Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.633016772568226
cohesive_energy=4.280573320677608
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.485507733688754e-19, 2.2546150028974797e-19, 2.9193260448114e-19, 3.4856954849304003e-19, 3.9552293692904397e-19, 4.35665472493914e-19, 4.7225758463784e-19, 5.077025383118219e-19, 5.406785377928099e-19, 5.67880292684862e-19, 5.8841539060284e-19, 6.04275337102806e-19, 6.178794189021e-19, 6.30470925068706e-19, 6.42173223203442e-19, 6.526578670963379e-19, 6.61622045363568e-19, 6.689504012874839e-19, 6.746974088736419e-19, 6.7901847925554e-19, 6.821106801591599e-19, 6.841742836637519e-19, 6.85375916139252e-19, 6.85770051591216e-19, 6.8533746390003595e-19, 6.8391312887241e-19, 6.812535156599699e-19, 6.77026973699478e-19, 6.708521849520419e-19, 6.6227573343024e-19, 6.50714426839296e-19, 6.35434468280838e-19, 6.1554825189963e-19, 5.900175672368399e-19, 5.57655201406674e-19, 5.171329499795459e-19, 4.66928745153156e-19, 4.05208094681574e-19, 3.2956933579043396e-19, 2.36628671428728e-19, 1.212211647814302e-19, -2.5223547402052197e-20, -2.1607274521450798e-19, -4.6747188303208195e-19, -7.960975367850899e-19, -1.2255577791755218e-18, -1.79471020010778e-18, -2.56719966419088e-18, -3.64995063344808e-18, -5.233429866129299e-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: 0.0 eV

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

Energy: 0.01634670758915987
Energy: 0.016838199825626992
Energy: 0.016730741080740658
Energy: 0.01662210775141352
Energy: 0.8581563213081348
Energy: 0.016691761621656472
Energy: 0.016838199825626992
Energy: 0.16722800566463858
Energy: 0.16706513378907123
Energy: 0.1664249003165814
Energy: 0.1649697940445882
Energy: 0.1669099889087121
Energy: 0.01673074108136167
Energy: 0.16706513378938173
Energy: 0.16644382924627846
Energy: 0.016633111347244354
Energy: 0.16525996663886566
Energy: 0.16603925349772708
Energy: 0.01662210775141352
Energy: 0.1664249003168919
Energy: 0.016633111347244354
Energy: 0.01666442622899167
Energy: 0.16552594148957422
Energy: 0.01657308826631095
Energy: 0.8581563213072032
Energy: 0.16496979404517473
Energy: 0.16525996663855516
Energy: 0.16552594148988475
Energy: 0.165225657019632
Energy: 0.16734425621542884
Energy: 0.016691761621932477
Energy: 0.1669099889087121
Energy: 0.16603925349741658
Energy: 0.01657308826662145
Energy: 0.16734425621511834
Energy: 0.016613770346475838

minimum gb energy = 0.01634670758915987 eV
minimum distance =  2.56693449443285 Angstroms
sigma value = 1


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

Energy: 2.214649003002142
Energy: 1.301423391320209
Energy: 1.392284643929248
Energy: 1.2177113476484116
Energy: 1.293107527336943
Energy: 1.4420960375718495
Energy: 2.089404555521731
Energy: 1.3003391120572763
Energy: 1.2978438835565491
Energy: 1.2724832474010814
Energy: 1.2972548203271876
Energy: 1.2847949466750368
Energy: 2.0383932256295703
Energy: 1.293722690086558
Energy: 1.2816988618067902
Energy: 1.319432414613707
Energy: 1.2919608038285704
Energy: 1.283926253011763
Energy: 2.196927197258981
Energy: 1.2751171371547854
Energy: 1.3090225378773364
Energy: 1.2969834520244283
Energy: 1.2751997693183805
Energy: 1.3111501284039775
Energy: 2.0868670681422152
Energy: 1.296527893453114
Energy: 1.2967835997462467
Energy: 1.2774107084802706
Energy: 1.2971285669472343
Energy: 1.2845234515757007
Energy: 1.9823077744626125
Energy: 1.295720945786314
Energy: 1.286167259816025
Energy: 1.3128325046543947
Energy: 1.2958886635392823
Energy: 1.3053137344489876
Energy: 1.985909591604825
Energy: 1.2989241115912882
Energy: 1.313782785725839
Energy: 1.313921871336411
Energy: 1.2956379241766482
Energy: 1.314365758772162
Energy: 1.8502727279458338
Energy: 1.2965367233571534
Energy: 1.2963250300535902
Energy: 1.2305213995459559
Energy: 1.3104571426827372
Energy: 1.3144156270819407
Energy: 1.5580860620140442
Energy: 1.3068698413151878
Energy: 1.3023197976612426
Energy: 1.2949532730698299
Energy: 1.3128566708831533
Energy: 1.3049529707310923
Energy: 1.5560539912763125
Energy: 1.2806851881039458
Energy: 1.2857565813549365
Energy: 1.2958441052152612
Energy: 1.2852424718100748
Energy: 1.2886371481736547
Energy: 1.460401853542901
Energy: 1.2963334421538615
Energy: 1.2856050521546367
Energy: 1.274541212530556
Energy: 1.3049341391589473
Energy: 1.3141727282678493
Energy: 1.3252854819880788
Energy: 1.2834383929413922
Energy: 1.2839806739532862
Energy: 1.2905929283484339
Energy: 1.316659862763931
Energy: 1.2934073706654272
Energy: 1.3249870502831587
Energy: 1.2726482922548474
Energy: 1.2730972538789755
Energy: 1.2863126097390498
Energy: 1.281956056780111
Energy: 1.27307087351834
Energy: 1.4698380988492954
Energy: 1.3393355653543866
Energy: 1.3086337602639224
Energy: 1.3482109618361615
Energy: 1.3408824545069975
Energy: 1.29252817326923
Energy: 1.3834471990818997
Energy: 1.2820772906223559
Energy: 1.2828301444719445
Energy: 1.2898460533209841
Energy: 1.2702179724348353
Energy: 1.2913939577816451
Energy: 1.383590017859081
Energy: 1.3210807397433193
Energy: 1.314497433597501
Energy: 1.2908704167141614
Energy: 1.3210074902559055
Energy: 1.3256473634173114
Energy: 1.8162071546702157
Energy: 1.3032993729425832
Energy: 1.303483378325196
Energy: 1.2697226607438237
Energy: 1.3052524346320533
Energy: 1.289742231774371
Energy: 1.7707960340185602
Energy: 1.3098174069075783
Energy: 1.3107992406653621
Energy: 1.3156393868385545
Energy: 1.3111904517803208
Energy: 1.3169695428251762
Energy: 1.7740859429600984
Energy: 1.3234356286173
Energy: 1.3114095963376755
Energy: 1.3156050818115606
Energy: 1.3159548768456277
Energy: 1.3020874805411498
Energy: 2.052903013087281
Energy: 1.3147230151846343
Energy: 1.3195751069880686
Energy: 1.3149430878673063
Energy: 1.316106628507283
Energy: 1.3211772373018966
Energy: 2.075024651381866
Energy: 1.310755291927946
Energy: 1.3089622590153813
Energy: 1.2664012163098377
Energy: 1.2817488850367635
Energy: 1.3043175166991865
Energy: 2.07255377404517
Energy: 1.2900062518720614
Energy: 1.281108047380041
Energy: 1.315168470550277
Energy: 1.2931273117477282
Energy: 1.3137489417842738
Energy: 2.0905765344087945
Energy: 1.3008071205114298
Energy: 1.2785292132425872
Energy: 1.245285930399794
Energy: 1.2890622510059675
Energy: 1.285373208337647

minimum gb energy = 1.2177113476484116 eV
minimum distance =  2.39848498828143 Angstroms
sigma value = 33


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

Energy: 2.6506206865831903
Energy: 1.5342242967083164
Energy: 1.4027867451598428
Energy: 1.3798203888873535
Energy: 1.3413289686493768
Energy: 1.548378304895628
Energy: 1.5046608473620613
Energy: 1.3310133273894549
Energy: 1.3462471331649564
Energy: 1.3747382234898344
Energy: 1.3400166829721243
Energy: 1.3681009788985266
Energy: 1.5499301641182843
Energy: 1.3430455725036399
Energy: 1.3747229360046251
Energy: 1.5203776268926061
Energy: 1.34181900310321
Energy: 1.3716156652230522
Energy: 1.5010811914915936
Energy: 1.4846330875522922
Energy: 1.3682021118910521
Energy: 1.505352272686233
Energy: 1.3555670587807622
Energy: 1.4814631507713838
Energy: 1.4154554398155395
Energy: 1.3497030602900757
Energy: 1.3512946573348301
Energy: 1.402914998498201
Energy: 1.350194575809599
Energy: 1.373380096770258
Energy: 2.06071780480274
Energy: 1.350387137166939
Energy: 1.4911836639159792
Energy: 1.5329069883647903
Energy: 1.3827352135860633
Energy: 1.378920433357339
Energy: 1.5359222270767403
Energy: 1.5110152722124781
Energy: 1.5253601351788761
Energy: 1.5212098588605147
Energy: 1.4854325652315221
Energy: 1.5188883909692121
Energy: 1.529352274279056
Energy: 1.5009891907352577
Energy: 1.5025281155025276
Energy: 1.3638502007030187
Energy: 1.5013851035734178
Energy: 1.5008527531932172
Energy: 1.6844961369034814
Energy: 1.5033812033274503
Energy: 1.5112454810019402
Energy: 1.5104661010731784
Energy: 1.5169366368853718
Energy: 1.5107889773922643
Energy: 1.6879796266027207
Energy: 1.4971492942235864
Energy: 1.497362957891139
Energy: 1.5207236471719505
Energy: 1.4969754836479716
Energy: 1.4985716708183994
Energy: 1.5850844570800624
Energy: 1.4393980499487449
Energy: 1.432280426270945
Energy: 1.544311079904338
Energy: 1.3820926327516307
Energy: 1.3042003030319889
Energy: 1.468461669071082
Energy: 1.4309160561022405
Energy: 1.495522730298128
Energy: 1.4699320758292218
Energy: 1.3720432922947545
Energy: 1.4739421175396092
Energy: 1.468758383753504
Energy: 1.5117636795381577
Energy: 1.5084888543095585
Energy: 1.4686118582055487
Energy: 1.5200637350561554
Energy: 1.4990980948807122
Energy: 1.4840821201070518
Energy: 1.505461202311233
Energy: 1.4737531802087351
Energy: 1.4823707921275768
Energy: 1.505208954613917
Energy: 1.4571701173141356
Energy: 1.4879161957117357
Energy: 1.509500134769106
Energy: 1.5083577722330186
Energy: 1.4825022715532554
Energy: 1.5122429641769826
Energy: 1.4777475780597764
Energy: 1.4871268395104529
Energy: 1.5074331353425199
Energy: 1.5092274031600847
Energy: 1.620749063337271
Energy: 1.5136250523067545
Energy: 1.4904232959614063
Energy: 1.8912982770354285
Energy: 1.6404974799629717
Energy: 1.639481209699466
Energy: 1.613322093919192
Energy: 1.638674935100184
Energy: 1.6142959592119086
Energy: 1.8900580572520054
Energy: 1.5077765475910905
Energy: 1.5065134027844491
Energy: 1.5002578989300266
Energy: 1.5015250140286251
Energy: 1.5013628472490677
Energy: 1.724968551216715
Energy: 1.6336169903629718
Energy: 1.6399743727564293
Energy: 1.51027122697551
Energy: 1.6408971887401553
Energy: 1.638357077328688
Energy: 1.5890272785368822
Energy: 1.6383769469412834
Energy: 1.6279805093121196
Energy: 1.6387014141872083
Energy: 1.6395671027736565
Energy: 1.6229372876847001
Energy: 1.4218686067356543
Energy: 1.6046164463665153
Energy: 1.3057152794225422
Energy: 1.3810443013241458
Energy: 1.4613652755877484
Energy: 1.3690364580169732
Energy: 1.4071931199207672
Energy: 1.6065441946047725
Energy: 1.5964103112133958
Energy: 1.374595444978339
Energy: 1.5985988628418322
Energy: 1.6183424524697168
Energy: 1.980230702809677
Energy: 1.600672475974886
Energy: 1.5997699265509504
Energy: 1.634932854708456
Energy: 1.5965345090281948
Energy: 1.6280496360896954
Energy: 1.508842598626838
Energy: 1.6663697019292993
Energy: 1.4886994907443463
Energy: 1.4810655658816396
Energy: 1.6099071063897676
Energy: 1.5045299551805258
Energy: 1.9853276464343317
Energy: 1.491690485068805
Energy: 1.490156136957775
Energy: 1.6356995837310466
Energy: 1.62144228994781
Energy: 1.6285214623627082
Energy: 1.9761992346105706
Energy: 1.4929117768270939
Energy: 1.4926840714937404
Energy: 1.5156298537771085
Energy: 1.6145265923459189
Energy: 1.5100346924986376
Energy: 1.5532280294921494
Energy: 1.484017771464691
Energy: 1.5226891869343726
Energy: 1.5117619878197526
Energy: 1.4645171155274805
Energy: 1.5110209461277868
Energy: 1.511986666953335
Energy: 1.5025968938181846
Energy: 1.500818995761838
Energy: 1.51201508454403
Energy: 1.500506722979841
Energy: 1.519898858414538
Energy: 1.6799794756234006
Energy: 1.502779470376508
Energy: 1.5002215255960434
Energy: 1.5067426682846836
Energy: 1.5002409583949932
Energy: 1.5127725591276857
Energy: 1.6850139207936596
Energy: 1.5061645899681513
Energy: 1.5022033741843253
Energy: 1.5093361847729339
Energy: 1.6625058909192936
Energy: 1.5110406954838933
Energy: 1.8146752090113962
Energy: 1.380389514011851
Energy: 1.3806869291069024
Energy: 1.4803195036523866
Energy: 1.4380334707710416
Energy: 1.4382337710789979
Energy: 1.477944606861539
Energy: 1.3757899425984206
Energy: 1.3754883179232804
Energy: 1.4753199511791482
Energy: 1.4313325200352878
Energy: 1.4578884433110406
Energy: 1.4738607815121911
Energy: 1.4948047048012807
Energy: 1.498012296146256
Energy: 1.4724177970151695
Energy: 1.5001164725111256
Energy: 1.473964099184593
Energy: 1.4773472215158177
Energy: 1.4802869840252775
Energy: 1.4877133328793786
Energy: 1.476647031993296
Energy: 1.505404220092134
Energy: 1.4886213201810925
Energy: 1.4869118295753168
Energy: 1.5260232165457994
Energy: 1.5238265485877807
Energy: 1.4910289755946509
Energy: 1.5298261904040595
Energy: 1.5269788990973912
Energy: 1.4873376849958244
Energy: 1.3873627716172838
Energy: 1.5257226081235564
Energy: 1.4943169358601183
Energy: 1.6535705525551212
Energy: 1.4882285899409786
Energy: 1.8025749958166848
Energy: 1.3880907670766809
Energy: 1.3889042514543342
Energy: 1.359775149024823
Energy: 1.3903306917541485
Energy: 1.3604926405526938
Energy: 1.5423117823465078
Energy: 1.5337109013669405
Energy: 1.39934831519296
Energy: 1.5004260393098556
Energy: 1.3854561129226657
Energy: 1.392526895849507
Energy: 1.8897421387120457
Energy: 1.3815032062704433
Energy: 1.3743222451021695
Energy: 1.5001243319640343
Energy: 1.3787260569862971
Energy: 1.5023535521437597
Energy: 1.3969932033837795
Energy: 1.3881919130707627
Energy: 1.3715007307250746
Energy: 1.375584138779266
Energy: 1.3744716927285374
Energy: 1.3764935456429093
Energy: 1.5085534863899808
Energy: 1.337840183883594
Energy: 1.3791897991804316
Energy: 1.3787073155184901
Energy: 1.337855651600662
Energy: 1.4982276383761028

minimum gb energy = 1.3042003030319889 eV
minimum distance =  2.27575819680388 Angstroms
sigma value = 51


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

Energy: 2.3012408006333382
Energy: 1.388215646305185
Energy: 1.3884381623803403
Energy: 1.3278421478051041
Energy: 1.3734683602318336
Energy: 1.2827566487264384
Energy: 2.0665917611292457
Energy: 1.3736190322889934
Energy: 1.3652094127212977
Energy: 1.3618833296439148
Energy: 1.3735077305174828
Energy: 1.3985849973874622
Energy: 2.0274397698064615
Energy: 1.373277163315409
Energy: 1.3630707157544668
Energy: 1.400531447051407
Energy: 1.373552046619941
Energy: 1.379783654524008
Energy: 2.0278879060498824
Energy: 1.451828674785194
Energy: 1.4516157296356729
Energy: 1.3956103361981926
Energy: 1.399468069980359
Energy: 1.3954971454515244
Energy: 1.9609401978805434
Energy: 1.422412530278988
Energy: 1.3623821543915304
Energy: 1.3662859053642409
Energy: 1.4228880971921352
Energy: 1.3637320037199268
Energy: 1.725211291507798
Energy: 1.4215347979034327
Energy: 1.4173690471069553
Energy: 1.424292576184354
Energy: 1.4221392861083206
Energy: 1.3644163521729544
Energy: 1.7253227665717914
Energy: 1.3617469048159117
Energy: 1.3629516002078328
Energy: 1.4244267403619264
Energy: 1.36539777000409
Energy: 1.3622836519027128
Energy: 1.8656494029420072
Energy: 1.398961313894264
Energy: 1.3988979824856258
Energy: 1.4109243458777407
Energy: 1.4014875837174692
Energy: 1.3991398024665542
Energy: 1.3735409260427298
Energy: 1.4023728124693142
Energy: 1.3988736141457112
Energy: 1.3735436840274016
Energy: 1.4030805321528357
Energy: 1.3806327811403754
Energy: 1.3740847148307591
Energy: 1.3631882137405533
Energy: 1.4011931558840995
Energy: 1.3735120808188221
Energy: 1.3630510145170833
Energy: 1.3622840393677687
Energy: 1.37482584704481
Energy: 1.3913491400499216
Energy: 1.3914206141383791
Energy: 1.3744162376108229
Energy: 1.3857682786473275
Energy: 1.3913542183342862
Energy: 1.47124989377461
Energy: 1.3635822797958144
Energy: 1.3990530785115554
Energy: 1.3765706972370269
Energy: 1.359149910135622
Energy: 1.3631464525090335
Energy: 1.468121422831142
Energy: 1.4415951410334629
Energy: 1.4412385624059714
Energy: 1.3730745883725888
Energy: 1.442993739870887
Energy: 1.374999818362993
Energy: 1.4705766047814408
Energy: 1.3983006421142774
Energy: 1.3978871561569293
Energy: 1.3772154533787602
Energy: 1.4455666621391325
Energy: 1.39763650143982
Energy: 1.858157651395879
Energy: 1.3982616723827952
Energy: 1.3981820386667931
Energy: 1.4374028312247915
Energy: 1.3963957361724604
Energy: 1.4450728105739516
Energy: 1.858777920137327
Energy: 1.3761380993204033
Energy: 1.3980130990973603
Energy: 1.4383805720308975
Energy: 1.37638102106266
Energy: 1.3918348884088905
Energy: 1.9484712797332913
Energy: 1.3761248301517928
Energy: 1.3770743508363648
Energy: 1.3617361289047023
Energy: 1.3756704881048838
Energy: 1.4003835064265218
Energy: 2.195012274637244
Energy: 1.4159150560469373
Energy: 1.3263251316763984
Energy: 1.3983900711303079
Energy: 1.3761766683766052
Energy: 1.3262309101640641

minimum gb energy = 1.2827566487264384 eV
minimum distance =  2.40567830683628 Angstroms
sigma value = 19


