Model name: model_name=EAM_Dynamo_Mishin_2004_NiAl__MO_101214310689_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000256299973
cohesive_energy=4.427798539389678
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: -0.0225496501540919 eV

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

Energy: 0.022124525710265425
Energy: 0.6441284312036446
Energy: 0.3820504250943247
Energy: 0.6440923760832523
Energy: 0.02212452571290609
Energy: 0.6441284312010038
Energy: 0.3820504250969653
Energy: 0.6865954648592829
Energy: 0.022602166933638337
Energy: 0.34407674412358025
Energy: 0.02252194835810911
Energy: 0.6865954648592829
Energy: 0.022602166933638337
Energy: 0.3440767441209395
Energy: 0.022124525710265425
Energy: 0.6441284312036446
Energy: 0.3820504250943247
Energy: 0.6440923760832523
Energy: 0.02212452571290609
Energy: 0.6441284312010038
Energy: 0.3820504250969653
Energy: 0.6865954648592829
Energy: 0.022602166933638337
Energy: 0.34407674412358025
Energy: 0.02252194835810911
Energy: 0.6865954648592829
Energy: 0.022602166930997668
Energy: 0.3440767441209395
Energy: 0.022124525710265425
Energy: 0.6441284312036446
Energy: 0.3820504250943247
Energy: 0.6440923760832523
Energy: 0.02212452571290609
Energy: 0.6441284312010038
Energy: 0.3820504250969653
Energy: 0.6865954648592829
Energy: 0.022602166933638337
Energy: 0.34407674412358025
Energy: 0.02252194835810911
Energy: 0.6865954648592829
Energy: 0.022602166930997668
Energy: 0.3440767441209395

minimum gb energy = 0.022124525710265425 eV
minimum distance =  2.46948896131719 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.5464959248050278
Energy: 1.520824260931837
Energy: 1.574440259180405
Energy: 1.5181747235823277
Energy: 1.5464959248147063
Energy: 1.5208242609253846
Energy: 1.574440259170727
Energy: 1.4271951177335125
Energy: 1.4653368886496416
Energy: 1.5093899166387208
Energy: 1.4597636397984721
Energy: 1.4271951177367384
Energy: 1.4653368886431895
Energy: 1.5093899166258165
Energy: 1.4261743672158373
Energy: 1.4273515693222187
Energy: 1.5399491324823216
Energy: 1.4604233370380844
Energy: 1.4261743672222895
Energy: 1.4273515693383492
Energy: 1.5399491324855477
Energy: 1.5264242901034721
Energy: 1.470911199451866
Energy: 1.5718671496410777
Energy: 1.4539390608347202
Energy: 1.5264242901099243
Energy: 1.4709111994389616
Energy: 1.571867149628232
Energy: 1.439507794885555
Energy: 1.413200304797717
Energy: 1.5443686746988252
Energy: 1.4712619828583124
Energy: 1.439507794904853
Energy: 1.4132003048073953
Energy: 1.544368674692373
Energy: 1.4786047004555198
Energy: 1.459724783267069
Energy: 1.4644190559695702
Energy: 1.4651164800461447
Energy: 1.4786047004490677
Energy: 1.4597247832735212
Energy: 1.4644190559727965
Energy: 1.4258549585433011
Energy: 1.4912303491031318
Energy: 1.5527982209588143
Energy: 1.4826091503174055
Energy: 1.4258549585368487
Energy: 1.4912303491128105
Energy: 1.5432192452435833
Energy: 1.4282478840655581
Energy: 1.42826134927626
Energy: 1.544953762324906
Energy: 1.4647234589850733
Energy: 1.4282478840591062
Energy: 1.4282613492665814
Energy: 1.54495376229593
Energy: 1.4096422109435658
Energy: 1.4540337218504302
Energy: 1.5303314466584779
Energy: 1.4339007876962924
Energy: 1.4096422109371134
Energy: 1.4540337218310737
Energy: 1.5303314466455735
Energy: 1.4387564766359053
Energy: 1.4965254197366324
Energy: 1.5290144286951992
Energy: 1.4563191365885102
Energy: 1.4387564766262857
Energy: 1.4965254197430846
Energy: 1.5290144286855798
Energy: 1.425742275107244
Energy: 1.4423958333594482
Energy: 1.471638785835487
Energy: 1.500954439711309
Energy: 1.425742275104018
Energy: 1.4423958333433178
Energy: 1.471638785829035
Energy: 1.4656047875915397
Energy: 1.5148365825371835
Energy: 1.5210424455748484
Energy: 1.469427929268784
Energy: 1.4656047876043854
Energy: 1.5148365825468617
Energy: 1.5210424455909788
Energy: 1.558292475917575
Energy: 1.510069779742184
Energy: 1.5481907958567451
Energy: 1.457538902181347
Energy: 1.5582924759369312
Energy: 1.5100697797357319
Energy: 1.5481907958664236
Energy: 1.4255047763254827
Energy: 1.4932020463575897
Energy: 1.5487042354896645
Energy: 1.4307542119168577
Energy: 1.4255047763319348
Energy: 1.4932020463608158
Energy: 1.5487042354574623
Energy: 1.4382572959601168
Energy: 1.4331400352627899
Energy: 1.5581373530856601
Energy: 1.4419182600052356
Energy: 1.438257295934308
Energy: 1.4331400352724681
Energy: 1.5581373530985645
Energy: 1.4964849899901445
Energy: 1.499913192037481
Energy: 1.5435850590053837
Energy: 1.5631137441974459
Energy: 1.496484989974014
Energy: 1.4999131920471591
Energy: 1.5435850589828013
Energy: 1.4328013026046125
Energy: 1.4445118364308296
Energy: 1.4653119582621146
Energy: 1.475256743002608
Energy: 1.4328013026046125
Energy: 1.4445118364308296
Energy: 1.465311958249269
Energy: 1.4259925135510145
Energy: 1.4173202315310087
Energy: 1.5466088301255234
Energy: 1.4640905637205823
Energy: 1.4259925135413363
Energy: 1.417320231537461
Energy: 1.5466088301319758
Energy: 1.4570084578680447
Energy: 1.4363894949462233
Energy: 1.5465778670248702
Energy: 1.4542414420510068
Energy: 1.4570084578583662
Energy: 1.436389494962354
Energy: 1.5465778670184183
Energy: 1.4397178381413906
Energy: 1.4160989508073984
Energy: 1.5484074374480385
Energy: 1.473242381882118
Energy: 1.4397178381317126
Energy: 1.4160989507977788
Energy: 1.5484074374319081
Energy: 1.4259355802433684
Energy: 1.4396222559538796
Energy: 1.5661341130245001
Energy: 1.4425765519464915
Energy: 1.4259355802369162
