Energy: 1.1436096716986854
Energy: 1.1588302279005456
Energy: 1.1665861990224282
Energy: 1.1021607480058082

minimum gb energy = 1.0848107798116358 eV
minimum distance =  2.34380870984005 Angstroms
sigma value = 9


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

Energy: 2.3616798189209667
Energy: 1.1551386103961137
Energy: 1.0324250128402974
Energy: 1.1595047241551812
Energy: 1.1554581721927342
Energy: 1.0711964115115593
Energy: 1.1298726828911028
Energy: 1.0873463184783168
Energy: 1.026820320248735
Energy: 1.03780908574942
Energy: 1.0865827176298068
Energy: 1.0390895782504088
Energy: 1.128666078577138
Energy: 1.0865638760109717
Energy: 1.0787366729770906
Energy: 1.068293435081646
Energy: 1.0875326714616702
Energy: 1.0642363215433406
Energy: 1.1279106637296834
Energy: 1.0118476077655232
Energy: 1.0107085596591134
Energy: 1.0500987217365407
Energy: 1.0846413662612977
Energy: 1.0115609630837494
Energy: 1.1977291246754134
Energy: 1.0475552879666745
Energy: 1.0109071651321162
Energy: 1.0910109272936628
Energy: 1.0469696603031806
Energy: 1.082022789416218
Energy: 1.1161079065152233
Energy: 1.0200385514846562
Energy: 0.991685050058842
Energy: 1.1159797411090413
Energy: 1.0344032323428787
Energy: 0.991975447682133
Energy: 1.1170199480634657
Energy: 1.011234544050371
Energy: 1.0109949518858192
Energy: 1.1179887299809022
Energy: 1.0473866344235356
Energy: 1.1136449563144974
Energy: 1.115395355945884
Energy: 1.0535504601636694
Energy: 1.0120089388538294
Energy: 1.1155773290590325
Energy: 1.0475319639500142
Energy: 1.0119523092949887
Energy: 1.3154552166294426
Energy: 1.055021896449822
Energy: 1.013457999559617
Energy: 1.0851445951304353
Energy: 1.0798374506399155
Energy: 1.065957339865748
Energy: 1.0352544652974813
Energy: 1.012860502538559
Energy: 1.0106169760327925
Energy: 1.0320440160387792
Energy: 1.084075506576041
Energy: 1.0182944763861084
Energy: 1.034932881974554
Energy: 1.1153594945394851
Energy: 1.1157159136855659
Energy: 1.057896307351299
Energy: 1.1150722476783805
Energy: 1.0360343293666383
Energy: 1.3430202543135812
Energy: 1.1151867577028547
Energy: 1.081509358640027
Energy: 1.02967273733225
Energy: 1.1156338941531232
Energy: 1.0002952783229866
Energy: 2.074400210529455
Energy: 1.251216035543669
Energy: 1.0093353809362426
Energy: 1.0222846458822368
Energy: 1.2887184731954835
Energy: 1.0652024472447255
Energy: 1.339083214236411
Energy: 1.084988465706417
Energy: 1.0664396092924764
Energy: 1.0294552519532694
Energy: 1.1171167141896312
Energy: 1.0614813463760093
Energy: 1.0871747800048626
Energy: 1.0572132623238073
Energy: 1.0573757897902065
Energy: 1.0874352259579172
Energy: 1.0602960439286249
Energy: 1.0639444891769043
Energy: 1.08752420024729
Energy: 1.0301300844428731
Energy: 1.039439253680325
Energy: 1.0867617716714868
Energy: 1.0651033776034236
Energy: 1.062163868562422
Energy: 1.0852267882700228
Energy: 1.0269717229591104
Energy: 1.0213460655609263
Energy: 1.0852090893579123
Energy: 1.0278926067683694
Energy: 1.046412582201788
Energy: 1.1288382049000407
Energy: 1.0136983203654444
Energy: 1.079508645018247
Energy: 1.08562326176832
Energy: 1.0514782232055282
Energy: 1.0269972557579534
Energy: 1.1285818709886903
Energy: 1.0323500783825776
Energy: 1.0336518221665354
Energy: 1.086357998286492
Energy: 1.0323519684075493
Energy: 1.0357438652123283
Energy: 1.1276697855140294
Energy: 1.0559425889922471
Energy: 1.0358319729174008
Energy: 1.0539440035051886
Energy: 1.0541049010026715
Energy: 1.0313597625882984
Energy: 1.1286928414434683
Energy: 1.0483003597764986
Energy: 1.0327451747047047
Energy: 1.0525711590662867
Energy: 1.049073938763503
Energy: 1.0356949759741834
Energy: 1.1971821343358746
Energy: 1.0671557677756796
Energy: 1.06595794371022
Energy: 1.0495857569402454
Energy: 1.086385970182403
Energy: 0.9903469401902012
Energy: 1.1936428414694942
Energy: 1.0862717527188035
Energy: 1.0310453827941704
Energy: 1.0496065365749572
Energy: 1.0855893212914083
Energy: 1.0414019789269882
Energy: 1.127923102648789
Energy: 1.0867716145708874
Energy: 1.060805062295944
Energy: 1.0556414102304463
Energy: 1.0872125861939677
Energy: 1.0575084163892934
Energy: 1.501816213828836
Energy: 1.0312350149373364
Energy: 1.0645290016722337
Energy: 1.0634440239081406
Energy: 1.0867893974271727
Energy: 1.0689899415099227
Energy: 1.1269610300679254
Energy: 1.029292664127199
Energy: 1.0012724340446244
Energy: 1.0935086037536637
Energy: 1.0301063046371945
Energy: 1.0627532441920073
Energy: 1.0373046522157652
Energy: 1.0376073764843616
Energy: 1.0220213872714576
Energy: 1.037725661426339
Energy: 1.049732860293044
Energy: 1.0204149396350433
Energy: 1.1160745441514996
Energy: 1.0012256449223509
Energy: 1.0010269439748107
Energy: 1.115184647526575
Energy: 1.029101239714379
Energy: 1.1146302351016375
Energy: 1.115806319257055
Energy: 1.053531426584191
Energy: 1.0173061030047517
Energy: 1.1157198019512515
Energy: 1.053364419278112
Energy: 1.1149499356332604
Energy: 1.0982736108887752
Energy: 1.0554014893568402
Energy: 1.0112574100399676
Energy: 1.0843320456679015
Energy: 1.047681832542298
Energy: 1.0104501460126525
Energy: 1.0350756674289074
Energy: 1.0536962313778424
Energy: 1.011971580358102
Energy: 1.056050353546452
Energy: 1.0534434503491061
Energy: 1.1046797247663316
Energy: 1.040946478815382
Energy: 1.087750700165938
Energy: 1.0679437161663972
Energy: 1.032581763886764
Energy: 1.115975488495497
Energy: 1.0180070407354067
Energy: 1.3407324822772577
Energy: 1.1162308833889738
Energy: 1.080768596693678
Energy: 1.084876751059401
Energy: 1.1185019166495962
Energy: 1.0116723341214648
Energy: 1.1205204707122556
Energy: 1.1160421520207824
Energy: 1.116516298326615
Energy: 1.0517093374555333
Energy: 1.1157276722977725
Energy: 1.0086035879400246
Energy: 1.1154677190052078
Energy: 1.0672111313653079
Energy: 1.0620796693397978
Energy: 1.0544191148989293
Energy: 1.091048424530503
Energy: 1.0829116386495998
Energy: 1.1201368793627329
Energy: 1.0594537749979314
Energy: 1.0166045697567208
Energy: 1.072874951694627
Energy: 1.0614123042466923
Energy: 1.012961549838992
Energy: 1.0868542486261905
Energy: 1.0653653791403075
Energy: 1.056374874740709
Energy: 1.0882853266379673
Energy: 1.0618603152389738
Energy: 1.0687793914053918
Energy: 1.0856896076518052
Energy: 1.0343009822060374
Energy: 1.0354601180087923
Energy: 1.0857249278550163
Energy: 1.0394575468108396
Energy: 1.0557432498592911
Energy: 1.1176362283711097
Energy: 1.0248822646576055
Energy: 1.0111836711270956
Energy: 1.1178415378080215
Energy: 1.0504325075939618
Energy: 1.101690857169626
Energy: 1.1270715612745499
Energy: 1.0430163717641099
Energy: 1.0507782878441887
Energy: 1.0858531520860375
Energy: 1.0394119518428997
Energy: 1.0461180251780737
Energy: 1.125817481917731
Energy: 1.0343949680586297
Energy: 1.043995174048463
Energy: 1.0522436456844484
Energy: 1.0565347540164636
Energy: 1.0386314873995057
Energy: 1.1292429427193307
Energy: 1.0567147660755092
Energy: 1.0632885119724058
Energy: 1.0508758551187702
Energy: 1.0557524349826675
Energy: 1.0293278961856855
Energy: 1.1936492572016422
Energy: 1.0864549826661392
Energy: 1.0601061167584176
Energy: 1.049284287552061
Energy: 1.0863698860663593
Energy: 1.0443303459558244

minimum gb energy = 0.9903469401902012 eV
minimum distance =  2.31682638746942 Angstroms
sigma value = 57


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

Energy: 1.1032488321243095
Energy: 0.8082978678070443
Energy: 0.5440926481728348
Energy: 0.5380095529213625
Energy: 0.8131799227176317
Energy: 1.0634665632405431
Energy: 1.2015170736177856
Energy: 0.8648073682443873
Energy: 0.8642434069491
Energy: 0.8668022851593713
Energy: 0.8648674826494951
Energy: 0.8072628428634399
Energy: 1.206221612425918
Energy: 1.5395723388262184
Energy: 0.8064444038644945
Energy: 0.8067594652856221
Energy: 0.8106480767620464
Energy: 1.4792715606071356
Energy: 1.2035822121205004
Energy: 1.1338656701850132
Energy: 0.8516648512420647
Energy: 0.8686466509355782
Energy: 1.146227601575956
Energy: 1.1416220360640241
Energy: 1.2027123960612645
Energy: 0.7311865698538202
Energy: 0.7329429435477676
Energy: 1.1385193401945592
Energy: 0.7289422959650491
Energy: 1.1433706866693663
Energy: 1.1612271473201854
Energy: 0.7299830595947563
Energy: 0.7327636811992799
Energy: 0.9244805014568754
Energy: 0.7278912065453046
Energy: 0.6974177178723716
Energy: 1.162107001561923
Energy: 1.1286267502902594
Energy: 0.8078998864187946
Energy: 0.9245461601119613
Energy: 0.7982946901508651
Energy: 1.1357172029827136
Energy: 0.9000324640679087
Energy: 1.147087630321581
Energy: 1.3708102140209324
Energy: 1.570290363449255
Energy: 1.4978690466122777
Energy: 1.4814481510806048
Energy: 0.8138418806248147
Energy: 1.1007062454074892
Energy: 1.233835112704609
Energy: 1.192288965502673
Energy: 1.1911064105599252
Energy: 1.2726492854690634
Energy: 0.9165803938087941
Energy: 0.864233005090664
Energy: 0.5407921244671
Energy: 0.5369465558985863
Energy: 0.8156536567073289
Energy: 0.8896046957632453
Energy: 0.9166600674791109
Energy: 1.2493445408003476
Energy: 1.1623632375286554
Energy: 0.5371644511704944
Energy: 1.1334416132630443
Energy: 0.8546814206227553
Energy: 0.814382007947482
Energy: 1.19717531053932
Energy: 1.204546784849931
Energy: 1.205202579541776
Energy: 1.1918890409494607
Energy: 1.5157193694585545
Energy: 1.1775055658456808
Energy: 1.1115844919427729
Energy: 1.1213735406028922
Energy: 0.9163090169260313
Energy: 0.8106821297888218
Energy: 1.1115084956165946
Energy: 1.1689017767627368
Energy: 1.1333941733193584
Energy: 0.9021561780062367
Energy: 0.9215140591327572
Energy: 0.9037496504799487
Energy: 1.129558454915057
Energy: 0.8143976693870885
Energy: 0.7318768379999933
Energy: 0.7318934285112538
Energy: 0.8095513084415348
Energy: 0.7280535711940102
Energy: 0.7296579770087811
Energy: 1.17361220093633
Energy: 0.8991736922419438
Energy: 0.8442532478910265
Energy: 0.8645958996666974
Energy: 0.7299525450308764
Energy: 1.1439876442916548
Energy: 1.1792711291145694
Energy: 1.1598228320539157
Energy: 0.9006752763481771
Energy: 0.8667654657757915
Energy: 1.1104036773715362
Energy: 1.1280564594130214
Energy: 1.2031978520903648
Energy: 0.8776035108828294
Energy: 0.8301482187791679
Energy: 0.8111394662260847
Energy: 0.8065657313774682
Energy: 1.502147813879295
Energy: 1.1051931886964192
Energy: 0.8649926124826677
Energy: 0.8334979283419032
Energy: 0.5372905818761522
Energy: 0.8671900634146908
Energy: 0.8071662413919795

minimum gb energy = 0.5369465558985863 eV
minimum distance =  2.28658267516078 Angstroms
sigma value = 11


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

Energy: 1.8390107434877323
Energy: 1.0065138620786163
Energy: 1.0751768449579036
Energy: 0.9736943463414939
Energy: 1.0076433918542447
Energy: 1.0596641655830055
Energy: 0.810235780335345
Energy: 0.8335188318571392
Energy: 0.8416003101269109
Energy: 0.8292590278268563
Energy: 0.8125002147924294
Energy: 0.8234064878012809
Energy: 0.8315316643021591
Energy: 0.8178206621836279
Energy: 0.8106228509730585
Energy: 0.8332492365678363
Energy: 0.8184964037500995
Energy: 0.8284320900725284
Energy: 0.8297649786795651
Energy: 0.8126247468219128
Energy: 0.8267907138901791
Energy: 0.8310359242800468
Energy: 0.8290399358516094
Energy: 0.8258868739531393
Energy: 0.8099497611239495
Energy: 0.946823903571914
Energy: 0.9246229602594237
Energy: 0.8129843326354099
Energy: 0.8330972132511095
Energy: 0.8196695641135667
Energy: 0.869385411745427
Energy: 0.8586650847385531
Energy: 0.8316554133389212
Energy: 0.836869670724063
Energy: 0.8637525246994363
Energy: 0.9176793047437902
Energy: 0.8822533679149853
Energy: 0.8353672096504905
Energy: 0.8269797856566078
Energy: 0.8216058927567377
Energy: 0.8471479994595923
Energy: 0.8301351085459872
Energy: 0.8345110480625983
Energy: 0.8627603175954381
Energy: 0.863048311673881
Energy: 0.8433914662384705
Energy: 0.86217159387482
Energy: 0.8673389618088493
Energy: 0.8813106140588365
Energy: 0.842058513653629
Energy: 0.8244177318246678
Energy: 0.8614532983778314
Energy: 0.8308218550128885
Energy: 0.8371595881136172
Energy: 1.5360673572493715
Energy: 0.9194563859917472
Energy: 0.9182316395974216
Energy: 1.047740007746432
Energy: 0.9148785642775066
Energy: 0.8299825803842245
Energy: 1.268325660127264
Energy: 0.9182338948163415
Energy: 0.9195406721560709
Energy: 0.8466723738550277
Energy: 0.9446150294165097
Energy: 0.9237341592702969
Energy: 1.045618021260014
Energy: 0.7926328478132244
Energy: 0.825359902902446
Energy: 0.8674916636936266
Energy: 0.8061127702647939
Energy: 0.8105232170078207
Energy: 1.0180464892467322
Energy: 0.7931868189924255
Energy: 0.7872545095950794
Energy: 0.8682030917846718
Energy: 0.8092672227256902
Energy: 0.8127124936893615
Energy: 1.017283106167512
Energy: 1.0304259703235414
Energy: 1.0289896438567843
Energy: 0.8377945298267658
Energy: 0.9220118917171617
Energy: 1.028152554029367
Energy: 1.02455107365438
Energy: 1.0193014904224995
Energy: 0.9009444014976271
Energy: 0.9608185269392812
Energy: 1.0144692822720407
Energy: 0.8545801005858037
Energy: 1.2614909069332947
Energy: 1.0304429247391182
Energy: 1.0277802337572413
Energy: 0.9362392295514711
Energy: 0.9572937061401777
Energy: 1.0278206002626995
Energy: 1.3038707857240022
Energy: 0.9535251739788597
Energy: 0.8267143856304477
Energy: 1.2323411478251742
Energy: 1.1747262381201018
Energy: 0.7908288528229306
Energy: 1.6332281288653252
Energy: 0.9237892393631818
Energy: 0.9258034161229879
Energy: 0.8548727233232906
Energy: 0.936655293908521
Energy: 0.9238673113112541
Energy: 1.2603015515542348
Energy: 0.8295367455267129
Energy: 0.8204655735407972
Energy: 0.8314505888143449
Energy: 0.8491738863266327
Energy: 0.8279754397516249
Energy: 1.068878179654136
Energy: 1.0321635752568457
Energy: 0.8416249557658927
Energy: 1.0455375712524395
Energy: 1.0264686348027894
Energy: 0.820545323785108
Energy: 1.260338846289593
Energy: 0.9500138094600626
Energy: 0.9247853906487574
Energy: 0.9166012385803121
Energy: 1.023960223567066
Energy: 0.9233874158354496
Energy: 1.1939068505336896
Energy: 0.8579674552288427
Energy: 0.8888423724860343
Energy: 1.191483362796959
Energy: 0.894878640077791
Energy: 0.7907654728088723
Energy: 0.8246134436815665
Energy: 0.9458024804097148
Energy: 0.9275642999455213
Energy: 0.8262053243774254
Energy: 0.8255475917729683
Energy: 0.9261499066917736
Energy: 0.8217485629977209
Energy: 0.8227694848978382
Energy: 0.8288532834053909
Energy: 0.8221505745151099
Energy: 0.8159543806666423
Energy: 0.8109081040834442
Energy: 0.9826813979099898
Energy: 0.8214209220739875
Energy: 0.8080484563399639
Energy: 0.9641466316673101
Energy: 0.8301632966266999
Energy: 0.8381741772799874
Energy: 0.9197943636268536
Energy: 0.8270498232939962
Energy: 0.8195336864548611
Energy: 0.834803239750959
Energy: 0.8555321975459539
Energy: 0.790762827172031

minimum gb energy = 0.7872545095950794 eV
minimum distance =  2.32362767141653 Angstroms
sigma value = 41