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

Energy: 2.0007303624122565
Energy: 1.478774958194946
Energy: 1.478047527541907
Energy: 1.5246638026559913
Energy: 1.2940895756046995
Energy: 1.4786788944084293
Energy: 1.7395818751946703
Energy: 1.29389532055315
Energy: 1.2928122075688175
Energy: 1.415192051778277
Energy: 1.2939514491200994
Energy: 1.2925695256385954
Energy: 2.0500156578965427
Energy: 1.2941724038385256
Energy: 1.2940672562508875
Energy: 1.4064462848663442
Energy: 1.2945239693923631
Energy: 1.2938230492537561
Energy: 1.6042680459741991
Energy: 1.2944575100277047
Energy: 1.2945185166723965
Energy: 1.3844344735495655
Energy: 1.2944238137845294
Energy: 1.2951296454202268
Energy: 1.6175743564955907
Energy: 1.4178587291075633
Energy: 1.4185146271519398
Energy: 1.2667137526735208
Energy: 1.2940302058124462
Energy: 1.343169727611406
Energy: 1.6162955824676226
Energy: 1.2512757731877087
Energy: 1.3928156959011047
Energy: 1.4013814003168121
Energy: 1.251220928014629
Energy: 1.3928809643658038
Energy: 1.6187340349002375
Energy: 1.4051812074546859
Energy: 1.393932904224458
Energy: 1.393892531156947
Energy: 1.2659941268494708
Energy: 1.3938167725188018
Energy: 1.460868833621995
Energy: 1.443383430438208
Energy: 1.443132175769236
Energy: 1.2928933092561534
Energy: 1.4440973843397469
Energy: 1.4431755054984492
Energy: 1.294621964999986
Energy: 1.4433930327545688
Energy: 1.4432225073695992
Energy: 1.2946426125635246
Energy: 1.3587549093331142
Energy: 1.2513352104265845
Energy: 1.2919534396653556
Energy: 1.42102421861064
Energy: 1.2932510698586024
Energy: 1.2927303378724455
Energy: 1.4050264518924882
Energy: 1.2933609705855573
Energy: 1.2910886041718246
Energy: 1.414130061110083
Energy: 1.4142224960895766
Energy: 1.2913667427660087
Energy: 1.383255880737344
Energy: 1.381755712063948
Energy: 1.461520654847012
Energy: 1.3487493227584069
Energy: 1.4204313850077857
Energy: 1.2943264685425742
Energy: 1.406411640464462
Energy: 1.4210315778825013
Energy: 1.2510143014555057
Energy: 1.4663100810447551
Energy: 1.3938340073223838
Energy: 1.2510315134930223
Energy: 1.3958517795415353
Energy: 1.392487168020319
Energy: 1.461491603614209
Energy: 1.3907768873388502
Energy: 1.3915211502772349
Energy: 1.2931727944875624
Energy: 1.3913517508750417
Energy: 1.3922078971305976
Energy: 1.9481538178335793
Energy: 1.2932201284377598
Energy: 1.2936209999009312
Energy: 1.252294361545763
Energy: 1.2939509223519414
Energy: 1.357382706963663
Energy: 1.949938521153502
Energy: 1.2931440523166033
Energy: 1.4434615623517921
Energy: 1.4434510829384737
Energy: 1.292797539632942
Energy: 1.4434476563708987
Energy: 1.6161232767236788
Energy: 1.291731585758494
Energy: 1.2916842339176955
Energy: 1.2665325362960358
Energy: 1.2914875618726336
Energy: 1.2917903072735402
Energy: 1.6044523188526292
Energy: 1.2942007599415777
Energy: 1.294409383199896
Energy: 1.3840067570563508
Energy: 1.2941774868545193
Energy: 1.2938683343316817
Energy: 1.6055783410598137
Energy: 1.2941312489345473
Energy: 1.2939067749087572
Energy: 1.3836762129230689
Energy: 1.2944926075405323
Energy: 1.4208443157039226
Energy: 1.6171774926233147
Energy: 1.2512634243889402
Energy: 1.3438083889003838
Energy: 1.344537205131365
Energy: 1.2510527660653576
Energy: 1.342931654310608
Energy: 1.616055306906845
Energy: 1.4189952499636471
Energy: 1.392406900690657
Energy: 1.3920352039918533
Energy: 1.2953641628738655
Energy: 1.3926045188269474
Energy: 1.6180425244896905
Energy: 1.266992128208378
Energy: 1.4207851961676443
Energy: 1.295793269950172
Energy: 1.2665031599691443
Energy: 1.4208410761197263
Energy: 1.462311342391504
Energy: 1.4431732716220504
Energy: 1.4444568842403884
Energy: 1.4622823418243922
Energy: 1.443582129159503
Energy: 1.4441457375063367
Energy: 1.2939968899014016
Energy: 1.401249804853013
Energy: 1.2935972490469538
Energy: 1.293999152265593
Energy: 1.3835615384447124
Energy: 1.2928867220762583
Energy: 1.2946545571299393
Energy: 1.4214257783184376
Energy: 1.2938552037950841
Energy: 1.294390898341798
Energy: 1.3456227345532326
Energy: 1.2938063437518077
Energy: 1.461714753412583
Energy: 1.3831950825297572
Energy: 1.3830205603724757
Energy: 1.2939472637717173
Energy: 1.3841766745071227
Energy: 1.294761460925802
Energy: 1.6180971022883053
Energy: 1.3455120285812932
Energy: 1.3446694788692486
Energy: 1.2922531450040142
Energy: 1.267301969003303
Energy: 1.4191562283970627
Energy: 1.2510321295744349
Energy: 1.393268208105296
Energy: 1.3928095871258535
Energy: 1.2511424445142445
Energy: 1.3925425922187447
Energy: 1.3931985392042048
Energy: 1.4622359296680434
Energy: 1.3943463622400556
Energy: 1.3937064926061435
Energy: 1.2662303772108836
Energy: 1.3936731616061355
Energy: 1.393921001871069
Energy: 1.9472908569771115
Energy: 1.2934717154637674
Energy: 1.4429470169441054
Energy: 1.4436859115559348
Energy: 1.293160359486053
Energy: 1.4428747844090533

minimum gb energy = 1.2510143014555057 eV
minimum distance =  2.39765038118082 Angstroms
sigma value = 27


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

Energy: 1.6695263884813463
Energy: 1.4057326236164938
Energy: 1.4069370705318558
Energy: 1.2944428905684615
Energy: 1.3231299215530001
Energy: 1.4074833915606306
Energy: 1.3607497895598593
Energy: 1.3215455750858927
Energy: 1.321465365064505
Energy: 1.2638523517096765
Energy: 1.3213928166596816
Energy: 1.2694823909332993
Energy: 1.4516908232995707
Energy: 1.3222786291238666
Energy: 1.3417960073926856
Energy: 1.27770043868519
Energy: 1.3224140836418228
Energy: 1.2618278583562097
Energy: 1.2139530812786437
Energy: 1.2751161338007893
Energy: 1.287457254485421
Energy: 1.2777240264615737
Energy: 1.3225056785424942
Energy: 1.262130274923551
Energy: 1.5618828763857566
Energy: 1.2632166799606117
Energy: 1.2919001881057104
Energy: 1.3025069295835308
Energy: 1.2517398390301355
Energy: 1.287873002338483
Energy: 1.442581503288758
Energy: 1.2605219050037566
Energy: 1.2516686721904566
Energy: 1.4431709046097745
Energy: 1.2581524098994674
Energy: 1.2520179092307249
Energy: 1.322061212334804
Energy: 1.260325546657361
Energy: 1.2611039546642357
Energy: 1.3223453166368344
Energy: 1.2792715351782091
Energy: 1.2548590202753616
Energy: 1.4767422191725617
Energy: 1.2576998051169173
Energy: 1.2584695336297034
Energy: 1.4767970688837417
Energy: 1.2831108885517084
Energy: 1.2573052145498291
Energy: 1.451198999109483
Energy: 1.2722780492042414
Energy: 1.3044083870652314
Energy: 1.3218421221335614
Energy: 1.2726211398258713
Energy: 1.2609644866344047
Energy: 1.4491063402643674
Energy: 1.2807385366546056
Energy: 1.2895582519489501
Energy: 1.290135892444463
Energy: 1.2896395134162877
Energy: 1.2989559844345906
Energy: 1.4519746516581948
Energy: 1.2844651531701656
Energy: 1.2957347320791357
Energy: 1.2898279747302308
Energy: 1.2838595066728054
Energy: 1.3069881234538734
Energy: 1.451090294058923
Energy: 1.2899094017435488
Energy: 1.2815960503171129
Energy: 1.2828518564152256
Energy: 1.2904238164184558
Energy: 1.3051184039675388

minimum gb energy = 1.2139530812786437 eV
minimum distance =  2.4037247672726 Angstroms
sigma value = 9


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

Energy: 1.3214223420703213
Energy: 1.1461886292972088
Energy: 1.0850583498419881
Energy: 1.1295149919680605
Energy: 1.1173016553243333
Energy: 1.0921804192323055
Energy: 1.55561390912689
Energy: 1.1591616758477263
Energy: 1.124527331659873
Energy: 1.1062342293800238
Energy: 1.1472256235535057
Energy: 1.1216430543912237
Energy: 1.2269709855441935
Energy: 1.1587557267452733
Energy: 1.1283921433529545
Energy: 1.1690635046801523
Energy: 1.147310187354594
Energy: 1.1281344505962678
Energy: 1.661488336039945
Energy: 1.1287926456273616
Energy: 1.1332113102121384
Energy: 1.1664715325166217
Energy: 1.1144995831152191
Energy: 1.1286423821977212
Energy: 1.3623480759507862
Energy: 1.1986549381760927
Energy: 1.138274615457313
Energy: 1.1842338989179946
Energy: 1.1194838578542126
Energy: 1.142067084638838
Energy: 1.1745992748547673
Energy: 1.0955586226291396
Energy: 1.1347020695177654
Energy: 1.175729439829485
Energy: 1.0917428274716374
Energy: 1.1329773779761996
Energy: 1.1756563357811276
Energy: 1.1224909536761367
Energy: 1.1316942976399396
Energy: 1.1775748012259946
Energy: 1.1277009709770482
Energy: 1.1718042759565883
Energy: 1.240709525666209
Energy: 1.1135212889186412
Energy: 1.1329753300402652
Energy: 1.2406637210297184
Energy: 1.113661948157493
Energy: 1.2379482192071751
Energy: 1.375267433980398
Energy: 1.145042833290805
Energy: 1.1486399327032044
Energy: 1.189887249320335
Energy: 1.1655012740306974
Energy: 1.1489531758787423
Energy: 1.957913763676309
Energy: 1.1426256714215544
Energy: 1.1371408184379856
Energy: 1.1741805344229166
Energy: 1.1217848383494546
Energy: 1.1345900350343179
Energy: 1.0984172429208878
Energy: 1.1759622584770337
Energy: 1.1455604728621882
Energy: 1.155986788422938
Energy: 1.1750802338486237
Energy: 1.1401792561489559
Energy: 1.5788355757261143
Energy: 1.1759867920353535
Energy: 1.1736023846195878
Energy: 1.1175472629631205
Energy: 1.1753261310842076
Energy: 1.1413367172508286
Energy: 1.5236208387776782
Energy: 1.1602264283986794
Energy: 1.1665772716100145
Energy: 1.15691879320336
Energy: 1.160800711152776
Energy: 1.1669412991279176
Energy: 1.5795767055309886
Energy: 1.152514887937162
Energy: 1.1438063246619463
Energy: 1.1526567907121192
Energy: 1.1690009210591705
Energy: 1.133310867329189
Energy: 1.146088670041953
Energy: 1.0880871353448676
Energy: 1.0847050932186149
Energy: 1.1456525903452341
Energy: 1.0987959964581007
Energy: 1.1877129702784477
Energy: 1.1472284179266912
Energy: 1.113821197373455
Energy: 1.13189694493241
Energy: 1.1472259171228485
Energy: 1.1489684787550942
Energy: 1.1290066665405336
Energy: 1.146267213876442
Energy: 1.1329718340077137
Energy: 1.1361891073989285
Energy: 1.1468362176828408
Energy: 1.1063079471138666
Energy: 1.1165631504832698
Energy: 1.2333666006656054
Energy: 1.1186667529641456
Energy: 1.1289959357367125
Energy: 1.1495596543948559
Energy: 1.11138129023999
Energy: 1.1325035957122167
Energy: 1.2285087081187267
Energy: 1.151276064427
Energy: 1.1074443300678591
Energy: 1.1451779522350771
Energy: 1.1169291646725252
Energy: 1.117692641223794
Energy: 1.2281310916397123
Energy: 1.1138645560759692
Energy: 1.1074005674312046
Energy: 1.1114793515976944
Energy: 1.110062125939885
Energy: 1.1063102556748134
Energy: 1.227219404085416
Energy: 1.1215884865747716
Energy: 1.132328127315062
Energy: 1.1253778029126427
Energy: 1.1344658472872726
Energy: 1.1080983035770604
Energy: 1.3073825143923563
Energy: 1.1239841850630368
Energy: 1.1295046545089202
Energy: 1.1199495677904394
Energy: 1.1373782702579178
Energy: 1.1345150501766994
Energy: 1.4784717185251697
Energy: 1.1598406918118658
Energy: 1.1245971950237657
Energy: 1.1481309060386997
Energy: 1.1475975490785515
Energy: 1.1127938874038554
Energy: 1.2268538311572084
Energy: 1.1593476589347766
Energy: 1.1295884406202097
Energy: 1.19502972545704
Energy: 1.1478625777994456
Energy: 1.1332294285503695
Energy: 1.538269243330821
Energy: 1.1589592683902143
Energy: 1.1547272703560467
Energy: 1.1846173590131817
Energy: 1.148056139138869
Energy: 1.1161247004191996
Energy: 1.5353803059181144
Energy: 1.1340506283422818
Energy: 1.1304846814669087
Energy: 1.188738000654936
Energy: 1.1148006575063913
Energy: 1.1376953406584847
Energy: 1.1559623940312798
Energy: 1.2021305061521979
Energy: 1.2020193923469558
Energy: 1.1570121134990974
Energy: 1.259631280274368
Energy: 1.1148815859467547
Energy: 1.1748874126655404
Energy: 1.1144456149133997
Energy: 1.1395102450828307
Energy: 1.1750594632577696
Energy: 1.1174895259562239
Energy: 1.1465607559681648
Energy: 1.1758078126668783
Energy: 1.1444862933161069
Energy: 1.1413328602938706
Energy: 1.1752953072491998
Energy: 1.168115541707263
Energy: 1.1458754249024432
Energy: 1.2031631410083445
Energy: 1.1379228903264227
Energy: 1.129878266682549
Energy: 1.1964650357015558
Energy: 1.1141655376304243
Energy: 1.1312905349016524
Energy: 1.0983159250272492
Energy: 1.1325056380919238
Energy: 1.1503209952964544
Energy: 1.1888336232703745
Energy: 1.157318002430684
Energy: 1.147503356481712
Energy: 1.9579365054796394
Energy: 1.2450543988163882
Energy: 1.2526743181050533
Energy: 1.1655291888086448
Energy: 1.241553786864726
Energy: 1.118759744569234
Energy: 1.5805877151823955
Energy: 1.174667885433924
Energy: 1.1698796092856858
Energy: 1.1591941883141348
Energy: 1.1780601784391265
Energy: 1.1727266862341676
Energy: 1.209087861184984
Energy: 1.159607442609384
Energy: 1.1417683314581364
Energy: 1.1398412777993483
Energy: 1.1768361668709002
Energy: 1.145964905377806
Energy: 1.3838244296113067
Energy: 1.1461655112159557
Energy: 1.146386263122629
Energy: 1.1683167185876548
Energy: 1.1621662036140195
Energy: 1.1422415623547006
Energy: 1.2086510543381426
Energy: 1.0900947922033233
Energy: 1.1549301728491306
Energy: 1.2163608751910637
Energy: 1.088942674110178
Energy: 1.138149877137943
Energy: 1.1485518439009612
Energy: 1.1541884593478837
Energy: 1.1274091957145944
Energy: 1.1474161925006165
Energy: 1.1803203526533876
Energy: 1.1292566863941351
Energy: 1.146032273475256
Energy: 1.1198449351053148
Energy: 1.1190812058198736
Energy: 1.1461698599381402
Energy: 1.1194848514565774
Energy: 1.124637722546294
Energy: 1.6046010087071823
Energy: 1.1897091306588956
Energy: 1.1388711483313658
Energy: 1.5885007383112049
Energy: 1.301272498372112
Energy: 1.1230922881307417
Energy: 1.311760912874748
Energy: 1.107911778566989
Energy: 1.1101966882370704
Energy: 1.1460637217589666
Energy: 1.1119086674333172
Energy: 1.1127582947944377
Energy: 1.2244415943563272
Energy: 1.1188305241167056
Energy: 1.1188195256620967
Energy: 1.11165756700358
Energy: 1.1379208505651264
Energy: 1.1209912057234723
Energy: 1.2271299520022143
Energy: 1.1401426613313006
Energy: 1.138201877665709
Energy: 1.1798190586681385
Energy: 1.136237094053601
Energy: 1.1354403837542677
Energy: 1.6007659230004676
Energy: 1.1445957190357914
Energy: 1.1199877638060112
Energy: 1.1511736546071463
Energy: 1.1467695947219914
Energy: 1.1039686621283265

minimum gb energy = 1.0847050932186149 eV
minimum distance =  2.39925417262992 Angstroms
sigma value = 57


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

Energy: 1.154600929854887
Energy: 1.0401996924382575
Energy: 0.5938829884803847
Energy: 0.6403034756640222
Energy: 1.0413050929713281
Energy: 1.0360780074360483
Energy: 1.0366788672629277
Energy: 0.9944672961654256
Energy: 0.9832283250391983
Energy: 0.938151537700246
Energy: 1.0289263232035768
Energy: 0.9732749929418772
Energy: 1.298920191421452
Energy: 1.3839970321677977
Energy: 0.95515020577676
Energy: 0.9770077673989082
Energy: 0.9665986598111531
Energy: 1.362282649776573
Energy: 1.300012616888263
Energy: 1.2759553703549327
Energy: 1.0287345740281049
Energy: 1.2368641322086769
Energy: 1.2598690515273456
Energy: 1.2334897697054836
Energy: 1.3024000916887162
Energy: 0.819325592695122
Energy: 0.8195568531652357
Energy: 1.2633034524654376
Energy: 0.5916648044717475
Energy: 1.2383186519126794
Energy: 1.3074337756484344
Energy: 0.8183103904171967
Energy: 0.8181384047777104
Energy: 1.2645051694455915
Energy: 0.5930031189078894
Energy: 0.5944752171581484
Energy: 1.3998545846360606
Energy: 1.2624399443628216
Energy: 1.254549445520531
Energy: 1.2678581545658
Energy: 1.281130779411439
Energy: 1.2550983789558119
Energy: 1.549869207996502
Energy: 1.441798983318223
Energy: 1.4455622289074976
Energy: 1.305215211667638
Energy: 1.4833301899654219
Energy: 1.4881659851219546
Energy: 1.5637830454965236
Energy: 1.435140153962894
Energy: 1.4470825601369297
Energy: 1.493706623349927
Energy: 1.4983878898639527
Energy: 1.4321255813557319
Energy: 0.6405761430869517
Energy: 1.4631444215845915
Energy: 0.5958003583225757
Energy: 0.6415894997369276
Energy: 1.4025064922979515
Energy: 0.5950871823556488
Energy: 0.6405538684632519
Energy: 1.4382490577326301
Energy: 1.4927808345291398
Energy: 0.6203486084591762
Energy: 1.490668828540757
Energy: 0.5944677968241266
Energy: 1.4892643454783243
Energy: 1.4330169645618318
Energy: 1.4737662309576256
Energy: 1.4488745553666926
Energy: 1.4532906393056058
Energy: 1.4282513775869452
Energy: 1.580132122928471
Energy: 1.2963084313035782
Energy: 1.276162154142362
Energy: 1.3121009126436827
Energy: 1.2899035280298252
Energy: 1.4853463050379787
Energy: 1.3177968074884367
Energy: 1.2876250180975675
Energy: 1.287600799025302
Energy: 1.2810574581283314
Energy: 1.2813319296528853
Energy: 1.2548126641365216
Energy: 1.3200408702111108
Energy: 0.5907986851961695
Energy: 0.5911643670629371
Energy: 1.3013450177579031
Energy: 0.8549195090726086
Energy: 0.8187987523177258
Energy: 1.2955865596033378
Energy: 1.2576873623136897
Energy: 1.2422688399529649
Energy: 1.2622066247106338
Energy: 0.8220497292321776
Energy: 1.241682054862067
Energy: 1.2995025592696023
Energy: 1.2352570422050329
Energy: 1.250062813292512
Energy: 1.2433214685240177
Energy: 0.9908127133860888
Energy: 1.2472891098189842
Energy: 1.2913027663152217
Energy: 0.936987111623735
Energy: 0.9492568086065921
Energy: 0.9667923525779143
Energy: 0.9481827715928818
Energy: 1.2356183329541137
Energy: 1.0355256198548046
Energy: 0.9841542830129156
Energy: 0.9833992194227367
Energy: 0.5916609743274381
Energy: 0.9907650430996309
Energy: 0.9835141670431621

minimum gb energy = 0.5907986851961695 eV
minimum distance =  2.3788099167293 Angstroms
sigma value = 11


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

Energy: 1.7882331228550403
Energy: 0.8664107165256907
Energy: 1.442172289926565
Energy: 1.524506551218287
Energy: 1.1503959301916367
Energy: 1.117042191164828
Energy: 0.944607328815953
Energy: 0.8810104918957089
Energy: 0.8719432947683073
Energy: 0.8687563848603334
Energy: 0.8702025848114434
Energy: 0.8683440576115957
Energy: 0.9343704265532036
Energy: 0.8729599391668922
Energy: 0.8706319647111147
Energy: 0.9031572494353527
Energy: 0.8993570757365931
Energy: 0.8704960441701717
Energy: 0.9351347525551902
Energy: 0.8695548822921315
Energy: 0.8830700690539709
Energy: 0.9330718973428278
Energy: 0.8702319823600116
Energy: 0.8812394721611784
Energy: 0.9211531345984574
Energy: 0.976657541307867
Energy: 0.993386215967721
Energy: 0.8712710232140382
Energy: 0.9766293026985764
Energy: 0.8707232076612376
Energy: 0.9855785969868532
Energy: 0.9805870051625721
Energy: 0.9831697889257182
Energy: 1.0288703897866662
Energy: 0.9957630288501369
Energy: 1.0790648149166213
Energy: 0.9870902118073323
Energy: 0.8753601635062691
Energy: 0.8732292212696685
Energy: 0.8768518722331993
Energy: 1.042231732701051
Energy: 0.877726667754972
Energy: 0.9511853597720852
Energy: 1.0649521609511379
Energy: 1.0646369314648694
Energy: 0.8770027327048802
Energy: 1.11050848344115
Energy: 0.8945297553992622
Energy: 1.3052382150381139
Energy: 0.8766736420440103
Energy: 0.8815678442207715
Energy: 0.8808513317543595
Energy: 0.868237741725778
Energy: 0.8807143844783961
Energy: 1.3792961061815074
Energy: 0.9703474141470246
Energy: 0.972204293059012
Energy: 0.9236816272777455
Energy: 1.1693916358615601
Energy: 0.9775490425944728
Energy: 1.7104160529391017
Energy: 0.9739413512447579
Energy: 0.966918896443781
Energy: 0.9732073061522926
Energy: 1.0192302503583226
Energy: 0.9774216026620137
Energy: 1.3119763760578573
Energy: 0.8875323980418431
Energy: 0.8815922458148198
Energy: 0.8716012426706192
Energy: 0.8777714334456517
Energy: 0.9156971372519586
Energy: 1.2672079564548877
Energy: 0.8923200884242033
Energy: 0.8829305931080298
Energy: 1.2216216123190882
Energy: 0.8799903083109488
Energy: 0.8869938452531079
Energy: 1.2743135747206507
Energy: 1.0752846969692205
Energy: 1.069689718249024
Energy: 1.1849027237073555
Energy: 1.0877097141554217
Energy: 1.0710216442080283
Energy: 1.303011313711925
Energy: 1.073236880882896
Energy: 1.114225771153
Energy: 1.2465296226428393
Energy: 0.9210828013805341
Energy: 1.2735964714800387
Energy: 1.6983018814567106
Energy: 1.075257355103149
Energy: 1.0733456327307378
Energy: 1.0147190372434407
Energy: 1.0743578604413557
Energy: 1.0720766880545392
Energy: 1.644888166699422
Energy: 1.3244091600759482
Energy: 0.8878030560888373
Energy: 0.8739632711024488
Energy: 1.3703365145560626
Energy: 0.8848382572766237
Energy: 1.7429284373303253
Energy: 0.9807356039093043
Energy: 1.0777946891056922
Energy: 0.9145329638964016
Energy: 1.1643197029314891
Energy: 1.0767515628636717
Energy: 1.7164230350257086
Energy: 0.8823103025772118
Energy: 0.9839412552756372
Energy: 0.9005859654791177
Energy: 1.1946608364876294
Energy: 0.9823931937420813
Energy: 1.308384731511139
Energy: 0.9063858245367621
Energy: 0.9087941992958759
Energy: 0.8716583717737267
Energy: 1.2614188659655337
Energy: 1.1057250535480785
Energy: 1.6979577021134524
Energy: 0.971156148011463
Energy: 0.9674918368331622
Energy: 1.0132037293916845
Energy: 1.076511406598761
Energy: 0.9689895908379074
Energy: 1.5464650438126508
Energy: 1.059093621133269
Energy: 1.0489898960536679
Energy: 1.1918859667625386
Energy: 0.8795932399331258
Energy: 1.1186482869055798
Energy: 1.0778201923510815
Energy: 0.9722666398984701
Energy: 0.9720402104424095
Energy: 0.973081873706347
Energy: 0.9786088009297332
Energy: 0.970637603476026
Energy: 1.079353473608786
Energy: 0.8757994652835088
Energy: 0.8722478514361681
Energy: 1.0790965561962655
Energy: 0.8745447247246172
Energy: 0.87210922897364
Energy: 0.926754763114119
Energy: 0.8856073853664999
Energy: 0.8778722110156258
Energy: 0.8713554846079788
Energy: 0.8776711327750976
Energy: 0.8800907707816068
Energy: 1.6617066270895289
Energy: 0.8683626236544151
Energy: 0.868117709896307
Energy: 1.1601636408804068
Energy: 1.0245917412565746
Energy: 0.8707767499942178

minimum gb energy = 0.8664107165256907 eV
minimum distance =  2.42164749068911 Angstroms
sigma value = 41