Energy: 1.4396222559635579
Energy: 1.5661341130212743
Energy: 1.4249484392710556
Energy: 1.4730489280528019
Energy: 1.5856877348391734
Energy: 1.4367461246919901
Energy: 1.4249484392710556
Energy: 1.473048928059254
Energy: 1.585687734829495
Energy: 1.4400629205049935
Energy: 1.4279504924150197
Energy: 1.5501880747896903
Energy: 1.4751479014422868
Energy: 1.4400629205146716
Energy: 1.4279504924278652
Energy: 1.5501880747896903
Energy: 1.4690106026264544
Energy: 1.4724755153471123
Energy: 1.5384138336884292
Energy: 1.4531685989060257
Energy: 1.4690106026425849
Energy: 1.4724755153600169
Energy: 1.5384138336852033
Energy: 1.4339492482560676
Energy: 1.4938319794722805
Energy: 1.5324828886762405
Energy: 1.4432368766159425
Energy: 1.4339492482625196
Energy: 1.4938319794658281
Energy: 1.5116369826351106
Energy: 1.4416406117618343
Energy: 1.4434013917680952
Energy: 1.4851667658415177
Energy: 1.5159778430023385
Energy: 1.4416406117522147
Energy: 1.4434013917874515
Energy: 1.4851667658318393
Energy: 1.5342476849887832
Energy: 1.4233169695984078
Energy: 1.5410864936083628
Energy: 1.442193466825972
Energy: 1.5342476849952351
Energy: 1.42331696960486
Energy: 1.5210402846318865
Energy: 1.4916745830643423
Energy: 1.5172968205820447
Energy: 1.5556898203408966
Energy: 1.5171788108975015
Energy: 1.4916745830707945
Energy: 1.517296820601401
Energy: 1.5556898203408966
Energy: 1.4873525785297208
Energy: 1.459807894469261
Energy: 1.5904529540492185
Energy: 1.4306383542584358
Energy: 1.487352578542625
Energy: 1.4598078944789394
Energy: 1.5904529540395402
Energy: 1.4219337247525459
Energy: 1.4625408665460249
Energy: 1.5792429674336823
Energy: 1.4470157738703793
Energy: 1.42193372476545
Energy: 1.4625408665492508
Energy: 1.5792429674110997
Energy: 1.4343142137130038
Energy: 1.4917872402922712
Energy: 1.54820436551412
Energy: 1.4848142073294146
Energy: 1.4343142137065519
Energy: 1.4917872402825931
Energy: 1.5482043655205722
Energy: 1.4721472722663262
Energy: 1.4598253145825257
Energy: 1.4898899274280848
Energy: 1.4631656714683343
Energy: 1.4721472722824567
Energy: 1.459825314592204
Energy: 1.4898899274087283
Energy: 1.4484147623080221
Energy: 1.478567282900338
Energy: 1.5448269031536848
Energy: 1.4281249292753522
Energy: 1.4484147623080221
Energy: 1.4785672829035637
Energy: 1.5448269031504587
Energy: 1.4554666853575497
Energy: 1.4292817543020488
Energy: 1.5772458674013465
Energy: 1.4642459746661733
Energy: 1.4554666853510974
Energy: 1.4292817543085012
Energy: 1.5772458673948941
Energy: 1.4196734662585044
Energy: 1.431378994009278
Energy: 1.5429803327566396
Energy: 1.4793937039135514
Energy: 1.4196734662552781
Energy: 1.431378994009278
Energy: 1.5429803327598657
Energy: 1.439033896012154
Energy: 1.4395718382111418
Energy: 1.5768826743328814
Energy: 1.4459806489039586
Energy: 1.439033896008928
Energy: 1.4395718382079157
Energy: 1.5768826743264293
Energy: 1.4110033259497115
Energy: 1.4540724762653905
Energy: 1.6025849529680252
Energy: 1.4362319425545444
Energy: 1.411003325936807
Energy: 1.4540724762653905
Energy: 1.6025849529551208
Energy: 1.4260483316150279
Energy: 1.4299971621501197
Energy: 1.5253680482865668
Energy: 1.47698862847323
Energy: 1.4260483316279322
Energy: 1.4299971621694765
Energy: 1.5253680482962448
Energy: 1.47066394577369
Energy: 1.4857673394915667
Energy: 1.5595356717054054
Energy: 1.4724504797521427
Energy: 1.4706639457930466
Energy: 1.4857673395011861
Energy: 1.5595356717086317
Energy: 1.4919062486943742
Energy: 1.5011544954114027
Energy: 1.5041399436015825
Energy: 1.474333280482029
Energy: 1.4919062486717913
Energy: 1.5011544954178546
Energy: 1.504139943579
Energy: 1.4872289354078192
Energy: 1.435689127194465
Energy: 1.5400750986485723
Energy: 1.4861539275206042
Energy: 1.4872289354206647
Energy: 1.435689127194465
Energy: 1.5400750986485723
Energy: 1.4922572271652892
Energy: 1.4305252183308133
Energy: 1.5481467602288588
Energy: 1.4448480282998142
Energy: 1.4922572271814194
Energy: 1.430525218317909
Energy: 1.5481467602127281
Energy: 1.5579916122518604
Energy: 1.472640149781706
Energy: 1.5701597840846495
Energy: 1.5106213900432934
Energy: 1.5579916122421822
Energy: 1.4726401497913844
Energy: 1.5701597840749715
Energy: 1.4844198303341318
Energy: 1.4949529888106794
Energy: 1.5213892098438597
Energy: 1.434859364642503
Energy: 1.484419830340584
Energy: 1.4949529888042274
Energy: 1.5213892098309554
Energy: 1.410589108088612
Energy: 1.443071456500484
Energy: 1.5644154557919767
Energy: 1.448107636526616
Energy: 1.410589108085386
Energy: 1.4430714565101626
Energy: 1.5644154558015964
Energy: 1.4390639215276235
Energy: 1.5046104931687607
Energy: 1.6297677410094986
Energy: 1.4894307907253552
Energy: 1.4390639215179455
Energy: 1.5046104931558564
Energy: 1.6297677410127245
Energy: 1.4099635881182235
Energy: 1.4845884511914882
Energy: 1.5214726631772957
Energy: 1.437386314962008
Energy: 1.4099635881149972
Energy: 1.4845884511882619
Energy: 1.5214726631902

minimum gb energy = 1.4096422109371134 eV
minimum distance =  2.16178787075985 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.4978785411771502
Energy: 1.4932186478192087
Energy: 1.6002313497734135
Energy: 1.4832785513188103
Energy: 1.4978785411771502
Energy: 1.4932186478228708
Energy: 1.6002313497734135
Energy: 1.4193495449170137
Energy: 1.444928477074376
Energy: 1.5054595341653214
Energy: 1.4738432760306643
Energy: 1.4193495449279996
Energy: 1.444928477074376
Energy: 1.5054595341689834
Energy: 1.4294590820653699