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

Energy: 1.7738745922949612
Energy: 0.9869383537362563
Energy: 0.9837204048683295
Energy: 1.0561384482568763
Energy: 0.9926583331080111
Energy: 1.058691915406391
Energy: 0.88056340067962
Energy: 0.8858696969460189
Energy: 0.8845207725135243
Energy: 0.8741807203599404
Energy: 0.8784766735576739
Energy: 0.8827429453884252
Energy: 0.8763040345129429
Energy: 0.8932601658599312
Energy: 0.8795609209338336
Energy: 0.8770769812438792
Energy: 0.8845736515184448
Energy: 0.8808332925916067
Energy: 0.8763346805800294
Energy: 0.8752922396582442
Energy: 0.8813599040963563
Energy: 0.8760517795286646
Energy: 0.8850538341245137
Energy: 0.8798525980160453
Energy: 0.8788612152646794
Energy: 0.8875460460288169
Energy: 0.9076377525520509
Energy: 0.879492085490228
Energy: 0.8865427401119655
Energy: 0.8802523115503478
Energy: 0.9701352938893718
Energy: 0.935237538675807
Energy: 0.9125188577113729
Energy: 0.9074123091407438
Energy: 0.8751730681405819
Energy: 0.9080495481214824
Energy: 0.9699374090390857
Energy: 0.8759801854530466
Energy: 0.8777680309518823
Energy: 0.8822061696380162
Energy: 0.9091858350459078
Energy: 0.8815005058253106
Energy: 0.9095700904153596
Energy: 0.9697387945873671
Energy: 0.9709803314115695
Energy: 0.9176377577170799
Energy: 0.9694719381434691
Energy: 0.8975666217746542
Energy: 0.9731752667389194
Energy: 0.8813668470512088
Energy: 0.8792926035238255
Energy: 0.9102302779717719
Energy: 0.888826221859008
Energy: 0.8804273736637546
Energy: 1.2791245578906214
Energy: 0.9080483750997735
Energy: 0.9266905685642467
Energy: 1.1884693572707767
Energy: 0.9300209811879949
Energy: 0.8823521427035332
Energy: 0.9712273550310031
Energy: 0.9052504589210963
Energy: 0.9057876561134572
Energy: 0.8810971897958184
Energy: 0.9304297150203682
Energy: 0.8915517963582296
Energy: 1.2346340365835997
Energy: 0.8472211610515754
Energy: 0.8437596616081763
Energy: 0.9271720002322696
Energy: 0.8482846815903132
Energy: 0.891135003107951
Energy: 0.8929875311617238
Energy: 0.8473592455739805
Energy: 0.8432869412746945
Energy: 0.9281529154442516
Energy: 0.8485135661426857
Energy: 0.8404161145798537
Energy: 0.8925762003783388
Energy: 0.8761746245446933
Energy: 0.8788638893546333
Energy: 0.8745199606003503
Energy: 0.907754426476745
Energy: 0.8805448170736638
Energy: 0.9693971846143281
Energy: 0.9735460956408976
Energy: 0.9742168252177046
Energy: 0.9696073201555525
Energy: 0.8935555669043369
Energy: 0.9716923113227278
Energy: 0.882286056726726
Energy: 0.8806137093310956
Energy: 0.8815572046780575
Energy: 0.9088442865575663
Energy: 0.877358062104014
Energy: 0.8803125548706662
Energy: 1.6447447601427916
Energy: 0.8831658687734768
Energy: 0.8494437961260825
Energy: 1.4349027825038678
Energy: 0.8821000702093242
Energy: 0.9353039593733136
Energy: 0.91299091476488
Energy: 0.8738618126120088
Energy: 0.8738134827289495
Energy: 0.843312039663118
Energy: 0.886311137526288
Energy: 0.8484610513180265
Energy: 0.8775474609229833
Energy: 0.8824706150028502
Energy: 0.881587826953771
Energy: 0.8775186689405381
Energy: 0.8839844369539481
Energy: 0.8814310939336455
Energy: 0.8762093314509211
Energy: 0.8830755134239918
Energy: 0.8811909300206918
Energy: 0.8778975174111621
Energy: 0.8853800817450639
Energy: 0.8780634323340639
Energy: 0.8807210753453047
Energy: 0.8807753696098434
Energy: 0.8830977486468841
Energy: 0.8813943265048317
Energy: 0.8737606684133993
Energy: 0.8825214599875781
Energy: 0.8874694114304621
Energy: 1.1644650150349196
Energy: 1.171438274154534
Energy: 0.8867159420822517
Energy: 1.1359099694557873
Energy: 0.971002815432065
Energy: 0.9722275370064802
Energy: 0.8775633421315747
Energy: 0.8803227097585206
Energy: 0.877102127915633
Energy: 0.8728588441753243
Energy: 0.8811133655009948
Energy: 0.9100295330704077
Energy: 0.9709443545172425
Energy: 0.8814244846584731
Energy: 0.9159694678297152
Energy: 0.9712161189244016
Energy: 0.8435661522273943
Energy: 0.9704406395126935
Energy: 0.8800514057939351
Energy: 0.8816223126674498
Energy: 0.901875412098954
Energy: 0.8815176305637266
Energy: 0.8821825291498535
Energy: 1.2781793720459993
Energy: 0.9047613588280633
Energy: 0.9059586651090068
Energy: 0.8804010785409956
Energy: 0.9321657018177074
Energy: 0.9046754621415406
Energy: 1.279562764667462
Energy: 0.9048117780049938
Energy: 0.89208441358401
Energy: 1.138993378178087
Energy: 0.9280289619962254
Energy: 0.8809015052017714
Energy: 0.9740943908322451
Energy: 0.8716156225740087
Energy: 0.9053909236818619
Energy: 0.9251814139509277
Energy: 0.8496998941772139
Energy: 0.9086064711597862
Energy: 0.8936740816241191
Energy: 0.9424800147084312
Energy: 0.919064093052441
Energy: 0.932338831799286
Energy: 1.2119997294876403
Energy: 0.9157019099363883
Energy: 1.0711187413387953
Energy: 0.9042266580176944
Energy: 0.9055997822516265
Energy: 0.8937968868418388
Energy: 0.9043201158755101
Energy: 0.9059560793747923
Energy: 0.8901360352963985
Energy: 0.8805695105866932
Energy: 0.8788226431217269
Energy: 0.8905418313701593
Energy: 0.880922867532684
Energy: 0.884313359650714
Energy: 0.8831893776770566
Energy: 0.8736359890720176
Energy: 0.8819074788422032
Energy: 0.8823222295223411
Energy: 0.8775747667746784
Energy: 0.8777891341875913
Energy: 1.6448209825991125
Energy: 0.8915354088933004
Energy: 0.8477378008426442
Energy: 0.8559165404734522
Energy: 0.9099996793024611
Energy: 0.9037526215714302

minimum gb energy = 0.8404161145798537 eV
minimum distance =  2.32058143731419 Angstroms
sigma value = 33


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

Energy: 1.2584912033563322
Energy: 1.112150001311045
Energy: 0.9872876051271378
Energy: 0.9749013939589649
Energy: 1.0414351761218978
Energy: 1.1565556510789972
Energy: 0.9606810142466344
Energy: 0.949824810639305
Energy: 0.976645841891302
Energy: 0.9714133395126838
Energy: 0.9739861387824823
Energy: 0.9522959857008523
Energy: 0.9633507089837318
Energy: 0.9478744801981388
Energy: 0.9454124501849324
Energy: 0.968974458925108
Energy: 0.9457308737465099
Energy: 0.9459038417941873
Energy: 0.9644496245570721
Energy: 0.9614669923028182
Energy: 0.9459759034017236
Energy: 0.9589936655749114
Energy: 0.9473458287077229
Energy: 0.9459307042337307
Energy: 0.9614313440025081
Energy: 0.9643147998855522
Energy: 0.9232644161807133
Energy: 0.95803174543747
Energy: 0.9695568493821691
Energy: 0.9460911349535419
Energy: 1.0398180096913756
Energy: 0.9596885334848735
Energy: 0.9609613712919475
Energy: 1.040954074005351
Energy: 0.9258953950443517
Energy: 0.9588407638871786
Energy: 1.01500039243462
Energy: 0.9292236911904858
Energy: 0.9482372388189165
Energy: 0.9616560276698163
Energy: 0.941883745062657
Energy: 0.9428411597080332
Energy: 0.9985899154641187
Energy: 1.0137853924195637
Energy: 0.971540480240808
Energy: 0.9150235689961712
Energy: 1.0607535846959857
Energy: 0.9719928872778173
Energy: 1.0230851374170133
Energy: 0.9612171503604833
Energy: 0.9305790011297642
Energy: 0.9260503920366449
Energy: 0.9287828190591457
Energy: 0.9317020076123022
Energy: 1.5152980780256171
Energy: 0.9458874313323347
Energy: 0.9458937111632651
Energy: 0.9420862795509147
Energy: 0.980126066982764
Energy: 0.9452124212573062
Energy: 1.0828096650035999
Energy: 0.9300091677209992
Energy: 0.9472939211582855
Energy: 0.9601091030587975
Energy: 0.9931014497026203
Energy: 0.94987960278123
Energy: 1.0167996548012999
Energy: 0.9191764737258195
Energy: 0.9178154915901179
Energy: 0.957967865289606
Energy: 0.9170859380765132
Energy: 0.9179239758167993
Energy: 1.0405313548070225
Energy: 0.920385532096622
Energy: 0.9177923261548001
Energy: 1.042214341424663
Energy: 0.916739580231477
Energy: 0.9145482025533599
Energy: 0.9860871435008395
Energy: 0.9455559596910172
Energy: 0.9485913842149076
Energy: 0.966243211165912
Energy: 0.9629462535290344
Energy: 0.9451688573354995
Energy: 0.9146398568726604
Energy: 0.9460771480570893
Energy: 0.9440668872777702
Energy: 0.9432899146781051
Energy: 0.9485315723307974
Energy: 0.943948907505488
Energy: 0.9748611759674632
Energy: 0.9689487436461951
Energy: 0.9526883859421899
Energy: 0.9746697132717658
Energy: 0.9654129308791155
Energy: 0.9501553403921927
Energy: 1.5126933435391796
Energy: 0.9247288047122051
Energy: 0.928851897240518
Energy: 1.331457469006655
Energy: 1.042583880220539
Energy: 0.9538781205514528
Energy: 1.0225396041830832
Energy: 0.9277433974142301
Energy: 0.9245417295406435
Energy: 0.9983681826356507
Energy: 1.0246138895223058
Energy: 0.9241596596254084
Energy: 0.9592626032428402
Energy: 0.9147316132422875
Energy: 0.9173027293440017
Energy: 0.979109790344538
Energy: 0.9142177708223729
Energy: 0.9468659633370267
Energy: 0.9236720076052017
Energy: 0.9165438622709171
Energy: 0.9229275664222174
Energy: 0.9237615135718551
Energy: 0.9974501191671876
Energy: 0.9491501345952348
Energy: 0.9216817406841208
Energy: 0.9317538497049833
Energy: 0.9292753930826232
Energy: 0.9222429311188411
Energy: 0.932992807636731
Energy: 0.9290587703094504
Energy: 1.0634582819564276
Energy: 0.9477181192995336
Energy: 0.9465958593812415
Energy: 1.063535325476689
Energy: 0.9462407431840795
Energy: 1.0688923594290756
Energy: 0.960642021018551
Energy: 0.9623796822720717
Energy: 0.957686101452823
Energy: 0.9223041747501792
Energy: 0.9997233395476042
Energy: 0.9305578481321232
Energy: 1.014460017914556
Energy: 0.9211443875045181
Energy: 0.9172055341661245
Energy: 0.9158067765104135
Energy: 1.046939441657105
Energy: 0.9188214565264453
Energy: 1.0014577620389908
Energy: 0.978190249435415
Energy: 0.9580320192381437
Energy: 0.9771618387564972
Energy: 0.9635228389901184
Energy: 0.9484626308028987
Energy: 0.9652542156438034
Energy: 0.9483322329130109
Energy: 0.9447240032482938
Energy: 0.9708139602351438
Energy: 0.9419736139549301
Energy: 0.9448208992624614
Energy: 0.9625309541432162
Energy: 0.9470652290968575
Energy: 0.9470150948041139
Energy: 0.9674515382566088
Energy: 0.9656324822174497
Energy: 0.9488810244449705
Energy: 0.9584499336334207
Energy: 0.9618054297190965
Energy: 0.9501876110930804
Energy: 0.95901827990524
Energy: 0.9888150295368587
Energy: 0.9486137847990032
Energy: 1.0377638790543284
Energy: 0.9505258889567954
Energy: 0.9516816617640879
Energy: 1.1711770994881818
Energy: 1.3366444212302468
Energy: 0.9508928997980953
Energy: 1.0148757473532943
Energy: 0.9292212404199272
Energy: 0.9294095289003117
Energy: 0.9964204425534249
Energy: 0.9612446562124494
Energy: 0.9580940524503506
Energy: 0.9986959843893308
Energy: 1.063840567706531
Energy: 0.9748180498941083
Energy: 0.9205742930094272
Energy: 1.0622807177644653
Energy: 0.9708859886060821
Energy: 1.015302494852829
Energy: 0.9610968120422675
Energy: 0.9303888234676636
Energy: 0.9737885704213977
Energy: 0.9216344846209084
Energy: 0.9302006385322531
Energy: 1.0828990399113676
Energy: 0.9459068984547784
Energy: 0.9464376343846297
Energy: 0.9635397965403404
Energy: 0.9465715913261361
Energy: 0.9459388834197001
Energy: 1.0826205934410136
Energy: 0.942820769591321
Energy: 0.9466053322463973
Energy: 0.9636990748342548
Energy: 0.95491049458531
Energy: 0.9443612199989571
Energy: 1.0152468556894316
Energy: 0.9523197369522227
Energy: 0.9177324787789819
Energy: 0.9984668578867115
Energy: 0.9509013723810957
Energy: 0.9310738068479066
Energy: 1.0419544375259835
Energy: 0.9200661929336401
Energy: 0.9184150033080253
Energy: 1.0428681925894132
Energy: 0.9185833005503246
Energy: 0.9184434065353205
Energy: 0.9790725910605346
Energy: 0.9675438268196638
Energy: 0.953250565986014
Energy: 0.9807045699647926
Energy: 0.967342660039593
Energy: 0.9544082486542838
Energy: 0.9850319795406062
Energy: 0.9477148779987903
Energy: 0.946120025316931
Energy: 0.9856935012240092
Energy: 0.9463112722969277
Energy: 0.9442685701565978
Energy: 0.9798376075934409
Energy: 0.9693614441014874
Energy: 0.9492665592297153
Energy: 0.9449160679032451
Energy: 0.9693519443530282
Energy: 0.9493671329499628
Energy: 1.512340416964251
Energy: 0.9748875488262174
Energy: 0.9240951622610875
Energy: 0.9720482721782665
Energy: 0.9551874318701257
Energy: 0.934994472661853
Energy: 1.0861748127568291
Energy: 0.9717648400359871
Energy: 0.9231942755451549
Energy: 0.9647517912116663
Energy: 0.9207979659720881
Energy: 0.9222506474632697
Energy: 0.9649221512810737
Energy: 0.9149677459082131
Energy: 0.9191317805318644
Energy: 0.9434518160801262
Energy: 0.9962540267017023
Energy: 0.948703165910081
Energy: 0.9757360827156756
Energy: 0.9143620715543248
Energy: 0.917515365069963
Energy: 0.9764882206286506
Energy: 0.9169439137225873
Energy: 0.9246030224522305
Energy: 0.9265093744406326
Energy: 0.9356014029583573
Energy: 0.9317195244459691
Energy: 0.9277453984112924
Energy: 1.0209177939741023
Energy: 0.9315095165041305
Energy: 1.0603230409261637
Energy: 0.9441662547285818
Energy: 1.0135495500811484
Energy: 1.060255283942867
Energy: 0.9461173618555412
Energy: 1.0104373495452044
Energy: 0.9616361348459045
Energy: 0.9621773530295168
Energy: 0.943223315033373
Energy: 0.9937081822392488
Energy: 0.9699229104261963
Energy: 0.9433921979861717
Energy: 2.0241238700575974
Energy: 0.9771753212937517
Energy: 0.9181489218541944
Energy: 0.9158048817895207
Energy: 0.9251527111819388
Energy: 0.9179880353986206

minimum gb energy = 0.9142177708223729 eV
minimum distance =  2.32792651352496 Angstroms
sigma value = 67


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

Energy: 1.5051676226781863
Energy: 1.0747990571650234
Energy: 1.0763080511142065
Energy: 1.0767838010217716
Energy: 1.0733590022332085
Energy: 1.0741694465462246
Energy: 1.0681857815978588
Energy: 1.025333363988593
Energy: 1.0248844424935946
Energy: 1.0251050158912534
Energy: 1.0283418422846144
Energy: 1.0244717054380648
Energy: 1.0282250989726578
Energy: 0.9647753584261859
Energy: 1.0053109895796424
Energy: 1.0033418401217622
Energy: 0.9636616523726411
Energy: 1.0036326288471247
Energy: 1.0279072560380733
Energy: 1.0008382498286759
Energy: 1.001582388029748
Energy: 1.0010908317633755
Energy: 1.0019104902992422
Energy: 1.0021529875636181
Energy: 1.0647108480450311
Energy: 1.0265461316502293
Energy: 1.026849796035348
Energy: 1.0656260143139467
Energy: 1.0263033043239427
Energy: 1.027354222348578
Energy: 1.0661060891338223
Energy: 1.0187279888874243
Energy: 1.0303646336086618
Energy: 1.0665170972345135
Energy: 1.0259288226889538
Energy: 1.030973829313995
Energy: 1.0905158849823609
Energy: 1.0253153277379388
Energy: 1.025197151309701
Energy: 0.9612942234246397
Energy: 1.02823482795046
Energy: 1.0245989007339462

minimum gb energy = 0.9612942234246397 eV
minimum distance =  2.34827151252077 Angstroms
sigma value = 3