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

Energy: 2.156977467837435
Energy: 1.702343470561536
Energy: 1.4068122843299802
Energy: 1.4764215571881723
Energy: 1.4608185870924313
Energy: 1.4768066767953603
Energy: 1.027692820134839
Energy: 0.927343538455661
Energy: 0.9249773817670786
Energy: 0.9287097496755395
Energy: 0.9235496165682924
Energy: 0.9274435711967535
Energy: 0.9953836561456842
Energy: 0.9290989297859537
Energy: 0.9293944964331898
Energy: 0.930010956627725
Energy: 0.9286087087064521
Energy: 0.9297794872064086
Energy: 0.9898876564227046
Energy: 0.9286104010201774
Energy: 0.9389132834077393
Energy: 0.9490453609987777
Energy: 0.9297029161701574
Energy: 0.9277249399373229
Energy: 0.986691961540765
Energy: 0.935494353859047
Energy: 0.9359837896423812
Energy: 1.1458963028399125
Energy: 0.9344241336629501
Energy: 0.9274478269512919
Energy: 1.487402417129268
Energy: 0.9343508947225159
Energy: 0.9398155518438227
Energy: 1.1544373089806579
Energy: 0.9403688836766495
Energy: 0.9363292145191204
Energy: 1.0820914185570905
Energy: 0.934083629388319
Energy: 0.9246794890575549
Energy: 0.9280355810093458
Energy: 1.1818400214297236
Energy: 0.9281613885421421
Energy: 1.0300342541968768
Energy: 1.1854236746349287
Energy: 1.2318406998215579
Energy: 0.9457577075840217
Energy: 1.188183201015772
Energy: 0.9439306833371616
Energy: 1.487365269995124
Energy: 0.933298631845352
Energy: 0.9280707756223879
Energy: 0.927727504976155
Energy: 1.1864350286307783
Energy: 0.9278466171749239
Energy: 1.0853530065034527
Energy: 1.3755971186902827
Energy: 1.1482536816560647
Energy: 0.9405820562550421
Energy: 1.385255665052024
Energy: 0.9272601483471531
Energy: 1.0859561438091
Energy: 1.1776032780463765
Energy: 0.9347480318737365
Energy: 0.9564569563028351
Energy: 1.3796463388381681
Energy: 0.9313254113936126
Energy: 1.4871646860533811
Energy: 0.9391451652734535
Energy: 0.9320639533169506
Energy: 1.385350385807887
Energy: 0.9607079642257278
Energy: 0.9351376838541492
Energy: 1.1813083362250263
Energy: 0.9317490784370144
Energy: 0.9441932732092191
Energy: 1.3854203400988723
Energy: 0.9346245798862468
Energy: 0.9378568419320585
Energy: 1.1876068415230971
Energy: 0.9279195270785714
Energy: 0.9275008680961985
Energy: 1.1889499314280156
Energy: 0.9339646469849736
Energy: 0.9278444766494732
Energy: 1.2330588078279128
Energy: 0.9282568077818103
Energy: 1.221906267608628
Energy: 1.2334019663251576
Energy: 0.9273289887954005
Energy: 1.1940715073686696
Energy: 0.9888033941101282
Energy: 0.928302385585878
Energy: 0.9341018160644042
Energy: 0.9280534478961585
Energy: 0.9282239270126
Energy: 0.9340742999108401
Energy: 1.6076045979894156
Energy: 0.9287909488316302
Energy: 1.3322294085772601
Energy: 0.960189937340271
Energy: 0.9241715145175391
Energy: 0.9480784532331651
Energy: 1.0235334516295793
Energy: 0.9236806352276762
Energy: 0.9268192872081431
Energy: 1.189670401150753
Energy: 1.1420910597972111
Energy: 0.9311711791202144
Energy: 0.9904861145106758
Energy: 0.9290113085674745
Energy: 0.9340621102059097
Energy: 0.9295826811067616
Energy: 0.9287486622799146
Energy: 0.9332554365666877
Energy: 0.9947588282917512
Energy: 0.9285487431957352
Energy: 0.9339692318069043
Energy: 0.9305230375416093
Energy: 0.934669894453284
Energy: 0.9341650643481227
Energy: 0.9884474898230695
Energy: 0.9258628509029212
Energy: 0.9255688871135423
Energy: 0.9341802381069471
Energy: 0.9249965325285967
Energy: 0.925235289003544
Energy: 1.6233759203454086
Energy: 0.9395998572603961
Energy: 0.9324106641349617
Energy: 1.2800023128920768
Energy: 0.9383480870169907
Energy: 1.1464434859298918
Energy: 1.4902159023394732
Energy: 0.9256389439135112
Energy: 0.9347076531162698
Energy: 0.928061955170581
Energy: 0.928985040623194
Energy: 0.9346974206234873
Energy: 1.0301471375025324
Energy: 0.9334302930818484
Energy: 1.2202924422682695
Energy: 0.9445432871214029
Energy: 1.1850611804087738
Energy: 0.9439985190540297
Energy: 1.48774271188611
Energy: 0.9343063477271351
Energy: 0.9285171476403761
Energy: 0.9323320202283231
Energy: 1.1894624908919165
Energy: 0.9270784552527301
Energy: 1.086050617152934
Energy: 1.1856534057314383
Energy: 0.9343579467062444
Energy: 0.9575406714610334
Energy: 1.3793397479664722
Energy: 0.9317989243329426
Energy: 1.0858910766461436
Energy: 1.3759276208209104
Energy: 1.1849655675697202
Energy: 0.9564583160546665
Energy: 1.385578893588416
Energy: 0.934851495991448
Energy: 1.490272274808958
Energy: 0.9325885859796217
Energy: 0.9313198435872471
Energy: 1.161011378991409
Energy: 0.9692409308319919
Energy: 0.9319682623102129
Energy: 1.1814939142729293
Energy: 0.9332295635423589
Energy: 0.9307473599627901
Energy: 1.1814874079913802
Energy: 0.933634222333719
Energy: 0.9436104364821868
Energy: 1.1869632099538099
Energy: 0.933467562973213
Energy: 0.9329178230341773
Energy: 1.1875183038404897
Energy: 0.9324745874963105
Energy: 0.9316834577856913
Energy: 1.1888655818068787
Energy: 0.9291863884745544
Energy: 0.9336901057933691
Energy: 1.1888498059842803
Energy: 0.9285739193664689
Energy: 0.934066973000519
Energy: 0.9897622418161318
Energy: 0.9338021556315675
Energy: 0.9340298623912486
Energy: 1.1880195365984638
Energy: 0.9541788749633736
Energy: 0.929663699440316
Energy: 1.1556642399919028
Energy: 1.1519878431062247
Energy: 0.9231718274013855
Energy: 0.9871948990496269
Energy: 1.1455860047024935
Energy: 0.9225024366170925

minimum gb energy = 0.9225024366170925 eV
minimum distance =  2.42412657232053 Angstroms
sigma value = 33


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

Energy: 1.2127084060142344
Energy: 1.6318240399460517
Energy: 1.6335230513897376
Energy: 1.0766227670079975
Energy: 1.397600103014325
Energy: 1.636498057415222
Energy: 1.1225293225130335
Energy: 0.99745744330815
Energy: 1.0020657248587679
Energy: 0.9964714341205546
Energy: 1.0137397656799707
Energy: 1.0019728947353015
Energy: 1.076069692338323
Energy: 1.0145448118245448
Energy: 0.9970510390919756
Energy: 1.0226158698491612
Energy: 1.0267163214451291
Energy: 0.9981920080521665
Energy: 1.0755789431718734
Energy: 1.0046065311420185
Energy: 1.003464209285434
Energy: 1.0280286964083523
Energy: 1.0261244236808782
Energy: 1.0028067465772357
Energy: 1.3456455174362754
Energy: 1.02614896401941
Energy: 1.0189251564144548
Energy: 1.2997090235056648
Energy: 1.0596966196005602
Energy: 1.0028203561288855
Energy: 1.116405686989497
Energy: 1.0338108960989596
Energy: 1.0326817905413523
Energy: 1.3069085503214413
Energy: 1.0266738542252838
Energy: 1.030487695752193
Energy: 1.1190271240285266
Energy: 1.0122667648783894
Energy: 1.0090982585737696
Energy: 0.99915786363268
Energy: 1.0107729195587578
Energy: 1.013999016164483
Energy: 1.1196585494817055
Energy: 1.3109172196891112
Energy: 1.0071905997461978
Energy: 1.031898132297205
Energy: 1.370665368995223
Energy: 0.9965187462073093
Energy: 1.124982007067779
Energy: 1.016066672837404
Energy: 1.0162773769983304
Energy: 1.0024495972557237
Energy: 1.0199889635405157
Energy: 1.016483499987024
Energy: 1.1173514044894115
Energy: 1.3101548671580996
Energy: 1.3074944646112623
Energy: 1.026159284701537
Energy: 1.3049029970943375
Energy: 0.9969576105204003
Energy: 1.1159322987408056
Energy: 1.0119902690787523
Energy: 1.0126746108429463
Energy: 1.0223351734989627
Energy: 1.298766268583444
Energy: 1.0107232930734795
Energy: 1.1166705594055177
Energy: 0.9981913923961258
Energy: 1.019985806514959
Energy: 1.3043313438995165
Energy: 1.0389695724438361
Energy: 1.0036707460047003
Energy: 1.3475492045078878
Energy: 0.9964099535080111
Energy: 0.9985656524140978
Energy: 1.3065826682195716
Energy: 1.0303779568763474
Energy: 1.0276331272295747
Energy: 1.0820042197127109
Energy: 1.010136760015996
Energy: 1.0097851065964574
Energy: 1.0273319526147744
Energy: 0.9982417121773428
Energy: 1.0099626792175715
Energy: 1.0264550889838997
Energy: 1.1109990927020663
Energy: 1.0105380334171583
Energy: 1.1104394892787366
Energy: 1.1106770971221862
Energy: 0.9991479867610177
Energy: 1.0763762968604484
Energy: 0.9998643855405333
Energy: 1.0133614768943628
Energy: 1.0004154389646018
Energy: 1.0173686004839047
Energy: 1.0130834074363546
Energy: 1.1987083353997736
Energy: 1.3041317515285515
Energy: 1.0180131323458235
Energy: 1.0254205846915452
Energy: 1.303581009701282
Energy: 1.0120447986417447
Energy: 1.1981341571776574
Energy: 0.9991435656471531
Energy: 0.9974947968878028
Energy: 1.0197883983441909
Energy: 1.2968415698449742
Energy: 1.0052011598449304
Energy: 1.074580796526813
Energy: 1.0060469535828505
Energy: 1.0069053743484293
Energy: 1.3051737711147298
Energy: 1.028949697970317
Energy: 1.0219381985133325
Energy: 1.3062318883603274
Energy: 1.0071030575931448
Energy: 1.0157606289103744
Energy: 1.3054536252939835
Energy: 1.0031465253641612
Energy: 1.0216113702752436
Energy: 1.0185105948659192
Energy: 1.0008212229249431
Energy: 1.00628742333101
Energy: 1.0194359032972633
Energy: 1.0105499230298651
Energy: 1.0068275689316175
Energy: 1.3459024200607252
Energy: 1.000222432011255
Energy: 1.3152095222702243
Energy: 1.3450653262281431
Energy: 0.9993194377454021
Energy: 1.3153947788579492
Energy: 1.0659266026334209
Energy: 0.9970743668145959
Energy: 1.0043830066141946
Energy: 1.0031367367532522
Energy: 1.0001491738932218
Energy: 1.0023710710383638
Energy: 1.1582439000067861
Energy: 1.320420882269298
Energy: 1.5797873292343312
Energy: 1.0257231345959663
Energy: 1.3092681803358344
Energy: 1.0222496019377585
Energy: 1.123587161348962
Energy: 0.9976893203446717
Energy: 1.0011292778931566
Energy: 1.0243137734874863
Energy: 1.0124676366893437
Energy: 0.9998644519726566
Energy: 1.076047911688452
Energy: 1.0161466002755815
Energy: 1.006523957003685
Energy: 1.0170654195107967
Energy: 1.0214482795493443
Energy: 0.998641038009761
Energy: 1.0753493214066459
Energy: 1.009811192876589
Energy: 1.00226734142322
Energy: 1.0285137418613772
Energy: 0.999246037709003
Energy: 0.9988952556594167
Energy: 1.0585841113761667
Energy: 1.0049519694795879
Energy: 0.9968974665472721
Energy: 1.010577950650573
Energy: 1.0261431035013326
Energy: 0.9977381878578088
Energy: 1.3440757594104198
Energy: 1.0315497294455072
Energy: 1.0303434296862897
Energy: 1.2988921781354128
Energy: 1.0267812163646193
Energy: 1.0197681950376098
Energy: 1.1238052804533556
Energy: 1.010458318323932
Energy: 1.008897144507041
Energy: 0.993344976948599
Energy: 1.003251160771393
Energy: 1.011739216617368
Energy: 1.1199640240109983
Energy: 1.3492230228321913
Energy: 1.0277952016081358
Energy: 0.9995708482401977
Energy: 1.3057670375143566
Energy: 0.9962427041294021
Energy: 1.115560597855302
Energy: 1.0119105135717308
Energy: 1.0169437042808172
Energy: 1.0000371578108307
Energy: 1.021108702509916
Energy: 1.0173581548966482
Energy: 1.1174303469840996
Energy: 1.3097038084252994
Energy: 1.0191929151434138
Energy: 1.021955762191113
Energy: 1.3054065642957215
Energy: 1.0080567033271415
Energy: 1.1167933397451388
Energy: 1.298813361857874
Energy: 1.0201988573528706
Energy: 1.02951465707644
Energy: 1.3081221244427328
Energy: 0.9986685241073783
Energy: 1.1176482535640873
Energy: 1.0394321049606852
Energy: 1.0359298764952194
Energy: 1.2991239335468217
Energy: 0.9967967577142867
Energy: 0.9990486238773619
Energy: 1.3453927273742212
Energy: 0.9961165632234639
Energy: 0.9984923172397139
Energy: 1.3036625853609052
Energy: 1.0272436888328909
Energy: 1.0018726886199574
Energy: 1.0774194280021874
Energy: 1.0006382873669906
Energy: 1.0007128398720617
Energy: 1.0270328660484813
Energy: 1.0087599843859494
Energy: 1.000571357478184
Energy: 1.091459258505901
Energy: 1.0181990040415823
Energy: 0.9988274796971891
Energy: 1.0898776058144255
Energy: 1.0119078054864314
Energy: 0.9997621487132111
Energy: 1.0779432659526427
Energy: 1.000189568856144
Energy: 1.0091779447152862
Energy: 0.9968475513629308
Energy: 1.0202582527901332
Energy: 1.008853738727311
Energy: 1.1991579074665688
Energy: 1.306224861025317
Energy: 1.3038465049451131
Energy: 1.062148345731348
Energy: 1.3038719889054122
Energy: 1.0269886842362341
Energy: 1.1992282294245409
Energy: 0.9904389224065223
Energy: 1.0062734378517606
Energy: 1.0302758422984182
Energy: 1.2978591795744594
Energy: 1.006321106213462
Energy: 1.07426705611675
Energy: 1.0089976917900487
Energy: 1.0094073647797512
Energy: 1.304740553886978
Energy: 1.0056989537682384
Energy: 1.001889914856333
Energy: 1.3047161984691076
Energy: 1.0016681078617105
Energy: 1.0088573068921756
Energy: 1.304854536862609
Energy: 1.0035297601709718
Energy: 1.0243330303895095
Energy: 1.0265065131884936
Energy: 1.0054995384492529
Energy: 1.0053900014955035
Energy: 1.0278957599933092
Energy: 1.0073157097770151
Energy: 1.0055187963804588
Energy: 1.352096556020812
Energy: 0.9992127055581029
Energy: 1.0008505611195315
Energy: 1.3525996949056411
Energy: 1.0042131063674489
Energy: 1.3487826102610483
Energy: 1.0678633321889224
Energy: 1.000474938492777
Energy: 0.9998617722607123
Energy: 1.0005892296176726
Energy: 1.0007875097674992
Energy: 1.0094657381749483
Energy: 1.1036842688104758
Energy: 1.3065819075468283
Energy: 1.579756134701753
Energy: 1.0261258706552887
Energy: 1.3041718889274485
Energy: 1.0012137233083673

minimum gb energy = 0.9904389224065223 eV
minimum distance =  2.4219519363044 Angstroms
sigma value = 67


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

Energy: 1.6613104351496812
Energy: 1.1680073151926265
Energy: 1.2175876650025896
Energy: 1.217319392463028
Energy: 1.154569128440856
Energy: 1.2179952083130632
Energy: 1.2183529731487635
Energy: 1.0880974690910983
Energy: 1.1072462633736533
Energy: 1.0744634455923519
Energy: 1.0887561068668308
Energy: 1.088193483246908
Energy: 1.1335937238008325
Energy: 1.0700395321529679
Energy: 1.0538809836508214
Energy: 1.0855334808029784
Energy: 1.0702422387219501
Energy: 1.0535837678586968
Energy: 1.1323094484793268
Energy: 1.054936083540474
Energy: 1.053774827793595
Energy: 1.0614115690902446
Energy: 1.0619291699747335
Energy: 1.0540890250122648
Energy: 1.1496461751913645
Energy: 1.0869203309526088
Energy: 1.0869403524442414
Energy: 1.0934912642394816
Energy: 1.087503891571456
Energy: 1.0868578609815414
Energy: 1.1471401987987522
Energy: 1.1061857935260726
Energy: 1.0887516291371548
Energy: 1.090345920652512
Energy: 1.109024821934529
Energy: 1.0889845209691582
Energy: 1.2186312639494028
Energy: 1.0860994523975398
Energy: 1.1006119032633552
Energy: 1.0682093823740888
Energy: 1.087962490874466
Energy: 1.1085245049648074

minimum gb energy = 1.0535837678586968 eV
minimum distance =  2.42113334448147 Angstroms
sigma value = 3