Energy: 1.468108732624772
Energy: 1.563140787989422
Energy: 1.458747866504734
Energy: 1.4294590820653699
Energy: 1.468108732643082
Energy: 1.5631407879747743
Energy: 1.4677975106302745
Energy: 1.4862566006968487
Energy: 1.554254848496202
Energy: 1.4403200455440894
Energy: 1.4677975106339367
Energy: 1.4862566006895248
Energy: 1.5547632896575465
Energy: 1.4673645160116604
Energy: 1.4746481018807363
Energy: 1.497386506735053
Energy: 1.4403280550750246
Energy: 1.4673645160116604
Energy: 1.4746481018734787
Energy: 1.497386506742377
Energy: 1.4172608552880197
Energy: 1.443202433696669
Energy: 1.4802907138544255
Energy: 1.4892738394643499
Energy: 1.4172608552844241
Energy: 1.443202433696669
Energy: 1.4802907138580876
Energy: 1.4348115142621456
Energy: 1.4943622678772748
Energy: 1.5344429709840055
Energy: 1.4523088469425667
Energy: 1.4348115142621456
Energy: 1.4943622678955846
Energy: 1.5081633460211334
Energy: 1.4362330748560412
Energy: 1.4386110295950294
Energy: 1.5648782209390446
Energy: 1.4747437486088308
Energy: 1.4362330748487173
Energy: 1.4386110295950294
Energy: 1.548737599599572
Energy: 1.4340188386459798
Energy: 1.442863575303542
Energy: 1.46950679757421
Energy: 1.471854817355378
Energy: 1.4340188386496415
Energy: 1.442863575314528
Energy: 1.4543929196470629
Energy: 1.4675319376631828
Energy: 1.5061922785548072
Energy: 1.4660437102965274
Energy: 1.4720796747258593
Energy: 1.4675319376558589
Energy: 1.5061922785401596
Energy: 1.4296431667830445
Energy: 1.4676533780448353
Energy: 1.5163139756921515
Energy: 1.4908652190562532
Energy: 1.4717646785209382
Energy: 1.4676533780338497
Energy: 1.5163139756884898
Energy: 1.4908652190525917
Energy: 1.4168578527675126
Energy: 1.452445952526512
Energy: 1.5089190218899335
Energy: 1.479357937300276
Energy: 1.4168578527711744
Energy: 1.45244595252285
Energy: 1.4952506002215682
Energy: 1.444189169519967
Energy: 1.4585111579925092
Energy: 1.5653367576200439
Energy: 1.455506451619049
Energy: 1.444189169519967
Energy: 1.4585111579888475
Energy: 1.5329051812870873
Energy: 1.4535290696767171
Energy: 1.4932186478228708
Energy: 1.6002313497734135
Energy: 1.4832785513188103
Energy: 1.4535290696950267
Energy: 1.4932186478265326
Energy: 1.6002313497770753
Energy: 1.4193495449206754
Energy: 1.4449284770853619
Energy: 1.5054595341653214
Energy: 1.4743952047973798
Energy: 1.4193495449243378
Energy: 1.4449284770817001
Energy: 1.5054595341689834
Energy: 1.4294590820653699
Energy: 1.4681087326211102
Energy: 1.563140787989422
Energy: 1.458747866504734
Energy: 1.429459082058046
Energy: 1.46810873263942
Energy: 1.5631407879747743
Energy: 1.4677975106229506
Energy: 1.4791492979131171
Energy: 1.5550862454187386
Energy: 1.4403200455477514
Energy: 1.4677975106302745
Energy: 1.4791492979094552
Energy: 1.5547632896538848
Energy: 1.4673645160043367
Energy: 1.4695837080613423
Energy: 1.4973865067314578
Energy: 1.4403280550860105
Energy: 1.4673645160043367
Energy: 1.469583708065004
Energy: 1.497386506742377
Energy: 1.4172645982950967
Energy: 1.443202433696669
Energy: 1.5202440510300377
Energy: 1.4892738394606881
Energy: 1.4172645983024204
Energy: 1.443202433696669
Energy: 1.4802907138654116
Energy: 1.4344251718860268
Energy: 1.4943622678736128
Energy: 1.5122638543194644
Energy: 1.4523088469389045
Energy: 1.4344251718860268
Energy: 1.4943622678955846
Energy: 1.5122638543048166
Energy: 1.4361746844019854
Energy: 1.4386110295913674
Energy: 1.5661383210511328
Energy: 1.47495108797379
Energy: 1.4361746843983239
Energy: 1.4386110295950294
Energy: 1.5487375995959103
Energy: 1.4340188386459798
Energy: 1.442863575307204
Energy: 1.4559957652840296
Energy: 1.4718548173480541
Energy: 1.4340188386496415
Energy: 1.442863575314528
Energy: 1.4559957652840296
Energy: 1.4675319376668445
Energy: 1.5061922785511455
Energy: 1.429643166797692
Energy: 1.472079674722264
Energy: 1.4675319376558589
Energy: 1.5061922785511455
Energy: 1.4296431667830445
Energy: 1.4676533780448353
Energy: 1.5076598969492458
Energy: 1.4908652190562532
Energy: 1.4717646785246
Energy: 1.4676533780301875
Energy: 1.50765989693826
Energy: 1.4908652190489964
Energy: 1.41689640056345
Energy: 1.45244595252285
Energy: 1.4952506002215682
Energy: 1.479357937300276
Energy: 1.4168964005524642
Energy: 1.452445952526512
Energy: 1.4952506002142445
Energy: 1.422362965764012
Energy: 1.4585111579851853
Energy: 1.5329051812761016
Energy: 1.4555064516153873
Energy: 1.422362965756688
Energy: 1.4585111579778613
Energy: 1.5329051812870873
Energy: 1.4978785411734885
Energy: 1.4932186478265326
Energy: 1.6002313497697513
Energy: 1.483278551326134
Energy: 1.4978785411734885
Energy: 1.4932186478265326
Energy: 1.6002313497660896
Energy: 1.4193495449206754
Energy: 1.4449284770817001
Energy: 1.5054595341616595
Energy: 1.4738432760306643
Energy: 1.4193495449279996
Energy: 1.4449284770817001
Energy: 1.5054595341689834
Energy: 1.429459082061708
Energy: 1.468108732624772
Energy: 1.56314078798576
Energy: 1.458747866504734
Energy: 1.429459082061708
Energy: 1.468108732646744
Energy: 1.5631407879711123
Energy: 1.4677975106302745
Energy: 1.4862566006968487
Energy: 1.5547632896648704
Energy: 1.4403200455514134
Energy: 1.4677975106339367
Energy: 1.4862566006858626
Energy: 1.5547632896538848
Energy: 1.4673645160043367
Energy: 1.474648101877074
Energy: 1.497386506735053
Energy: 1.4403280550823485
Energy: 1.4673645160079984
Energy: 1.474648101869817
Energy: 1.497386506742377
Energy: 1.4172608552807624
Energy: 1.4432024336893448