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

Energy: 1.4982322289829035
Energy: 1.2275668383550762
Energy: 1.1275407002470794
Energy: 1.1039601944631396
Energy: 1.229679025095065
Energy: 1.1872485692955153
Energy: 1.2758188092882137
Energy: 1.2044481083511762
Energy: 1.1741732288848727
Energy: 1.1386140756669234
Energy: 1.1500364366028537
Energy: 1.1444765930737695
Energy: 1.2522215002909218
Energy: 1.2294915715277774
Energy: 1.2363041158697923
Energy: 1.17953977077047
Energy: 1.2255935301034506
Energy: 1.1637204550996794
Energy: 1.2541213378905638
Energy: 1.1646706627130696
Energy: 1.1628276750098483
Energy: 1.2576480604101998
Energy: 1.1980515382256987
Energy: 1.1649175269801058
Energy: 1.2687159692319585
Energy: 1.2208693338849776
Energy: 1.2241262528990091
Energy: 1.2718064698350544
Energy: 1.2348849732500544
Energy: 1.2451549093807737
Energy: 1.2529560987133246
Energy: 1.2211371004339988
Energy: 1.2155647172887676
Energy: 1.2546325480194749
Energy: 1.2246630969469745
Energy: 1.2487046977275074
Energy: 1.2403720666823388
Energy: 1.2466276620763432
Energy: 1.2237670967506644
Energy: 1.2418959229927498
Energy: 1.1217951948687497
Energy: 1.2289416598409857
Energy: 1.4619262329179157
Energy: 1.3197803386156286
Energy: 1.1661646765577645
Energy: 1.1966705126161563
Energy: 1.2394207043198944
Energy: 1.2235855011443588
Energy: 1.2202589656972895
Energy: 1.2294885228490464
Energy: 1.2994506829195906
Energy: 1.215691871068375
Energy: 1.2225998219198118
Energy: 1.2756467646659833
Energy: 1.2656240833171206
Energy: 1.1552615083704583
Energy: 1.160684437526741
Energy: 1.319203428133204
Energy: 1.152229356805574
Energy: 1.1741155942276509
Energy: 1.2560751136301755
Energy: 1.1353436642427608
Energy: 1.2051111612791434
Energy: 1.259344271643663
Energy: 1.1550644796780705
Energy: 1.2069605299286352
Energy: 1.2609868934265254
Energy: 1.2177154821400284
Energy: 1.2273962698210177
Energy: 1.2066102564591255
Energy: 1.2231091055003287
Energy: 1.2254202788694784
Energy: 1.1716672937064996
Energy: 1.2411044709225956
Energy: 1.2350647135107549
Energy: 1.1338934998454198
Energy: 1.2411716757797024
Energy: 1.2312590824824865
Energy: 1.2854379134562859
Energy: 1.2391664024737878
Energy: 1.2407778912785046
Energy: 1.2700811485186456
Energy: 1.2425841792361918
Energy: 1.2386827811435988
Energy: 1.3042286288421752
Energy: 1.2703489007648232
Energy: 1.2750753380834088
Energy: 1.1596491795417616
Energy: 1.2697904658360029
Energy: 1.2381289989444797
Energy: 1.261888349348725
Energy: 1.2647931062028772
Energy: 1.2645045795149517
Energy: 1.3017289563409913
Energy: 1.2616058354488464
Energy: 1.2726613888718423
Energy: 1.3526871677229164
Energy: 1.1770284287955484
Energy: 1.1767113232369433
Energy: 1.3535883579035735
Energy: 1.2108666584013958
Energy: 1.1455420566388395
Energy: 1.3747895300254496
Energy: 1.2422724537492726
Energy: 1.3056122969611488
Energy: 1.3153405421163693
Energy: 1.1733116456196424
Energy: 1.3088549621140402
Energy: 1.3148880315287572
Energy: 1.235746009784549
Energy: 1.2362385942600842
Energy: 1.235044010003373
Energy: 1.3251457742677606
Energy: 1.1623116080443219
Energy: 1.2563965983492673
Energy: 1.2199709031686115
Energy: 1.2211153588166
Energy: 1.2349340597066374
Energy: 1.2207939256407112
Energy: 1.1643126976255762
Energy: 1.2236090129489083
Energy: 1.2133353556863105
Energy: 1.2150111553824945
Energy: 1.224645191477371
Energy: 1.2160298326588614
Energy: 1.2238914520696875
Energy: 1.2257118201605308
Energy: 1.211220053388528
Energy: 1.2234849038165612
Energy: 1.2336574557825817
Energy: 1.224488219786891
Energy: 1.2205624942051154
Energy: 1.2431349859382566
Energy: 1.2371085476166566
Energy: 1.245181636998167
Energy: 1.2228134872913305
Energy: 1.2401081150610516
Energy: 1.245268948314395
Energy: 1.2131968789102408
Energy: 1.1938541966226883
Energy: 1.196149268211529
Energy: 1.2134402832230844
Energy: 1.194443663271281
Energy: 1.2677182713150483
Energy: 1.2428840776374859
Energy: 1.269068918570044
Energy: 1.2774873636305304
Energy: 1.2810504333266481
Energy: 1.2344797536057805
Energy: 1.276197511726287
Energy: 1.3210261067583666
Energy: 1.28474448350397
Energy: 1.1132699402262527
Energy: 1.122953862671059
Energy: 1.255735454659475
Energy: 1.173349022136992
Energy: 1.115359260591529
Energy: 1.2839113931792487
Energy: 1.1155040815604922
Energy: 1.1720984434795085
Energy: 1.258486014706581
Energy: 1.1726772109320565
Energy: 1.2425319627049387
Energy: 1.271981315179692
Energy: 1.2758151361047207
Energy: 1.2881689918181878
Energy: 1.280202820566423
Energy: 1.2628435725193938
Energy: 1.2565186202994443
Energy: 1.2326758244323084
Energy: 1.2366383478813978
Energy: 1.2570089853176012
Energy: 1.1658692096953198
Energy: 1.2565679845330653
Energy: 1.2569272783118295
Energy: 1.2414693613626933
Energy: 1.2714102380588015
Energy: 1.2591534662080344
Energy: 1.2293002651124183
Energy: 1.2667709009462336
Energy: 1.2558998055573467
Energy: 1.3015446318969102
Energy: 1.2688719837310307
Energy: 1.2630292757679569
Energy: 1.3206511704099584
Energy: 1.2677508243043976
Energy: 1.2671834237231525
Energy: 1.2054132995032107
Energy: 1.21113521970618
Energy: 1.2211720783694324
Energy: 1.2208624439840452
Energy: 1.2117516791500995
Energy: 1.3686326486954512
Energy: 1.2187496965293627
Energy: 1.2811918821339736
Energy: 1.196270027822372
Energy: 1.2856558443768682
Energy: 1.1778353562847912
Energy: 1.287921637618372
Energy: 1.293036624342438
Energy: 1.2966952664438294
Energy: 1.189169436478004
Energy: 1.289593456736692
Energy: 1.2770092905631878
Energy: 1.254120691673299
Energy: 1.2108910114217846
Energy: 1.2131138646713253
Energy: 1.2748861330297037
Energy: 1.2140263761905066
Energy: 1.2249803643280193
Energy: 1.2770576304974601
Energy: 1.1555107949922854
Energy: 1.1614137197092007
Energy: 1.2774866725063414
Energy: 1.152576241297266
Energy: 1.1762284439618729
Energy: 1.2585761719961912
Energy: 1.2182037483970123
Energy: 1.2155767464991574
Energy: 1.255464742477985
Energy: 1.2235075686286525
Energy: 1.2122588304226958
Energy: 1.1759148562899553
Energy: 1.2387804988824307
Energy: 1.241254042130766
Energy: 1.1441287980159807
Energy: 1.2397666865514896
Energy: 1.239972863189588
Energy: 1.2679130504411487
Energy: 1.2437816606189696
Energy: 1.2419238069659397
Energy: 1.219594202621641
Energy: 1.242907380238081
Energy: 1.224199850287913
Energy: 1.2200485448176657
Energy: 1.2392567223544249
Energy: 1.2403896436797104
Energy: 1.1739569269881176
Energy: 1.2383217868847078
Energy: 1.2486241997361691
Energy: 1.3584942024028996
Energy: 1.2374010598494696
Energy: 1.238524260525656
Energy: 1.27050347127304
Energy: 1.2708018945633235
Energy: 1.2557160616242873
Energy: 1.3548375684472918
Energy: 1.1540494667808299
Energy: 1.1511796002623529
Energy: 1.3118528202615587
Energy: 1.2123637375906129
Energy: 1.2650569457105714
Energy: 1.3795879029123117
Energy: 1.1834502861068976
Energy: 1.181953739535306
Energy: 1.4250938141517364
Energy: 1.2093667901794853
Energy: 1.2200995685149583
Energy: 1.24527655544192
Energy: 1.2769691099142864
Energy: 1.2774364767255675
Energy: 1.2147238767308592
Energy: 1.2556857806081532
Energy: 1.2861958131104065
Energy: 1.7508735559403938
Energy: 1.2092072530812117
Energy: 1.1948042732726285
Energy: 1.2691278257911718
Energy: 1.1008438206784545
Energy: 1.1954733993457993
Energy: 1.2436421678771126
Energy: 1.2136135226154225
Energy: 1.2360729362991634
Energy: 1.2269795529800946
Energy: 1.0972227031975883
Energy: 1.231776068325902
Energy: 1.218723282104064
Energy: 1.222363390540008
Energy: 1.224755499745105
Energy: 1.2325758348794378
Energy: 1.2184558353129815
Energy: 1.22589984493371
Energy: 1.2223487045803212
Energy: 1.099718410851147
Energy: 1.2292533014755493
Energy: 1.2229373910155248
Energy: 1.2239728852638516
Energy: 1.1201421928132873
Energy: 1.2247865867440324
Energy: 1.189682314404215
Energy: 1.1324615454595266
Energy: 1.2272053354471604
Energy: 1.1911336572191655
Energy: 1.1572315546438174
Energy: 1.2541702610369305
Energy: 1.1931084743242746
Energy: 1.1930746449234904
Energy: 1.1620180995524416
Energy: 1.1914973881596151
Energy: 1.1633611700899984
Energy: 1.1743425841207147
Energy: 1.1981255541586544
Energy: 1.191462047184835
Energy: 1.1569108994586397
Energy: 1.1729711569212335
Energy: 1.1607594965426622

minimum gb energy = 1.0972227031975883 eV
minimum distance =  2.2915023917536 Angstroms
sigma value = 81


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

Energy: 2.1244799754234016
Energy: 1.1298808101173818
Energy: 1.0751866195324353
Energy: 1.075956272919651
Energy: 1.129976729913174
Energy: 1.0754342754355515
Energy: 1.1438755448436382
Energy: 1.1585154660359063
Energy: 1.1583667466709937
Energy: 1.121348981858071
Energy: 1.1283453347419221
Energy: 1.1645274992513397
Energy: 1.1190776831020606
Energy: 1.0945964244139263
Energy: 1.1028312980096218
Energy: 1.1021892290947448
Energy: 1.0799930685365067
Energy: 1.1810224915563043
Energy: 1.1419246094410855
Energy: 1.103533321732457
Energy: 1.1341003818648965
Energy: 1.1422094457453729
Energy: 1.088188167872116
Energy: 1.1400946156054912
Energy: 1.1465621644625659
Energy: 1.1396920455221344
Energy: 1.139126444149013
Energy: 1.1468959493857516
Energy: 1.1584555212991579
Energy: 1.1513921310637159
Energy: 1.157669170533603
Energy: 1.1518642706314375
Energy: 1.151805267212838
Energy: 1.1551373331188357
Energy: 1.156300061453972
Energy: 1.1519282493549152
Energy: 1.143165888686703
Energy: 1.1440165860777187
Energy: 1.1555820992000252
Energy: 1.1270640064515915
Energy: 1.1544754090053617
Energy: 1.1529650060355703
Energy: 1.288003457943652
Energy: 1.2331464436084933
Energy: 1.1566085218307869
Energy: 1.1110407928269932
Energy: 1.2469267311528776
Energy: 1.135741309306095
Energy: 1.1292669989889716
Energy: 1.0701246380983849
Energy: 1.0961508545076035
Energy: 1.1378806001014525
Energy: 1.0691600209763212
Energy: 1.1459532982097238
Energy: 1.1014535640598428
Energy: 1.0308238022180845
Energy: 1.0304020165850274
Energy: 1.100020246186832
Energy: 1.030814599459353
Energy: 1.0299107902489057
Energy: 1.1466424774328685
Energy: 1.0222407861519491
Energy: 1.0366567643201101
Energy: 1.146034934646329
Energy: 1.0376852341068354
Energy: 1.142054860443194
Energy: 1.0797024089094276
Energy: 1.0701705864291542
Energy: 1.0710701289850242
Energy: 1.088537562293616
Energy: 1.0883373467984565
Energy: 1.0712880336019794
Energy: 1.0782865848964749
Energy: 1.1642877556603697
Energy: 1.1445972156666937
Energy: 1.0858335157693735
Energy: 1.15756856115999
Energy: 1.0989602860659526
Energy: 1.1787315260132745
Energy: 1.1650649560226183
Energy: 1.1633152926725616
Energy: 1.1699651908170616
Energy: 1.1658762911759344
Energy: 1.1643080356480016
Energy: 1.2126080728183983
Energy: 1.1914602848771283
Energy: 1.1776048787490605
Energy: 1.1794517495485624
Energy: 1.14535968504871
Energy: 1.177879736266161
Energy: 1.1769257109058913
Energy: 1.1516541971412482
Energy: 1.1692521420604867
Energy: 1.176047850081461
Energy: 1.1597243676496047
Energy: 1.1705383082059093
Energy: 1.2078283389319122
Energy: 1.1109552747114788
Energy: 1.111076572535715
Energy: 1.2125729701471406
Energy: 1.1262339903444385
Energy: 1.0919643003824486
Energy: 1.3281573695565627
Energy: 1.1642810331783295
Energy: 1.2261488215681857
Energy: 1.0758716130670931
Energy: 1.1310813886070732
Energy: 1.0877303414687827
Energy: 1.2766138210387816
Energy: 1.1359367389525505
Energy: 1.0324064414368794
Energy: 1.13893470897877
Energy: 1.1537738900134311
Energy: 1.0331073485120945
Energy: 1.2734213836690684
Energy: 1.1364980049215085
Energy: 1.0313031103850656
Energy: 1.0227620016802768
Energy: 1.1568160060019574
Energy: 1.0317864839691449
Energy: 1.0769924587613455
Energy: 1.1324283292785915
Energy: 1.07506658061509
Energy: 1.0759997631287737
Energy: 1.1331124380034194
Energy: 1.077416699840118
Energy: 1.159370117833153
Energy: 1.099087570082032
Energy: 1.0997290517261888
Energy: 1.1605405884890758
Energy: 1.1031186431924944
Energy: 1.1258095646005657
Energy: 1.1595704280815722
Energy: 1.1562745334358766
Energy: 1.1564398070289463
Energy: 1.15994738909257
Energy: 1.1630986636004805
Energy: 1.1630007730645953
Energy: 1.1770405171699307
Energy: 1.173758173018442
Energy: 1.172351510670247
Energy: 1.1734105618525061
Energy: 1.1810176162324664
Energy: 1.1722578947471995
Energy: 1.1661881552993074
Energy: 1.171781425184283
Energy: 1.1701111189051532
Energy: 1.159327980662585
Energy: 1.175285361086519
Energy: 1.1699989980160665
Energy: 1.2000903279037236
Energy: 1.166922668232113
Energy: 1.1639121012278377
Energy: 1.1059060802003096
Energy: 1.157679623322049
Energy: 1.231237975925742
Energy: 1.20557644621984
Energy: 1.224160027926772
Energy: 1.2240519278968969
Energy: 1.1079443918386545
Energy: 1.2243649205546834
Energy: 1.2261662944219132
Energy: 1.134003414911402
Energy: 1.024834864603306
Energy: 1.1433659651174177
Energy: 1.1312547923950174
Energy: 1.0181888218369486
Energy: 1.1429490104360693
Energy: 1.1457194381627631
Energy: 1.029228218600975
Energy: 1.0297896062339504
Energy: 1.149673344479205
Energy: 1.0288644832342504
Energy: 1.0298403825161306
Energy: 1.143445634579321
Energy: 1.0684768797172708
Energy: 1.1327532357575472
Energy: 1.142517690701355
Energy: 1.0743967141499473
Energy: 1.1567206798566692
Energy: 1.0758429993487657
Energy: 1.1685838137511475
Energy: 1.126127604521393
Energy: 1.0797682530402328
Energy: 1.2162624583773392
Energy: 1.099220975647669
Energy: 1.1427509702585423
Energy: 1.139248582442883
Energy: 1.1523885856116225
Energy: 1.1263123285673984
Energy: 1.1383487182272913
Energy: 1.1271365312551676
Energy: 1.2062323655806337
Energy: 1.1477790621436408
Energy: 1.1467271354050608
Energy: 1.1624316149117935
Energy: 1.153625734513694
Energy: 1.1468298790879934
Energy: 1.2048604453113771
Energy: 1.1421317921285319
Energy: 1.1447448288451667
Energy: 1.1575620676954888
Energy: 1.1574386345431946
Energy: 1.1591228948443115
Energy: 1.1996226439094477
Energy: 1.1502911207242401
Energy: 1.1481619901263591
Energy: 1.1496530653495451
Energy: 1.1128962779638734
Energy: 1.1564889033649677
Energy: 1.2492227215266392
Energy: 1.1258844426833186
Energy: 1.1259590820733234
Energy: 1.27099575136851
Energy: 1.1241827431766405
Energy: 1.2470316860914985
Energy: 1.14259889831961
Energy: 1.1430111835579735
Energy: 1.1582942040582886
Energy: 1.1218843433077692
Energy: 1.1805712560961859
Energy: 1.1609132437135277
Energy: 1.2688984693551317
Energy: 1.081620659683754
Energy: 1.0764203963745662
Energy: 1.0653167625653985
Energy: 1.1209828822301298
Energy: 1.0770796454950038

minimum gb energy = 1.0181888218369486 eV
minimum distance =  2.28884837860861 Angstroms
sigma value = 43