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

Energy: 1.6817746222064762
Energy: 1.6785926429720068
Energy: 1.1986270501212135
Energy: 1.4689540286987626
Energy: 2.384463447364075
Energy: 1.1522293995500337
Energy: 1.1939005253642174
Energy: 1.2904137610664324
Energy: 1.2927140083481405
Energy: 1.2468092738661836
Energy: 1.2376777461169404
Energy: 1.2153167971260288
Energy: 1.3098823188567963
Energy: 1.177299589800643
Energy: 1.2158950712177552
Energy: 1.310736278035304
Energy: 1.1682464520069478
Energy: 1.2432731839406619
Energy: 1.225182677416664
Energy: 1.2207142385761114
Energy: 1.2216865548924154
Energy: 1.2244057154629655
Energy: 1.1919168647098934
Energy: 1.2282235874539238
Energy: 1.2082225787433511
Energy: 1.173770893614385
Energy: 1.1726563615474275
Energy: 1.2079542574669118
Energy: 1.1718725386075142
Energy: 1.1832302011065374
Energy: 1.2052439692009218
Energy: 1.1496244365220847
Energy: 1.175732515308899
Energy: 1.1599510175370142
Energy: 1.1750327686270763
Energy: 1.175856611202361
Energy: 1.2135622445687717
Energy: 1.1544926466718555
Energy: 1.1554335406827523
Energy: 1.1864790727643852
Energy: 1.1373547511487436
Energy: 1.1688582743338616
Energy: 1.3717978097580972
Energy: 1.2206919933710176
Energy: 1.3785823589594604
Energy: 1.2458562075434414
Energy: 1.310002883169339
Energy: 1.2375667119648759
Energy: 1.204139831805175
Energy: 1.1734759804840922
Energy: 1.2113620415030866
Energy: 1.1611964595603734
Energy: 1.177470189823758
Energy: 1.2108729164215357
Energy: 1.5497888688919077
Energy: 1.2533240374597474
Energy: 1.2476700970747487
Energy: 1.3082177532360908
Energy: 1.2494000489897918
Energy: 1.1869702984954529
Energy: 1.2495494818538524
Energy: 1.1988560398756893
Energy: 1.1775069209240772
Energy: 1.1810764034073904
Energy: 1.1463331775481715
Energy: 1.1682284653534898
Energy: 1.250746680278453
Energy: 1.1609739077650905
Energy: 1.1805232510399095
Energy: 1.153926080957909
Energy: 1.1547235217193381
Energy: 1.1715056310009628
Energy: 1.1966815420645815
Energy: 1.1373930593351425
Energy: 1.1473975440030675
Energy: 1.130112585063879
Energy: 1.1728155283790238
Energy: 1.1501688078858083
Energy: 1.2138060188937876
Energy: 1.266092628935785
Energy: 1.2652149720208272
Energy: 1.2715594451225358
Energy: 1.2794848550271216
Energy: 1.2694971283317653
Energy: 1.2552019243144525
Energy: 1.448551272190718
Energy: 1.4498256539081096
Energy: 1.1401834536413684
Energy: 1.3560893570517953
Energy: 1.25451444941128
Energy: 1.364714146118575
Energy: 1.2127853987027049
Energy: 1.2177087997748879
Energy: 1.223320702438899
Energy: 1.241749389365463
Energy: 1.2192349782222673
Energy: 1.3735539595764672
Energy: 1.2389845474334504
Energy: 1.2498604675907194
Energy: 1.184028719559187
Energy: 1.2371857760551876
Energy: 1.2213207124026106
Energy: 1.354112791720251
Energy: 1.2222166074338754
Energy: 1.2173014442248056
Energy: 1.2495294840839615
Energy: 1.2233852616337941
Energy: 1.217877948986034
Energy: 1.426482733335216
Energy: 1.2372711158378145
Energy: 1.2240602833456777
Energy: 1.2506936390362826
Energy: 1.3244182518380054
Energy: 1.2574156618622407
Energy: 1.3050866974044486
Energy: 1.2193439356034028
Energy: 1.2389120441160977
Energy: 1.246593044457364
Energy: 1.2485693088577752
Energy: 1.257525708817218
Energy: 1.1820221533849542
Energy: 1.1155714408232036
Energy: 1.1101246767578896
Energy: 1.1060589482003864
Energy: 1.1509773545386734
Energy: 1.147157112274354
Energy: 1.185260120183655
Energy: 1.291187335695651
Energy: 1.1518775554220553
Energy: 1.1314211271093033
Energy: 1.1487745716565758
Energy: 1.121842314248047
Energy: 1.2344381963181736
Energy: 1.1183035737368185
Energy: 1.125446029021642
Energy: 1.2119828418633019
Energy: 1.1062720101453896
Energy: 1.1096208287097091
Energy: 1.2495380108772727
Energy: 1.2418304577781758
Energy: 1.2222277404454847
Energy: 1.2522334493562157
Energy: 1.222477938290531
Energy: 1.3471623606541485
Energy: 1.2285388705472342
Energy: 1.2196443171376006
Energy: 1.2258421921450506
Energy: 1.245355018542417
Energy: 1.235319920634985
Energy: 1.2168975333821408
Energy: 1.4293748692381647
Energy: 1.285088403046512
Energy: 1.1948079327317536
Energy: 1.1970571361532332
Energy: 1.2644101984506544
Energy: 1.2007973240508791
Energy: 1.209158843822898
Energy: 1.2740073163097696
Energy: 1.3142113755179614
Energy: 1.1812599281946923
Energy: 1.2957109368008504
Energy: 1.184044923808289
Energy: 1.2287090445985396
Energy: 1.2254980532370479
Energy: 1.2141163997849604
Energy: 1.229818569870593
Energy: 1.2347369284934455
Energy: 1.2343505099343228
Energy: 1.2279189671615618
Energy: 1.1894651211915743
Energy: 1.1892634708575784
Energy: 1.2294497263514423
Energy: 1.193468731141001
Energy: 1.3069318561882661
Energy: 1.2610651830295103
Energy: 1.234372965559182
Energy: 1.25749474093567
Energy: 1.214751389081345
Energy: 1.2657283886462918
Energy: 1.2375901082141965
Energy: 1.207497662085076
Energy: 1.3040757482265306
Energy: 1.1707977504560576
Energy: 1.1605980081584732
Energy: 1.3601141437473347
Energy: 1.1625517054116363
Energy: 1.2080561433341803
Energy: 1.152144723051972
Energy: 1.1598499407895588
Energy: 1.1518807548982608
Energy: 1.1542565682243588
Energy: 1.1620728376303189
Energy: 1.374985075925872
Energy: 1.187394006197407
Energy: 1.1416895246992451
Energy: 1.2462574243400657
Energy: 1.248600445297313
Energy: 1.2552608058969708
Energy: 1.4029714472470804
Energy: 1.307650478058659
Energy: 1.1543079864417147
Energy: 1.238735668259564
Energy: 1.237682233370288
Energy: 1.2182633624912933
Energy: 1.2052736620244275
Energy: 1.1908370539628694
Energy: 1.1923631141308935
Energy: 1.1867826694304573
Energy: 1.2050653716640547
Energy: 1.1682717191651915
Energy: 1.252986528173169
Energy: 1.2543018025487755
Energy: 1.2713568008439318
Energy: 1.4096329401236172
Energy: 1.24939329090701
Energy: 1.2114107173918345
Energy: 1.2512584408854859
Energy: 1.1542006229652892
Energy: 1.1514143955581433
Energy: 1.154262865166857
Energy: 1.1694668270049446
Energy: 1.1588868869634514
Energy: 1.1964531162736578
Energy: 1.3928920235595335
Energy: 1.3928643902589237
Energy: 1.152811760042007
Energy: 1.173584248562301
Energy: 1.3755250840052893
Energy: 1.428306718949759
Energy: 1.1952863942102858
Energy: 1.1791446130773744
Energy: 1.1327606330169098
Energy: 1.2047218483666093
Energy: 1.142202605666097
Energy: 1.2534967482248947
Energy: 1.2228547970468084
Energy: 1.2499117760543257
Energy: 1.201384272558265
Energy: 1.2296631151341895
Energy: 1.2204638201283162
Energy: 1.365306988417588
Energy: 1.214096877475833
Energy: 1.2325927844106945
Energy: 1.2249654054351724
Energy: 1.2235190685508168
Energy: 1.219902399305224
Energy: 1.3643964341585317
Energy: 1.2148511447230939
Energy: 1.225066154895732
Energy: 1.1913575786943693
Energy: 1.2294381331321393
Energy: 1.3379549443657384
Energy: 1.5825640067198294
Energy: 1.2240661155115595
Energy: 1.2209290179437522
Energy: 1.2637704633137137
Energy: 1.2250508410880767
Energy: 1.2167786658365856
Energy: 1.3715248942394536
Energy: 1.231987810169591
Energy: 1.2256139162483635
Energy: 1.2269018430318457
Energy: 1.230740542825026
Energy: 1.2262130154620594
Energy: 1.3097804409932998
Energy: 1.4659451428721104
Energy: 1.3980910195532403
Energy: 1.2845583196841446
Energy: 1.2718446754661563
Energy: 1.391732148737765
Energy: 1.2367819330732783
Energy: 1.1766245170663228
Energy: 1.1353357184527406
Energy: 1.1075245656290327
Energy: 1.2014372320862001
Energy: 1.1306795153676326
Energy: 1.1850806341967457
Energy: 1.1368470945185594
Energy: 1.110356531546465
Energy: 1.128041337901548
Energy: 1.115263623667788
Energy: 1.1181267996771376
Energy: 1.182276939855936
Energy: 1.1174494303348388
Energy: 1.1166737549039936
Energy: 1.206664737004675
Energy: 1.1286155786512753
Energy: 1.1169085354619608
Energy: 1.249185470040544
Energy: 1.2222787778545603
Energy: 1.2209059755870275
Energy: 1.2485045883945463
Energy: 1.227767203485839
Energy: 1.2170554373110705
Energy: 1.2285021498825965
Energy: 1.2254521700043035
Energy: 1.231020603770158
Energy: 1.2268485872970603
Energy: 1.2267954903205596
Energy: 1.2320526008896042
Energy: 1.214845312809051
Energy: 1.2612092837400637
Energy: 1.2544696460993228
Energy: 1.2095140473477155
Energy: 1.2403003147825111
Energy: 1.2295653368247168

minimum gb energy = 1.1060589482003864 eV
minimum distance =  2.3919339185483 Angstroms
sigma value = 81


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

Energy: 2.129976504770801
Energy: 1.3990065810150532
Energy: 1.3999606039924501
Energy: 1.4023545034719838
Energy: 1.3751005335775544
Energy: 1.3836854788541375
Energy: 1.3728842355977484
Energy: 1.1326574516546488
Energy: 1.1154140013346268
Energy: 1.183953218397093
Energy: 1.1378623769149132
Energy: 1.08897804346931
Energy: 1.1872624898628559
Energy: 1.0658319904528337
Energy: 1.0522946073793344
Energy: 1.1416784263354365
Energy: 1.0658838989395505
Energy: 1.1559789271686625
Energy: 1.1382765532541328
Energy: 1.0649873519922974
Energy: 1.088695152937198
Energy: 1.1386150977261984
Energy: 1.0495023252849462
Energy: 1.111300402616081
Energy: 1.1850083440427839
Energy: 1.1550294071334444
Energy: 1.155185609758796
Energy: 1.1847903662635502
Energy: 1.1542597345878491
Energy: 1.1568323641030411
Energy: 1.1879979764243205
Energy: 1.1549758303859623
Energy: 1.154316919330729
Energy: 1.1449675921574218
Energy: 1.1514741119897876
Energy: 1.1544865736023817
Energy: 1.1864432594387628
Energy: 1.1505036294200361
Energy: 1.1516956480313962
Energy: 1.1520649068870004
Energy: 1.2133802951918664
Energy: 1.1502377855641557
Energy: 1.2988953788734863
Energy: 1.35355110685329
Energy: 1.3572819474786335
Energy: 1.157357479822318
Energy: 1.357729729336981
Energy: 1.1584950168607702
Energy: 1.1862268033668162
Energy: 1.2689835544933665
Energy: 1.2822961125098744
Energy: 1.1845799290100423
Energy: 1.279634117446978
Energy: 1.1433765153826063
Energy: 1.185067892484778
Energy: 1.2281041188478794
Energy: 1.227538083627733
Energy: 1.1855337527191327
Energy: 1.2344188968257335
Energy: 1.2353223013760102
Energy: 1.1836515391961013
Energy: 1.174062589868679
Energy: 1.2394882553811122
Energy: 1.1840799160076556
Energy: 1.1734776645494627
Energy: 1.15178386620126
Energy: 1.1336145394487174
Energy: 1.1542807300405655
Energy: 1.1538865199417419
Energy: 1.1348726239145783
Energy: 1.1567079198947783
Energy: 1.1485212683804646
Energy: 1.1353024677439236
Energy: 1.1465501063146992
Energy: 1.1469984297953981
Energy: 1.0671490490701292
Energy: 1.1549637626596683
Energy: 1.0512704029219748
Energy: 1.1584494004263663
Energy: 1.13288750524047
Energy: 1.1109756981987298
Energy: 1.0935777487791354
Energy: 1.154566066724878
Energy: 1.0929982998733787
Energy: 1.2556033688861876
Energy: 1.3864265494481993
Energy: 1.292777934966255
Energy: 1.1549474018147075
Energy: 1.344794586274907
Energy: 1.1517358824135004
Energy: 1.2557255368396631
Energy: 1.1442530554719044
Energy: 1.1347438209157716
Energy: 1.150461951329815
Energy: 1.1530520778761975
Energy: 1.1460826829081356
Energy: 1.3876444315596341
Energy: 1.1652689097854234
Energy: 1.1743063156892541
Energy: 1.386093848880453
Energy: 1.1589152874329565
Energy: 1.171308094652841
Energy: 1.392982472631317
Energy: 1.1500274527915457
Energy: 1.2673026612434595
Energy: 1.2708179315934498
Energy: 1.1549989710332327
Energy: 1.2662298750482517
Energy: 1.4039946558833276
Energy: 1.1571195531017768
Energy: 1.2355031459506478
Energy: 1.244605009712492
Energy: 1.152450506798286
Energy: 1.2377503223104238
Energy: 1.3998867998221305
Energy: 1.145931479636141
Energy: 1.2306735275714193
Energy: 1.2408563346240846
Energy: 1.1542330955690563
Energy: 1.2303357944480653
Energy: 1.1861077757525451
Energy: 1.1331154412935096
Energy: 1.0890764088990361
Energy: 1.1736477677164228
Energy: 1.1329641629054492
Energy: 1.1501656389156294
Energy: 1.1881507034574426
Energy: 1.0655179238249457
Energy: 1.0517485627983034
Energy: 1.149412259733949
Energy: 1.06589058920438
Energy: 1.0519923114459444
Energy: 1.1471139004172435
Energy: 1.0694703992448897
Energy: 1.0692039327222942
Energy: 1.1461838373337445
Energy: 1.0943549526187395
Energy: 1.089189015850419
Energy: 1.1880374966728497
Energy: 1.1421793588535782
Energy: 1.1465882476534033
Energy: 1.1483984632148616
Energy: 1.146707131591871
Energy: 1.1533559298197038
Energy: 1.186228792832703
Energy: 1.151102977973754
Energy: 1.1501880590845008
Energy: 1.1512860527603859
Energy: 1.1507249075936918
Energy: 1.1496158049326886
Energy: 1.293091452611117
Energy: 1.2883656988109717
Energy: 1.2735689476614764
Energy: 1.1588568013513627
Energy: 1.2869822813419913
Energy: 1.275650466686106
Energy: 1.2926576443066002
Energy: 1.2727007208120589
Energy: 1.272480097712788
Energy: 1.2136802568293608
Energy: 1.2685085567123193
Energy: 1.272916900897464
Energy: 1.18620718997001
Energy: 1.1736351777979424
Energy: 1.150300915574032
Energy: 1.168061024274681
Energy: 1.186895182107455
Energy: 1.1489543556576824
Energy: 1.1846937457818454
Energy: 1.2275851659221066
Energy: 1.2379793717009084
Energy: 1.1563933250820913
Energy: 1.232046249097489
Energy: 1.36642402964896
Energy: 1.1567373718731273
Energy: 1.1516763175749607
Energy: 1.12875619323948
Energy: 1.1580279696617242
Energy: 1.1540328471040995
Energy: 1.0939992753983023
Energy: 1.13505396427931
Energy: 1.38759482335565
Energy: 1.1516282768091681
Energy: 1.065943324507546
Energy: 1.3873019260759267
Energy: 1.051794461133278
Energy: 1.1571737744493782
Energy: 1.1454931174776835
Energy: 1.0912013817474577
Energy: 1.1332881234532413
Energy: 1.1473730166894818
Energy: 1.0820857164969326
Energy: 1.2466792243500842
Energy: 1.1561416648868634
Energy: 1.14917195227486
Energy: 1.1545427185953292
Energy: 1.1545158974897183
Energy: 1.149119993442791
Energy: 1.2459201260655681
Energy: 1.1498348146435313
Energy: 1.1507412734104057
Energy: 1.1506288688090156
Energy: 1.141626266721324
Energy: 1.1540963645213966
Energy: 1.2554975621734066
Energy: 1.1497054596235332
Energy: 1.150328612239276
Energy: 1.1260131047084037
Energy: 1.1528959764889775
Energy: 1.1505016450568457
Energy: 1.3987902312807783
Energy: 1.1595040248579913
Energy: 1.1624157046297363
Energy: 1.358348487811596
Energy: 1.1612793428928683
Energy: 1.2761548088847277
Energy: 1.3972973397505126
Energy: 1.1370772819884691
Energy: 1.1501999584100302
Energy: 1.2783617452524303
Energy: 1.1555248341389273
Energy: 1.1436890895088534
Energy: 1.4012144783175549
Energy: 1.3576707710744402
Energy: 1.3856129853907737
Energy: 1.2280538450642242
Energy: 1.290700594895501
Energy: 1.4116229434723992

minimum gb energy = 1.0495023252849462 eV
minimum distance =  2.38232762663529 Angstroms
sigma value = 43


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

Energy: 1.856787860484924
Energy: 1.3500913818418434
Energy: 1.3672301249334022
Energy: 1.3682240637841843
Energy: 1.525530075096903
Energy: 1.3691833901945643
Energy: 1.203993140911093
Energy: 1.202940085866341
Energy: 1.2044354333991467
Energy: 1.2337931794954444
Energy: 1.2076655674008774
Energy: 1.1871950776915916
Energy: 1.2411502806384385
Energy: 1.200711386985169
Energy: 1.2010830792294829
Energy: 1.210666766092815
Energy: 1.2006942592930943
Energy: 1.2389102368410365
Energy: 1.239823237729969
Energy: 1.2013882217331038
Energy: 1.2174739010286546
Energy: 1.24007480715768
Energy: 1.3366355634947709
Energy: 1.2165134934616646
Energy: 1.1750745677198153
Energy: 1.1017550497847584
Energy: 1.0891155336079408
Energy: 1.1764536540102444
Energy: 1.1011175871056487
Energy: 1.0827334520198422
Energy: 1.1744908488296892
Energy: 1.1014069118059677
Energy: 1.0915088244575109
Energy: 1.094871573245653
Energy: 1.1021092417363614
Energy: 1.092576227056679
Energy: 1.3046369905707191
Energy: 1.1621766326354572
Energy: 1.1388622626974174
Energy: 1.2222459007836872
Energy: 1.1621651816644571
Energy: 1.0852206030775042
Energy: 1.2842000969039058
Energy: 1.2334558523289858
Energy: 1.4817834500480687
Energy: 1.157770771495125
Energy: 1.2425045181955987
Energy: 1.2593411168030382
Energy: 1.304867050948349
Energy: 1.2437887747431993
Energy: 1.24361704520075
Energy: 1.2080683465360862
Energy: 1.2458009048124823
Energy: 1.243816406781865
Energy: 1.3884775925660442
Energy: 1.238911836811552
Energy: 1.3113753796319745
Energy: 1.3927065471232256
Energy: 1.25334038359868
Energy: 1.3139404553724703
Energy: 1.1360943720123435
Energy: 1.1759150835619734
Energy: 1.2448730116328335
Energy: 1.1137907362908581
Energy: 1.2831374920330256
Energy: 1.1242120265139088
Energy: 1.4358500899448106
Energy: 1.2288897902189468
Energy: 1.2427826861894065
Energy: 1.0974409057948182
Energy: 1.2379919177487755
Energy: 1.2426891717549788
Energy: 1.4353100799000444
Energy: 1.244513762302106
Energy: 1.3961285341622736
Energy: 1.2032414734814323
Energy: 1.318111962657654
Energy: 1.3106882086575653
Energy: 1.1565900826121518
Energy: 1.190866160830371
Energy: 1.1105278590110064
Energy: 1.1300315470811555
Energy: 1.2335754629875983
Energy: 1.1196816137156536
Energy: 1.137678900751864
Energy: 1.1043244108818735
Energy: 1.206026851925169
Energy: 1.1116010050800869
Energy: 1.0746213961539435
Energy: 1.0941354572340354
Energy: 1.2102671358500083
Energy: 1.2142879432259475
Energy: 1.2009853488592557
Energy: 1.2113043559932692
Energy: 1.222303436539905
Energy: 1.2046024328841194
Energy: 1.1781945026718084
Energy: 1.1708408600629425
Energy: 1.1697514773969235
Energy: 1.1743214240745206
Energy: 1.1211872521320436
Energy: 1.1708024417531615
Energy: 1.1787652776207382
Energy: 1.1551771115747556
Energy: 1.171690473551541
Energy: 1.144615761586155
Energy: 1.1605349077535865
Energy: 1.1717653697270705
Energy: 1.3554886184472545
Energy: 1.276100916812455
Energy: 1.1700199129371103
Energy: 1.241875668982374
Energy: 1.2657625749387709
Energy: 1.2706866886998776
Energy: 1.3983933016502053
Energy: 1.2729790707434796
Energy: 1.1731849600591695
Energy: 1.2433427927499927
Energy: 1.2943663602417792
Energy: 1.2497014650683178
Energy: 1.1788435624397744
Energy: 1.1686408874500194
Energy: 1.1560841538965443
Energy: 1.1706345909965588
Energy: 1.1412800549527609
Energy: 1.1609303501822212
Energy: 1.2772651760168316
Energy: 1.289027629722526
Energy: 1.2748476570494793
Energy: 1.2771609914000552
Energy: 1.1950137903388358
Energy: 1.4178581678773305
Energy: 1.2886885036053133
Energy: 1.1449271740864202
Energy: 1.1488982585802459
Energy: 1.2322853367162367
Energy: 1.1748079031418317
Energy: 1.164882825082634
Energy: 1.308131786174691
Energy: 1.4173622360477736
Energy: 1.1715029089077784
Energy: 1.1402615775054668
Energy: 1.4176446609568576
Energy: 1.1720379738239712
Energy: 1.4137986222936807
Energy: 1.177438748660284
Energy: 1.1732301758501553
Energy: 1.2876747953841126
Energy: 1.178675919232526
Energy: 1.1722791730297375
Energy: 1.2554353464418972
Energy: 1.122216426561386
Energy: 1.1143209013613946
Energy: 1.128265628565136
Energy: 1.1364925005358697
Energy: 1.1107532082481446
Energy: 1.2504443543024664
Energy: 1.1293831121088644
Energy: 1.1291417427107502
Energy: 1.1910344761938711
Energy: 1.1316778094669129
Energy: 1.1175861914191425
Energy: 1.2508092177427075
Energy: 1.0963315555336914
Energy: 1.1101217567601191
Energy: 1.1589426690593594
Energy: 1.1132319018640993
Energy: 1.1233120484343944
Energy: 1.5056141190947891
Energy: 1.2126782485691912
Energy: 1.2130731932671535
Energy: 1.4181735165984968
Energy: 1.1726003761038648
Energy: 1.4274002405166433
Energy: 1.2397233974137958
Energy: 1.1028768004684815
Energy: 1.1089572837607937
Energy: 1.234419309467823
Energy: 1.1203949697994822
Energy: 1.2142393472847524
Energy: 1.4609475939583008
Energy: 1.1492039772762923
Energy: 1.2780244327559183
Energy: 1.281515939633562
Energy: 1.1394895792641055
Energy: 1.2027917512285942

minimum gb energy = 1.0746213961539435 eV
minimum distance =  2.38405554529224 Angstroms
sigma value = 57