Energy: 1.5202440510373616
Energy: 1.4892738394570262
Energy: 1.4172608552807624
Energy: 1.443202433696669
Energy: 1.4802907138617494
Energy: 1.4348115142621456
Energy: 1.4943622678772748
Energy: 1.5131022530396752
Energy: 1.4523088469462284
Energy: 1.4348115142584839
Energy: 1.4943622678955846
Energy: 1.513102253046999
Energy: 1.4362330748523793
Energy: 1.4386110295950294
Energy: 1.5661383210547948
Energy: 1.4747437486088308
Energy: 1.4362330748487173
Energy: 1.4386110295950294
Energy: 1.564878220950031
Energy: 1.4340188386459798
Energy: 1.442863575303542
Energy: 1.4543929196434011
Energy: 1.4718548173480541
Energy: 1.4340188386533037
Energy: 1.442863575314528
Energy: 1.4543929196434011
Energy: 1.4675319376595206
Energy: 1.5061922785511455
Energy: 1.4296431668013545
Energy: 1.4720796747258593
Energy: 1.467531937652197
Energy: 1.5061922785474833
Energy: 1.4296431667867064
Energy: 1.4676533780448353
Energy: 1.5163139756884898
Energy: 1.4908652190562532
Energy: 1.4717646785246
Energy: 1.4676533780301875
Energy: 1.5163139756884898
Energy: 1.4908652190525917
Energy: 1.4168578527639173
Energy: 1.45244595252285
Energy: 1.4952506002215682
Energy: 1.4793579372929522
Energy: 1.4168578527675126
Energy: 1.452445952526512
Energy: 1.4952506002142445
Energy: 1.444189169516305
Energy: 1.4585111579888475
Energy: 1.5329051812724397
Energy: 1.4555064516227112
Energy: 1.444189169516305
Energy: 1.4585111579888475
Energy: 1.5329051812834253
Energy: 1.4535290696767171
Energy: 1.4932186478265326
Energy: 1.6002313497734135
Energy: 1.483278551322472
Energy: 1.4535290696950267
Energy: 1.4932186478301945
Energy: 1.6002313497697513
Energy: 1.4193495449206754
Energy: 1.4449284770817001
Energy: 1.5054595341653214
Energy: 1.4743952047937179
Energy: 1.4193495449279996
Energy: 1.4449284770817001
Energy: 1.5054595341689834

minimum gb energy = 1.4168578527639173 eV
minimum distance =  2.21879283355475 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.5227845083689804
Energy: 1.4735967836198813
Energy: 1.5838255543581765
Energy: 1.5160169828203383
Energy: 1.5227845083689804
Energy: 1.4735967836198813
Energy: 1.5832806858535062
Energy: 1.5471054397826773
Energy: 1.5251130228642569
Energy: 1.5981295664207626
Energy: 1.46356943792727
Energy: 1.5471054397856372
Energy: 1.5251130228608738
Energy: 1.5981295664249913
Energy: 1.5033074975911467
Energy: 1.5188298943594158
Energy: 1.655680778986544
Energy: 1.509237920597403
Energy: 1.503307497592415
Energy: 1.5188298943632217
Energy: 1.67305462889481
Energy: 1.531726277620103
Energy: 1.4615976516355222
Energy: 1.6357321671896985
Energy: 1.4653439881313464
Energy: 1.5317262776196803
Energy: 1.4615976516355222
Energy: 1.6357321671901213
Energy: 1.5252906409111067
Energy: 1.4855128898766508
Energy: 1.5722627152787343
Energy: 1.490847497441185
Energy: 1.525290640911914
Energy: 1.4855128898783423
Energy: 1.617540222097074
Energy: 1.4682777038224064
Energy: 1.4782239562092652
Energy: 1.531067388360382
Energy: 1.5086654475831547
Energy: 1.4682777038236747
Energy: 1.4782239562084198
Energy: 1.5310673883553079
Energy: 1.4677861427335164
Energy: 1.5586458941361028
Energy: 1.543611405716379
Energy: 1.4823675943531467
Energy: 1.4677861427326708
Energy: 1.558645894136948
Energy: 1.5436114057184935
Energy: 1.5190799289045573
Energy: 1.4779335232459017
Energy: 1.6678618507008962
Energy: 1.510825077017768
Energy: 1.5190799288986374
Energy: 1.47793352325309
Energy: 1.6678618507004732
Energy: 1.499910924777078
Energy: 1.4662881502283776
Energy: 1.591217616499255
Energy: 1.4855941713398064
Energy: 1.4999109247779239
Energy: 1.4662881502292233
Energy: 1.5912176165009464
Energy: 1.467517022094163
Energy: 1.504892711394658
Energy: 1.5485222462875827
Energy: 1.4873109576496748
Energy: 1.4675170220903575
Energy: 1.504892711395504
Energy: 1.5485222462850456
Energy: 1.579624989274507
Energy: 1.526598247007991
Energy: 1.5524614503557677
Energy: 1.4498018506787598
Energy: 1.579624989271124
Energy: 1.5265982470109511
Energy: 1.5524614503519618
Energy: 1.5330274519002527
Energy: 1.5225852197388607
Energy: 1.5958511274456213
Energy: 1.5707878190386353
Energy: 1.5330274518977158
Energy: 1.522585219740552
Energy: 1.5958511274481582
Energy: 1.5181120369514265
Energy: 1.5304667556894178
Energy: 1.6092556375561982
Energy: 1.4631537604465705
Energy: 1.5181120369535406
Energy: 1.5304667556894178
Energy: 1.6092556375507012
Energy: 1.4952969272184657
Energy: 1.4900386931499048
Energy: 1.6348835788856761
Energy: 1.520144707706432
Energy: 1.4952969272205798
Energy: 1.4900386931520193
Energy: 1.6348835788894815
Energy: 1.525630658858217
Energy: 1.4603859249344384
Energy: 1.6132964350062737
Energy: 1.46343268739319
Energy: 1.5256306588565258
Energy: 1.4603859249386668
Energy: 1.613296435002468
Energy: 1.5709219657005327
Energy: 1.5016976017005743
Energy: 1.5540084864771793
Energy: 1.4967203578399264
Energy: 1.5709219656958815
Energy: 1.5016976017001518
Energy: 1.5540084864797163
Energy: 1.550275553407587
Energy: 1.4840405950567734
Energy: 1.5567285691331711
Energy: 1.5201612220004646
Energy: 1.55027555340209
Energy: 1.4840405950559277
Energy: 1.5567285691344395
Energy: 1.4815461619423327
Energy: 1.4874543252216201
Energy: 1.5316069091376752
Energy: 1.5046623653622533
Energy: 1.4815461619448695
Energy: 1.4874543252233117
Energy: 1.5316069091372526
Energy: 1.469473967884896
Energy: 1.4835160122026867
Energy: 1.5831328605002335
Energy: 1.4767687335228104
Energy: 1.4694739678874331
Energy: 1.4835160122060698