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

Energy: 2.088951755804322
Energy: 1.219419051218089
Energy: 1.1781911452506961
Energy: 1.0970937087400563
Energy: 1.219028071377462
Energy: 1.0971823628964457
Energy: 1.0528576067963853
Energy: 1.0693295176111524
Energy: 1.1000520710993276
Energy: 1.1514536090684213
Energy: 1.0614162749371263
Energy: 1.1695769861109617
Energy: 1.2192305526080833
Energy: 1.0423890992687785
Energy: 1.0428564624283785
Energy: 1.1312118848265051
Energy: 1.0425234532682521
Energy: 1.0517626548072878
Energy: 1.0533080548387224
Energy: 1.0426964519594943
Energy: 1.051298253575469
Energy: 1.052202148900737
Energy: 1.0565239178881334
Energy: 1.0523731659237792
Energy: 1.0640898915140329
Energy: 1.073709838418792
Energy: 1.0654549163972833
Energy: 1.0651023046528942
Energy: 1.0743368295611877
Energy: 1.0680366161793942
Energy: 1.065968909069977
Energy: 1.0669696977273175
Energy: 1.0681786675317306
Energy: 1.072420088535424
Energy: 1.0722347093118014
Energy: 1.0639907045372217
Energy: 1.0564007769201822
Energy: 1.0534504173500392
Energy: 1.052616456113507
Energy: 1.0502287969179978
Energy: 1.052812150598923
Energy: 1.0730746011816545
Energy: 1.1712019865107863
Energy: 1.0497193477280196
Energy: 1.0499496350963902
Energy: 1.1385224933562075
Energy: 1.0664030047479707
Energy: 1.0509267141145207
Energy: 1.060445797508235
Energy: 1.174856659073385
Energy: 1.17553948862566
Energy: 1.0618925243878108
Energy: 1.1750024529124108
Energy: 1.0548243648629512
Energy: 1.2462505875604282
Energy: 1.086005339708949
Energy: 1.073753187248685
Energy: 1.2465190276339293
Energy: 1.1185444901137462
Energy: 1.1187132074423158
Energy: 1.129886100137348
Energy: 1.1006642455329736
Energy: 1.1091563905514954
Energy: 1.0597914735639054
Energy: 1.0777326393559856
Energy: 1.079407347022976
Energy: 1.0792163110204491
Energy: 1.0529823105408114
Energy: 1.0530570520795435
Energy: 1.0524617502955018
Energy: 1.0527729769624714
Energy: 1.053079957751227
Energy: 1.2135700190079635
Energy: 1.051546309864109
Energy: 1.0646894352443295
Energy: 1.0511023528845715
Energy: 1.0967340228511064
Energy: 1.064932726499033
Energy: 1.1287186355618108
Energy: 1.058400935381815
Energy: 1.0896702706691226
Energy: 1.0687826146524895
Energy: 1.0546424611495275
Energy: 1.1022689096399712
Energy: 1.1275330935626449
Energy: 1.1177018231613476
Energy: 1.0891511680989507
Energy: 1.128804990187251
Energy: 1.0747590913816065
Energy: 1.087376348247819
Energy: 1.1264109620166922
Energy: 1.06897075089021
Energy: 1.0816111595595128
Energy: 1.127896639395764
Energy: 1.070472119970002
Energy: 1.0609294341628117
Energy: 1.0577604925477595
Energy: 1.138937122931835
Energy: 1.1394657737024687
Energy: 1.0579446452100245
Energy: 1.096766551510268
Energy: 1.1398043682701995
Energy: 1.057702109991983
Energy: 1.13976066376573
Energy: 1.1448891279836075
Energy: 1.1048801011449547
Energy: 1.1442682992126063
Energy: 1.1433038356412264
Energy: 1.07001866940536
Energy: 1.1254180763361068
Energy: 1.1417506122872194
Energy: 1.0930652072017637
Energy: 1.107394323454567
Energy: 1.0598382920797675
Energy: 1.2903202892326464
Energy: 1.124740615867479
Energy: 1.128331034879226
Energy: 1.0708950001937347
Energy: 1.102779747076422
Energy: 1.0588909220562148
Energy: 1.0586793725822523
Energy: 1.099923917514556
Energy: 1.1428769043738256
Energy: 1.1019096852835244
Energy: 1.0739620091946778
Energy: 1.142179920432753
Energy: 1.168127143218184
Energy: 1.0888991637820522
Energy: 1.092977307672899
Energy: 1.1684403860500245
Energy: 1.0892289352385858
Energy: 1.2369475320106342
Energy: 1.0951712095358763
Energy: 1.0986778081595918
Energy: 1.1018955471349325
Energy: 1.1446405362075973
Energy: 1.0977972625920556
Energy: 1.1285935133784344
Energy: 1.1307609760869568
Energy: 1.1416192760273682
Energy: 1.1414370567785639
Energy: 1.1256749891050977
Energy: 1.1462194626445201
Energy: 1.1400397123335322
Energy: 1.091261394547597
Energy: 1.128321795578277
Energy: 1.129884597121059
Energy: 1.130659256946656
Energy: 1.1281839103178177
Energy: 1.1428334660622106
Energy: 1.0963856186409804
Energy: 1.0652065875569392
Energy: 1.0815120648003473
Energy: 1.0848326797645367
Energy: 1.1292081113564676
Energy: 1.078119789840977
Energy: 1.0966594925855528
Energy: 1.069540778805547
Energy: 1.0828215540155581
Energy: 1.0584068987972846
Energy: 1.0640008111135293
Energy: 1.081052824926756
Energy: 1.0980495101081147
Energy: 1.064700768804803
Energy: 1.0602205705133925
Energy: 1.0526960417715348
Energy: 1.0604245409041992
Energy: 1.0643875001648664
Energy: 1.0623689701622556
Energy: 1.059899042465929
Energy: 1.0595979013792867
Energy: 1.0623330315241686
Energy: 1.1388719200800508
Energy: 1.0596883338086445
Energy: 1.0521028685185496
Energy: 1.0655032388354324
Energy: 1.0652874237710774
Energy: 1.1867289373506642
Energy: 1.0604037737361458
Energy: 1.0525980043920595
Energy: 1.191099329638068
Energy: 1.1715626725598225
Energy: 1.0796053178216876
Energy: 1.0996265695769576
Energy: 1.2248221711919915
Energy: 1.0749181701372856

minimum gb energy = 1.0423890992687785 eV
minimum distance =  2.29321750397878 Angstroms
sigma value = 57


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

Energy: 1.365702232471256
Energy: 1.136239399805413
Energy: 1.1026226895226676
Energy: 1.1045082685764478
Energy: 1.135918978504049
Energy: 1.2282750161036258
Energy: 1.3294648902311332
Energy: 1.066629632263167
Energy: 1.166001408360768
Energy: 1.0753030953704579
Energy: 1.0683822521710222
Energy: 1.0496280471530457
Energy: 1.277967562892514
Energy: 1.1424784279241686
Energy: 1.1490855107722229
Energy: 1.0989349334633696
Energy: 1.1409438739223872
Energy: 1.1499284176751599
Energy: 1.3302927381441534
Energy: 1.1502161679948375
Energy: 1.1487628582730356
Energy: 1.3343554891454938
Energy: 1.1501098183423413
Energy: 1.1226327139302994
Energy: 1.2637008936763119
Energy: 1.2670621460390126
Energy: 1.2662509490465945
Energy: 1.0420408725726056
Energy: 1.0541600629071888
Energy: 1.2691615576217383
Energy: 1.1471699156093167
Energy: 1.2462897145173801
Energy: 1.2546738308589016
Energy: 1.2637764503444695
Energy: 1.2491778010118257
Energy: 1.2511122659854754
Energy: 1.30906177652894
Energy: 1.2939137308320492
Energy: 1.29518192065699
Energy: 1.29846341599986
Energy: 1.2931023905067465
Energy: 1.266049779040781
Energy: 1.2915417691199886
Energy: 1.3083680156578852
Energy: 1.318247181005196
Energy: 1.2020121390051666
Energy: 1.3255103763392815
Energy: 1.3151401287428124
Energy: 1.3482348801033393
Energy: 1.3178509978990676
Energy: 1.313010831109331
Energy: 1.3501695526877682
Energy: 1.3188499498650625
Energy: 1.284004095143344
Energy: 1.4152588988271595
Energy: 1.221351870886034
Energy: 1.2206482629066702
Energy: 1.4154186575668888
Energy: 1.2203169325267862
Energy: 1.2208092040317275
Energy: 1.2580175455896947
Energy: 1.1957567488558034
Energy: 1.2618488486101718
Energy: 1.3382212237824214
Energy: 1.196055904274502
Energy: 1.337496085703489
Energy: 1.010552988978389
Energy: 1.2946849970719603
Energy: 1.2946854233693097
Energy: 1.0117657617433562
Energy: 1.305686433198668
Energy: 1.0581243871686024
Energy: 1.0097274821624618
Energy: 1.2950711637298642
Energy: 1.0645102280870087
Energy: 1.0111924113893895
Energy: 1.307547542565472
Energy: 1.0633269715314224
Energy: 1.262276205153698
Energy: 1.2662723854627382
Energy: 1.2629172770667048
Energy: 1.3850082028203898
Energy: 1.3617491966032969
Energy: 1.2768392342188826
Energy: 1.2952074361037824
Energy: 1.153617876451428
Energy: 1.1938963904165074
Energy: 1.3940635234426504
Energy: 1.1449650678593792
Energy: 1.1867340621206717
Energy: 1.331499925002418
Energy: 1.2982236257304658
Energy: 1.300166846959099
Energy: 1.3309887653849684
Energy: 1.2851600905110845
Energy: 1.3002054635637728
Energy: 1.3270449603290244
Energy: 1.2781556313761724
Energy: 1.2767285431482693
Energy: 1.2971314174166924
Energy: 1.2791922062593597
Energy: 1.2821665029427447
Energy: 1.3049897721057075
Energy: 1.2619245401078287
Energy: 1.2862560044262852
Energy: 1.2833433157418208
Energy: 1.2977245646861848
Energy: 1.2808042210783035
Energy: 1.354023965697728
Energy: 1.3001626108698785
Energy: 1.3005389359118482
Energy: 1.2855291497857162
Energy: 1.3017198255917493
Energy: 1.3019325449121608
Energy: 1.3528112755627728
Energy: 1.30983873102857
Energy: 1.3144865609166954
Energy: 1.2854412057320677
Energy: 1.3153537027238627
Energy: 1.3093738296840918
Energy: 1.2638418407692955
Energy: 1.0571711991568522
Energy: 1.2771190055181598
Energy: 1.3521464135555783
Energy: 1.0737761817339502
Energy: 1.1180115479733752
Energy: 1.4854108861776003
Energy: 1.218712849120818
Energy: 1.2114500743120804
Energy: 1.2912317164441476
Energy: 1.2188941641341893
Energy: 1.1769935477120672
Energy: 1.295915584686111
Energy: 1.2019668592273747
Energy: 1.0718995652055625
Energy: 1.0753385383266592
Energy: 1.2023626653412478
Energy: 1.1123865742789034
Energy: 1.1440921853948658
Energy: 1.0550340761942505
Energy: 1.0651173560963865
Energy: 1.0111986779329492
Energy: 1.0679259402860812
Energy: 1.187875532308932

minimum gb energy = 1.0097274821624618 eV
minimum distance =  2.29466212325653 Angstroms
sigma value = 17


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

Energy: 1.2469525723011332
Energy: 1.157650843651804
Energy: 1.2912385728271045
Energy: 1.0285439534268126
Energy: 1.0958896874672481
Energy: 1.0660376892730816
Energy: 1.2292078422479695
Energy: 1.159074369268061
Energy: 1.113798990498037
Energy: 1.1832605408414205
Energy: 1.1647960254462628
Energy: 1.0319790753712714
Energy: 1.1408798306780268
Energy: 0.9819777409140563
Energy: 0.9804911469982618
Energy: 1.140831245862988
Energy: 0.9613316094416234
Energy: 1.0046240811368294
Energy: 1.1574456333810346
Energy: 0.9702988711706929
Energy: 1.0325788008180177
Energy: 1.1575538769735991
Energy: 1.0140849440059365
Energy: 1.1581072779423995
Energy: 1.0661573242431246
Energy: 0.9624358362527828
Energy: 0.9617723556673162
Energy: 1.0673976576983315
Energy: 0.9896920689037506
Energy: 0.9481965149096117
Energy: 1.0311167246971291
Energy: 0.9917125120877938
Energy: 0.9703266444191875
Energy: 0.9521513843299602
Energy: 1.0584838369716336
Energy: 0.9318351668909499
Energy: 1.0644504719210024
Energy: 1.053511253277149
Energy: 1.0581610012309581
Energy: 1.0212640605859695
Energy: 1.0544214149301878
Energy: 0.9977308303965035
Energy: 0.9963167685545691
Energy: 0.9312893678599993
Energy: 0.9298700742825594
Energy: 0.9329224406054207
Energy: 0.9293905771031098
Energy: 0.9335021977218072
Energy: 1.0569109913807382
Energy: 0.9278155991016904
Energy: 0.9279885077351528
Energy: 1.0567272874061868
Energy: 0.9311245699814036
Energy: 0.9315591161232915
Energy: 1.0610926982232107
Energy: 0.9560966229929768
Energy: 0.9683984810640122
Energy: 1.0592956628793286
Energy: 0.95300305934171
Energy: 0.968795234262331
Energy: 0.9600727310564524
Energy: 0.9487942365513045
Energy: 0.9477773569937448
Energy: 1.0196950546606947
Energy: 1.1895666644535716
Energy: 0.9613604854269288
Energy: 1.186428112222087
Energy: 1.1890289964707945
Energy: 1.1873370766908087
Energy: 1.1336784763976209
Energy: 1.1889935181713722
Energy: 1.1881003384351292
Energy: 1.180731275273198
Energy: 1.1184757563873482
Energy: 1.1194925437214782
Energy: 0.9669295307472976
Energy: 1.118357169669039
Energy: 1.115101753197726
Energy: 1.1489123399829841
Energy: 1.1431489355028066
Energy: 1.142419576211176
Energy: 1.1656830598965127
Energy: 1.1670701800690646
Energy: 0.9943093536213907
Energy: 1.1964370399459852
Energy: 1.1336227050390162
Energy: 1.1333198298954241
Energy: 1.0973048246664057
Energy: 1.1336832970956472
Energy: 1.1556293979257908
Energy: 1.2602888272103006
Energy: 1.165237626993392
Energy: 1.0220820671808528
Energy: 1.164358541635952
Energy: 1.165779720118374
Energy: 1.1351125919168894
Energy: 1.17958035131547
Energy: 1.1204986522252331
Energy: 1.296186182317452
Energy: 1.006242290086893
Energy: 1.1197644181169746
Energy: 1.2953442582666537

minimum gb energy = 0.9278155991016904 eV
minimum distance =  2.29883844559239 Angstroms
sigma value = 17


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

Energy: 1.9467027056856387
Energy: 1.3836649613395315
Energy: 1.0058777210912886
Energy: 1.0061348508671557
Energy: 1.4115557078464487
Energy: 1.0020455191665663
Energy: 1.2551994360395449
Energy: 1.0944109664335395
Energy: 0.8909752812085604
Energy: 1.083616025082924
Energy: 1.1067799266236469
Energy: 1.0018573075070165
Energy: 1.3745228862876795
Energy: 0.8669703532417264
Energy: 0.9146312613745909
Energy: 1.1576925197638526
Energy: 0.8671444247303681
Energy: 0.914776142286118
Energy: 1.1527632837891177
Energy: 0.8985100048638399
Energy: 0.9150086782203838
Energy: 1.154389424514267
Energy: 0.8626416924800828
Energy: 0.9970662542817063
Energy: 1.021056075110627
Energy: 0.8981638954088338
Energy: 0.9038430692811676
Energy: 1.021817204359432
Energy: 0.9113642229902965
Energy: 0.8896147065060053
Energy: 0.9961865639603252
Energy: 0.9045172155862377
Energy: 0.8566055869056269
Energy: 0.8599790168710856
Energy: 1.0061028778722276
Energy: 0.8573482258829401
Energy: 0.9495447202357394
Energy: 1.0062234395519278
Energy: 1.005564324369382
Energy: 0.8474687352550152
Energy: 1.0120042554674729
Energy: 0.8555163527290038
Energy: 0.9698764085342171
Energy: 0.8396583742452863
Energy: 0.8465381442797068
Energy: 0.8539794295757326
Energy: 0.8413746438806831
Energy: 0.8455977983420758
Energy: 0.9509305571168148
Energy: 0.8485593118623647
Energy: 0.8561713977845555
Energy: 0.9527933867086161
Energy: 0.9108666896613417
Energy: 0.9505002726910309
Energy: 0.9507769852069192
Energy: 0.8532895644457561
Energy: 0.8529042218670144
Energy: 0.9509533705667628
Energy: 0.8530894038882992
Energy: 0.8399901355808204
Energy: 0.9724292053305853
Energy: 0.8467832617859482
Energy: 0.8504589891717248
Energy: 0.8500909267180142
Energy: 0.9507381174726088
Energy: 0.8505976998813758
Energy: 0.9541368109886905
Energy: 0.9513384519599116
Energy: 0.9507780400935032
Energy: 0.9568527512607402
Energy: 0.9563062676759918
Energy: 0.8467362810408299
Energy: 0.9731175726898047
Energy: 0.8458205094475191
Energy: 0.8452565862288238
Energy: 0.8488758688131702
Energy: 0.8742357683617735
Energy: 0.8461680221527766
Energy: 1.0081706419922665
Energy: 0.8547134522866088
Energy: 0.8548460950892789
Energy: 1.0081626012989668
Energy: 0.8512121707736943
Energy: 1.00615411927209
Energy: 1.0056916437727272
Energy: 0.8796429811281666
Energy: 0.8626303115393662
Energy: 1.0058105329745897
Energy: 0.8509653808215576
Energy: 0.8879788212497137
Energy: 1.1599351778956213
Energy: 0.9629845896317798
Energy: 0.8886189235552303
Energy: 0.963334228769477
Energy: 0.9880341631694758
Energy: 0.9001566145892723
Energy: 0.9505155598501214
Energy: 1.1496554835387465
Energy: 1.1490230330321987
Energy: 0.9116498921381814
Energy: 1.1559409044132336
Energy: 0.8901428652538652
Energy: 0.9825106603797895
Energy: 1.0962786270858236
Energy: 1.0423434679127523
Energy: 0.9876216948788392
Energy: 1.0993093684486173
Energy: 0.8894698489891915
Energy: 1.277851645601319
Energy: 1.0406385083828589
Energy: 1.002319228399049
Energy: 1.1494231478920214
Energy: 0.9859778023236588
Energy: 0.8849375154002783
Energy: 1.3765182020204507
Energy: 0.9525969849068229
Energy: 0.9297226076840126
Energy: 1.037933105328597
Energy: 0.916849469166984
Energy: 1.0505784363607753
Energy: 1.3714553376727157
Energy: 1.0244071815422628
Energy: 1.0549801941584627
Energy: 1.1514741095364853
Energy: 1.0645152795103947
Energy: 1.087417349943944
Energy: 0.9634163416357876
Energy: 1.1022262372925506
Energy: 1.2457119234594765
Energy: 0.9155500382697618
Energy: 1.1137290096364636
Energy: 0.9464312976600227
Energy: 0.966981453206756
Energy: 1.0974734640509063
Energy: 1.0985266241174059
Energy: 0.9261388472987314
Energy: 1.1119868070642605
Energy: 1.1811439907234644
Energy: 1.3784843590793352
Energy: 0.8966460067405037
Energy: 1.090133362387717
Energy: 1.150193428916932
Energy: 0.8564655163011841
Energy: 1.0069055419067579
Energy: 1.148918578883294
Energy: 0.8669779521599157
Energy: 0.9152466864047781
Energy: 1.149214668304287
Energy: 0.8687416610232218
Energy: 0.9148522757170582
Energy: 1.0241162023821728
Energy: 0.8967305919541347
Energy: 0.8990524113184293
Energy: 0.9918118565521193
Energy: 0.9074257019953197
Energy: 0.8960565460849412
Energy: 1.0031755802303242
Energy: 0.9040356034761553
Energy: 0.9288180865078443
Energy: 0.8603151228036342
Energy: 0.9078223049841556
Energy: 0.858493096065442
Energy: 0.9461720672424417
Energy: 1.0066996082570323
Energy: 1.0063143847445937
Energy: 0.9364129886771081
Energy: 1.009110587937719
Energy: 1.0058961214991875
Energy: 0.9734574927494457
Energy: 0.8498486513432632
Energy: 0.8490300275585652
Energy: 0.8529132829757242
Energy: 1.0069412613356046
Energy: 0.8479958305597636
Energy: 0.9501380248463457
Energy: 0.8402796233279985
Energy: 0.8470354553012086
Energy: 0.9500746763355379
Energy: 0.8410143487565763
Energy: 0.8457435608515159
Energy: 0.9569606539939084
Energy: 0.8449724441612246
Energy: 0.8452993025439807
Energy: 0.9585693859795479
Energy: 0.8447990928933554
Energy: 0.8476771921788667
Energy: 0.9543395307352125
Energy: 0.8464293085481568
Energy: 0.8468195434654515
Energy: 0.8469881601380318
Energy: 0.8434032184490603
Energy: 0.8470988369350938
Energy: 0.9649512832486852
Energy: 0.9508701151725267
Energy: 0.9505694943516724
Energy: 0.9656604635885775
Energy: 0.9515707759350128
Energy: 0.9507489654440248
Energy: 0.9577928578534153
Energy: 0.8640103457128284
Energy: 0.856342003030554
Energy: 0.8513611474581477
Energy: 0.846615218890776
Energy: 0.8538730072237354
Energy: 1.007373090240823
Energy: 0.8517966326311299
Energy: 0.852682848661727
Energy: 1.0071206657678184
Energy: 0.8518587388013141
Energy: 0.8513631244258504
Energy: 1.0168719238426658
Energy: 0.853536538550735
Energy: 0.8788403729228161
Energy: 1.0074444464706938
Energy: 0.8547792220708369
Energy: 0.9038968788043783
Energy: 1.1641098645439698
Energy: 0.8856462191675168
Energy: 0.8780564050348906
Energy: 0.9653149885820209
Energy: 0.9858893776040911
Energy: 0.8852805200244401
Energy: 0.960556728551806
Energy: 1.1486928187787258
Energy: 1.148356708629914
Energy: 0.9349616283834561
Energy: 1.1507420974822686
Energy: 0.9639627455097661
Energy: 0.9799853690364079
Energy: 1.0586027556569608
Energy: 0.9273665219035517
Energy: 0.8989448039537505
Energy: 1.069888260705226
Energy: 0.9280263998507101
Energy: 1.0057793683023437
Energy: 1.0776487990017891
Energy: 1.0182117661091583
Energy: 1.0235105978994694
Energy: 1.097742700911569
Energy: 0.9293794102073947
Energy: 1.2848928091589928
Energy: 0.9139068320224414
Energy: 1.0551715593137303
Energy: 1.1122038016231208
Energy: 0.8973062838643322
Energy: 1.0670136751000807
Energy: 1.3743698507499424
Energy: 1.0063755022416119
Energy: 0.8919501187367076
Energy: 1.1500670142810274
Energy: 0.9404293083905658
Energy: 1.0262738255425687
Energy: 0.9686416877726529
Energy: 1.0968127637504117
Energy: 1.0431268156933402
Energy: 0.9265181846394339
Energy: 1.1106043011828453
Energy: 0.9923697304744198