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

Energy: 1.8138111349017556
Energy: 1.4240920326318438
Energy: 1.4405294543912683
Energy: 1.1651959835638086
Energy: 1.4572222557470578
Energy: 1.440821842637729
Energy: 1.113330133073856
Energy: 1.1832100659700293
Energy: 1.1223845582679408
Energy: 1.1876953150515002
Energy: 1.182818710886623
Energy: 1.1220191634339542
Energy: 1.2906589124135912
Energy: 1.0719019942685557
Energy: 1.1252423357417478
Energy: 1.2537337205112333
Energy: 1.072256131813802
Energy: 1.123931338266589
Energy: 1.200324261228857
Energy: 1.0728937333858422
Energy: 1.0861453057794315
Energy: 1.1988050932870251
Energy: 1.0866722190684113
Energy: 1.1005315268746712
Energy: 1.1612781738425269
Energy: 1.0887399638385158
Energy: 1.0873628449959443
Energy: 1.1515814735499421
Energy: 1.0893182937486445
Energy: 1.0774297332023306
Energy: 1.11045728939084
Energy: 1.0890589733959555
Energy: 1.087362498207136
Energy: 1.0873018929158502
Energy: 1.0787598872391642
Energy: 1.0903113191026812
Energy: 1.2201296139098903
Energy: 1.194628209937111
Energy: 1.161476357643153
Energy: 1.0993473336263329
Energy: 1.1999721721557841
Energy: 1.1006350160918499
Energy: 1.1609471999118761
Energy: 1.3217678517522178
Energy: 1.3134801125156308
Energy: 1.133274057383728
Energy: 1.2460217074891207
Energy: 1.2321431951250887
Energy: 1.219670859866179
Energy: 1.16854487522182
Energy: 1.1682135978314316
Energy: 1.217163491138536
Energy: 1.1713001991622833
Energy: 1.1845987107612286
Energy: 1.452748624101983
Energy: 1.181234072591395
Energy: 1.189047377437305
Energy: 1.4536640460489936
Energy: 1.1890417924899634
Energy: 1.168924158114056
Energy: 1.2761290125403155
Energy: 1.1036676432626569
Energy: 1.098967636514377
Energy: 1.1702144721757357
Energy: 1.1835628399753217
Energy: 1.251205135844082
Energy: 1.1659776049611303
Energy: 1.169692101972846
Energy: 1.1477284466735456
Energy: 1.0941026407710515
Energy: 1.1964799227889744
Energy: 1.2580681841380823
Energy: 1.4464075874824196
Energy: 1.2926661986887102
Energy: 1.3433054124162922
Energy: 1.2774507953493517
Energy: 1.272982877892372
Energy: 1.2585479541670834
Energy: 1.2893634766162354
Energy: 1.185114548937695
Energy: 1.121732676568542
Energy: 1.1800123737434984
Energy: 1.1864386324109704
Energy: 1.1211496560922545
Energy: 1.288354235992013
Energy: 1.0940307958784117
Energy: 1.0952176928988373
Energy: 1.2597283178068692
Energy: 1.0938544106576347
Energy: 1.1637734363784253
Energy: 1.1968058722185024
Energy: 1.1027751299716047
Energy: 1.1006978214534546
Energy: 1.1992017289372283
Energy: 1.1002709903326666
Energy: 1.1513224321099247
Energy: 1.1491210036993817
Energy: 1.0784058771423934
Energy: 1.076952442075322
Energy: 1.1653525737566517
Energy: 1.0786499526439974
Energy: 1.0794307554514107
Energy: 1.1505973070551123
Energy: 1.0882492789169809
Energy: 1.0765646674769445
Energy: 1.0897456523624693
Energy: 1.152495540235827
Energy: 1.0887677670003513
Energy: 1.2210040538210252
Energy: 1.2893108186425473
Energy: 1.2511434289947962
Energy: 1.100353812159566
Energy: 1.2770153194449136
Energy: 1.1453604922259912
Energy: 1.22091565908589
Energy: 1.1804594691121093
Energy: 1.1542975240579882
Energy: 1.1883938344034657
Energy: 1.3147574903181207
Energy: 1.1549793033545952
Energy: 1.2203097052380545
Energy: 1.1902818300230167
Energy: 1.1220028936163218
Energy: 1.185267814287212
Energy: 1.1692310980734186
Energy: 1.136642089641231
Energy: 1.4288308007643336
Energy: 1.1925937901186512
Energy: 1.1924766822434447
Energy: 1.4290896327716214
Energy: 1.167360822068251
Energy: 1.260940792677534
Energy: 1.2878812589195445
Energy: 1.1691398239552746
Energy: 1.1850261491814487
Energy: 1.2694151458947591
Energy: 1.1455782407592903
Energy: 1.1209219996085011
Energy: 1.4481701007015868
Energy: 1.1587230913729254
Energy: 1.3260536536019745
Energy: 1.27702885513683
Energy: 1.160804430906031
Energy: 1.2583641136151993

minimum gb energy = 1.0719019942685557 eV
minimum distance =  2.39936991584025 Angstroms
sigma value = 17


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

Energy: 1.497190232907252
Energy: 1.2926108401262724
Energy: 1.255891107439593
Energy: 1.1196245647583307
Energy: 1.1404185180727018
Energy: 1.1198524693019147
Energy: 1.1550819841248716
Energy: 1.2119032328036161
Energy: 1.230532984728904
Energy: 1.2329165228488532
Energy: 1.2124051812361085
Energy: 1.0656007166011419
Energy: 1.4175554804806634
Energy: 1.0527252246916998
Energy: 1.0522839806900552
Energy: 1.220007440925012
Energy: 1.0530291351486047
Energy: 1.0515050500804888
Energy: 1.2277227640652166
Energy: 1.0520417446722086
Energy: 1.0517993010998101
Energy: 1.2277374207224763
Energy: 0.994788867828848
Energy: 1.0729908521563154
Energy: 1.2460566124343644
Energy: 1.0311600072355107
Energy: 1.03133745883253
Energy: 1.1891380366442013
Energy: 1.0311924343684915
Energy: 1.0311094918050738
Energy: 1.1946747013194134
Energy: 1.011711034852862
Energy: 1.0118084307648387
Energy: 1.0159930764474174
Energy: 1.0742785903860894
Energy: 1.0148416578065613
Energy: 1.1087404255502769
Energy: 1.1088986328262829
Energy: 0.9695227556772043
Energy: 1.0530684611373582
Energy: 1.1076183120091423
Energy: 1.0121249471674023
Energy: 1.1085448614518103
Energy: 0.9820589204814202
Energy: 0.9803055883073908
Energy: 0.972078758169211
Energy: 0.9810514844704531
Energy: 1.1513625288980487
Energy: 1.1614013286062241
Energy: 0.992325961954128
Energy: 0.9924818653114307
Energy: 1.162114525786771
Energy: 0.9887177912422251
Energy: 0.9919536395136124
Energy: 1.1400264015540063
Energy: 1.0121400060119847
Energy: 1.0114739962469395
Energy: 1.124295099391299
Energy: 1.0134010029691687
Energy: 1.01141198026828
Energy: 1.1253555118069292
Energy: 1.0158381047835594
Energy: 1.0304889601274214
Energy: 1.0308326104574523
Energy: 1.1879342080841226
Energy: 1.0303673921024947
Energy: 1.2807539453025671
Energy: 1.169715407380282
Energy: 1.171496343859235
Energy: 1.2837577451679159
Energy: 1.2296991478479875
Energy: 1.072220559511139
Energy: 1.2800105005332882
Energy: 1.1295213317161612
Energy: 1.0993412565703362
Energy: 1.0319674632215028
Energy: 1.130054398748222
Energy: 1.098199938784695
Energy: 1.2817616560600307
Energy: 1.227812999717793
Energy: 1.220041550329027
Energy: 1.232418519520895
Energy: 1.225825863111874
Energy: 1.0670841970359026
Energy: 1.3817670292674118
Energy: 1.1937958699963087
Energy: 1.142979548670815
Energy: 1.3108370748851088
Energy: 1.0982368341417799
Energy: 1.1354989484983902
Energy: 1.3052159851872662
Energy: 1.2327916660215499
Energy: 1.0734789927941757
Energy: 1.0633628145784482
Energy: 1.2419262918678053
Energy: 1.2106722374976844
Energy: 1.2715647549811633
Energy: 1.0958478441037576
Energy: 1.1340568141313605
Energy: 1.2184558041353728
Energy: 1.1920744131100294
Energy: 1.1218038191916346

minimum gb energy = 0.9695227556772043 eV
minimum distance =  2.39988992316772 Angstroms
sigma value = 17


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

Energy: 1.3874241823804823
Energy: 1.1409373336145674
Energy: 1.0541053576716763
Energy: 1.0514149022299697
Energy: 1.1090731820447535
Energy: 1.0557493962224178
Energy: 1.1211354609477755
Energy: 1.1385762799910095
Energy: 1.1515133578366459
Energy: 1.139433746661592
Energy: 1.135879995257254
Energy: 0.9671750506692219
Energy: 1.4543625231039725
Energy: 0.9232449466203639
Energy: 0.9550548978022647
Energy: 1.1246155837320218
Energy: 0.8995675877595259
Energy: 0.9554215263370184
Energy: 1.225528678431583
Energy: 0.9543410678722978
Energy: 0.9541512309302131
Energy: 1.2269157255188052
Energy: 0.9062589780469708
Energy: 0.9649502661868743
Energy: 1.1208469050776853
Energy: 0.9564382542979241
Energy: 0.9276979942281576
Energy: 1.0473663508460045
Energy: 0.9561240480217099
Energy: 0.9294999133731099
Energy: 1.1566564335284681
Energy: 0.9306375535710777
Energy: 0.8966017718869637
Energy: 0.9018090491772816
Energy: 0.9980206137898511
Energy: 0.897146264451711
Energy: 1.0399731790037041
Energy: 1.0981843755533969
Energy: 1.1323850451377435
Energy: 0.8914324222001159
Energy: 1.1018852547579168
Energy: 0.9219392285208277
Energy: 1.0320147284267978
Energy: 0.885662816056528
Energy: 0.8861922604567226
Energy: 0.9027597939514079
Energy: 0.8860475216746964
Energy: 1.0530254516315145
Energy: 1.0316747703122882
Energy: 0.880874871064173
Energy: 0.9024051636874186
Energy: 1.031515586331078
Energy: 0.9838468137908145
Energy: 1.037662667895814
Energy: 1.027669098220845
Energy: 0.8859385694192183
Energy: 0.8856046791555958
Energy: 1.0279784722963352
Energy: 0.881930994123905
Energy: 0.8910319269177406
Energy: 1.1614915893901356
Energy: 1.0487849584423776
Energy: 0.8907629661805749
Energy: 0.8876187810355648
Energy: 1.0290375342233993
Energy: 0.9026966917655297
Energy: 1.062968249688074
Energy: 1.02863803310009
Energy: 1.038049761288481
Energy: 0.9841627241633378
Energy: 1.0331512412653703
Energy: 0.8802197339587838
Energy: 1.0970441271157938
Energy: 1.0504575996975936
Energy: 0.9035234524619922
Energy: 1.0314893570054342
Energy: 1.055028160780191
Energy: 0.8793129448363806
Energy: 1.0811191859206981
Energy: 0.9021406465904965
Energy: 0.9221930494739129
Energy: 1.0834050784978873
Energy: 0.9027667846120725
Energy: 1.1001996484296068
Energy: 1.0911267334641552
Energy: 0.9324892694491956
Energy: 0.9187782191928808
Energy: 1.0043807548806172
Energy: 0.9327170123035117
Energy: 0.9266338649899492
Energy: 1.2547809045351972
Energy: 1.0787032144139281
Energy: 0.9269483228881762
Energy: 0.9253938291318881
Energy: 1.2379542425763312
Energy: 0.930280116101042
Energy: 1.044032846527506
Energy: 0.9934829451086017
Energy: 0.9925174558211567
Energy: 0.8994966454647416
Energy: 1.0851927454743706
Energy: 0.9271507083702498
Energy: 1.113052423695607
Energy: 0.9919565350192001
Energy: 0.9924813279157941
Energy: 1.0451695324999917
Energy: 0.9937238128057337
Energy: 0.9270515744109308
Energy: 1.3613845289465867
Energy: 1.1406858993350446
Energy: 0.9688671672787293
Energy: 1.1365391673312664
Energy: 0.940179719704155
Energy: 0.9687454746771946
Energy: 1.4672838157840868
Energy: 0.9532830651167072
Energy: 0.9922850605776655
Energy: 1.040112117150338
Energy: 0.9758574064288816
Energy: 1.0361557381710509
Energy: 1.3416804851188389
Energy: 1.1411662992877947
Energy: 0.9673739632923986
Energy: 1.1348332623279789
Energy: 0.9776616116167892
Energy: 0.9676052632589754
Energy: 1.2096663975981459
Energy: 1.029703213816782
Energy: 1.0311490177231857
Energy: 0.957197159666514
Energy: 1.028222225188308
Energy: 0.9553351505822087
Energy: 1.191704982413626
Energy: 1.1431999362962149
Energy: 1.1403482648347498
Energy: 1.1712505512499405
Energy: 1.141209762514241
Energy: 1.1824329696070726
Energy: 1.4610896215142775
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Energy: 0.9711424225741261
Energy: 1.0153433620286618
Energy: 1.1256818562265043
Energy: 1.0157806093833157
Energy: 1.223483265137313
Energy: 0.9473386971226609
Energy: 0.9552374773111967
Energy: 1.2244149013280132
Energy: 0.9479711858511133
Energy: 0.9538834019357886
Energy: 1.2383739299972074
Energy: 0.9508638572880164
Energy: 0.9544313867562714
Energy: 1.240360208627545
Energy: 0.9507793140083921
Energy: 1.0913842725966576
Energy: 1.1555754685313901
Energy: 0.9278400769948196
Energy: 0.9304461440596933
Energy: 0.9013304123200131
Energy: 0.926795351092352
Energy: 0.8983184069351705
Energy: 1.0404411375599414
Energy: 1.0866436296429707
Energy: 0.9998718982355773
Energy: 0.9610501315188218
Energy: 1.081992138391999
Energy: 1.0056238388216523
Energy: 1.047290742509633
Energy: 0.8954661326956952
Energy: 0.8963988201658952
Energy: 1.0521183529527796
Energy: 1.0995138716013373
Energy: 0.9032104073871056
Energy: 1.0285630002923256
Energy: 0.8862768656143309
Energy: 0.886866864645801
Energy: 1.0286005798532374
Energy: 0.8864702372358646
Energy: 0.8899381735725842
Energy: 1.0512554280209032
Energy: 0.9007903300238924
Energy: 0.8986414245912182
Energy: 1.0282270185869833
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Energy: 0.8977484490512383
Energy: 1.165029122141394
Energy: 0.9015480739833607
Energy: 0.9003105747225626
Energy: 0.9069327706122657
Energy: 0.8922371174385408
Energy: 0.9002578622554327
Energy: 1.155411662442104
Energy: 1.0290291211037264
Energy: 1.027615353905162
Energy: 1.0848242395051833
Energy: 1.0312643391373613
Energy: 1.0376339011854536
Energy: 1.0404183555951267
Energy: 0.9219396283964383
Energy: 0.9227118482256025
Energy: 0.9169489418129877
Energy: 0.8937458152984881
Energy: 0.9240954412035478
Energy: 1.1223667880182244
Energy: 0.9242061996108889
Energy: 0.9243225404044695
Energy: 1.1239600023999117
Energy: 0.9257250411652551
Energy: 0.926419314226143
Energy: 1.0841735555812402
Energy: 0.8936079809606122
Energy: 0.9250239810375188
Energy: 1.0837237532893962
Energy: 0.8916331509134846
Energy: 0.9236579951107122
Energy: 1.2608287273117866
Energy: 0.9242809295870436
Energy: 0.9243555857044772
Energy: 1.1136786125438376
Energy: 1.0844918333747804
Energy: 0.9371136237868744
Energy: 1.0532029189247445
Energy: 1.221492556845605
Energy: 1.137540188487675
Energy: 0.9242121490172075
Energy: 1.2406943616774733
Energy: 0.9684924693156132
Energy: 1.1110165316443845
Energy: 1.0129753652500797
Energy: 0.9931797417578972
Energy: 0.9281562198400863
Energy: 1.0117031895947726
Energy: 0.9609136836648785
Energy: 1.0904108973241902
Energy: 1.0095223235634743
Energy: 1.1390092845530926
Energy: 0.9248372485097436
Energy: 1.0079556827614744
Energy: 0.9660774692461084
Energy: 1.3666858725908626
Energy: 0.9542919237468311
Energy: 0.9975016082463479
Energy: 1.1444530723474557
Energy: 0.9542193484139899
Energy: 0.9978010914801849
Energy: 1.4606541806711784
Energy: 0.9674368199969757
Energy: 0.9695069632415081
Energy: 0.9959210723833656
Energy: 1.0047477093558914
Energy: 0.993460782267783
Energy: 1.1914845835381058
Energy: 0.998215568280826
Energy: 0.992204301528252
Energy: 1.147016824848164
Energy: 0.9948260450908963
Energy: 1.1821103533954738

minimum gb energy = 0.8793129448363806 eV
minimum distance =  2.33031290321657 Angstroms
sigma value = 57


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

Energy: 0.9377067820257352
Energy: 1.054122623757088
Energy: 0.9555604931997551
Energy: 0.8927456967505881
Energy: 0.9417564249358622
Energy: 0.9583092940481787
Energy: 1.0643489643335382
Energy: 1.078664510285956
Energy: 0.8625000916449345
Energy: 1.061073232706794
Energy: 1.0740903781342956
Energy: 0.9039428124418808
Energy: 1.363051396957455
Energy: 0.8464876626114273
Energy: 0.8466280856257457
Energy: 0.9437114760406667
Energy: 0.8479867213660444
Energy: 0.8754343980292351
Energy: 1.1578368102376637
Energy: 0.8469210344936572
Energy: 0.9063852089607747
Energy: 1.1588859558582036
Energy: 0.8407175326334314
Energy: 0.9247438247668736
Energy: 1.0286732872848274
Energy: 0.8792331091951747
Energy: 0.8832652270001032
Energy: 0.9792773783960094
Energy: 0.8773584058788105
Energy: 0.8909053421364218
Energy: 0.9193955461034209
Energy: 0.8605877843954205
Energy: 0.8470954516446159
Energy: 0.8233259586859535
Energy: 0.927863108924275
Energy: 0.8469111548345097
Energy: 0.9558310410293616
Energy: 1.0494218267294442
Energy: 1.031555902726527
Energy: 0.8455473431869293
Energy: 1.043257566308831
Energy: 0.8467922496897428
Energy: 1.242228543770118
Energy: 0.8032558644411392
Energy: 0.8013702579293995
Energy: 0.8366839984893387
Energy: 0.8014041049406037
Energy: 0.8500310329913601
Energy: 0.959167495051721
Energy: 0.8154171370411992
Energy: 0.8343217687081016
Energy: 0.9622262526028528
Energy: 1.1568487641032892
Energy: 0.9565151758387564
Energy: 0.9678305326963063
Energy: 0.8334204480411198
Energy: 0.8327160343566238
Energy: 0.9679810764727963
Energy: 0.8283969207813907
Energy: 0.8154786906579177
Energy: 0.9320528241854258
Energy: 0.9270459288922247
Energy: 0.8102254632367323
Energy: 0.7993795645598984
Energy: 0.9263607448928703
Energy: 0.8019716578346484
Energy: 0.9602593071770661
Energy: 0.927072858366641
Energy: 0.9355304202800987
Energy: 1.1525116973220528
Energy: 0.932896837223611
Energy: 0.8240420434697561
Energy: 0.9254020183448544
Energy: 0.9269335843604966
Energy: 0.9233121660739759
Energy: 0.8861336954748193
Energy: 0.8831393975920749
Energy: 0.8197611646305494
Energy: 0.9273365457946313
Energy: 0.8059328285379165
Energy: 0.8150668806947317
Energy: 0.9299348051526122
Energy: 1.145573018936212
Energy: 0.9273385958809439
Energy: 0.9265195421354943
Energy: 0.8089487232595318
Energy: 0.8022867875260221
Energy: 0.926882675322703
Energy: 0.8861146448707878
Energy: 0.8029784631989534
Energy: 0.9743996217556619
Energy: 0.9555637438146237
Energy: 0.8321450172707677
Energy: 0.8350247525674502
Energy: 0.9718641250411826
Energy: 0.8305327823690275
Energy: 0.9774146254794138
Energy: 0.9596102420285483
Energy: 0.9620390444202217
Energy: 1.1629301365869669
Energy: 0.9656369604782072
Energy: 0.8239407038247423
Energy: 0.9709426848869283
Energy: 0.8453440638402162
Energy: 0.8494391552626318
Energy: 1.0386332996025767
Energy: 0.9862762772170628
Energy: 0.831679827845529
Energy: 1.020805513690973
Energy: 0.8537746892265885
Energy: 1.0273191003641675
Energy: 1.0235438206160814
Energy: 0.8499367951680153
Energy: 0.9548579923434317
Energy: 1.1590222144822342
Energy: 0.8743340887445727
Energy: 0.8661642483793998
Energy: 0.8608397670605464
Energy: 0.8384830705665878
Energy: 0.8829077622765045
Energy: 1.2930544835556406
Energy: 0.9769202075988722
Energy: 0.8773676128829445
Energy: 0.8613023011109798
Energy: 1.1777556876779334
Energy: 0.8836951851186846
Energy: 0.9276061810150272
Energy: 0.9517456594131618
Energy: 0.8772193404656625
Energy: 0.8365443916669024
Energy: 0.9521869162903953
Energy: 0.8770120383505602
Energy: 1.050948489787632
Energy: 0.9467671885414267
Energy: 0.944947448948824
Energy: 0.9906205740823143
Energy: 0.9461507926386482
Energy: 0.9297940342847452
Energy: 1.2749925390154708
Energy: 0.8744757782352554
Energy: 0.8900047937758203
Energy: 1.0780647396298395
Energy: 0.8755476198523047
Energy: 0.8884894417792134
Energy: 1.3571619651014568
Energy: 0.8790342787214344
Energy: 0.8789062479503428
Energy: 0.9389107917730899
Energy: 0.8782627048050095
Energy: 0.9363400343047703
Energy: 1.363966910686123
Energy: 1.0801274136494083
Energy: 1.089456846218133
Energy: 1.0750672713366844
Energy: 0.9203391914543125
Energy: 0.9050687624966912
Energy: 0.934404146267765
Energy: 0.9396589328314602
Energy: 0.9088093046314296
Energy: 0.84899052102404
Energy: 0.9397756098288799
Energy: 0.9068241189385219

minimum gb energy = 0.7993795645598984 eV
minimum distance =  2.39020156025997 Angstroms
sigma value = 43