Energy: 1.5414055335871186
Energy: 1.4976151935098772
Energy: 1.4660617505493079
Energy: 1.6044529024395857
Energy: 1.4754393178715879
Energy: 1.49761519350438
Energy: 1.4660617505509992
Energy: 1.6044529024412768
Energy: 1.5077024021793948
Energy: 1.4925149812598668
Energy: 1.5901050724553112
Energy: 1.5246854021649054
Energy: 1.5077024021777035
Energy: 1.492514981261981
Energy: 1.576675570085276
Energy: 1.4806159376084824
Energy: 1.5288739041043193
Energy: 1.545840876846715
Energy: 1.4519322548069042
Energy: 1.4806159376059456
Energy: 1.528873904108125
Energy: 1.545840876846292
Energy: 1.5295537772503758
Energy: 1.4997829723640699
Energy: 1.5098139032859454
Energy: 1.543846942435132
Energy: 1.5295537772482617
Energy: 1.499782972363647
Energy: 1.5098139032838314
Energy: 1.4804802180197527
Energy: 1.5281087592346152
Energy: 1.617618403386517
Energy: 1.4626046415945824
Energy: 1.480480218015947
Energy: 1.5281087592363063
Energy: 1.6176184033882084
Energy: 1.5064360005659232
Energy: 1.4847662225633798
Energy: 1.554018119377096
Energy: 1.4967967917947753
Energy: 1.5064360005676147
Energy: 1.4847662225633798
Energy: 1.5540181193758273
Energy: 1.519372175670898
Energy: 1.5170496637824062
Energy: 1.5960595626390017
Energy: 1.4659537247182606
Energy: 1.519372175668361
Energy: 1.5170496637866346
Energy: 1.5960595626373102
Energy: 1.5496088281982194
Energy: 1.4814941697965711
Energy: 1.5492073985210564
Energy: 1.473635894996583
Energy: 1.5496088281944522
Energy: 1.4814941697965711
Energy: 1.5773277591714012
Energy: 1.5277820624157765
Energy: 1.4793169663086292
Energy: 1.5925978601383128
Energy: 1.5225257168309123
Energy: 1.527782062425079
Energy: 1.4793169663052466
Energy: 1.5925978601323927
Energy: 1.5002324729339522
Energy: 1.5154590496932265
Energy: 1.6733171308779944
Energy: 1.4926069703940676
Energy: 1.500232472926764
Energy: 1.515459049692381
Energy: 1.6733171308805317
Energy: 1.4859069753640757
Energy: 1.483820624624004
Energy: 1.6326381727196662
Energy: 1.4828638407991972
Energy: 1.48590697536619
Energy: 1.4838206246197756
Energy: 1.63263817272178
Energy: 1.5162298599036577
Energy: 1.4857141746958198
Energy: 1.5317745991768226
Energy: 1.4860925537442273
Energy: 1.5162298599011206
Energy: 1.4857141746958198
Energy: 1.5317745991776683
Energy: 1.5002916649666196
Energy: 1.4526813920789357
Energy: 1.5451212108983197
Energy: 1.464722344271809
Energy: 1.500291664967888
Energy: 1.4526813920759758
Energy: 1.545121210894937
Energy: 1.4718922956438816
Energy: 1.562300302627425
Energy: 1.5486545104508813
Energy: 1.509099250307108
Energy: 1.4718922956468417
Energy: 1.5623003026320765
Energy: 1.548654510451304
Energy: 1.4945695787972568
Energy: 1.5068614239414104
Energy: 1.7075978305017505
Energy: 1.5040528982660002
Energy: 1.4945695788023305
Energy: 1.506861423941833
Energy: 1.7075978305051334
Energy: 1.4710905271395087
Energy: 1.502212811988588
Energy: 1.5846426990327438
Energy: 1.514035367434108
Energy: 1.4710905271390857
Energy: 1.5022128119894338
Energy: 1.584642699038241
Energy: 1.4673948384270192
Energy: 1.5031334147361928
Energy: 1.6044749920674652
Energy: 1.4870817084839953
Energy: 1.4673948384236362
Energy: 1.5031334147323874
Energy: 1.6044749920657737

minimum gb energy = 1.4498018506787598 eV
minimum distance =  2.22107655526281 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.4799966902448132
Energy: 1.48433452124897
Energy: 1.5129949583293743
Energy: 1.4843286795500024
Energy: 1.4799966902363295
Energy: 1.4843345212434809
Energy: 1.5129949583238849
Energy: 1.4614226481325583
Energy: 1.5098591534768413
Energy: 1.3642795860369135
Energy: 1.5095621956080711
Energy: 1.461422648131061
Energy: 1.5098591534883192
Energy: 1.3642795860379116
Energy: 1.4801638308421037
Energy: 1.4029649287325408
Energy: 1.481750773826744
Energy: 1.4433123414171805
Energy: 1.480163830845098
Energy: 1.4029649287325408
Energy: 1.4817507738307363
Energy: 1.48091312402704
Energy: 1.5098526958459806
Energy: 1.3641666425798604
Energy: 1.4239201288138978
Energy: 1.4809131240285371
Energy: 1.5098526958379956
Energy: 1.3641666425698797
Energy: 1.5349568753381861
Energy: 1.4422974515240614
Energy: 1.4407938233922417
Energy: 1.4432866164389626
Energy: 1.5349568753346932
Energy: 1.4422974515310478
Energy: 1.4407938233812627
Energy: 1.481285261979976
Energy: 1.4246792220908606
Energy: 1.5797750511184683
Energy: 1.4416781149801268
Energy: 1.4812852619605135
Energy: 1.4246792220948525
Energy: 1.5797750511180146
Energy: 1.555868487613564
Energy: 1.4421315845874045
Energy: 1.4700335214489386
Energy: 1.4422865132750529
Energy: 1.555868487613564
Energy: 1.442131584594391
Energy: 1.4577027277564125
Energy: 1.48139354721955
Energy: 1.3956968394969056
Energy: 1.5793121949913784
Energy: 1.3956455519917097
Energy: 1.4813935472110664
Energy: 1.3956968394983573
Energy: 1.5793121950018583
Energy: 1.5560878532387565
Energy: 1.4423010812415447
Energy: 1.4815140570868566
Energy: 1.4421990660651123
Energy: 1.5560878532342652
Energy: 1.4423010812400479
Energy: 1.4815140570873555
Energy: 1.4812187998978479
Energy: 1.4416926433595147
Energy: 1.5794946764986815
Energy: 1.4246534370022106
Energy: 1.4812187998893642
Energy: 1.441692643365503
Energy: 1.579494676494689
Energy: 1.5351454309922208
Energy: 1.4433283546622961
Energy: 1.454779414192534
Energy: 1.4422725246277566
Energy: 1.5351454309907235
Energy: 1.4433283546603
Energy: 1.4243000189333874
Energy: 1.4808279290176976
Energy: 1.4239690442058104