minimum gb energy = 0.8396583742452863 eV
minimum distance =  2.30029315033045 Angstroms
sigma value = 57


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

Energy: 0.8749129129851676
Energy: 1.2855680175423587
Energy: 0.9306763480030399
Energy: 0.808278918894131
Energy: 1.410808935689489
Energy: 0.9419097732295175
Energy: 1.3006384034833913
Energy: 0.8370152261173902
Energy: 0.8396377375501531
Energy: 1.0386256862342975
Energy: 1.0362864525299
Energy: 0.9559415088465422
Energy: 1.2873672527028857
Energy: 0.8016685042152731
Energy: 0.8014217594672226
Energy: 1.1041741515171963
Energy: 0.8012729869522759
Energy: 0.8498032431941924
Energy: 1.0986314061320421
Energy: 0.8006329468111276
Energy: 0.8374355124861971
Energy: 1.1001818707388356
Energy: 0.8179571752217033
Energy: 0.9482715627484768
Energy: 0.955729112775308
Energy: 0.837255925966834
Energy: 0.8393068877582409
Energy: 0.9570515215873345
Energy: 0.8457378193949864
Energy: 0.8296964223715538
Energy: 0.8678141288099711
Energy: 0.8245401777112297
Energy: 0.7972213526471845
Energy: 0.7814700761954411
Energy: 0.9637722557921106
Energy: 0.7991000980213709
Energy: 0.8943612836714749
Energy: 0.9743043423756245
Energy: 0.964092542302291
Energy: 0.7864565728264731
Energy: 0.9722999008063572
Energy: 0.7879333388143878
Energy: 1.1778259602199068
Energy: 0.7736298668703278
Energy: 0.7719056355585631
Energy: 0.7865703266927673
Energy: 0.7739162527268478
Energy: 0.7832778783807746
Energy: 0.8989743326290116
Energy: 0.8532820552478582
Energy: 0.7899840521452342
Energy: 0.9014223424085563
Energy: 0.9042407322410347
Energy: 0.8953125949376471
Energy: 0.8949454503879228
Energy: 0.7708283110181408
Energy: 0.7712303535070352
Energy: 0.8951747788826954
Energy: 0.7702591194966133
Energy: 0.7714241307907197
Energy: 0.8712538362225655
Energy: 0.8650111567835391
Energy: 0.7651975044751624
Energy: 0.7671989487250868
Energy: 0.8654357196425354
Energy: 0.7661368806384738
Energy: 0.9009748554696188
Energy: 0.8757451206732606
Energy: 0.8650213646566037
Energy: 0.8334648943139589
Energy: 0.8719433352076743
Energy: 0.7768276441956797
Energy: 0.8637313402044677
Energy: 0.847092448384731
Energy: 0.7718918413080694
Energy: 0.7754473994746588
Energy: 0.792724000499916
Energy: 0.7853387164870252
Energy: 0.8655931751483135
Energy: 0.7745522801587562
Energy: 0.8276332369015024
Energy: 0.8682180409244493
Energy: 0.8452426435602007
Energy: 0.8653281676374908
Energy: 0.8647539046992626
Energy: 0.7677712754462274
Energy: 0.7669119912927488
Energy: 0.8650070679737193
Energy: 0.8494244421083073
Energy: 0.7659875329686983
Energy: 0.916611009561815
Energy: 0.895386375834493
Energy: 0.7800234147705852
Energy: 0.7842828732465417
Energy: 0.9102255606058227
Energy: 0.7797196948399672
Energy: 0.880134746915744
Energy: 0.8962218537295052
Energy: 0.8971434042106469
Energy: 0.7703648552542801
Energy: 0.9047978058166654
Energy: 0.7830722311718321
Energy: 0.8693877494305642
Energy: 0.7825906776978475
Energy: 0.7823100547514171
Energy: 0.8700670216441128
Energy: 0.7828039428970583
Energy: 0.7833413382874611
Energy: 0.9647583264073891
Energy: 0.7909014635228446
Energy: 0.8769930769196519
Energy: 0.9675003548637295
Energy: 0.8023485603932031
Energy: 0.9645125430811505
Energy: 1.09351212658482
Energy: 0.8142922370419954
Energy: 0.8167627390883144
Energy: 0.8458199503383874
Energy: 0.813694472431755
Energy: 0.8354351707087146
Energy: 1.2110655516079631
Energy: 0.9098574781223407
Energy: 0.8328355578190254
Energy: 0.9107853349491065
Energy: 0.9114254758076064
Energy: 0.8346591076616592
Energy: 0.8656156160602395
Energy: 1.0962819875809386
Energy: 0.8531262592287825
Energy: 0.79186939612793
Energy: 1.1074499303158656
Energy: 0.8360785744235127
Energy: 0.9008097486833768
Energy: 0.9837616624840769
Energy: 0.9553380786840938
Energy: 0.849164901827588
Energy: 1.056374153099212
Energy: 0.9242737305280614
Energy: 1.2480241536096695
Energy: 0.9125574606772259
Energy: 0.8283556729196242
Energy: 0.9136692389073402
Energy: 0.8885597936176786
Energy: 0.8411005901391728
Energy: 1.2938616649689165
Energy: 0.8307489320057467
Energy: 0.8412244741571081
Energy: 1.039767552055678
Energy: 0.8403141125028287
Energy: 0.9922279218089093
Energy: 1.2857883253568216
Energy: 0.9742246538573823
Energy: 0.932054980745069
Energy: 1.0366679471819347
Energy: 0.9696795788123382
Energy: 0.8688761048216438
Energy: 0.8726075872683823
Energy: 1.0322209781904346
Energy: 0.8804353062832914
Energy: 0.8099250428236419
Energy: 1.0408074143019552
Energy: 0.8628023088080428

minimum gb energy = 0.7651975044751624 eV
minimum distance =  2.30625771713578 Angstroms
sigma value = 43


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

Energy: 0.7405455932433425
Energy: 0.9784860676450423
Energy: 0.8049145305065929
Energy: 0.6917059440080361
Energy: 1.0664019833583218
Energy: 0.7814717754863488
Energy: 1.0260757966071998
Energy: 0.6745655614014796
Energy: 0.6794726678401186
Energy: 0.8534856589390977
Energy: 0.6832489816596762
Energy: 0.6672810818304166
Energy: 1.0954073006249359
Energy: 0.666947251729301
Energy: 0.6800982957719438
Energy: 0.8557127366058975
Energy: 0.6656375271553537
Energy: 0.6795050654166306
Energy: 0.9545140047890925
Energy: 0.6799291670689499
Energy: 0.6791981961775249
Energy: 0.7761161475290944
Energy: 0.7226890250991405
Energy: 0.7012835132174954
Energy: 0.8504944182570456
Energy: 0.67329367981214
Energy: 0.678806499410243
Energy: 0.7682381454207182
Energy: 0.6787809122064759
Energy: 0.6795299778980175
Energy: 0.7191428672780528
Energy: 0.682196756292407
Energy: 0.6630833397002545
Energy: 0.6479276707087701
Energy: 0.844220538307645
Energy: 0.7077568230790049
Energy: 0.9505108083601586
Energy: 0.8448310898800314
Energy: 0.844871077480684
Energy: 0.6489007625697697
Energy: 0.8450421399893305
Energy: 0.6448008749310655
Energy: 1.010013347939523
Energy: 0.6378355135872639
Energy: 0.640393737309891
Energy: 0.6426581596750217
Energy: 0.6388598446281953
Energy: 0.6399834665340302
Energy: 0.7886435294169447
Energy: 0.6426785410472681
Energy: 0.6422778846633184
Energy: 0.7909189751345892
Energy: 0.7338906880854409
Energy: 0.7845090405948137
Energy: 0.7669850921289091
Energy: 0.6299966739654494
Energy: 0.6306916518970478
Energy: 0.7848398149670143
Energy: 0.6316786591265298
Energy: 0.6331515375256482
Energy: 0.7139323565607024
Energy: 0.7473241739542658
Energy: 0.6289280624960495
Energy: 0.6267062186405763
Energy: 0.7471606733809767
Energy: 0.6268931105171623
Energy: 0.7845995209135251
Energy: 0.7477998570523582
Energy: 0.7471280653700082
Energy: 0.6321528286908858
Energy: 0.7478987435660723
Energy: 0.6297374496124022
Energy: 0.9760639305946063
Energy: 0.7185720649033073
Energy: 0.7271094963294201
Energy: 0.723282785938444
Energy: 0.7157477311426877
Energy: 0.7258329921063874
Energy: 0.7263768240587498
Energy: 0.5124593027821248
Energy: 0.7340563523469876
Energy: 0.7287585643817942
Energy: 0.7160667288200697
Energy: 0.7263754954606696
Energy: 0.7256847700870086
Energy: 0.6210490806423101
Energy: 0.6207181842032597
Energy: 0.7258526680206221
Energy: 0.6221331490066804
Energy: 0.626757565473998
Energy: 0.7185439055188703
Energy: 0.7161555883344576
Energy: 0.6199800611559015
Energy: 0.620946969179555
Energy: 0.7163233229510667
Energy: 0.6193436550746971
Energy: 0.7312293471767252
Energy: 0.7163300005390778
Energy: 0.7167586548508377
Energy: 0.6250488023876936
Energy: 0.7162404593383216
Energy: 0.623084560678647
Energy: 0.7163974837563141
Energy: 0.622019512673105
Energy: 0.6223552104921714
Energy: 0.7166560946405731
Energy: 0.7104546972056284
Energy: 0.6224465626920986
Energy: 0.7170939716994531
Energy: 0.6899082155857518
Energy: 0.7160933077338946
Energy: 0.7179188633568258
Energy: 0.8025209939743949
Energy: 0.7165999860166958
Energy: 0.716188571750279
Energy: 0.6285864783351992
Energy: 0.6279694742964972
Energy: 0.7162106751050288
Energy: 0.7124234602719439
Energy: 0.62725501400982
Energy: 0.7526417652037497
Energy: 0.7262767910208686
Energy: 0.7271877259256632
Energy: 0.6812639276967596
Energy: 0.7263344634496794
Energy: 0.6306184329555542
Energy: 0.7224687438364693
Energy: 0.7259638105005085
Energy: 0.6214395688084093
Energy: 0.6249259462892982
Energy: 0.7263658782552667
Energy: 0.6213631733780284
Energy: 0.7471755903299219
Energy: 0.6217264792880975
Energy: 0.6221018540532369
Energy: 0.7471942647978086
Energy: 0.6225555340103948
Energy: 0.6223709980071697
Energy: 0.7484466934020745
Energy: 0.6398460727880263
Energy: 0.7562484363411489
Energy: 0.7506797665357389
Energy: 0.6810046606660285
Energy: 0.7474010697729339
Energy: 0.9895968615458236
Energy: 0.6817620237853518
Energy: 0.6850737652745766
Energy: 0.7452189310568689
Energy: 0.683324998327863
Energy: 0.6856089919810888
Energy: 0.9058835072076667
Energy: 0.784552078489697
Energy: 0.7845514288523813
Energy: 0.6286961929249998
Energy: 0.7852048799114641
Energy: 0.6254665947736741
Energy: 0.7174424624085449
Energy: 0.784480370500195
Energy: 0.6444645337566116
Energy: 0.638910670959927
Energy: 0.7840724530188219
Energy: 0.639616222525292
Energy: 0.7678620227408975
Energy: 0.6414298215359665
Energy: 0.6420798884262129
Energy: 0.7649083955228971
Energy: 0.6431725012762278
Energy: 0.6437276056454638
Energy: 0.8497163969990961
Energy: 0.6594619445487193
Energy: 0.6894159759149202
Energy: 0.8514529818526807
Energy: 0.6955676319226115
Energy: 0.789528197714709
Energy: 1.038501764726149
Energy: 0.6521710436797263
Energy: 0.6582480956453234
Energy: 0.6822745390313163
Energy: 0.6529733886968744
Energy: 0.6576928300832181
Energy: 1.0348563110824307
Energy: 0.7738266653051296
Energy: 0.7738586311672259
Energy: 0.7734991173214089
Energy: 0.7737437446578769
Energy: 0.686995503539496
Energy: 0.7288226312402009
Energy: 0.8141628076625984
Energy: 0.6903272974005787
Energy: 0.6639291176114056
Energy: 0.9470417378414346
Energy: 0.6751696995083045
Energy: 0.949429241633265
Energy: 0.7687360424687252
Energy: 0.7586042556489471
Energy: 0.7833673164547428
Energy: 0.766747942781413
Energy: 0.7428870730083268
Energy: 1.0369938728595427
Energy: 0.7038433134714603
Energy: 0.7125711445332654
Energy: 0.7761439677057801
Energy: 0.7373235228397347
Energy: 0.7812565247935529
Energy: 1.0950633282106454
Energy: 0.6895968343166851
Energy: 0.7134661190497796
Energy: 0.8559300524607037
Energy: 0.6889589294451897
Energy: 0.7923445855432522
Energy: 1.0466727317346176
Energy: 0.7782523482657201
Energy: 0.7428727767583637
Energy: 0.8544708880890068
Energy: 0.7768914184810557
Energy: 0.763389763182994

minimum gb energy = 0.5124593027821248 eV
minimum distance =  2.30799549044424 Angstroms
sigma value = 81


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

Energy: 0.014425909558453059
Energy: 0.015413149973486443
Energy: 0.01551547741961702
Energy: 0.01769898083137947
Energy: 0.015841770788987464
Energy: 0.015510243453972682
Energy: 0.06884663484033059
Energy: 0.015502844871812221
Energy: 0.015640185862896963
Energy: 0.06751723553654958
Energy: 0.02107909142350388
Energy: 0.015988111534729295
Energy: 0.0672520300027277
Energy: 0.015473010716417804
Energy: 0.01597869784028923
Energy: 0.06718581545933612
Energy: 0.015228851633230917
Energy: 0.06827739295675508
Energy: 0.018385594153104368
Energy: 0.015731905913738388
Energy: 0.015419188352144828
Energy: 0.02174812883329813
Energy: 0.015470695819108394
Energy: 0.0689695605181628
Energy: 0.06808291279196224
Energy: 0.06715774651096482
Energy: 0.06742187783236753
Energy: 0.06952239076664012
Energy: 0.06727123607790145
Energy: 0.06770638866079226
Energy: 0.016278765601796346
Energy: 0.015612675038705365
Energy: 0.015186823628826182
Energy: 0.018139738631646824
Energy: 0.015793516520134915
Energy: 0.015537928777894786
Energy: 0.06731855319645332
Energy: 0.015984696260888033
Energy: 0.0159681500565747
Energy: 0.06731256427662163
Energy: 0.016571105525483267
Energy: 0.015951717890005646
Energy: 0.06697713690664521
Energy: 0.015281224766020904
Energy: 0.015650381049019075
Energy: 0.0673407316267003
Energy: 0.015233251347859697
Energy: 0.07004961382015522
Energy: 0.016414965592990785
Energy: 0.01595881781930323
Energy: 0.07081621023487984
Energy: 0.019025387037472856
Energy: 0.015372801942697053
Energy: 0.07092980930968228
Energy: 0.015405343640128386
Energy: 0.06695567972229671
Energy: 0.06714086545986085
Energy: 0.014858165323334317
Energy: 0.06683127109353662
Energy: 0.06702555297924503

minimum gb energy = 0.014425909558453059 eV
minimum distance =  2.4442569870871 Angstroms
sigma value = 3