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

Energy: 0.7857494462221066
Energy: 0.8951522378341223
Energy: 0.8513716119021307
Energy: 0.8232191480604174
Energy: 0.7757204576303243
Energy: 0.8074058331359576
Energy: 1.1065681458722831
Energy: 0.7465432974284147
Energy: 0.7358910633796024
Energy: 0.9112423033991585
Energy: 0.7465636259248367
Energy: 0.8771521743899249
Energy: 1.1484831712318975
Energy: 0.6974979008834604
Energy: 0.7161794140939484
Energy: 0.9736732046938968
Energy: 0.6968247334242033
Energy: 0.7159813889495547
Energy: 0.9964085930014641
Energy: 0.7164035219415559
Energy: 0.7167122320906427
Energy: 0.7378180297285287
Energy: 0.8342433424196379
Energy: 0.7584693888097608
Energy: 0.9993684373055991
Energy: 0.7352030989500505
Energy: 0.7370835086762592
Energy: 0.9923979457499439
Energy: 0.7346916953315537
Energy: 0.7329333895498452
Energy: 0.7641396895158992
Energy: 0.7329228913005666
Energy: 0.7143488707954211
Energy: 0.7713101963800457
Energy: 0.7235186581905043
Energy: 0.7031919410311969
Energy: 1.055907230902
Energy: 0.7221035074067024
Energy: 0.7356101545902474
Energy: 0.7215654679865305
Energy: 0.9067849019268555
Energy: 0.7024999218685716
Energy: 1.0572011267624695
Energy: 0.6800661897251018
Energy: 0.6780553124262281
Energy: 0.7071821273600232
Energy: 0.6799406321652688
Energy: 0.6845564356715111
Energy: 0.8326160842790216
Energy: 0.686607177962302
Energy: 0.6941487169732915
Energy: 0.835454100026244
Energy: 0.6990356029665482
Energy: 0.7627352650742659
Energy: 0.8128567854027843
Energy: 0.6694152922850073
Energy: 0.6694185878119242
Energy: 0.833476323675201
Energy: 0.7380344415375713
Energy: 0.6693842619282037
Energy: 0.7586907747595211
Energy: 0.7957770699180158
Energy: 0.6688476616990575
Energy: 0.6724153779859492
Energy: 0.793511485997288
Energy: 0.67004088730479
Energy: 0.8334339421748386
Energy: 0.7983628985627896
Energy: 0.7969165223324136
Energy: 0.7513860551777013
Energy: 0.7928859970972418
Energy: 0.6890499733235956
Energy: 1.0224475981028007
Energy: 0.7433224952169987
Energy: 0.7564306313673405
Energy: 0.8596068542790687
Energy: 0.6703551791434954
Energy: 0.7732702818115242
Energy: 0.7716677616344876
Energy: 0.7340492626697038
Energy: 0.7779341912274924
Energy: 0.7747544208494984
Energy: 0.978239154059649
Energy: 0.7780101078204539
Energy: 0.7717027923547667
Energy: 0.6735213205552751
Energy: 0.6727144938770672
Energy: 0.7715980262412038
Energy: 0.7070927946637637
Energy: 0.667751845597967
Energy: 0.7630397646160739
Energy: 0.7628519546561922
Energy: 0.6603312890988137
Energy: 0.6603405435695964
Energy: 0.760517191610336
Energy: 0.6607567033701746
Energy: 0.7745275784430037
Energy: 0.7655532230320792
Energy: 0.7650554709101512
Energy: 0.7757593751760817
Energy: 0.761932144530511
Energy: 0.6631898735977636
Energy: 0.7609245271222719
Energy: 0.7384361775539983
Energy: 0.6635133913839905
Energy: 0.7700030654271137
Energy: 0.7350074918338999
Energy: 0.6728681459926684
Energy: 0.7607632765441739
Energy: 0.7275273750875075
Energy: 0.7688368827006664
Energy: 0.7627948363674036
Energy: 0.968638251786411
Energy: 0.7692467606330027
Energy: 0.7611467741763353
Energy: 0.7397255010232722
Energy: 0.6784063609941995
Energy: 0.7611935730266083
Energy: 0.7383166050498352
Energy: 0.6775899891330576
Energy: 0.7968497900424729
Energy: 0.7770716706217227
Energy: 0.775487969160721
Energy: 0.7375543409423029
Energy: 0.770895738587727
Energy: 0.6782397236636339
Energy: 0.7630550908109595
Energy: 0.7728583701454835
Energy: 0.6615531136842188
Energy: 0.662655882212086
Energy: 0.7711636385672468
Energy: 0.6622296699743015
Energy: 0.7931617500840601
Energy: 0.6762300789866339
Energy: 0.6761294869930595
Energy: 0.7931226389897278
Energy: 0.7548174674817292
Energy: 0.677028999221354
Energy: 0.7937727967378774
Energy: 0.6881929599327404
Energy: 0.7987772297882505
Energy: 0.7969825586687475
Energy: 0.738293264826124
Energy: 0.7996715540894771
Energy: 1.0363641777454962
Energy: 0.7520782815940302
Energy: 0.7266324083866996
Energy: 0.6937025283505432
Energy: 0.7170315892493666
Energy: 0.6936491162243551
Energy: 1.0168619625794442
Energy: 0.8347112659514139
Energy: 0.8358405739275305
Energy: 0.6922823574106968
Energy: 0.829760697049925
Energy: 0.6888241291113357
Energy: 0.7621632968580139
Energy: 0.7633542310195792
Energy: 0.6924994517526808
Energy: 0.680582388907968
Energy: 0.8314550876089214
Energy: 0.6841464383928538
Energy: 0.833727407054464
Energy: 0.7021494243740737
Energy: 0.7029091081256621
Energy: 0.9465896036639098
Energy: 0.7023698198494114
Energy: 0.692220887958396
Energy: 0.8912602598741198
Energy: 0.7026955204484704
Energy: 0.7377787853157177
Energy: 0.8060621092475391
Energy: 0.7120217564640279
Energy: 0.7482484054888272
Energy: 1.0905396097068714
Energy: 0.6899997889263
Energy: 0.704764747911782
Energy: 0.7329335665146525
Energy: 0.6903364569660756
Energy: 0.7049915280210809
Energy: 1.0894943996758568
Energy: 0.7330184851036008
Energy: 0.8198091671887452
Energy: 0.7335852761349207
Energy: 0.8305579980487201
Energy: 0.8176552519080351
Energy: 0.7735195420701815
Energy: 0.7639234647580024
Energy: 0.7397454092366204
Energy: 0.7054496898732534
Energy: 0.7644837040924829
Energy: 0.7296245329234756
Energy: 1.0135983039455796
Energy: 0.7755411611144608
Energy: 0.7651808858312978
Energy: 0.8267081072000223
Energy: 0.7747773464438458
Energy: 0.7646463856615587
Energy: 1.0872179120836718
Energy: 0.7554261599318595
Energy: 0.7557304675493851
Energy: 0.7213928067302154
Energy: 0.8388314112879056
Energy: 0.7828307245744967
Energy: 1.1473464675362064
Energy: 0.7371457968740155
Energy: 0.755838400122511
Energy: 0.9115679174494424
Energy: 0.7796558986852121
Energy: 0.7543863150554982
Energy: 1.106568145225203
Energy: 0.910663965415045
Energy: 0.7647124497156869
Energy: 0.911727209403737
Energy: 0.7635702199491606
Energy: 0.7229225733882199

minimum gb energy = 0.6603312890988137 eV
minimum distance =  2.40295477689747 Angstroms
sigma value = 81


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

Energy: 0.03488021765658625
Energy: 0.08666286672598221
Energy: 0.03603640736813976
Energy: 0.038004817525276895
Energy: 0.03747154765985417
Energy: 0.03543143530931916
Energy: 0.08815896240668496
Energy: 0.03617805460686924
Energy: 0.03624932979878025
Energy: 0.08929724843654493
Energy: 0.03862269909732084
Energy: 0.035974020390227415
Energy: 0.08630935153010053
Energy: 0.03540082361683706
Energy: 0.03553488456373647
Energy: 0.08609888505548091
Energy: 0.03525708745324398
Energy: 0.08686009117107088
Energy: 0.03803441101310192
Energy: 0.03558885999050258
Energy: 0.03570709082355286
Energy: 0.038609200232710805
Energy: 0.03539570656886831
Energy: 0.08753039732662446
Energy: 0.08699153059856798
Energy: 0.08631252503078035
Energy: 0.08599120836697743
Energy: 0.08825821330292145
Energy: 0.08633372502588402
Energy: 0.08644849075129182
Energy: 0.03616990081731131
Energy: 0.036219673999872144
Energy: 0.035975809503041876
Energy: 0.03795858846095703
Energy: 0.03592206913657498
Energy: 0.03548523709713022
Energy: 0.08735091604945676
Energy: 0.03580609945875608
Energy: 0.03600117720547081
Energy: 0.08635869479747284
Energy: 0.037763345143809565
Energy: 0.036565043564194065
Energy: 0.08683720989887725
Energy: 0.035462716760183324
Energy: 0.035595963114116086
Energy: 0.08598937183021145
Energy: 0.03508987076297472
Energy: 0.08708602494418466
Energy: 0.03777558332864055
Energy: 0.03609155726845159
Energy: 0.09053973751777968
Energy: 0.03836683085572307
Energy: 0.03566057822409922
Energy: 0.08953663080143177
Energy: 0.035719994740432505
Energy: 0.08622055640043469
Energy: 0.08607430125484718
Energy: 0.03581326267010137
Energy: 0.08634009981885592
Energy: 0.08681303170831028

minimum gb energy = 0.03488021765658625 eV
minimum distance =  2.53465151831939 Angstroms
sigma value = 3


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

Energy: 0.8706981938600901
Energy: 0.9024063948592146
Energy: 0.8483406012858834
Energy: 0.8114563060888944
Energy: 0.8462122286964069
Energy: 0.8205939739904561
Energy: 0.8830838454406625
Energy: 0.8617103518520404
Energy: 0.8574655616279043
Energy: 0.8525783846474358
Energy: 0.8727704398531996
Energy: 0.8575205356520127
Energy: 0.9029093273125401
Energy: 0.8066558969377636
Energy: 0.8100102660039593
Energy: 0.8512766607634793
Energy: 0.8363645999128113
Energy: 0.835443293262958
Energy: 0.876896565043884
Energy: 0.8110336228365206
Energy: 0.8101249919193699
Energy: 0.8495541901698905
Energy: 0.806850306297434
Energy: 0.8386726267735564
Energy: 0.8206457805433697
Energy: 0.8589986749422484
Energy: 0.8539271122120475
Energy: 0.8205465545418161
Energy: 0.8804967578204731
Energy: 0.8540441178041622
Energy: 0.8026278598953926
Energy: 0.8502774529063526
Energy: 0.8303113796846044
Energy: 0.7881203722738389
Energy: 0.8506959344954029
Energy: 0.787682134929643
Energy: 0.8596185954436821
Energy: 0.8364157932707253
Energy: 0.8360710726973162
Energy: 0.8597428898192561
Energy: 0.8420095263231463
Energy: 0.9552665277778679
Energy: 0.8588100968423887
Energy: 0.8022692356981624
Energy: 0.8068201333064356
Energy: 0.8405069264788249
Energy: 0.7716645873402189
Energy: 0.797530894184056
Energy: 0.839179841304211
Energy: 0.8031334194114841
Energy: 0.8418112447278125
Energy: 0.8497022058862086
Energy: 0.8173268749188929
Energy: 0.8427452917671278
Energy: 0.8309482899063589
Energy: 0.8134712365003035
Energy: 0.8168782319488067
Energy: 0.832310950694104
Energy: 0.8272562387485495
Energy: 0.8185416451511657
Energy: 0.7955977741492983
Energy: 0.8127578423143413
Energy: 0.8177193209265544
Energy: 0.7814121826396312
Energy: 0.8042491485284653
Energy: 0.7858052955211416
Energy: 0.7654076419506458
Energy: 0.8243074248767672
Energy: 0.8221439873530452
Energy: 0.7652093401366243
Energy: 0.8246604780579819
Energy: 0.7766904619598589
Energy: 0.7703521097828533
Energy: 0.7675121338114483
Energy: 0.7961547595846359
Energy: 0.7704766614031789
Energy: 0.766581932286452
Energy: 0.7708037051249794
Energy: 0.7835142134037899
Energy: 0.804026391678768
Energy: 0.7931005129386706
Energy: 0.7967788254238721
Energy: 0.8045494229309321
Energy: 0.7952891672512321
Energy: 0.7825607378168071
Energy: 0.7398843079779407
Energy: 0.7399458347301965
Energy: 0.7822804057576743
Energy: 0.7448822109695795
Energy: 0.737532769542247
Energy: 0.7792734945467382
Energy: 0.7827779085233704
Energy: 0.7857887288944813
Energy: 0.7785331519116409
Energy: 0.7774134948047104
Energy: 0.7867255414290978
Energy: 0.7215983966235008
Energy: 0.7874584002064238
Energy: 0.7861723810408977
Energy: 0.7212770060739903
Energy: 0.7791391369117726
Energy: 0.7212532656643722
Energy: 0.7218951287499534
Energy: 0.770180419134168
Energy: 0.7708319023330275
Energy: 0.7218872740163861
Energy: 0.7698867055830788
Energy: 0.7699813171035371
Energy: 0.7670220762577729
Energy: 0.7696284674858579
Energy: 0.7736604571211986
Energy: 0.7699916590170492
Energy: 0.778215324081292
Energy: 0.7710605403176636
Energy: 0.7768319777882011
Energy: 0.7230704413292094
Energy: 0.7228847726702078
Energy: 0.7784250446189797
Energy: 0.7232246879588102
Energy: 0.7233059396814637
Energy: 0.7769084142885894
Energy: 0.7774528529165753
Energy: 0.7878764866134098
Energy: 0.7790321198523591
Energy: 0.7798534907188213
Energy: 0.785853537474429
Energy: 0.7441352806668642
Energy: 0.7783066988160299
Energy: 0.7590331561219038
Energy: 0.7402001066294307
Energy: 0.7791855868269509
Energy: 0.7409614104794562
Energy: 0.7355673098600642
Energy: 0.7925776540112247
Energy: 0.7928814309318131
Energy: 0.7357946708885023
Energy: 0.7923710999079349
Energy: 0.7919664209896554
Energy: 0.7851482562222778
Energy: 0.7714315668487526
Energy: 0.7962767576910326
Energy: 0.7822869860043393
Energy: 0.7788186480342976
Energy: 0.7826007644328049
Energy: 0.8078585368220743
Energy: 0.7665787893519458
Energy: 0.7643965092453974
Energy: 0.8093884671671049
Energy: 0.7702629080083946
Energy: 0.7771438101268279
Energy: 0.8073942346447633
Energy: 0.7990641661223943
Energy: 0.7995609368342851
Energy: 0.8087345246342807
Energy: 0.7667494680052209
Energy: 0.8196121451494994
Energy: 0.8259004525158812
Energy: 0.8006236812285746
Energy: 0.8019095135248008
Energy: 0.826879525205157
Energy: 0.8141090713807844
Energy: 0.8218941022721568
Energy: 0.8123098055568254
Energy: 0.8507140217369273
Energy: 0.8505553922685515
Energy: 0.7845804268691233
Energy: 0.8511686567141493
Energy: 0.8503547181404205
Energy: 0.8037402506587829
Energy: 0.8498353700519865
Energy: 0.8340189002323201
Energy: 0.7870147942548318
Energy: 0.8430854885883908
Energy: 0.7866152067444052
Energy: 0.8423118220607315
Energy: 0.8480113029495712
Energy: 0.8515681293634616
Energy: 0.8369219664439449
Energy: 0.844504235786339
Energy: 0.9597838629235257
Energy: 0.8513319731352222
Energy: 0.806498104911171
Energy: 0.8157463183560221
Energy: 0.8515064018653627
Energy: 0.7750796060444011
Energy: 0.8162581573570176
Energy: 0.9024414191090693
Energy: 0.8085156949563299
Energy: 0.8499069055966896
Energy: 0.856121310519428
Energy: 0.8196807425821041
Energy: 0.851848321438249
Energy: 0.8125026226595342
Energy: 0.8514329162142933
Energy: 0.8455544711068352
Energy: 0.8115741966739257
Energy: 0.8700145443906278
Energy: 0.8339626105579563

minimum gb energy = 0.7212532656643722 eV
minimum distance =  2.35350106779815 Angstroms
sigma value = 67


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

Energy: 1.0631167345200314
Energy: 1.0780648368313093
Energy: 1.0286507038545283
Energy: 1.0233139497103454
Energy: 1.083682983310049
Energy: 1.0616637730986884
Energy: 1.0939735191881474
Energy: 1.0752330974029325
Energy: 1.05058011672969
Energy: 1.0660510840372046
Energy: 1.0653367873432011
Energy: 1.0435619331340638
Energy: 1.130905610259339
Energy: 1.0171017304263474
Energy: 1.0367177550229147
Energy: 1.0707719008115029
Energy: 1.0174184134950115
Energy: 1.036821658849087
Energy: 1.142830893592221
Energy: 1.0365665055375788
Energy: 1.0407320018654593
Energy: 1.1457015532920474
Energy: 1.0166739673797152
Energy: 1.0408939425352974
Energy: 1.0434450036197975
Energy: 1.057551318603436
Energy: 1.046594933184216
Energy: 1.0389012063802037
Energy: 1.06405832614313
Energy: 1.043671981778111
Energy: 0.9856693862831326
Energy: 1.0304764964955326
Energy: 1.0082833228308468
Energy: 1.0201084341988906
Energy: 1.0299165921432902
Energy: 1.020649962877902
Energy: 1.0590439716803535
Energy: 1.0495725646900496
Energy: 1.054152214477964
Energy: 1.0603697246958663
Energy: 1.0316849925497844
Energy: 1.0293266895933233
Energy: 1.0572032346157862
Energy: 0.9973790379807752
Energy: 1.003358978866983
Energy: 1.0517352831992919
Energy: 0.9966857382284043
Energy: 1.0339289119967603
Energy: 0.9988735202188057
Energy: 1.0325238373874637
Energy: 1.034090774093382
Energy: 1.021080203069085
Energy: 1.0184076220013585
Energy: 1.0397674935313
Energy: 0.9990368538169441
Energy: 0.9896132281036898
Energy: 0.9902027361677701
Energy: 0.9999003227309669
Energy: 0.9842081724518447
Energy: 1.0060730777084277
Energy: 0.9960534655996495
Energy: 0.9733369513342351
Energy: 1.0153412438347615
Energy: 0.9416296603504862
Energy: 0.9712067318994265
Energy: 1.0163861870893096
Energy: 0.9449958454606658
Energy: 1.0160954344447097
Energy: 1.0154741006183587
Energy: 0.9387694489447896
Energy: 1.0142046901088395
Energy: 0.9408994109126787
Energy: 0.9382822059468886
Energy: 1.0052948498784704
Energy: 1.0050139516415928
Energy: 0.938494961845679
Energy: 1.000986082838292
Energy: 0.9412964584621257
Energy: 0.9673812459061075
Energy: 0.9744414576458553
Energy: 1.0066445865249383
Energy: 0.9665013407530235
Energy: 0.9705560802915131
Energy: 1.0053412149791208
Energy: 0.9694126495310197
Energy: 0.9471434759859862
Energy: 0.9376472842473719
Energy: 0.9691041425807677
Energy: 0.9457305026277553
Energy: 0.9412380310091929
Energy: 0.9693598909956936
Energy: 1.0119386004528907
Energy: 1.008893078713933
Energy: 1.012436196915695
Energy: 1.0011281732186594
Energy: 1.006843417766468
Energy: 0.9894420668364262
Energy: 0.9934472834561663
Energy: 1.0119766120824116
Energy: 0.9839502834241047
Energy: 0.9917624813626567
Energy: 0.9847625344156149
Energy: 0.986982323285986
Energy: 1.0313841832415078
Energy: 1.033870691300297
Energy: 0.9865211139484072
Energy: 1.0158797623880678
Energy: 1.028540039299373
Energy: 0.9690660538331981
Energy: 0.9950371725992267
Energy: 1.0087414975488689
Energy: 1.011105427482564
Energy: 0.9955993658374946
Energy: 1.0084126100174307
Energy: 1.0235137321000451
Energy: 1.032391229396991
Energy: 1.030771476721465
Energy: 1.0194522161230661
Energy: 1.044254872870616
Energy: 1.035120906510074
Energy: 1.0403542258357383
Energy: 1.0373595620365654
Energy: 1.0373337012446169
Energy: 1.036932902605522
Energy: 1.0019754818431281
Energy: 1.0600202204792128
Energy: 1.2439402491204856
Energy: 1.007050136169744
Energy: 1.0371231354825876
Energy: 1.0717067598969803
Energy: 1.0057321122145397
Energy: 1.0370055329565546
Energy: 1.0762207440762661
Energy: 1.0716356473541562
Energy: 1.0565277580219583
Energy: 1.0702755832709636
Energy: 1.0614439938685771
Energy: 1.043575034518265

minimum gb energy = 0.9376472842473719 eV
minimum distance =  2.3846549711529 Angstroms
sigma value = 33