Energy: 1.364147257399449
Energy: 1.5100466165019621
Energy: 1.4808279290157014
Energy: 1.4239690441978259
Energy: 1.364147257400946
Energy: 1.479835021951448
Energy: 1.4433785147819413
Energy: 1.4460248284973658
Energy: 1.4029856769162512
Energy: 1.479835021951448
Energy: 1.4433785147814422
Energy: 1.4252541305522763
Energy: 1.4614308557814093
Energy: 1.509573126030157
Energy: 1.3641453289685126
Energy: 1.5098485482620565
Energy: 1.4614308557873978
Energy: 1.509573126025666
Energy: 1.3641453289685126
Energy: 1.4799966902433164
Energy: 1.4843345212514654
Energy: 1.512994958324883
Energy: 1.4843286795524975
Energy: 1.4799966902378265
Energy: 1.4843345212464751
Energy: 1.5129949583213895
Energy: 1.461422648131061
Energy: 1.5098591534758432
Energy: 1.3642795860349173
Energy: 1.50956219560857
Energy: 1.4614226481265697
Energy: 1.5098591534873211
Energy: 1.3642795860374126
Energy: 1.4801638308421037
Energy: 1.4029649287330397
Energy: 1.481750773826744
Energy: 1.4433123414171805
Energy: 1.4801638308421037
Energy: 1.402964928732042
Energy: 1.481750773829738
Energy: 1.4809131240295352
Energy: 1.5098526958454814
Energy: 1.3641666425783634
Energy: 1.423920128815894
Energy: 1.4809131240310323
Energy: 1.509852695837497
Energy: 1.3641666425723749
Energy: 1.534956875337188
Energy: 1.4422974515230633
Energy: 1.4407938233922417
Energy: 1.443286616438464
Energy: 1.534956875333196
Energy: 1.4422974515290514
Energy: 1.4407938233817619
Energy: 1.4812852619794767
Energy: 1.4246792220928564
Energy: 1.5797750511155195
Energy: 1.4416781149791287
Energy: 1.4812852619600145
Energy: 1.4246792220953517
Energy: 1.5797750511160185
Energy: 1.555868487614562
Energy: 1.4421315845874045
Energy: 1.4577027277449348
Energy: 1.4422865132750529
Energy: 1.5558684876155602
Energy: 1.442131584594391
Energy: 1.4577027277549155
Energy: 1.4813935472205482
Energy: 1.3956968394964064
Energy: 1.579312194987386
Energy: 1.3956455519922089
Energy: 1.4813935472100683
Energy: 1.3956968394993554
Energy: 1.5793121950023574
Energy: 1.5560878532397544
Energy: 1.4423010812425427
Energy: 1.4815140570883536
Energy: 1.442199066063615
Energy: 1.5560878532352633
Energy: 1.4423010812390498
Energy: 1.4815140570893515
Energy: 1.4812187998953525
Energy: 1.4416926433575188
Energy: 1.5794946764976834
Energy: 1.4246534370032085
Energy: 1.4812187998878668
Energy: 1.441692643363008
Energy: 1.579494676492693
Energy: 1.5351454309932189
Energy: 1.443328354664292
Energy: 1.4243000189318904
Energy: 1.4422725246282553
Energy: 1.5351454309897254
Energy: 1.443328354661298
Energy: 1.424300018933841
Energy: 1.4808279290196935
Energy: 1.4239690442043134
Energy: 1.3641472573989497
Energy: 1.510046616505954
Energy: 1.4808279290166995
Energy: 1.4239690442018178
Energy: 1.3641472574024431
Energy: 1.479835021951448
Energy: 1.4433785147839373
Energy: 1.4252541305632098
Energy: 1.4029856769172493
Energy: 1.479835021951448
Energy: 1.4433785147834381
Energy: 1.425254130550779
Energy: 1.4614308557834055
Energy: 1.509573126026165
Energy: 1.3641453289715069
Energy: 1.509848548266548
Energy: 1.4614308557888949
Energy: 1.5095731260226715
Energy: 1.3641453289685126
Energy: 1.4799966902448132
Energy: 1.48433452124897
Energy: 1.5129949583293743
Energy: 1.4843286795495032
Energy: 1.4799966902363295
Energy: 1.4843345212434809
Energy: 1.512994958324883
Energy: 1.4614226481325583
Energy: 1.5098591534763424
Energy: 1.3642795860354164
Energy: 1.5095621956080711
Energy: 1.461422648131061
Energy: 1.5098591534883192
Energy: 1.3642795860379116

minimum gb energy = 1.3641453289685126 eV
minimum distance =  2.24043067418817 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.4853861811510258
Energy: 1.593244720598648
Energy: 1.4855225885507108
Energy: 1.5932377068510042
Energy: 1.4853861811486027
Energy: 1.5932447206010714
Energy: 1.4855225885531342
Energy: 1.5279143719048407
Energy: 1.4520330215253587
Energy: 1.5222318957657501
Energy: 1.4518696849647854
Energy: 1.5279143719090815
Energy: 1.4520330215271764
Energy: 1.5222318957675678
Energy: 1.485488840161479
Energy: 1.452365443590418
Energy: 1.472434294443356
Energy: 1.4454511577542581
Energy: 1.4854888401632966
Energy: 1.452365443594053
Energy: 1.472434294439721
Energy: 1.5079041172424934
Energy: 1.4519704925354588
Energy: 1.6043694010197513
Energy: 1.452601448386592
Energy: 1.5079041172418874
Energy: 1.4519704925342471
Energy: 1.6043694010197513
Energy: 1.4385579166899827
Energy: 1.528449125694358
Energy: 1.437258520280226
Energy: 1.4807052104393377
Energy: 1.4385579166918
Energy: 1.5284491256937522
Energy: 1.4372585202747734
Energy: 1.5080203731819117
Energy: 1.4459789115342494
Energy: 1.4926587462178675
Energy: 1.4714472203678983
Energy: 1.5080203731849406
Energy: 1.445978911537884
Energy: 1.4926587462233196
Energy: 1.4854783353773724
Energy: 1.528393157123489
Energy: 1.4593550443092893
Energy: 1.4634182972927425
Energy: 1.4854783353779784
Energy: 1.5283931571216718
Energy: 1.4593550443086836
Energy: 1.4969471175263191
Energy: 1.4469631237890868
Energy: 1.493468912531985
Energy: 1.471333318688297
Energy: 1.4969471175257132
Energy: 1.4469631237902985
Energy: 1.493468912535014
Energy: 1.4854826422507577
Energy: 1.484685653129375
Energy: 1.5166247454512074
Energy: 1.4817562683139742
Energy: 1.4854826422519694
Energy: 1.4846856531317985
Energy: 1.516624745448812
Energy: 1.4889055605624597
Energy: 1.4459948143942114
Energy: 1.4636403223666181
Energy: 1.4701393695655234
Energy: 1.4889055605624597
Energy: 1.4459948143911825