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

Energy: 0.8028017687678469
Energy: 0.7842597017301459
Energy: 0.7900267340708775
Energy: 0.749500520902796
Energy: 0.7820121440045508
Energy: 0.7566280115589101
Energy: 0.8281584857547696
Energy: 0.7997990457740997
Energy: 0.8011967232442933
Energy: 0.8001763431353357
Energy: 0.8026403217285701
Energy: 0.8044451988748964
Energy: 0.8320620732595326
Energy: 0.7658274372381068
Energy: 0.7660981119789537
Energy: 0.8101357738041244
Energy: 0.7683717021354042
Energy: 0.7784422470883504
Energy: 0.7862884105719108
Energy: 0.7670803480109604
Energy: 0.7668960883809872
Energy: 0.7865422820803808
Energy: 0.7014832956310697
Energy: 0.777345213938715
Energy: 0.7194337181758472
Energy: 0.8048591055789224
Energy: 0.8048979373121244
Energy: 0.7198786833705293
Energy: 0.802226101234394
Energy: 0.804021308283519
Energy: 0.7635763532594186
Energy: 0.8010958491775034
Energy: 0.7882154786007629
Energy: 0.6629568803703991
Energy: 0.8008294510381306
Energy: 0.7522440922005158
Energy: 0.7912833171078799
Energy: 0.8185540247326736
Energy: 0.7799583888883446
Energy: 0.7908077125298824
Energy: 0.7445995091554461
Energy: 0.7715708783209482
Energy: 0.784995366925874
Energy: 0.7718860869758445
Energy: 0.7728682775907849
Energy: 0.7849534819942462
Energy: 0.7367968845554743
Energy: 0.742114634563533
Energy: 0.7995139426408511
Energy: 0.7735325843306339
Energy: 0.7985894656380633
Energy: 0.8051117797632683
Energy: 0.6794457627524303
Energy: 0.8001615637131859
Energy: 0.7454476110537596
Energy: 0.7357557460275452
Energy: 0.7347660706096429
Energy: 0.7453426892942587
Energy: 0.7429044325838872
Energy: 0.7581847559294844
Energy: 0.7748792289810713
Energy: 0.7868624049260782
Energy: 0.7894390598947022
Energy: 0.6531585991999813
Energy: 0.7904122257213213
Energy: 0.7539698247386377
Energy: 0.6914551236785796
Energy: 0.7952847681658497
Energy: 0.7975542941040535
Energy: 0.6912105406204776
Energy: 0.7958172490825118
Energy: 0.6901906803377454
Energy: 0.6936744004850386
Energy: 0.7398454099323013
Energy: 0.7671358529728562
Energy: 0.6938495586859702
Energy: 0.6396220246200985
Energy: 0.7298631495904011
Energy: 0.7790695316048806
Energy: 0.7072632504380327
Energy: 0.7659905820548606
Energy: 0.6946240139499252
Energy: 0.7136144190923155
Energy: 0.7692208239064153
Energy: 0.772220322763921
Energy: 0.6610425940794947
Energy: 0.6604411019752111
Energy: 0.7721136766629815
Energy: 0.667770313793493
Energy: 0.6599015157427076
Energy: 0.7717790126416567
Energy: 0.7480569776048108
Energy: 0.7531381144293259
Energy: 0.7497689883986538
Energy: 0.7680980760753585
Energy: 0.7516427830716809
Energy: 0.6445703461433528
Energy: 0.7536153850028695
Energy: 0.7524421390500011
Energy: 0.6446103137856088
Energy: 0.7510172938318187
Energy: 0.6441054467241035
Energy: 0.6450503128655415
Energy: 0.745058874017147
Energy: 0.7469477993237471
Energy: 0.645292196725231
Energy: 0.6491171944520209
Energy: 0.746671454587345
Energy: 0.7613511460931567
Energy: 0.6879174233442656
Energy: 0.7437593754399867
Energy: 0.7019988735860582
Energy: 0.690836755450909
Energy: 0.7444468951032353
Energy: 0.768885257749563
Energy: 0.6441678390881724
Energy: 0.6439716324216077
Energy: 0.7685678335354609
Energy: 0.6534013656070068
Energy: 0.6435384227241124
Energy: 0.7674405406148366
Energy: 0.7485671317299553
Energy: 0.7541232475895212
Energy: 0.7682384351909963
Energy: 0.775339167848724
Energy: 0.7517710778084294
Energy: 0.6624705286151614
Energy: 0.748961084732505
Energy: 0.7504886562802149
Energy: 0.6621756110129797
Energy: 0.7507325674711688
Energy: 0.6608271218896468
Energy: 0.660505112400027
Energy: 0.7633469905683067
Energy: 0.7645226804557634
Energy: 0.6605570175555578
Energy: 0.7379495994001145
Energy: 0.7657606089334096
Energy: 0.7743581322269439
Energy: 0.6927879479159916
Energy: 0.7361913326701742
Energy: 0.7149699798844604
Energy: 0.6914618915734627
Energy: 0.7505647196147603
Energy: 0.7956618544317356
Energy: 0.6914472649308944
Energy: 0.6910838674046441
Energy: 0.7968126873111933
Energy: 0.6936475679573019
Energy: 0.6905987418463239
Energy: 0.7963308122692787
Energy: 0.769342576487091
Energy: 0.7702832137278496
Energy: 0.7970646700825905
Energy: 0.7375767463863729
Energy: 0.7897225843539888
Energy: 0.7404628201303948
Energy: 0.7684255999488847
Energy: 0.7696925921334268
Energy: 0.7377348861822821
Energy: 0.7935005844709696
Energy: 0.7605914521596795
Energy: 0.7027016684701896
Energy: 0.8135182927866171
Energy: 0.8121131508439866
Energy: 0.702821641499895
Energy: 0.815798440106262
Energy: 0.8118577012819945
Energy: 0.7746711115266827
Energy: 0.7863131460809181
Energy: 0.7758899266917909
Energy: 0.6544945560200982
Energy: 0.7862517430961146
Energy: 0.7547135062146471
Energy: 0.7386241923336576
Energy: 0.7918496635263292
Energy: 0.79233077232486
Energy: 0.7386279452800045
Energy: 0.7876097997329244
Energy: 0.7987924118589077
Energy: 0.876262089367333
Energy: 0.7728048755395447
Energy: 0.7737792041543942
Energy: 0.787638181932069
Energy: 0.7330364317567258
Energy: 0.7741828542728134
Energy: 0.8286845986284072
Energy: 0.7764624589839686
Energy: 0.8131689355936175
Energy: 0.7989572640113407
Energy: 0.7173384599569363
Energy: 0.8022527980020254
Energy: 0.7306391370642107
Energy: 0.7863320779558823
Energy: 0.7842477018963732
Energy: 0.7306279765953686
Energy: 0.7974827239677876
Energy: 0.7623645434613431

minimum gb energy = 0.6396220246200985 eV
minimum distance =  2.28616070849673 Angstroms
sigma value = 67


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

Energy: 0.9971819292733753
Energy: 0.973898035645257
Energy: 0.9851102457026163
Energy: 0.8684561527766888
Energy: 0.9728711634959651
Energy: 0.9760542538120878
Energy: 1.0276601170575468
Energy: 0.9890587430966534
Energy: 0.9865622162428969
Energy: 0.9892038526621418
Energy: 0.9874950929488241
Energy: 0.9782336350084012
Energy: 1.022609505920343
Energy: 0.9542660774267764
Energy: 0.9548453079861188
Energy: 0.9810357757022866
Energy: 0.9542263531404541
Energy: 0.952468297387285
Energy: 0.9607067514187723
Energy: 0.9568494280966819
Energy: 0.9567176664889823
Energy: 0.9627186942700162
Energy: 0.9462258232277161
Energy: 0.9544762226284019
Energy: 0.9489261194407914
Energy: 0.9836676975456516
Energy: 0.9823536381306198
Energy: 0.9492752530212566
Energy: 0.9851479900534545
Energy: 0.9809178247559645
Energy: 0.9438742776309111
Energy: 0.9650605836321317
Energy: 0.9670947213176073
Energy: 0.894346306067311
Energy: 0.9646488707946915
Energy: 0.9673287712155809
Energy: 0.9662591914355655
Energy: 0.9711430618085425
Energy: 0.9650739500452993
Energy: 0.9510770869980387
Energy: 0.9666817452176002
Energy: 0.9580519770804384
Energy: 0.9557809727334053
Energy: 0.953431659965676
Energy: 0.9639125693849094
Energy: 0.9559084115537594
Energy: 0.8596983052484569
Energy: 0.957145409861795
Energy: 0.9826486835629633
Energy: 0.9896237227698368
Energy: 0.9836157794419728
Energy: 0.9872295837341817
Energy: 0.9038549809721965
Energy: 0.9931100938816015
Energy: 0.9827884171946778
Energy: 0.9061932864306786
Energy: 0.8995644042758908
Energy: 0.9836290866582871
Energy: 0.9054734926282348
Energy: 0.9018712928466082
Energy: 0.9695479296532756
Energy: 0.9653575378574595
Energy: 0.9686168932295013
Energy: 0.8644333108783303
Energy: 0.9650441537949539
Energy: 0.9698936061919388
Energy: 0.8707582043138976
Energy: 0.9665923235486282
Energy: 0.967018613137793
Energy: 0.8702979116341224
Energy: 0.9255154877715349
Energy: 0.8634068404363897
Energy: 0.8624369543196331
Energy: 0.9596005997225092
Energy: 0.9571940934698556
Energy: 0.8624503920842376
Energy: 0.8669589102707645
Energy: 0.8628949132504489
Energy: 0.9616322811991883
Energy: 0.9614533233130044
Energy: 0.9562739689569096
Energy: 0.8644048356111254
Energy: 0.962999493675453
Energy: 0.9551821029001901
Energy: 0.9658589447262589
Energy: 0.8692262986850052
Energy: 0.8646428727426859
Energy: 0.9667604783367318
Energy: 0.8676639461890172
Energy: 0.8665088078798934
Energy: 0.9644539301689949
Energy: 0.9727341856790925
Energy: 0.9689354887557994
Energy: 0.9319336491566846
Energy: 0.9282477050667511
Energy: 0.9655403263065232
Energy: 0.9053712630345595
Energy: 0.9586085241066903
Energy: 0.9537159305010366
Energy: 0.9067272091999761
Energy: 0.8546886967403671
Energy: 0.9012203511793239
Energy: 0.8979250213907675
Energy: 0.9903651058877264
Energy: 0.9937708530618217
Energy: 0.8981256812773104
Energy: 0.9914651288741174
Energy: 0.9042826677111616
Energy: 0.9483898383159283
Energy: 0.9759121914684802
Energy: 0.9713887792209203
Energy: 0.8734395819242228
Energy: 0.9751422754516089
Energy: 0.9735367470141445
Energy: 0.9602118009284091
Energy: 0.961837007908776
Energy: 0.9604336876822671
Energy: 0.9597004362375458
Energy: 0.9623467484105047
Energy: 0.9587022826818102
Energy: 0.9566102032277253
Energy: 0.978905199414353
Energy: 0.9853454567800675
Energy: 0.9540906709797128
Energy: 0.96049934302908
Energy: 0.9769101391792364
Energy: 1.0217751880184889
Energy: 0.9539658566128761
Energy: 0.9821460155798987
Energy: 0.9805778669226529
Energy: 0.9553594386531309
Energy: 0.9764370413228053
Energy: 0.9695167523607837
Energy: 0.965765316788742
Energy: 0.9665986765765591
Energy: 0.9700577035259945
Energy: 0.9621898630933451
Energy: 1.0586748001290118

minimum gb energy = 0.8546886967403671 eV
minimum distance =  2.24170847351769 Angstroms
sigma value = 33


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

Energy: 1.174396619792838
Energy: 1.1753238312058458
Energy: 1.161788601291685
Energy: 1.1225673878268507
Energy: 1.1744732842608754
Energy: 1.1389004780912424
Energy: 1.2097210838556716
Energy: 1.165781711967177
Energy: 1.155105215295203
Energy: 1.1580934561975051
Energy: 1.1970027198555162
Energy: 1.145542709875415
Energy: 1.1990069661487495
Energy: 1.105194637770974
Energy: 1.1145197373001505
Energy: 1.1434286484671035
Energy: 1.1070087821315884
Energy: 1.112498645351994
Energy: 1.1599222538743441
Energy: 1.1174691771826355
Energy: 1.1133041840008784
Energy: 1.1585198737335616
Energy: 1.1135030845470655
Energy: 1.1114454200558965
Energy: 1.099792178424425
Energy: 1.1568610292911417
Energy: 1.1418468992876014
Energy: 1.1005069959025084
Energy: 1.156893433389942
Energy: 1.1499846561362634
Energy: 1.1063836055966785
Energy: 1.134550337326377
Energy: 1.138044831376075
Energy: 1.0261804323233394
Energy: 1.1343438450100272
Energy: 1.1112812764412143
Energy: 1.0962481135768956
Energy: 1.1412175515856973
Energy: 1.1377514026899764
Energy: 1.0967978641859506
Energy: 1.1474709315656306
Energy: 1.0881474973037755
Energy: 1.1003441932971187
Energy: 1.0259774731388274
Energy: 1.1248743327132302
Energy: 1.1000702280538008
Energy: 1.0339437143874335
Energy: 1.0860710932851394
Energy: 1.1183184220023614
Energy: 1.0959390799174584
Energy: 1.1369337902371346
Energy: 1.0875232720052297
Energy: 1.0950325886531151
Energy: 1.1308968479881163
Energy: 1.117990384926192
Energy: 1.0291711602873954
Energy: 1.028833154052463
Energy: 1.1192972623159259
Energy: 1.028186226790253
Energy: 1.028718271114728
Energy: 1.1189405436660655
Energy: 1.1142614382412102
Energy: 1.1143031074263268
Energy: 1.0320769945515087
Energy: 1.0778453653854874
Energy: 1.112889693354343
Energy: 1.0267533627847383
Energy: 1.0274266432440347
Energy: 1.0274044073333986
Energy: 1.026190162085432
Energy: 1.0414652099612345
Energy: 1.0274595193431173
Energy: 1.0276301040563254
Energy: 1.087639065183904
Energy: 1.086182738288412
Energy: 1.0271617418703678
Energy: 1.087260070742903
Energy: 1.0270247072061465
Energy: 1.1175338446757135
Energy: 1.1229067957843064
Energy: 1.125493732013818
Energy: 1.0077881051443265
Energy: 1.1181790117607822
Energy: 1.1076646999332789
Energy: 1.120333374421396
Energy: 1.1011500758243138
Energy: 1.0859941524084484
Energy: 1.1227944333452178
Energy: 1.0996729367562887
Energy: 1.0858568830577315
Energy: 1.154920809522977
Energy: 1.122925040477195
Energy: 1.1211811652731005
Energy: 1.171462530189408
Energy: 1.0405821341592945
Energy: 1.0875771971819992
Energy: 1.1994816016746075
Energy: 1.041268419293957
Energy: 1.1207236006357006
Energy: 1.1433536999768954
Energy: 1.0485972452742913
Energy: 1.1191527986306056
Energy: 1.216951399569462
Energy: 1.1567975848124903
Energy: 1.1525520397998843
Energy: 1.1577773081551748
Energy: 1.1642959340239427
Energy: 1.168528267417954
Energy: 1.08426091166867
Energy: 1.1422396176879412
Energy: 1.1174208333813622
Energy: 1.0326050285213302
Energy: 1.1414068786747293
Energy: 1.110278833668001
Energy: 1.130674050768356
Energy: 1.1577819826496978
Energy: 1.1532309858345935
Energy: 1.1312912251050966
Energy: 1.1565217620678248
Energy: 1.1495776508204272
Energy: 1.1981481998495618
Energy: 1.122160130000954
Energy: 1.1150139957858944
Energy: 1.1442334132333472
Energy: 1.1495382425990102
Energy: 1.116155329574199
Energy: 1.145417284920556
Energy: 1.1049834355575712
Energy: 1.113711988913776
Energy: 1.1440387648087782
Energy: 1.1077987739079989
Energy: 1.1141752380022867
Energy: 1.1009836695458546
Energy: 1.1642544917853985
Energy: 1.150878333225993
Energy: 1.1004697359635516
Energy: 1.1586536659832405
Energy: 1.1457956106453218
Energy: 1.1047331388038943
Energy: 1.1349042968488257
Energy: 1.1364223297954288
Energy: 1.0188555235660754
Energy: 1.1352788777497973
Energy: 1.1108970225985182
Energy: 1.0955681439009468
Energy: 1.14121742541135
Energy: 1.1388907748208805
Energy: 1.0961814612117005
Energy: 1.14893445903287
Energy: 1.160013586796911
Energy: 1.0999897751247032
Energy: 1.0263870398551616
Energy: 1.1257093290772953
Energy: 1.0998838724167361
Energy: 1.033781726034996
Energy: 1.0861701296475395
Energy: 1.1174283403034766
Energy: 1.0971892867741238
Energy: 1.0866633098861247
Energy: 1.1185372908111568
Energy: 1.10782945033363
Energy: 1.131255254287475
Energy: 1.118008428653097
Energy: 1.0290275793104269
Energy: 1.0284696996338436
Energy: 1.1191951380754415
Energy: 1.0287721240260466
Energy: 1.0297485524748988
Energy: 1.1199435283605925
Energy: 1.0800521201178304
Energy: 1.112003778195276
Energy: 1.0331010768471278
Energy: 1.0770172706702386
Energy: 1.0953736516729111
Energy: 1.0263822140228276
Energy: 1.0277319807347403
Energy: 1.0287408076783162
Energy: 1.0262568414356261
Energy: 1.042998777306586
Energy: 1.0278490599490455
Energy: 1.028243009323257
Energy: 1.087330554133051
Energy: 1.0923042606242097
Energy: 1.0284684672494084
Energy: 1.0869984556670005
Energy: 1.0277113363487178
Energy: 1.117191897034188
Energy: 1.096440213157457
Energy: 1.1248336121568372
Energy: 1.0099094758042628
Energy: 1.1233275755484307
Energy: 1.1080817296671237
Energy: 1.1184969742358362
Energy: 1.1012631298213258
Energy: 1.0857851128521165
Energy: 1.1188906903407594
Energy: 1.1004629945330753
Energy: 1.0858280406813847
Energy: 1.087239684645063
Energy: 1.1282092239947132
Energy: 1.0900876313713024
Energy: 1.0880421387344703
Energy: 1.0410450972394214
Energy: 1.088917697894512
Energy: 1.3000590614487835
Energy: 1.041522017569276
Energy: 1.1185520269558011
Energy: 1.1493658760475816
Energy: 0.9980898186097557
Energy: 1.1207116697211916
Energy: 1.2049181218906564
Energy: 1.1530240823695397
Energy: 1.1481238899742245
Energy: 1.1579380362589677
Energy: 1.1626335091289712
Energy: 1.1450870426086388
Energy: 1.0848951643730513
Energy: 1.1423746830344224
Energy: 1.1182546765135437
Energy: 1.038823464873116
Energy: 1.1421469875802135
Energy: 1.111447953189728

minimum gb energy = 0.9980898186097557 eV
minimum distance =  2.30305977735312 Angstroms
sigma value = 41