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

Energy: 1.2489976294877743
Energy: 1.2272271036911313
Energy: 1.2164595186760134
Energy: 1.204139454663939
Energy: 1.2542836707237994
Energy: 1.2018777217987329
Energy: 1.2432885695559353
Energy: 1.21775171542399
Energy: 1.2036057604413726
Energy: 1.2316202829321432
Energy: 1.2558489054672382
Energy: 1.2022251652721936
Energy: 1.307544463127891
Energy: 1.1719150628626307
Energy: 1.171676970452245
Energy: 1.2114134689509062
Energy: 1.179676434598217
Energy: 1.173575770253266
Energy: 1.228248624598451
Energy: 1.1708137239432488
Energy: 1.1748411598588941
Energy: 1.2094406088794258
Energy: 1.1813685990231533
Energy: 1.1765687195534338
Energy: 1.2294879171035487
Energy: 1.2130381110415958
Energy: 1.1828543193651595
Energy: 1.2076962397376463
Energy: 1.2250511688832237
Energy: 1.1803641502990567
Energy: 1.1455127969652463
Energy: 1.1542108328163942
Energy: 1.15484761056591
Energy: 1.1554953375425399
Energy: 1.1527921732433293
Energy: 1.1734598340840177
Energy: 1.1958831431928882
Energy: 1.2046401536529903
Energy: 1.2019209356457758
Energy: 1.1957169833673196
Energy: 1.207081196148272
Energy: 1.1707422541711883
Energy: 1.1941939470165261
Energy: 1.178301171324917
Energy: 1.1780439176903772
Energy: 1.1822069024366328
Energy: 1.1358317025821227
Energy: 1.1773169852034875
Energy: 1.1084187303810582
Energy: 1.1753477718091019
Energy: 1.1619496890047378
Energy: 1.110573302128675
Energy: 1.1606007416189033
Energy: 1.179227562658379
Energy: 1.1083876671825765
Energy: 1.1319207355965253
Energy: 1.1393658630409056
Energy: 1.1096175809129614
Energy: 1.127595698348583
Energy: 1.1380458586343791
Energy: 1.10602961819345
Energy: 1.1055391551480043
Energy: 1.1661035173969858
Energy: 1.1475994638279552
Energy: 1.111280720118807
Energy: 1.1509802045661155
Energy: 1.1895137225663872
Energy: 1.1475944461130159
Energy: 1.1461552178986516
Energy: 1.12629539491381
Energy: 1.144095449340017
Energy: 1.1366859477377356
Energy: 1.1231274076323985
Energy: 1.140110119652503
Energy: 1.173319276573259
Energy: 1.1235567228019108
Energy: 1.1407204464673166
Energy: 1.1370561544614803
Energy: 1.114377485122659
Energy: 1.1055560199705323
Energy: 1.1782507540123992
Energy: 1.1436305186840545
Energy: 1.1055604899410434
Energy: 1.1430760036345593
Energy: 1.1207236415144401
Energy: 1.1857052432880641
Energy: 1.1785362225258385
Energy: 1.12194850139805
Energy: 1.1963166645670282
Energy: 1.1798392049106137
Energy: 1.162640657102314
Energy: 1.166533189955645
Energy: 1.1743860950627507
Energy: 1.1653074004205426
Energy: 1.1852563268389467
Energy: 1.1911676229998591
Energy: 1.3037801261045328
Energy: 1.1640722568414092
Energy: 1.164687430308688
Energy: 1.2087843834110161
Energy: 1.1430618013518534
Energy: 1.1646848432127592
Energy: 1.3295206382539366
Energy: 1.2233219391568535
Energy: 1.2055307024678252
Energy: 1.2302559911446274
Energy: 1.25927112661013
Energy: 1.2096258329872969
Energy: 1.1720046617805546
Energy: 1.2226268548404793
Energy: 1.1821176146583092
Energy: 1.1647881631785408
Energy: 1.222812193230323
Energy: 1.1617769019684416
Energy: 1.2447086508828156
Energy: 1.2120858589910888
Energy: 1.1860830242387628
Energy: 1.2105799885468274
Energy: 1.2271008572942017
Energy: 1.1828525246758792
Energy: 1.3123033852923605
Energy: 1.1751567371331213
Energy: 1.1714909295277856
Energy: 1.210646676594534
Energy: 1.186645359517298
Energy: 1.1769006414479044
Energy: 1.2197118831149845
Energy: 1.171452626093526
Energy: 1.1717194929027577
Energy: 1.210878760607128
Energy: 1.1782876330752232
Energy: 1.1741472003104685
Energy: 1.2312271077164043
Energy: 1.2290236307750633
Energy: 1.2048289189736987
Energy: 1.223150757663686
Energy: 1.2554808908558104
Energy: 1.2008185890323533
Energy: 1.145625806209374
Energy: 1.1535686644492336
Energy: 1.1538458241991736
Energy: 1.1544166682340142
Energy: 1.1537919589440109
Energy: 1.1541363963417104
Energy: 1.1947584196462893
Energy: 1.203070735508136
Energy: 1.20232043251371
Energy: 1.1957328613719367
Energy: 1.1557331104416135
Energy: 1.201120473377608
Energy: 1.193899417988528
Energy: 1.1789359454727746
Energy: 1.1781802916860102
Energy: 1.1924268378617817
Energy: 1.1360011862933352
Energy: 1.1773248350600776
Energy: 1.107475171029666
Energy: 1.1713114076886404
Energy: 1.1627818820708837
Energy: 1.1094018609195424
Energy: 1.1557095391213341
Energy: 1.1792255231841169
Energy: 1.109107613378077
Energy: 1.122587400781479
Energy: 1.1405512184091202
Energy: 1.110373106946496
Energy: 1.1278386617132239
Energy: 1.1377173075333933
Energy: 1.1064829461102417
Energy: 1.1055140770033105
Energy: 1.159567498562919
Energy: 1.1581383142795023
Energy: 1.108005774678044
Energy: 1.1471611022559793
Energy: 1.120698331605836
Energy: 1.1469132974763976
Energy: 1.1466944374230719
Energy: 1.1216523442872532
Energy: 1.1447739804564951
Energy: 1.1362088234150534
Energy: 1.1264145482323817
Energy: 1.1904798001569974
Energy: 1.1714797596885973
Energy: 1.1236348700200942
Energy: 1.1410647960579579
Energy: 1.1363875255608877
Energy: 1.1141219200538557
Energy: 1.1391661821746315
Energy: 1.1792374943894406
Energy: 1.1440765924240992
Energy: 1.1081373817722582
Energy: 1.15013307981255
Energy: 1.121763920803882
Energy: 1.1858639595902114
Energy: 1.1800306175803972
Energy: 1.1162514317319643
Energy: 1.1831541548630324
Energy: 1.1819491754792437
Energy: 1.2226971141640168
Energy: 1.1718472065808727
Energy: 1.2058724413137838
Energy: 1.221011437729043
Energy: 1.170358456362795
Energy: 1.1963240200918774
Energy: 1.3082349421076287
Energy: 1.1654308358415713
Energy: 1.1644568994919116
Energy: 1.2214380501357858
Energy: 1.140037288111404
Energy: 1.1644443401017057
Energy: 1.3293182516599353
Energy: 1.223151084025371
Energy: 1.207548945058452
Energy: 1.2291942604536397
Energy: 1.2598367222197295
Energy: 1.2061047041903745
Energy: 1.1719652061252135
Energy: 1.2234279591574366
Energy: 1.1816120212175028
Energy: 1.1612704828744085
Energy: 1.2237848639737217
Energy: 1.1630409584339314

minimum gb energy = 1.1055140770033105 eV
minimum distance =  2.38404730509751 Angstroms
sigma value = 41


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

Energy: 1.4374371153310017
Energy: 1.4450850927037606
Energy: 1.4379108736710988
Energy: 1.3898568251315688
Energy: 1.4198059073903322
Energy: 1.4380429650005295
Energy: 1.4354593177325836
Energy: 1.4287767524721973
Energy: 1.3801394673981828
Energy: 1.4327902117666333
Energy: 1.4322153378264078
Energy: 1.3822101322862346
Energy: 1.5611795357637555
Energy: 1.3740623969211128
Energy: 1.3721781879979926
Energy: 1.42509572170175
Energy: 1.362845643715843
Energy: 1.3803370868157805
Energy: 1.421901008628103
Energy: 1.375365219962522
Energy: 1.3748545163420276
Energy: 1.4210480358419746
Energy: 1.4030262565017109
Energy: 1.3906068809953733
Energy: 1.4236845720402191
Energy: 1.4379140008206799
Energy: 1.3892172438120558
Energy: 1.452285156528456
Energy: 1.4368965239276985
Energy: 1.3894397020323594
Energy: 1.358876311998831
Energy: 1.3662848208835254
Energy: 1.3886890195290678
Energy: 1.3637292266030117
Energy: 1.3649035672897465
Energy: 1.3867711015691697
Energy: 1.3974168138240564
Energy: 1.3855806566921658
Energy: 1.3801753198338773
Energy: 1.396917379821403
Energy: 1.3852351513630583
Energy: 1.348285857641209
Energy: 1.4296087352802624
Energy: 1.372546815901831
Energy: 1.3502047810593047
Energy: 1.430928592603549
Energy: 1.3514454819516672
Energy: 1.3717921239740376
Energy: 1.3307484555599098
Energy: 1.3736322453018153
Energy: 1.384807517255599
Energy: 1.3323940290246914
Energy: 1.3794043015510322
Energy: 1.36695809465269
Energy: 1.365326767084279
Energy: 1.3855913816824097
Energy: 1.3675559596296383
Energy: 1.390523477731869
Energy: 1.407824896351782
Energy: 1.3508619721108261
Energy: 1.36327750281442
Energy: 1.423482925155771
Energy: 1.3903997139137672
Energy: 1.3883763800399902
Energy: 1.44235513312345
Energy: 1.3891811363064817
Energy: 1.6426541191026496
Energy: 1.3670318872672877
Energy: 1.3701927896331076
Energy: 1.6444032195480005
Energy: 1.365249246031381
Energy: 1.3703731436444517
Energy: 1.561848667174208
Energy: 1.385293256691094
Energy: 1.3880069264926371
Energy: 1.4169847576294112
Energy: 1.4408782974102412
Energy: 1.3818517216241997
Energy: 1.3646397526535854
Energy: 1.4629419869213274
Energy: 1.3907627880947178
Energy: 1.3620287402486095
Energy: 1.4356738081853184
Energy: 1.4094557715956717

minimum gb energy = 1.3307484555599098 eV
minimum distance =  2.34670571015492 Angstroms
sigma value = 11


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

Energy: 1.7701169808592814
Energy: 1.903735338976465
Energy: 1.711586161738227
Energy: 1.636764933858147
Energy: 1.6165240153565592
Energy: 1.6115448676494533
Energy: 1.7601047398562595
Energy: 1.5977548839718143
Energy: 1.5845130977415396
Energy: 1.5308529739832446
Energy: 1.6001409207347783
Energy: 1.596384366655137
Energy: 1.8057362550105152
Energy: 1.556437269471202
Energy: 1.5631068658328873
Energy: 1.5836899827640523
Energy: 1.5576591268388047
Energy: 1.5561804822749654
Energy: 1.5273720610356922
Energy: 1.5584239738473749
Energy: 1.5495937050744624
Energy: 1.5279060765325474
Energy: 1.5701250703800904
Energy: 1.5590950054339547
Energy: 1.5402787795032364
Energy: 1.5641272576742993
Energy: 1.5405534845745055
Energy: 1.558008832828113
Energy: 1.5734364976537405
Energy: 1.5272511386834704
Energy: 1.5371324544280913
Energy: 1.5527443323199344
Energy: 1.5315703402955791
Energy: 1.529276884937187
Energy: 1.5616462206975976
Energy: 1.519865394121564
Energy: 1.5613673267940713
Energy: 1.5204633524319702
Energy: 1.5202401524831077
Energy: 1.5532484148705221
Energy: 1.5192033502128792
Energy: 1.5674643823811656
Energy: 1.6378999303901725
Energy: 1.563074423216642
Energy: 1.528390077472113
Energy: 1.5728086826543912
Energy: 1.555321518943802
Energy: 1.5299320733930388
Energy: 1.600243755275718
Energy: 1.5330000675158617
Energy: 1.5592685950736067
Energy: 1.6171970194878456
Energy: 1.5155944101308343
Energy: 1.5650531729219002
Energy: 1.6005609839782324
Energy: 1.5331861588817133
Energy: 1.5587781895375459
Energy: 1.6202467960385167
Energy: 1.5400900940874267
Energy: 1.5664842634427079
Energy: 1.6294050482891493
Energy: 1.556572601977252
Energy: 1.5504460472702835
Energy: 1.597895751416113
Energy: 1.5451588614175278
Energy: 1.583694714791781
Energy: 1.5780613561455383
Energy: 1.5724107336315927
Energy: 1.5595451884981015
Energy: 1.562419411728532
Energy: 1.5466942339440355
Energy: 1.5290108862283198
Energy: 1.6189965695021904
Energy: 1.5182874954500587
Energy: 1.522487366142366
Energy: 1.6132946792993668
Energy: 1.5332585709829643
Energy: 1.5890803140452212
Energy: 1.5763111682884956
Energy: 1.5591322524595552
Energy: 1.559988364398968
Energy: 1.5377783829824399
Energy: 1.676426327952086
Energy: 1.5618485357588006
Energy: 1.5956136106046723
Energy: 1.5654756510834933
Energy: 1.55688876028057
Energy: 1.5759820633830888
Energy: 1.5184880930785323
Energy: 1.5230316697158333
Energy: 1.6030712792593995
Energy: 1.5205963796595852
Energy: 1.521931501193673
Energy: 1.6039783462639612
Energy: 1.5407388914981412
Energy: 1.5217562028259914
Energy: 1.5594372274033115
Energy: 1.527313483787185
Energy: 1.520819613613844
Energy: 1.5519619062783379
Energy: 1.5186577843736215
Energy: 1.5127185457830066
Energy: 1.5487501991912922
Energy: 1.612202609325383
Energy: 1.609120000118832
Energy: 1.5253354941771657
Energy: 1.565485116782353
Energy: 1.5247192955229676
Energy: 1.5556408909504988
Energy: 1.5181466867916695
Energy: 1.5195364601162324
Energy: 1.5568471211708537
Energy: 1.5199681366372175
Energy: 1.5213930957358839
Energy: 1.5492276860279932
Energy: 1.5645778952744078
Energy: 1.5632057123388474
Energy: 1.5334430681332574
Energy: 1.5667484005905257
Energy: 1.5484404549082962
Energy: 1.7532913481047767
Energy: 1.565861664995425
Energy: 1.5147668801767924
Energy: 1.613226642319058
Energy: 1.554453039290517
Energy: 1.553580930323594
Energy: 1.6587463160779832
Energy: 1.5641564739254703
Energy: 1.5323512100839851
Energy: 1.6030118625857974
Energy: 1.5645799388132304
Energy: 1.550790928877658
Energy: 1.6330007468937504
Energy: 1.5553804794974704
Energy: 1.5536042679149444
Energy: 1.557719653909054
Energy: 1.5362653687482206
Energy: 1.5669381208798316
Energy: 1.7011147964828461
Energy: 1.5741688684180815
Energy: 1.5637252816417555
Energy: 1.519401672088653
Energy: 1.5769438664574198
Energy: 1.52043584254692
Energy: 1.5637250847002975
Energy: 1.540106313298282
Energy: 1.5398253345519337
Energy: 1.5640745456451004
Energy: 1.5253619936105869
Energy: 1.5596712058093618
Energy: 1.5171024568661904
Energy: 1.551978045794436
Energy: 1.5579140355956338
Energy: 1.5329053141485705
Energy: 1.537245733556245
Energy: 1.5203499586305047
Energy: 1.517886384399663
Energy: 1.544890029913327
Energy: 1.5363641917740116
Energy: 1.528900609547397
Energy: 1.5952101043176938
Energy: 1.535172332777543
Energy: 1.5150340363322166
Energy: 1.5724638678305194
Energy: 1.535187446930054
Energy: 1.5256770144867675
Energy: 1.5752877715209457
Energy: 1.5223654528503394
Energy: 1.5407860090169472
Energy: 1.5519482417563955
Energy: 1.5552760908690972
Energy: 1.540780432179187
Energy: 1.5234855352323402
Energy: 1.55088186475388
Energy: 1.7949330065304765
Energy: 1.5886357802469913
Energy: 1.5912025036341846
Energy: 1.515862149624383
Energy: 1.5879462569475726
Energy: 1.5247392369198332
Energy: 1.6733683657938567
Energy: 1.5568721478814715
Energy: 1.5276442859768058
Energy: 1.5665444029011757
Energy: 1.5572492216984488
Energy: 1.5278235208879214

minimum gb energy = 1.5127185457830066 eV
minimum distance =  2.32377216498235 Angstroms
sigma value = 57


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

Energy: 2.226227633495686
Energy: 1.696240808969722
Energy: 1.695935861006419
Energy: 1.7038928485521605
Energy: 1.6798664585444725
Energy: 1.696610236139957
Energy: 1.688706594949575
Energy: 1.6768168592931092
Energy: 1.6867776229682239
Energy: 1.6761639876648893
Energy: 1.6752183905882354
Energy: 1.646848529790857
Energy: 1.7944158503597567
Energy: 1.6243375451824298
Energy: 1.6239355274228855
Energy: 1.6425249141932174
Energy: 1.6054590602052974
Energy: 1.676900739986383
Energy: 1.6464585776954894
Energy: 1.6413389386395327
Energy: 1.6633705182418244
Energy: 1.6471298954525901
Energy: 1.6208909555754005
Energy: 1.6782887056851845
Energy: 1.633831927471035
Energy: 1.6455740224161635
Energy: 1.6423134409868345
Energy: 1.638656306201483
Energy: 1.6664127858963351
Energy: 1.6414202187715028
Energy: 1.634617782265464
Energy: 1.6700193642632846
Energy: 1.6943073603561334
Energy: 1.6252957213721941
Energy: 1.6913821751687954
Energy: 1.668889501146221
Energy: 1.6910889462617915
Energy: 1.6430372156767654
Energy: 1.641469049558394
Energy: 1.6927506936360772
Energy: 1.645385492368069
Energy: 1.6630081169634678
Energy: 1.7753047775946653
Energy: 1.6408703817911396
Energy: 1.6305644708492926
Energy: 1.668115558190795
Energy: 1.6879227600620874
Energy: 1.65958612925127
Energy: 1.6827944235520869
Energy: 1.6662293797406011
Energy: 1.6376621458713987
Energy: 1.6760402654720619
Energy: 1.6402653686585784
Energy: 1.6384866830859952
Energy: 1.6820400543086362
Energy: 1.676952759862022
Energy: 1.637577164145637
Energy: 1.6777189483839097
Energy: 1.6783698190105076
Energy: 1.638341120888695
Energy: 1.7849864995246478
Energy: 1.6407440197416958
Energy: 1.6642195792409191
Energy: 1.674456889295975
Energy: 1.6878870429555666
Energy: 1.6619080391491619
Energy: 1.6465036618555948
Energy: 1.652504488897126
Energy: 1.6531478669892827
Energy: 1.6478685351037612
Energy: 1.651900019872023
Energy: 1.6681817592903847
Energy: 1.6393979655876445
Energy: 1.6870469192937656
Energy: 1.6490970787161638
Energy: 1.6392959925231818
Energy: 1.6753880540986403
Energy: 1.661675551283968
Energy: 1.6360322756850076
Energy: 1.6410359969157795
Energy: 1.6372459835310413
Energy: 1.6256065994236149
Energy: 1.7009015960795966
Energy: 1.6330140366867103
Energy: 1.6556893938161312
Energy: 1.6297899357550816
Energy: 1.6490207647841384
Energy: 1.6669488801009111
Energy: 1.559006654136312
Energy: 1.6468486273191878
Energy: 1.7759656364122631
Energy: 1.6336956012108101
Energy: 1.6323577498558206
Energy: 1.637875533039119
Energy: 1.5606000504113517
Energy: 1.636306723604687
Energy: 1.6887236317845902
Energy: 1.6428787434085947
Energy: 1.6722853651338132
Energy: 1.689405824800255
Energy: 1.6439360026391525
Energy: 1.646642231651074

minimum gb energy = 1.559006654136312 eV
minimum distance =  2.35695478500635 Angstroms
sigma value = 9