Energy: 1.463640322369647
Energy: 1.4790378361916623
Energy: 1.5101717502227099
Energy: 1.473479469180785
Energy: 1.4627141420684313
Energy: 1.4790378361952972
Energy: 1.5101717502233156
Energy: 1.4734794691826028
Energy: 1.4022163055861712
Energy: 1.4734829005454622
Energy: 1.4746623109316292
Energy: 1.425280440220656
Energy: 1.402216305589806
Energy: 1.4734829005448562
Energy: 1.474662310932235
Energy: 1.479543852402051
Energy: 1.457744958135925
Energy: 1.4655024529641885
Energy: 1.456051715663704
Energy: 1.4795438523984161
Energy: 1.4577449581280493
Energy: 1.4553404577687052
Energy: 1.4028297936849854
Energy: 1.4743827454605374
Energy: 1.4954091892240355
Energy: 1.409293006059598
Energy: 1.4028297936837737
Energy: 1.4743827454599314
Energy: 1.4954091892210066
Energy: 1.507871924466812
Energy: 1.4118014100849339
Energy: 1.5071108035029834
Energy: 1.4623617702675513
Energy: 1.5078719244649947
Energy: 1.411801410074635
Energy: 1.5071108035048009
Energy: 1.4022574714366773
Energy: 1.5229517415050682
Energy: 1.4953971422820236
Energy: 1.5325651924485595
Energy: 1.4022574714372835
Energy: 1.5229517415038567
Energy: 1.4953971422783887
Energy: 1.5085073751561247
Energy: 1.411041076050814
Energy: 1.484037666931868
Energy: 1.4626921558055788
Energy: 1.5085073751591536
Energy: 1.4110410760502083
Energy: 1.4947489557539293
Energy: 1.4023433838445187
Energy: 1.4616069059441952
Energy: 1.4727388172946019
Energy: 1.4960858715020007
Energy: 1.4023433838439132
Energy: 1.461606905943589
Energy: 1.4727388172921785
Energy: 1.485859709253074
Energy: 1.4108860915748838
Energy: 1.514980568499388
Energy: 1.4544513362271605
Energy: 1.4858597092500452
Energy: 1.4108860915791246
Energy: 1.5149805684999937
Energy: 1.4035192574316693
Energy: 1.497710767092957
Energy: 1.4666263996172841
Energy: 1.4976993186185998
Energy: 1.4035192574304576
Energy: 1.4977107670911396
Energy: 1.4666263996094084
Energy: 1.4858631495343377
Energy: 1.4544065677383482
Energy: 1.514969999708981
Energy: 1.4108599269937228
Energy: 1.4858631495325203
Energy: 1.454406567735925
Energy: 1.514969999708981
Energy: 1.4023467546720383
Energy: 1.4960590087629704
Energy: 1.472722615557772
Energy: 1.4616717617889696
Energy: 1.4023467546677977
Energy: 1.496059008763576
Energy: 1.4727226155595894
Energy: 1.5085728416629574
Energy: 1.4626455669012586
Energy: 1.4842459927730445
Energy: 1.411214394371584
Energy: 1.5085728416635633
Energy: 1.4626455668988354
Energy: 1.4842459927712268
Energy: 1.4022678635338526
Energy: 1.5325448630633391
Energy: 1.4955794119895949
Energy: 1.5229817150553393
Energy: 1.4022678635332468
Energy: 1.5325448630572809
Energy: 1.4955794119883832
Energy: 1.5080601005019687
Energy: 1.4622893338881726
Energy: 1.5770258382979039
Energy: 1.4117951155013995
Energy: 1.50806010050318
Energy: 1.462289333890596
Energy: 1.5770258383033557

minimum gb energy = 1.4022163055861712 eV
minimum distance =  2.21279118975179 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.523236840944039
Energy: 1.5138481663276875
Energy: 1.495260240926089
Energy: 1.5138620365601705
Energy: 1.523236840950801
Energy: 1.5138481663142247
Energy: 1.495260240909184
Energy: 1.5001797131782488
Energy: 1.470487875921974
Energy: 1.5244719521845742
Energy: 1.4698306308730722
Energy: 1.5001797131849492
Energy: 1.470487875928736
Energy: 1.5244719521947174
Energy: 1.4557484190913994
Energy: 1.4519460189798536
Energy: 1.5883162289371546
Energy: 1.4527705325639046
Energy: 1.4557484190981613
Energy: 1.4519460189866156
Energy: 1.5883162289472976
Energy: 1.383687865874111
Energy: 1.4703022637538459
Energy: 1.6257908533521066
Energy: 1.4691580573342036
Energy: 1.383687865874111
Energy: 1.4703022637504646
Energy: 1.625790853358869
Energy: 1.5084527600656221
Energy: 1.3935800742643145
Energy: 1.5209499117552068
Energy: 1.3913572774502656
Energy: 1.5084527600757653
Energy: 1.3935800742609332
Energy: 1.5209499117585263
Energy: 1.3839587253325787
Energy: 1.4155536348030797
Energy: 1.5738222767225558
Energy: 1.413195714512979
Energy: 1.3839587253393408
Energy: 1.415553634813223
Energy: 1.5738222767360797
Energy: 1.4305350110209214
Energy: 1.3935786651653257
Energy: 1.5550585468482419
Energy: 1.4115282037456058
Energy: 1.4305350110209214
Energy: 1.3935786651788498
Energy: 1.5550585468245748
Energy: 1.3825444932403286
Energy: 1.4202082458962164
Energy: 1.6255847662114293
Energy: 1.4048332968876909
Energy: 1.3825444932335667
Energy: 1.4202082459029783
Energy: 1.6255847662148104
Energy: 1.4305624972544364
Energy: 1.4042728980523689
Energy: 1.5611753103089512
Energy: 1.390273348821188
Energy: 1.4305624972442934
Energy: 1.4042728980591308
Energy: 1.5611753103224753
Energy: 1.387313453674901
Energy: 1.4197016206175657
Energy: 1.474207014277921
Energy: 1.4064248113540143
Energy: 1.387313453674901
Energy: 1.4197016206141848
Energy: 1.4742070142508725
Energy: 1.4330213588682827
Energy: 1.4591186230059296
Energy: 1.5756335655768854
Energy: 1.390165129218361
Energy: 1.4330213588615208
Energy: 1.4591186229924058
Energy: 1.5756335655802667
Energy: 1.3872891190191794
Energy: 1.4063426046200025
Energy: 1.6070169369197338
Energy: 1.4089803704472303
Energy: 1.3872891190259413
Energy: 1.4063426046267646
Energy: 1.607016936923115
Energy: 1.4510562309160484
Energy: 1.4188457818962952
Energy: 1.545069559866789
Energy: 1.4074510331831014
Energy: 1.4510562308991435
Energy: 1.418845781892914
Energy: 1.545069559876932
Energy: 1.4321653322576513
Energy: 1.5028873851900801
Energy: 1.63846787202326