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

Energy: 1.3988962032195316
Energy: 1.3222237483308574
Energy: 1.429910771346294
Energy: 1.2295907508344475
Energy: 1.3205658129823834
Energy: 1.4360314013693887
Energy: 1.4327831786237237
Energy: 1.2924898916187677
Energy: 1.2929095930687495
Energy: 1.2901099050703932
Energy: 1.2935397742500179
Energy: 1.2597249283097998
Energy: 1.4391106647315397
Energy: 1.2341364283160317
Energy: 1.2306055700197733
Energy: 1.2892131861858136
Energy: 1.267267999995284
Energy: 1.3160443849325711
Energy: 1.290984640512738
Energy: 1.234123324606613
Energy: 1.2320756938706274
Energy: 1.290782713259501
Energy: 1.2343622307960254
Energy: 1.270926629258264
Energy: 1.2677874506360922
Energy: 1.2926631865607805
Energy: 1.260249816359405
Energy: 1.2678818000680592
Energy: 1.2929036954322912
Energy: 1.2365361639011951
Energy: 1.3346547927685322
Energy: 1.2901515761247067
Energy: 1.262104592302808
Energy: 1.2683577662036276
Energy: 1.2905093409454538
Energy: 1.2336113569833111
Energy: 1.2661681011068466
Energy: 1.2363910134529237
Energy: 1.2587408865774532
Energy: 1.266350440458291
Energy: 1.236117069590421
Energy: 1.2430772925853262
Energy: 1.2721200124185954
Energy: 1.2384964738821949
Energy: 1.2345622905539262
Energy: 1.2735570710933335
Energy: 1.2736466228597505
Energy: 1.2679666475152196
Energy: 1.313666622862122
Energy: 1.237797581220945
Energy: 1.2339193955656442
Energy: 1.3180488176125598
Energy: 1.2901977077439741
Energy: 1.2341693696626985
Energy: 1.2898024002575597
Energy: 1.2742522203566367
Energy: 1.2371974210070307
Energy: 1.2690191946160287
Energy: 1.2683947218070135
Energy: 1.2343010350906234
Energy: 1.2938044101252342
Energy: 1.2926646944962887
Energy: 1.2390273061311963
Energy: 1.3644960848160603
Energy: 1.2093670554879994
Energy: 1.2381353043413794
Energy: 1.4528105667717388
Energy: 1.2106443338386623
Energy: 1.2111803893880995
Energy: 1.452429262420319
Energy: 1.2099788360887693
Energy: 1.29031504469902
Energy: 1.4381902462591694
Energy: 1.2703647809344862
Energy: 1.262553223217059
Energy: 1.2910454345534075
Energy: 1.2695302655912277
Energy: 1.2631887288865657
Energy: 1.3437265044288889
Energy: 1.2904413394694023
Energy: 1.2174441576566262
Energy: 1.214447818824139
Energy: 1.289749430037438
Energy: 1.212689010403049

minimum gb energy = 1.2093670554879994 eV
minimum distance =  2.29413243030969 Angstroms
sigma value = 11


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

Energy: 1.4796676633655328
Energy: 1.7173026684467212
Energy: 1.5090357140107364
Energy: 1.47808848740166
Energy: 1.6235859977612062
Energy: 1.5739422076294969
Energy: 1.6636140376896111
Energy: 1.4318782077706707
Energy: 1.4323460242220067
Energy: 1.457117454236529
Energy: 1.4314418374214861
Energy: 1.4024027814744984
Energy: 1.6778455652711213
Energy: 1.4324047304475342
Energy: 1.434712423106884
Energy: 1.4362337886428904
Energy: 1.4160976256533027
Energy: 1.4374325648657997
Energy: 1.46366949781282
Energy: 1.4212179018156488
Energy: 1.4528497658131452
Energy: 1.4316076747513566
Energy: 1.4217453951622336
Energy: 1.4742832422379963
Energy: 1.4665174405239965
Energy: 1.4309940265503462
Energy: 1.4323495849653887
Energy: 1.4261560068163945
Energy: 1.4313354543144399
Energy: 1.4838446059873787
Energy: 1.4923412975760806
Energy: 1.4574797033683236
Energy: 1.4251514632835351
Energy: 1.4303157695361661
Energy: 1.4654966629875494
Energy: 1.4546721903626896
Energy: 1.4668988424281755
Energy: 1.4428585204516646
Energy: 1.4443767553591955
Energy: 1.4661824607857155
Energy: 1.4432604235401043
Energy: 1.4006768648118113
Energy: 1.4572299430651998
Energy: 1.4464441544915398
Energy: 1.482719428786624
Energy: 1.431401585446232
Energy: 1.4586708572273768
Energy: 1.4310739429319475
Energy: 1.4260897797614267
Energy: 1.463160041320564
Energy: 1.4374299724922954
Energy: 1.4116939049431376
Energy: 1.4364390943725451
Energy: 1.4276758056848198
Energy: 1.4208017629872158
Energy: 1.4630906128820345
Energy: 1.4373040939014123
Energy: 1.4315642439094698
Energy: 1.4364351791409697
Energy: 1.4272896751820823
Energy: 1.4581419174575114
Energy: 1.453528263201955
Energy: 1.484241403852269
Energy: 1.4316364334642289
Energy: 1.4307932672394414
Energy: 1.4325242551851756
Energy: 1.4571770810734879
Energy: 1.4318701097314261
Energy: 1.4472778157246529
Energy: 1.4335452601504675
Energy: 1.4282006262509461
Energy: 1.4479259865983367
Energy: 1.4285492720312039
Energy: 1.4421949983038802
Energy: 1.4303403273290671
Energy: 1.4288025245178937
Energy: 1.4260699464705364
Energy: 1.4720752797825603
Energy: 1.4477370153191502
Energy: 1.462513027987539
Energy: 1.4377337394940974
Energy: 1.421036892390104
Energy: 1.4875917422045661
Energy: 1.4451042526461517
Energy: 1.4293020736563198
Energy: 1.4291592978901069
Energy: 1.4735892640845256
Energy: 1.429825715100149
Energy: 1.4314727977261814
Energy: 1.4737133477315703
Energy: 1.4238791891946627
Energy: 1.4732073182597025
Energy: 1.474701913239206
Energy: 1.4256880147831559
Energy: 1.4297688129165447
Energy: 1.422584705822984
Energy: 1.4229935053183722
Energy: 1.4155020329447061
Energy: 1.4589397913255207
Energy: 1.4235390474737477
Energy: 1.4246878131529193
Energy: 1.4474464969669165
Energy: 1.4723286712070505
Energy: 1.5061434999864192
Energy: 1.485957049318481
Energy: 1.4203486665277452
Energy: 1.5386890915620823
Energy: 1.4212011108919014
Energy: 1.4375026938178685
Energy: 1.4253928720672089
Energy: 1.4238604256632856
Energy: 1.4379909673321425
Energy: 1.4249020230415463
Energy: 1.476981859863948
Energy: 1.453200071503595
Energy: 1.427374711885864
Energy: 1.424763952871556
Energy: 1.4302755871258552
Energy: 1.4044483811301072
Energy: 1.4639472569209409
Energy: 1.5488699039737308
Energy: 1.4246506416812124
Energy: 1.4640606496726083
Energy: 1.4294537406589245
Energy: 1.4287084785328148
Energy: 1.429502684776431
Energy: 1.5249129810380442
Energy: 1.4292846509804464
Energy: 1.4285363132535607
Energy: 1.4448600983059314
Energy: 1.4303022924522608
Energy: 1.4296497414289728
Energy: 1.4432930593156006
Energy: 1.4305744589295961
Energy: 1.4330589203437039
Energy: 1.4017257122738842
Energy: 1.4309361820209514
Energy: 1.4340041636040044
Energy: 1.5440800370668029
Energy: 1.4396960175086186
Energy: 1.4591474223732894
Energy: 1.4232482615808855
Energy: 1.431515162773903
Energy: 1.4163242755273713
Energy: 1.5369524676305646
Energy: 1.4362301805992512
Energy: 1.435404771742149
Energy: 1.5066882501577705
Energy: 1.4229634018947197
Energy: 1.4366585689955813
Energy: 1.5123047478377363
Energy: 1.410173239280243
Energy: 1.4100247541481499
Energy: 1.4311252118918414
Energy: 1.4140950819570302
Energy: 1.4764448823522256
Energy: 1.4842640629265835
Energy: 1.422905833666217
Energy: 1.4240563107349324
Energy: 1.4330099319735625
Energy: 1.4261033372767253
Energy: 1.423387084550355
Energy: 1.4858760979698828
Energy: 1.4265449919496316
Energy: 1.474695030226327
Energy: 1.422362520130589
Energy: 1.423080317550922
Energy: 1.4739125793586825
Energy: 1.542937130165116
Energy: 1.4281957527714755
Energy: 1.4221919199119408
Energy: 1.4310576556573542
Energy: 1.4249099703485448
Energy: 1.4213634284278212
Energy: 1.675998355610268
Energy: 1.4295154182329024
Energy: 1.4774930986705581
Energy: 1.4265455745003635
Energy: 1.4284914584094766
Energy: 1.4751748104863727
Energy: 1.455458863048251
Energy: 1.4328413275206024
Energy: 1.419365838567469
Energy: 1.4200867207370542
Energy: 1.4325519501644184
Energy: 1.3968515790654483

minimum gb energy = 1.3968515790654483 eV
minimum distance =  2.26788406650512 Angstroms
sigma value = 57


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

Energy: 1.9436017091868842
Energy: 2.0944014801746382
Energy: 1.6141311164649537
Energy: 1.6046424632940752
Energy: 2.088679063972793
Energy: 1.6013812120414348
Energy: 1.5275416541990003
Energy: 1.4566391724452465
Energy: 1.4608319088872577
Energy: 1.4640229740798016
Energy: 1.469058080085965
Energy: 1.4561630608622111
Energy: 1.5296067135245601
Energy: 1.4860525456689015
Energy: 1.4835637881176171
Energy: 1.5303016631895399
Energy: 1.4561670808897313
Energy: 1.4712073366496974
Energy: 1.4594929893398392
Energy: 1.4680383627723215
Energy: 1.4560674836001761
Energy: 1.4607515208091866
Energy: 1.4545310068695314
Energy: 1.457403891606174
Energy: 1.4609044227698744
Energy: 1.4665557826347029
Energy: 1.4642147678284754
Energy: 1.4623073133400526
Energy: 1.4607432061260357
Energy: 1.4575623218133065
Energy: 1.4624025613682254
Energy: 1.5332062678197709
Energy: 1.4609405828000526
Energy: 1.4694155346854503
Energy: 1.5338412518303017
Energy: 1.467855597080603
Energy: 1.5272304429406522
Energy: 1.4855271913693637
Energy: 1.4893840978999262
Energy: 1.5287359083505565
Energy: 1.4777450499377554
Energy: 1.5633816605893485
Energy: 1.5296639862991943
Energy: 1.4674796664817729
Energy: 1.4636878713963475
Energy: 1.467558627505866
Energy: 1.4619006586720618
Energy: 1.4553063968109152
Energy: 1.4242104043510826
Energy: 1.4628028215061422
Energy: 1.4827409354601147
Energy: 1.4251924205356556
Energy: 1.4575326302537959
Energy: 1.4895795494217876
Energy: 1.4239111236977573
Energy: 1.4621999095264422
Energy: 1.4834652832358297
Energy: 1.4248589175925763
Energy: 1.5101171063669574
Energy: 1.4898733311652623
Energy: 1.5289250530426115
Energy: 1.4681893543364777
Energy: 1.4737533927262474
Energy: 1.4678657386970666
Energy: 1.461744545506492
Energy: 1.4559574430843945
Energy: 1.5111228205528175
Energy: 1.4829728010784962
Energy: 1.4602988900438416
Energy: 1.5123531497824245
Energy: 1.4844328033390657
Energy: 1.4613422509124965
Energy: 1.469399093993089
Energy: 1.4576347532955616
Energy: 1.4566540817370437
Energy: 1.4703950043286134
Energy: 1.4686456761755375
Energy: 1.4556958842700507
Energy: 1.4618072079605005
Energy: 1.5306474465232378
Energy: 1.4634474237553163
Energy: 1.4722668336890907
Energy: 1.5337720441125875
Energy: 1.4662843380768995
Energy: 1.4579284138144566
Energy: 1.4811116229047963
Energy: 1.4598489183623808
Energy: 1.4663053512476156
Energy: 1.4757574842758747
Energy: 1.4558685485441427
Energy: 1.5314355462922087
Energy: 1.4825409911263998
Energy: 1.4856732929663063
Energy: 1.5298363555247079
Energy: 1.4772385770470293
Energy: 1.470086636674974
Energy: 1.4244824506543319
Energy: 1.4578685399414921
Energy: 1.4608350860089128
Energy: 1.424127925337363
Energy: 1.4697638745619104
Energy: 1.4594971609385643

minimum gb energy = 1.4239111236977573 eV
minimum distance =  2.29597609256445 Angstroms
sigma value = 9


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

Energy: 2.355341429988411
Energy: 1.5733802417455958
Energy: 1.5366084245650604
Energy: 1.5120381329232873
Energy: 1.6176492335899688
Energy: 1.537653569799494
Energy: 1.5507251008491496
Energy: 1.5777188110143523
Energy: 1.5341697363418219
Energy: 1.5259136373005315
Energy: 1.5779690900123031
Energy: 1.5338781182105734
Energy: 1.5498798376341802
Energy: 1.5436226385225373
Energy: 1.530100767208952
Energy: 1.5122460643412938
Energy: 1.5259100358727105
Energy: 1.5361749522380175
Energy: 1.5249077131768107
Energy: 1.531966825343897
Energy: 1.561278448126887
Energy: 1.522845849984002
Energy: 1.528369342968902
Energy: 1.5338798561696425
Energy: 1.586132263554634
Energy: 1.4827943440729061
Energy: 1.4774331754244785
Energy: 1.477810569065692
Energy: 1.4788859728014596
Energy: 1.4776234920716886
Energy: 1.5324241691043157
Energy: 1.537060375697043
Energy: 1.5342029355909639
Energy: 1.5343748728279474
Energy: 1.5412657251933721
Energy: 1.5338067921401641
Energy: 1.5155511286933647
Energy: 1.5340030029749527
Energy: 1.509918969964685
Energy: 1.479770123717786
Energy: 1.5375633927839285
Energy: 1.50906571212982
Energy: 1.578876771485254
Energy: 1.5341649361193013
Energy: 1.5401132529753947
Energy: 1.514913043522926
Energy: 1.5336986946847782
Energy: 1.5405325542875519
Energy: 1.6041934670458933
Energy: 1.4858322955187058
Energy: 1.4795834604091673
Energy: 1.5623700855528933
Energy: 1.4792360106735938
Energy: 1.5480400290013985
Energy: 1.5698307912377825
Energy: 1.4851239703178232
Energy: 1.479807692452662
Energy: 1.5593396220703517
Energy: 1.5165800427823126
Energy: 1.4806226721300777
Energy: 1.5786886609406297
Energy: 1.511025581199332
Energy: 1.4845586851297723
Energy: 1.5160380088732366
Energy: 1.5091731731923084
Energy: 1.4820491865010084
Energy: 1.582186865388501
Energy: 1.5283263353372953
Energy: 1.5326711017212393
Energy: 1.55135054356691
Energy: 1.527642786362653
Energy: 1.5388377386999275
Energy: 1.801702673021028
Energy: 1.5302619011138652
Energy: 1.5332758103681934
Energy: 1.543384830505248
Energy: 1.524387104270087
Energy: 1.5325227881204118
Energy: 1.5553450392372044
Energy: 1.5294144147110305
Energy: 1.5305893421327224
Energy: 1.514879096131684
Energy: 1.5232949836410248
Energy: 1.5554959813891944
Energy: 1.5782679202546546
Energy: 1.477438790397434
Energy: 1.4781302145501338
Energy: 1.5515686301769145
Energy: 1.47626217855941
Energy: 1.4776802167369911
Energy: 1.5506324040919153
Energy: 1.528496866261287
Energy: 1.4768644355968807
Energy: 1.5161498702452454
Energy: 1.5465628265376723
Energy: 1.47718772028535
Energy: 1.5432070473077804
Energy: 1.5558938693667994
Energy: 1.5590425344428889
Energy: 1.5491077538007663
Energy: 1.5283309203943838
Energy: 1.5353643869818567
Energy: 1.707766796903655
Energy: 1.5287302104724685
Energy: 1.4783466667278606
Energy: 1.483263313316856
Energy: 1.5588163788493175
Energy: 1.4787482617562244
Energy: 1.5568958407060334
Energy: 1.532950877507553
Energy: 1.5345692001378086
Energy: 1.5576160369761893
Energy: 1.5129801476684872
Energy: 1.5335218105207364
Energy: 1.5504159580052703
Energy: 1.531556820108731
Energy: 1.534710834898013
Energy: 1.4770325051327173
Energy: 1.5266689181750577
Energy: 1.5370333626079462
Energy: 1.5613621805188838
Energy: 1.5132925011912477
Energy: 1.531832450550253
Energy: 1.5317835968587707
Energy: 1.5559828460482008
Energy: 1.4751845124506433

minimum gb energy = 1.4751845124506433 eV
minimum distance =  2.29464400947391 Angstroms
sigma value = 27