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

Energy: 1.8363031445796336
Energy: 1.7348029290575535
Energy: 1.7231357849439732
Energy: 1.7166442910207804
Energy: 1.791074640327772
Energy: 1.6996099387025305
Energy: 1.8190375950041229
Energy: 1.6550157633459162
Energy: 1.6599767718365948
Energy: 1.7064331366301253
Energy: 1.6960508494335003
Energy: 1.6732497921349008
Energy: 1.8127934275803945
Energy: 1.7799614204242602
Energy: 1.7229865012191503
Energy: 1.7667939865200128
Energy: 1.7457151104346165
Energy: 1.7625101481660175
Energy: 1.7192565682371055
Energy: 1.6704394043984268
Energy: 1.6694470914111845
Energy: 1.6921714531960912
Energy: 1.6463683544703176
Energy: 1.6943261970162422
Energy: 1.7169460526882092
Energy: 1.632441462914115
Energy: 1.6347217485908259
Energy: 1.7240834188674605
Energy: 1.6694599571300646
Energy: 1.6371923146601204
Energy: 1.6304991849556467
Energy: 1.6540047287009594
Energy: 1.6492346384209786
Energy: 1.6801907064637416
Energy: 1.6708314121072334
Energy: 1.6484184604537708
Energy: 1.6627288442669057
Energy: 1.739106106343758
Energy: 1.6832659511622077
Energy: 1.664811571568626
Energy: 1.8259969009103545
Energy: 1.6831908116937933
Energy: 1.7708123292485876
Energy: 1.6630155518709422
Energy: 1.6576418916461912
Energy: 1.7258884946560118
Energy: 1.653690092884233
Energy: 1.6564730110129304
Energy: 1.7745511291687401
Energy: 1.682500973504
Energy: 1.6682426417010403
Energy: 1.6950309590285937
Energy: 1.6730625162415447
Energy: 1.717507770174452
Energy: 1.7740873889268538
Energy: 1.6827389199557494
Energy: 1.6682978527070143
Energy: 1.7102247751985469
Energy: 1.6895808979339113
Energy: 1.6705249069380925
Energy: 1.7772353305982833
Energy: 1.68289319062963
Energy: 1.6295846711671043
Energy: 1.6788479883427911
Energy: 1.694864649734297
Energy: 1.6250809384996519
Energy: 1.731529703380903
Energy: 1.6995299856734942
Energy: 1.6710124232237058
Energy: 1.6990042759467756
Energy: 1.713395395732124
Energy: 1.6698348181941702
Energy: 1.788529050254727
Energy: 1.7173608709078028
Energy: 1.719467084350024
Energy: 1.7344406205150753
Energy: 1.6901022651236703
Energy: 1.7397383838002978
Energy: 1.7958808377904287
Energy: 1.7055004690306252
Energy: 1.6945033830038592
Energy: 1.7108535740432294
Energy: 1.70217021534589
Energy: 1.6948712097970964
Energy: 1.732793257936775
Energy: 1.6596062884350935
Energy: 1.6573599734555107
Energy: 1.7344405930347795
Energy: 1.6538887864675436
Energy: 1.6651279618214494
Energy: 1.701567902959549
Energy: 1.72742439297715
Energy: 1.667738491346237
Energy: 1.7021021303814583
Energy: 1.714068532683383
Energy: 1.666298150547155
Energy: 1.7431861489403506
Energy: 1.7094126141431334
Energy: 1.6960603979308784
Energy: 1.7108951858561245
Energy: 1.7087561451617805
Energy: 1.6706253312168908
Energy: 1.7613040012273649
Energy: 1.7174429547540189
Energy: 1.713317865231421
Energy: 1.7544870857283417
Energy: 1.7444106942778381
Energy: 1.7140500815110096
Energy: 1.7614404650050048
Energy: 1.7375315640470108
Energy: 1.7319402114544367
Energy: 1.7633011506098315
Energy: 1.734986782079041
Energy: 1.711382483977382
Energy: 1.8124351955835671
Energy: 1.7316397046884398
Energy: 1.7329241823021826
Energy: 1.7338150238885741
Energy: 1.7135863333532713
Energy: 1.7236152600911352
Energy: 1.738859708206963
Energy: 1.6611837126328028
Energy: 1.6681264056305287
Energy: 1.6730329804171626
Energy: 1.7019845030535057
Energy: 1.6659174702425135

minimum gb energy = 1.6250809384996519 eV
minimum distance =  2.33904760848966 Angstroms
sigma value = 27


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

Energy: 2.46459068639769
Energy: 1.7221006527369518
Energy: 1.6818134257983484
Energy: 1.655364351449567
Energy: 2.3252817153380585
Energy: 1.7742987048795897
Energy: 1.7883077191978336
Energy: 1.7587124326579842
Energy: 1.7666050362377175
Energy: 1.655596931178596
Energy: 1.7090144545857588
Energy: 1.6907645472198685
Energy: 1.8539874557491962
Energy: 1.6395570508981647
Energy: 1.7076552503138667
Energy: 1.6762429335021303
Energy: 1.6952977820946127
Energy: 1.6512647902838302
Energy: 1.8963284556926965
Energy: 1.6849821549733603
Energy: 1.6699237098304738
Energy: 1.7432398932528619
Energy: 1.6951744239093463
Energy: 1.6795544098393662
Energy: 1.6807241473431795
Energy: 1.6964893428467935
Energy: 1.6280704060470936
Energy: 1.6805920619932113
Energy: 1.7168490116639108
Energy: 1.7720143901326064
Energy: 1.809974049180725
Energy: 1.7818231985674091
Energy: 1.768150358118967
Energy: 1.7901649599541753
Energy: 1.7621582355607375
Energy: 1.7812389545979939
Energy: 1.8453948117262475
Energy: 1.687401194643833
Energy: 1.6889425384307057
Energy: 1.6380641263182802
Energy: 1.688685520203824
Energy: 1.6836986409329546
Energy: 1.808367298300671
Energy: 1.686943903897268
Energy: 1.7748101325190013
Energy: 1.8080710758711878
Energy: 1.6919943855932404
Energy: 1.7662539128748307
Energy: 1.8087537671347034
Energy: 1.758801539778315
Energy: 1.7542893443269045
Energy: 1.7540438108673018
Energy: 1.7596567847987432
Energy: 1.7577008232594815
Energy: 1.807808526918665
Energy: 1.7819138124979745
Energy: 1.7722277208577675
Energy: 1.746648884944947
Energy: 1.7879099176473663
Energy: 1.7486452823795438
Energy: 1.8151841793288865
Energy: 1.7381251807236473
Energy: 1.75821106980844
Energy: 1.8298054907399466
Energy: 1.6814441135288611
Energy: 1.7504916582917582
Energy: 1.8372665848039549
Energy: 1.7435378724052022
Energy: 1.740099892134599
Energy: 1.7639855910237632
Energy: 1.7406767502825244
Energy: 1.7509549775263127
Energy: 1.8939718024131187
Energy: 1.7812643625277624
Energy: 1.7327924381698376
Energy: 1.701987077235511
Energy: 1.7799089500488416
Energy: 1.7316935949471624
Energy: 1.891064100566811
Energy: 1.7406968405935035
Energy: 1.7156855765365497
Energy: 1.6737549176086843
Energy: 1.732796998556094
Energy: 1.7024606970086327
Energy: 1.8275670237868942
Energy: 1.7433487105414225
Energy: 1.7328592412625332
Energy: 1.7579037475262116
Energy: 1.7393102224246724
Energy: 1.7611634655664807
Energy: 1.763515086820565
Energy: 1.7430331131273076
Energy: 1.7456139953340837
Energy: 1.7636604663171405
Energy: 1.7008684756335049
Energy: 1.7464162555299392
Energy: 1.6816576111777803
Energy: 1.7931130931252333
Energy: 1.7808368072821308
Energy: 1.6806678162068738
Energy: 1.8256715828063224
Energy: 1.7755300251216024
Energy: 1.749059708447421
Energy: 1.7531004373682362
Energy: 1.7454607424733037
Energy: 1.7579289078777383
Energy: 1.757496030033338
Energy: 1.7472708901921852
Energy: 1.7756003079043894
Energy: 1.6854217603312258
Energy: 1.6849991798854564
Energy: 1.7749376973824504
Energy: 1.6896115629769055
Energy: 1.6891288081025897
Energy: 1.8746241608773415
Energy: 1.6854505497800216
Energy: 1.6833000352398861
Energy: 1.6232884991571792
Energy: 1.6870298829597663
Energy: 1.683659597782367
Energy: 1.9704851849358556
Energy: 1.7551730363385354
Energy: 1.7571966207790262
Energy: 1.7543984806477522
Energy: 1.7623215679951452
Energy: 1.756273823673657
Energy: 1.7361501322483721
Energy: 1.7182501724841674
Energy: 1.717255111165377
Energy: 1.7040993557769348
Energy: 1.7205922068954815
Energy: 1.707715671336221
Energy: 1.864508932922154
Energy: 1.6837079416489273
Energy: 1.6579677351438304
Energy: 1.6402059884431772
Energy: 1.8613397287038294
Energy: 1.7063953012240776
Energy: 1.8929568494730942
Energy: 1.875418885768673
Energy: 1.6964030144523201
Energy: 1.6323086125003106
Energy: 1.6703846643461995
Energy: 1.6816974923534214
Energy: 1.7943315689024195
Energy: 1.7741471750363524
Energy: 1.7308228826831236
Energy: 1.6640742733491118
Energy: 1.7108220647087522
Energy: 1.6855874741986867

minimum gb energy = 1.6232884991571792 eV
minimum distance =  2.27348100104125 Angstroms
sigma value = 19


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

Energy: 1.7775551549452195
Energy: 1.6846241613814112
Energy: 1.6994848001399643
Energy: 1.5906302646363708
Energy: 1.748364305039739
Energy: 1.6253557996481791
Energy: 1.7913384215746266
Energy: 1.6398887974523781
Energy: 1.627776169294081
Energy: 1.633723886459387
Energy: 1.6159060393456035
Energy: 1.633838260499285
Energy: 1.6796286429281484
Energy: 1.6212502054720797
Energy: 1.6160773566544018
Energy: 1.6134037670782293
Energy: 1.6232274734500252
Energy: 1.620334458844954
Energy: 1.6573811618878238
Energy: 1.6402286008349076
Energy: 1.6517321497131185
Energy: 1.6394775349160031
Energy: 1.6128877017642484
Energy: 1.655459937414322
Energy: 1.6474632180870112
Energy: 1.6197279784557406
Energy: 1.6191223795112908
Energy: 1.6417573415712379
Energy: 1.625161822761888
Energy: 1.6204349271702188
Energy: 1.641105670198459
Energy: 1.65690851964708
Energy: 1.6575556211671179
Energy: 1.6317309774535116
Energy: 1.655442115473017
Energy: 1.6533739858924503
Energy: 1.6834626442041585
Energy: 1.5935953756001497
Energy: 1.6105652089141749
Energy: 1.6156481113294552
Energy: 1.6036466897363537
Energy: 1.6095004692828287
Energy: 1.6606699931454731
Energy: 1.6136392421678407
Energy: 1.6341787263525769
Energy: 1.6408711692795195
Energy: 1.6215044043864542
Energy: 1.6091578241508462
Energy: 1.6319060831735153
Energy: 1.615608579214229
Energy: 1.6162598805695025
Energy: 1.6322997533658499
Energy: 1.6251133993574851
Energy: 1.6240558695691876
Energy: 1.6298176309073786
Energy: 1.623146661732636
Energy: 1.6257008377334363
Energy: 1.6144921817549511
Energy: 1.6339437467800886
Energy: 1.626632944723984
Energy: 1.660943173520311
Energy: 1.5954594093208962
Energy: 1.6010091531972943
Energy: 1.5931639574532386
Energy: 1.5941194905767346
Energy: 1.6173545907145082
Energy: 1.7270218470409981
Energy: 1.627910651353839
Energy: 1.6114116256121835
Energy: 1.5855425165555281
Energy: 1.6059426872025886
Energy: 1.6221077297283235
Energy: 1.6554323804162936
Energy: 1.6078879131095143
Energy: 1.5967796590770762
Energy: 1.5988365888626261
Energy: 1.6252982176642408
Energy: 1.6115299059706505
Energy: 1.7004608586178054
Energy: 1.6269549124933633
Energy: 1.6324320907478138
Energy: 1.600714926198311
Energy: 1.6243198594621242
Energy: 1.6195876960406599
Energy: 1.7067991785446097
Energy: 1.5959591058270706
Energy: 1.5956744530089582
Energy: 1.6255344506746878
Energy: 1.5967366968461414
Energy: 1.6014982994525369
Energy: 1.7005232118582496
Energy: 1.6071682929500621
Energy: 1.6078272175922406
Energy: 1.6161621340262735
Energy: 1.6060646564915824
Energy: 1.6142460160082412
Energy: 1.6401247542114625
Energy: 1.6144483346969898
Energy: 1.6310979924006952
Energy: 1.6001416859794284
Energy: 1.6261708853447296
Energy: 1.6350122873787976
Energy: 1.6687118838280275
Energy: 1.6156056396841518
Energy: 1.6161258230701994
Energy: 1.591101591711476
Energy: 1.595985812015449
Energy: 1.6168996139899716
Energy: 1.6875288544311404
Energy: 1.6089583756725143
Energy: 1.6161277264825038
Energy: 1.6094480528328108
Energy: 1.6018972100113038
Energy: 1.624093673090496
Energy: 1.6672270496983246
Energy: 1.6180993523153517
Energy: 1.6174636670589593
Energy: 1.5842856866013244
Energy: 1.6044000429736287
Energy: 1.5948418268556643
Energy: 1.6168414423113642
Energy: 1.6030001943848815
Energy: 1.6015511939251696
Energy: 1.607628893717838
Energy: 1.6158031768042391
Energy: 1.5912277340722003
Energy: 1.6087378666617176
Energy: 1.6130385123917796
Energy: 1.6069257138730944
Energy: 1.6026172963489853
Energy: 1.619836278511291
Energy: 1.6060970203893237
Energy: 1.6474747027210874
Energy: 1.5983920827922953
Energy: 1.607912279749662
Energy: 1.6259910460349976
Energy: 1.5968194256900399
Energy: 1.6095933579458908
Energy: 1.6623236776506736
Energy: 1.5965324464328468
Energy: 1.6111703892870854
Energy: 1.6274758020592934
Energy: 1.592291904758243
Energy: 1.6223291229197723
Energy: 1.6600001663024735
Energy: 1.5915782772139642
Energy: 1.6113994638357936
Energy: 1.6066057159907505
Energy: 1.6117952587990674
Energy: 1.6194323128744008
Energy: 1.6511007942750195
Energy: 1.603487675555462
Energy: 1.587352628655455
Energy: 1.6255548932453885
Energy: 1.563233657830087
Energy: 1.6037717875493496
Energy: 1.6550497227144207
Energy: 1.6254329184972982
Energy: 1.6238944811432723
Energy: 1.6263289511151695
Energy: 1.6281531070703044
Energy: 1.6286429602334618
Energy: 1.6785106828297618
Energy: 1.6229287943927158
Energy: 1.6259511095197525
Energy: 1.628052569989686
Energy: 1.6129855511770057
Energy: 1.6254630728849608
Energy: 1.6633325424706786
Energy: 1.6013549647249927
Energy: 1.6487800038242293
Energy: 1.5891651405973637
Energy: 1.599443043019328
Energy: 1.6111794801548354

minimum gb energy = 1.563233657830087 eV
minimum distance =  2.33301171787999 Angstroms
sigma value = 101


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

Energy: 2.429517451645763
Energy: 1.6498252772421824
Energy: 1.6480109850129598
Energy: 1.4614819730548563
Energy: 1.9038437627732496
Energy: 1.5645211572791007
Energy: 1.6397000178015853
Energy: 1.503872721658583
Energy: 1.545182852249373
Energy: 1.5571989393613708
Energy: 1.563467652229235
Energy: 1.546876044458935
Energy: 1.6384030072586702
Energy: 1.5418933096637282
Energy: 1.5473973908514123
Energy: 1.5155915113655374
Energy: 1.54023580259641
Energy: 1.5172188752194462
Energy: 1.5974676316582037
Energy: 1.5653280580061057
Energy: 1.5609259668655677
Energy: 1.566217668531989
Energy: 1.5574433486404338
Energy: 1.550056493441867
Energy: 1.60445966108922
Energy: 1.5169237638311228
Energy: 1.5134222392290082
Energy: 1.5791280409584003
Energy: 1.5148238555507327
Energy: 1.5551609332486886
Energy: 1.5900261181353361
Energy: 1.527022129712727
Energy: 1.562297433530541
Energy: 1.5694215105277165
Energy: 1.5273078540427072
Energy: 1.56414552283037
Energy: 1.6496998247821604
Energy: 1.5253889134409326
Energy: 1.5338411964229643
Energy: 1.544299045829646
Energy: 1.5213103626121325
Energy: 1.5299760768236184
Energy: 1.571387167525893
Energy: 1.5526599213018293
Energy: 1.5443819628716104
Energy: 1.5718939070930373
Energy: 1.5438111902290184
Energy: 1.5216736261716568
Energy: 1.575161708538103
Energy: 1.5476706291045106
Energy: 1.5394490141320432
Energy: 1.546331325571247
Energy: 1.4981529949741403
Energy: 1.5385022742779926
Energy: 1.5742853765873084
Energy: 1.5592027604366077
Energy: 1.552092234109603
Energy: 1.5703229442581417
Energy: 1.5089489619910548
Energy: 1.5517473277204328
Energy: 1.6314478325724504
Energy: 1.5221324450960327
Energy: 1.535852120733515
Energy: 1.5183769646673377
Energy: 1.5126869325846415
Energy: 1.4492011150494042
Energy: 1.6212818051555578
Energy: 1.53192904971177
Energy: 1.5416613452429844
Energy: 1.5365086076995231
Energy: 1.5512970073438825
Energy: 1.540569726678131
Energy: 1.6020651146867302
Energy: 1.5092149000238253
Energy: 1.5189601995251578
Energy: 1.5376439510345516
Energy: 1.5080825026715445
Energy: 1.5384740835592596
Energy: 1.5841798391954225
Energy: 1.5256336620417599
Energy: 1.534484138744862
Energy: 1.5609069833889715
Energy: 1.5084195816463528
Energy: 1.5446025142902267
Energy: 1.6193918977047834
Energy: 1.543258088882335
Energy: 1.5347633955348294
Energy: 1.5459102292651579
Energy: 1.545836619710181
Energy: 1.5392602298586064
Energy: 1.640581016290404
Energy: 1.5435566184165832
Energy: 1.5504926394168044
Energy: 1.5091152602474898
Energy: 1.551954235118043
Energy: 1.5497458878503358
Energy: 1.6083209092858168
Energy: 1.5544819672294572
Energy: 1.5308562172147302
Energy: 1.5132181145424803
Energy: 1.5525768299721021
Energy: 1.5350060176991513
Energy: 1.6507022283114965
Energy: 1.5030153720443427
Energy: 1.5041511572222745
Energy: 1.5455812495594177
Energy: 1.5021859900665264
Energy: 1.5392796223415048
Energy: 1.6427106842047097
Energy: 1.5507080210050859
Energy: 1.5509954137639315
Energy: 1.510763182678703
Energy: 1.5569378186694642
Energy: 1.553363512809042
Energy: 1.6256899970974583
Energy: 1.5519090777728277
Energy: 1.5549481983757427
Energy: 1.5019687061976421
Energy: 1.5615100861846138
Energy: 1.5529547691593675
Energy: 1.5983485493774885
Energy: 1.550432184565022
Energy: 1.5449053186206643
Energy: 1.5618591995062452
Energy: 1.499637735955004
Energy: 1.5461823222758853
Energy: 1.5932402723225245
Energy: 1.5343129763329553
Energy: 1.5329965234379443
Energy: 1.5674485099056976
Energy: 1.51201526543386
Energy: 1.5506365192447562
Energy: 1.6059598258078571
Energy: 1.5311034939274173
Energy: 1.5400517310712791
Energy: 1.5770219391962506
Energy: 1.5336821187172467
Energy: 1.5405729849650218
Energy: 1.6019339456424613
Energy: 1.5328591166794105
Energy: 1.535621603386159
Energy: 1.5765971042337894
Energy: 1.5355299594059073
Energy: 1.504646015375375
Energy: 1.5744610546901008
Energy: 1.549655562225246
Energy: 1.5525938552169123
Energy: 1.558658346984512
Energy: 1.550767078521512
Energy: 1.5491877764034439
Energy: 1.578024126681432
Energy: 1.5443919351285251
Energy: 1.5491781723865288
Energy: 1.5460971206887066
Energy: 1.526424165379545
Energy: 1.5454499654480225
Energy: 1.636645855956418
Energy: 1.5141518841688788
Energy: 1.5393344598062901
Energy: 1.5060954694351096
Energy: 1.5168851443772922
Energy: 1.5367074903474038
Energy: 1.6225285748657288
Energy: 1.5341171129594822
Energy: 1.5449721605546496
Energy: 1.5062494342611343
Energy: 1.5542018407963112
Energy: 1.5426909931292663
Energy: 1.5944270215777492
Energy: 1.5254442978276483
Energy: 1.5432935348763648
Energy: 1.5555896348720197
Energy: 1.5083859050000807
Energy: 1.5444408473422702
Energy: 1.598866195332195
Energy: 1.5441076108735485
Energy: 1.5451000284044953
Energy: 1.5557258723216598
Energy: 1.5059976908333386
Energy: 1.5456067849757447
Energy: 1.620970168368759
Energy: 1.542276633287025
Energy: 1.5411703442693505
Energy: 1.5082599744015586
Energy: 1.5450431891507097
Energy: 1.5422511288075016
Energy: 1.6402610133798625
Energy: 1.542615265954227
Energy: 1.5413768606873324
Energy: 1.507898450416285
Energy: 1.5528038986592487
Energy: 1.5516985932646883
Energy: 1.600413814304913
Energy: 1.5001332526628133
Energy: 1.5373877135788296
Energy: 1.5412935731030866
Energy: 1.4999717829529309
Energy: 1.543737793218409

minimum gb energy = 1.4492011150494042 eV
minimum distance =  2.35227610551963 Angstroms
sigma value = 33


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

Energy: 0.018494188444030456
Energy: 0.019504401902647097
Energy: 0.019235520784286923
Energy: 0.02102635334026247
Energy: 1.6174270651596092
Energy: 0.019105465647500403
Energy: 0.019514877115318446
Energy: 0.17546783642304822
Energy: 0.17308596516398195
Energy: 0.17588317023786787
Energy: 0.17530917349036215
Energy: 0.17299767698291202
Energy: 2.1218697381863425
Energy: 1.6168673716285376
Energy: 1.6148866264938968
Energy: 1.6197168393281416
Energy: 1.6190792175182298
Energy: 1.6149160722097466
Energy: 0.6643761383690753
Energy: 0.17546783642387767
Energy: 0.17308596516398195
Energy: 0.17588317023786787
Energy: 0.1753091734908013
Energy: 0.17299767698291202

minimum gb energy = 0.018494188444030456 eV
minimum distance =  2.53271813701358 Angstroms
sigma value = 1