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

Energy: 1.6932204266894848
Energy: 1.528959310050313
Energy: 1.474095656328679
Energy: 1.471085879555871
Energy: 2.271314258612335
Energy: 1.4758688063782344
Energy: 1.7337185374047577
Energy: 1.5459068667901568
Energy: 1.5046389300521656
Energy: 1.5052994372611264
Energy: 1.4978278629782564
Energy: 1.4961954170563008
Energy: 1.5617561159564861
Energy: 1.518260505072691
Energy: 1.514137033998841
Energy: 1.4848444038060453
Energy: 1.5096503633381684
Energy: 1.5000982260144833
Energy: 1.5443735891013064
Energy: 1.5128722800561527
Energy: 1.5111067016297204
Energy: 1.5174798020680351
Energy: 1.512795208903693
Energy: 1.514697775453089
Energy: 1.5087339957589745
Energy: 1.485999826103114
Energy: 1.4856842767177199
Energy: 1.5012742799750858
Energy: 1.4831373480046848
Energy: 1.485507072881556
Energy: 1.562544714618209
Energy: 1.514220098724531
Energy: 1.5138938916022757
Energy: 1.4990472794673886
Energy: 1.514549989207836
Energy: 1.5149614950129395
Energy: 1.533151924025076
Energy: 1.442477745628012
Energy: 1.440600819060794
Energy: 1.47927276934617
Energy: 1.4342697969906715
Energy: 1.4373462075933936
Energy: 1.5282889100313262
Energy: 1.487178279773671
Energy: 1.5378762561884598
Energy: 1.5236904431122704
Energy: 1.4869541149960679
Energy: 1.5372661736768798
Energy: 1.53048292444028
Energy: 1.5040680522030372
Energy: 1.5067304342859773
Energy: 1.4997447974558098
Energy: 1.4878947054815
Energy: 1.4845604607982545
Energy: 1.5935154728541394
Energy: 1.5017660659905947
Energy: 1.5030760949703754
Energy: 1.4963293026273603
Energy: 1.5020318827962125
Energy: 1.498879943776011
Energy: 1.529473256163925
Energy: 1.4846419239552322
Energy: 1.4844758594645988
Energy: 1.5243939815903194
Energy: 1.5066884908444775
Energy: 1.4850133860544716
Energy: 1.5453628129145847
Energy: 1.5134164088764779
Energy: 1.5192562844965811
Energy: 1.5231578583903373
Energy: 1.516411479923369
Energy: 1.5172288677088084
Energy: 1.4783985838898492
Energy: 1.4920485315346548
Energy: 1.4183262691158587
Energy: 1.4372529992055052
Energy: 1.4912271540393232
Energy: 1.4348897016582256
Energy: 1.4674206913179535
Energy: 1.5329187406129203
Energy: 1.521656305716172
Energy: 1.4368650976343116
Energy: 1.5252680258387417
Energy: 1.4365886765920182
Energy: 1.553527103358006
Energy: 1.5188599852859015
Energy: 1.515737447537034
Energy: 1.521163238376635
Energy: 1.5215594137723203
Energy: 1.5186223358766702
Energy: 1.5756010740812296
Energy: 1.500080473732092
Energy: 1.501632713055137
Energy: 1.4890305100867651
Energy: 1.5004866116321356
Energy: 1.5016801650994955
Energy: 1.55025509512008
Energy: 1.5542486618583706
Energy: 1.532220978072399
Energy: 1.5409343824863813
Energy: 1.5477700242989623
Energy: 1.533988970537719
Energy: 1.5822492089862297
Energy: 1.5076453847752795
Energy: 1.5014996176565267
Energy: 1.5031412007692575
Energy: 1.5085166747749355
Energy: 1.5032253046084791
Energy: 1.5231494293654377
Energy: 1.4341011097605243
Energy: 1.4359461108130092
Energy: 1.524499584885075
Energy: 1.4356118301305385
Energy: 1.4177785534439762
Energy: 1.541937653576708
Energy: 1.4341845842741026
Energy: 1.4351612051985432
Energy: 1.481560571733917
Energy: 1.435892235807629
Energy: 1.4188908072097772
Energy: 1.5616905753584294
Energy: 1.5088770618493943
Energy: 1.508526370100019
Energy: 1.509894242837993
Energy: 1.5098110375243665
Energy: 1.505458281827015
Energy: 1.511843267500503
Energy: 1.4890231119936845
Energy: 1.4854582652895472
Energy: 1.507166174662898
Energy: 1.48719201818
Energy: 1.4840426287182282
Energy: 1.5617395551874977
Energy: 1.5140311699986622
Energy: 1.526259305089366
Energy: 1.5352074468847587
Energy: 1.5124194330764593
Energy: 1.5092619028221548
Energy: 1.5539174996559388
Energy: 1.5123871977163035
Energy: 1.5087912494077238
Energy: 1.5015848197248662
Energy: 1.5163119398840794
Energy: 1.5080764066869117
Energy: 1.5974914545791499
Energy: 1.565544876378976
Energy: 1.543816189629129
Energy: 1.4672177978909202
Energy: 1.5612975106812406
Energy: 1.4715280111203268

minimum gb energy = 1.4177785534439762 eV
minimum distance =  2.28133582347571 Angstroms
sigma value = 19


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

Energy: 2.3013253310406463
Energy: 1.4991439356984468
Energy: 1.4483435278607073
Energy: 1.472041689486321
Energy: 1.4957189908035908
Energy: 1.447864879140628
Energy: 1.5112367050331315
Energy: 1.4619640692445754
Energy: 1.449450702388859
Energy: 1.4682915016089584
Energy: 1.461215233992584
Energy: 1.4472063773239328
Energy: 1.5104171154136452
Energy: 1.459310085636795
Energy: 1.447124863104593
Energy: 1.4752746946644906
Energy: 1.4593038125727809
Energy: 1.4468696141758213
Energy: 1.5108850516466368
Energy: 1.4616604062616416
Energy: 1.4622175392119712
Energy: 1.4606672937799008
Energy: 1.4460984826694885
Energy: 1.4629538942616607
Energy: 1.5019614554900929
Energy: 1.4602800204696789
Energy: 1.4420054822002977
Energy: 1.4658111575418487
Energy: 1.4754706595400442
Energy: 1.4402760443318081
Energy: 1.5118688319726628
Energy: 1.4624988529009049
Energy: 1.4615259317576452
Energy: 1.460540327870501
Energy: 1.4428918895866774
Energy: 1.4635489250737
Energy: 1.5115076664757292
Energy: 1.4573649565785232
Energy: 1.4592371935949529
Energy: 1.465549496858385
Energy: 1.4643953842227189
Energy: 1.4572928026873437
Energy: 1.5070256771200221
Energy: 1.4576902005521521
Energy: 1.4465423071793775
Energy: 1.4608064909473448
Energy: 1.4557919682889384
Energy: 1.4456566808006273
Energy: 1.4828224282765907
Energy: 1.449964381077164
Energy: 1.4616943258158972
Energy: 1.4598218069262503
Energy: 1.4407051421548869
Energy: 1.4683336944744723
Energy: 1.4825861871211703
Energy: 1.4803071268042032
Energy: 1.4791677217933146
Energy: 1.4400342553725785
Energy: 1.4810826996884745
Energy: 1.4635478405348248
Energy: 1.5085927274544801
Energy: 1.4072968395921184
Energy: 1.4133442003438608
Energy: 1.4760845581920354
Energy: 1.4483831573362103
Energy: 1.4140143715328806
Energy: 1.5102685450887479
Energy: 1.4915913510421965
Energy: 1.430685752327806
Energy: 1.410440282327167
Energy: 1.4802477208227942
Energy: 1.4047444435539536
Energy: 1.5388731856895494
Energy: 1.4972451924153973
Energy: 1.434388973636115
Energy: 1.4650940963306394
Energy: 1.4909896061443453
Energy: 1.435106646354158
Energy: 1.5708689167655714
Energy: 1.4855742039457978
Energy: 1.4800431150986648
Energy: 1.4519542175077973
Energy: 1.4761553938949727
Energy: 1.4398849336455648
Energy: 1.508512726055894
Energy: 1.4280931473195657
Energy: 1.4384091029538792
Energy: 1.428659226611137
Energy: 1.458992939247474
Energy: 1.4399785470229507
Energy: 1.5097644554486125
Energy: 1.4048766249640166
Energy: 1.405035651151016
Energy: 1.4114924500997574
Energy: 1.411730394824105
Energy: 1.4044208244982292
Energy: 1.5083825668905342
Energy: 1.4603785339245619
Energy: 1.468419254003128
Energy: 1.457651269514153
Energy: 1.4793465906783778
Energy: 1.4697195928803006
Energy: 1.5448739993299196
Energy: 1.4302131464006362
Energy: 1.4103256989545039
Energy: 1.4734839067196688
Energy: 1.435489275752897
Energy: 1.4109840159827494
Energy: 1.5213348046787956
Energy: 1.426900486295238
Energy: 1.4271712211058478
Energy: 1.4689629483942013
Energy: 1.4552241030747046
Energy: 1.4240651432608642
Energy: 1.5010006645768899
Energy: 1.4267639355971222
Energy: 1.4383473194222158
Energy: 1.456126450563404
Energy: 1.454971781866213
Energy: 1.4181587235734119
Energy: 1.4613578332974517
Energy: 1.4323414414822493
Energy: 1.4110794768675274
Energy: 1.4544981841796822
Energy: 1.4367257119655694
Energy: 1.4044598959769494
Energy: 1.4567779865266377
Energy: 1.4109325867967446
Energy: 1.411059127469119
Energy: 1.4110856380760533
Energy: 1.4100122228092173
Energy: 1.4296120569711077
Energy: 1.5091083969696104
Energy: 1.3992526637502143
Energy: 1.4206046363503408
Energy: 1.5107106078739956
Energy: 1.4502597466639227
Energy: 1.4466245920654628
Energy: 1.5119234906529118
Energy: 1.3989954255020496
Energy: 1.4488910957133234
Energy: 1.4767298351213562
Energy: 1.448401940127594
Energy: 1.4393485561544648
Energy: 1.5436299266581104
Energy: 1.411817992530194
Energy: 1.4092032319890322
Energy: 1.460503725929761
Energy: 1.4244203416619439
Energy: 1.4046737314079898
Energy: 1.5062532834967888
Energy: 1.4438763656821898
Energy: 1.4435558265647106
Energy: 1.4571470565520028
Energy: 1.445241361618032
Energy: 1.4468273171172144
Energy: 1.5129993781014814
Energy: 1.4410811045994811
Energy: 1.4409128768871822
Energy: 1.4905279991193536
Energy: 1.4597556446492148
Energy: 1.4610827942465574
Energy: 1.510453985010893
Energy: 1.470794826088912
Energy: 1.4699436874301883
Energy: 1.4402596584501102
Energy: 1.4593263648467207
Energy: 1.4628364891438606
Energy: 1.5642813801032287
Energy: 1.5228131787060921
Energy: 1.5247190428416895
Energy: 1.4455710005203835
Energy: 1.5204061797513695
Energy: 1.4467215181163133

minimum gb energy = 1.3989954255020496 eV
minimum distance =  2.2740220764368 Angstroms
sigma value = 101


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

Energy: 2.1208539295619375
Energy: 1.3930651293864005
Energy: 1.423665458875082
Energy: 1.3470514874574286
Energy: 1.394941864888946
Energy: 1.345646229762481
Energy: 1.4884376554529326
Energy: 1.390517310414062
Energy: 1.390034781145398
Energy: 1.4111049702625371
Energy: 1.39170920074658
Energy: 1.424723099190992
Energy: 1.4861204299004291
Energy: 1.4101871042879597
Energy: 1.3880449912059198
Energy: 1.3893829347165452
Energy: 1.4091225892899015
Energy: 1.3894962935108024
Energy: 1.4728280791166761
Energy: 1.4121074181383864
Energy: 1.4111358960653468
Energy: 1.3917757943466829
Energy: 1.4325803841711007
Energy: 1.4104758069641041
Energy: 1.4233099522663772
Energy: 1.390365545725519
Energy: 1.3928257708640217
Energy: 1.4256003887189814
Energy: 1.3902417622491516
Energy: 1.4252713305694553
Energy: 1.4430590565197576
Energy: 1.4333787371832982
Energy: 1.4304468455286001
Energy: 1.430817812988248
Energy: 1.4119470460954044
Energy: 1.4453693771278049
Energy: 1.472754933340697
Energy: 1.4135986493084547
Energy: 1.3875619340238372
Energy: 1.4484860228475325
Energy: 1.3965113561869698
Energy: 1.3859841831704192
Energy: 1.48614820573946
Energy: 1.410280206196565
Energy: 1.4206170368902198
Energy: 1.39115667010845
Energy: 1.4346272561443003
Energy: 1.389421012245345
Energy: 1.4037445560467412
Energy: 1.3868865839665903
Energy: 1.387834616958335
Energy: 1.4031140494986227
Energy: 1.3850089210341192
Energy: 1.410358935964954
Energy: 1.4313437584828117
Energy: 1.4143734113142277
Energy: 1.439126977669884
Energy: 1.4031442461673167
Energy: 1.416277206087607
Energy: 1.4376333931658214
Energy: 1.485324233696024
Energy: 1.3413127756851497
Energy: 1.3399328011553704
Energy: 1.390898742378639
Energy: 1.3858342889183208
Energy: 1.3410864953802588
Energy: 1.4897877015692735
Energy: 1.4133818469832802
Energy: 1.4163882839688497
Energy: 1.397801195929684
Energy: 1.4061276422721496
Energy: 1.4151630742608114
Energy: 1.4406550880970856
Energy: 1.3877960658441066
Energy: 1.391389997040402
Energy: 1.3964402710620738
Energy: 1.3880934019034046
Energy: 1.3887814867942736
Energy: 1.4628616613195338
Energy: 1.3926581857038576
Energy: 1.427763661095247
Energy: 1.395572297933502
Energy: 1.397877114891555
Energy: 1.4208188655518637
Energy: 1.4853582790531374
Energy: 1.4087136758379017
Energy: 1.412553451735107
Energy: 1.3993989681377585
Energy: 1.4038206959179862
Energy: 1.4158634757269029
Energy: 1.4856223898059528
Energy: 1.416731757862498
Energy: 1.411329691876249
Energy: 1.388004669307208
Energy: 1.40844362130225
Energy: 1.410025778640109
Energy: 1.4485066368565538
Energy: 1.5138095900789514
Energy: 1.424269700082551
Energy: 1.367221539437308
Energy: 1.4967743188772427
Energy: 1.3405374134595007
Energy: 1.5544046927677264
Energy: 1.3899785078120064
Energy: 1.3891197888209104
Energy: 1.429491938509607
Energy: 1.3910813238319086
Energy: 1.422829405037919
Energy: 1.485574043010007
Energy: 1.412560269643272
Energy: 1.4175101294702086
Energy: 1.3847603230108012
Energy: 1.4087095853569864
Energy: 1.3903152130596244
Energy: 1.4692188631162648
Energy: 1.4079594787494423
Energy: 1.4194997925791024
Energy: 1.3915199928116473
Energy: 1.403771883360058
Energy: 1.4212441926162527
Energy: 1.4270159244597007
Energy: 1.3884824721083353
Energy: 1.389517329499234
Energy: 1.4258201554059677
Energy: 1.390682724816818
Energy: 1.4177361303384053
Energy: 1.464843557849414
Energy: 1.3889195124839677
Energy: 1.410666050500625
Energy: 1.4077824151404714
Energy: 1.3922222471995382
Energy: 1.410337137300435
Energy: 1.4429164276587978
Energy: 1.3969505507682634
Energy: 1.4003589435715238
Energy: 1.4359249000554697
Energy: 1.4008195501248908
Energy: 1.3855919084499437
Energy: 1.4876258359717243
Energy: 1.4083583337823617
Energy: 1.412318992486905
Energy: 1.3908235723990359
Energy: 1.4012694063813689
Energy: 1.389578515126218
Energy: 1.4263742353971858
Energy: 1.3904015740843811
Energy: 1.4221855224937168
Energy: 1.411043628150627
Energy: 1.3866280415203371
Energy: 1.4185086704797232
Energy: 1.4037178150335663
Energy: 1.4319147947519908
Energy: 1.4164107687582455
Energy: 1.4037691152870615
Energy: 1.3925370518415494
Energy: 1.4237334755131388
Energy: 1.4721480668186395
Energy: 1.388449838178594
Energy: 1.4084027083852249
Energy: 1.3744416697489636
Energy: 1.374935727923383
Energy: 1.3434954089246651
Energy: 1.4853826138749588
Energy: 1.38700450981831
Energy: 1.3917460496283967
Energy: 1.3995009654318769
Energy: 1.3752544369047461
Energy: 1.4234768900869592
Energy: 1.4391725935592856
Energy: 1.3929079469500991
Energy: 1.393343366024874
Energy: 1.3956525360734895
Energy: 1.398076383388987
Energy: 1.4190481698132973
Energy: 1.4418651248958179
Energy: 1.4097634697327104
Energy: 1.4095017953737397
Energy: 1.3958269547943947
Energy: 1.3910323351543004
Energy: 1.4125342655406192
Energy: 1.485402255030372
Energy: 1.4171353459764149
Energy: 1.4207432808843656
Energy: 1.3993475245020361
Energy: 1.402388930241934
Energy: 1.421853911750549
Energy: 1.4853111132668277
Energy: 1.4085192088344547
Energy: 1.4104387837508325
Energy: 1.385536706614426
Energy: 1.4080692944362017
Energy: 1.4230675428770438
Energy: 1.4490112935295558
Energy: 1.4858390925070142
Energy: 1.4246436864752807
Energy: 1.3675726673149926
Energy: 1.4017104142329555
Energy: 1.4209203816445084

minimum gb energy = 1.3399328011553704 eV
minimum distance =  2.25845983434652 Angstroms
sigma value = 33


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

Energy: 0.020883323691408783
Energy: 1.2653015900049702
Energy: 0.021719935898367772
Energy: 0.023645075542517168
Energy: 1.269401410734543
Energy: 0.021718519911927026
Energy: 0.7099980528644253
Energy: 0.18578304400763007
Energy: 0.18339352780166707
Energy: 0.1862638358968262
Energy: 0.18531957464965162
Energy: 0.18315533112909088
Energy: 1.8030153861381577
Energy: 1.2682079759578078
Energy: 1.2660993222912875
Energy: 1.2728923359357451
Energy: 1.271275318727888
Energy: 1.2658054490147383
Energy: 0.02225832189730792
Energy: 0.18578304400720638
Energy: 0.18339352780166707
Energy: 0.1862638358968262
Energy: 0.18531957464917498
Energy: 0.18315533112909088

minimum gb energy = 0.020883323691408783 eV
minimum distance =  2.43135014403022 Angstroms
sigma value = 1