Energy: 1.4596327783989507
Energy: 1.4321653322779375
Energy: 1.5028873851934608
Energy: 1.6384678720198793
Energy: 1.4512985816290698
Energy: 1.483703353352887
Energy: 1.585159048602261
Energy: 1.4705585272205253
Energy: 1.4512985816358317
Energy: 1.483703353352887
Energy: 1.585159048609023
Energy: 1.432208389008992
Energy: 1.406225929145953
Energy: 1.62937810968947
Energy: 1.4089126713447029
Energy: 1.4322083889988488
Energy: 1.4062259291391912
Energy: 1.6293781096827076
Energy: 1.4336853989623222
Energy: 1.418764644329215
Energy: 1.7093506309426358
Energy: 1.407169108449176
Energy: 1.4336853989420364
Energy: 1.418764644322453
Energy: 1.709350630949398
Energy: 1.3871198237366318
Energy: 1.395418049243945
Energy: 1.5845421843198586
Energy: 1.4078589183682668
Energy: 1.3871198237264886
Energy: 1.395418049243945
Energy: 1.5845421843164778
Energy: 1.4321393729536047
Energy: 1.4300120020097211
Energy: 1.5368254231149043
Energy: 1.4400811534346654
Energy: 1.4321393729502236
Energy: 1.430012002026626
Energy: 1.5368254231283673
Energy: 1.4080050785155727
Energy: 1.3968281118420198
Energy: 1.6052497248533981
Energy: 1.4035160986556234
Energy: 1.4080050785155727
Energy: 1.3968281118420198
Energy: 1.60524972486016
Energy: 1.4530864192391673
Energy: 1.3994063369838452
Energy: 1.5499497682908576
Energy: 1.498643334664021
Energy: 1.4530864192459294
Energy: 1.399406336987226
Energy: 1.5499497682908576
Energy: 1.4081865686589223
Energy: 1.4008879031630546
Energy: 1.5600522715769374
Energy: 1.4089522515812205
Energy: 1.4081865686859707
Energy: 1.4008879031731973
Energy: 1.5600522715566512
Energy: 1.4529322608411723
Energy: 1.3975478606091454
Energy: 1.6169420191400332
Energy: 1.4815881336827463
Energy: 1.4529322608445536
Energy: 1.3975478606125262
Energy: 1.6169420191231278
Energy: 1.4277443477667877
Energy: 1.4056646719853587
Energy: 1.5228758462434104
Energy: 1.4093410019187003
Energy: 1.4277443477634064
Energy: 1.4056646719853587
Energy: 1.5228758462400294
Energy: 1.4533073150253983
Energy: 1.4662731836993932
Energy: 1.507408476753047
Energy: 1.5393916520882147
Energy: 1.4533073150153168
Energy: 1.4662731837061551
Energy: 1.507408476749666
Energy: 1.431144724884561
Energy: 1.4733003141160497
Energy: 1.6232100004080487
Energy: 1.4080479746058023
Energy: 1.431144724884561
Energy: 1.4733003141160497
Energy: 1.6232100004046675
Energy: 1.5692885984632736
Energy: 1.4670342529127434
Energy: 1.4341480764086885
Energy: 1.54347611553263
Energy: 1.5692885984767975
Energy: 1.4670342529127434
Energy: 1.4341480763951646
Energy: 1.4334319580234827
Energy: 1.5376657536969573
Energy: 1.6496753925187448
Energy: 1.4715383004141753
Energy: 1.433431958003258
Energy: 1.5376657537003382
Energy: 1.6496753925052206
Energy: 1.5687229284597706
Energy: 1.467540769215325
Energy: 1.4366342422727851
Energy: 1.5399971030812871
Energy: 1.5687229284597706
Energy: 1.467540769218706
Energy: 1.4366342422660232
Energy: 1.4345285427873076
Energy: 1.4691217218455672
Energy: 1.6125556353650934
Energy: 1.408855714656306
Energy: 1.4345285427873076
Energy: 1.4691217218286619
Energy: 1.6125556353515693
Energy: 1.4441910097216428
Energy: 1.4678104048334821
Energy: 1.559420288356582
Energy: 1.543585246988246
Energy: 1.4441910097317856
Energy: 1.4678104048334821
Energy: 1.5594202883599633
Energy: 1.435431310813053
Energy: 1.41069876707081
Energy: 1.5499822822424518
Energy: 1.408341320400557
Energy: 1.4354313108333392
Energy: 1.4106987670674291
Energy: 1.5499822822255467
Energy: 1.4442351178967916
Energy: 1.4132609592765417
Energy: 1.5111220108754322
Energy: 1.4718380216659392
Energy: 1.4442351179035535
Energy: 1.4132609592630787
Energy: 1.5111220108889563
Energy: 1.4355525094165646
Energy: 1.4101170395871896
Energy: 1.4828263924410798
Energy: 1.419368149058267
Energy: 1.4355525094199455
Energy: 1.4101170395871896
Energy: 1.482826392457985
Energy: 1.4208933757271394
Energy: 1.405968190932411
Energy: 1.545708843621665
Energy: 1.4728150647509417
Energy: 1.4208933757305207
Energy: 1.405968190932411
Energy: 1.545708843621665
Energy: 1.4355564967233845
Energy: 1.4226095213787677
Energy: 1.5209909083966149
Energy: 1.4034169847833848
Energy: 1.4355564967233845
Energy: 1.4226095213720058
Energy: 1.5209909083932336
Energy: 1.4201289912285198
Energy: 1.4093099983443094
Energy: 1.4649618365270958
Energy: 1.493924686100654
Energy: 1.420128991225139
Energy: 1.4093099983443094
Energy: 1.4649618365203336
Energy: 1.4192704669657275
Energy: 1.4142517096659084
Energy: 1.4916207160818085
Energy: 1.4035094782277893
Energy: 1.4192704669657275
Energy: 1.4142517096591463
Energy: 1.4916207160818085
Energy: 1.4204598128442414
Energy: 1.4837358629826098
Energy: 1.509773619804274
Energy: 1.4720333059916544
Energy: 1.4204598128577652
Energy: 1.483735862975848
Energy: 1.5097736197772256
Energy: 1.4192369337648902
Energy: 1.4770688690690508
Energy: 1.529880360502713
Energy: 1.462598568725408
Energy: 1.419236933758128
Energy: 1.4770688690791935
Energy: 1.5298803604993318
Energy: 1.480329196557372
Energy: 1.488915158019218
Energy: 1.5841020482926897
Energy: 1.4724121701557826
Energy: 1.480329196553991
Energy: 1.4889151579854079
Energy: 1.5841020482724035
Energy: 1.4194359411294961
Energy: 1.4369128500202946
Energy: 1.707063615800604
Energy: 1.541328889332257
Energy: 1.4194359411294961
Energy: 1.4369128500135322
Energy: 1.7070636158107473
Energy: 1.425945983661718
Energy: 1.4732679116868046
Energy: 1.6229518707848791
Energy: 1.4568736736328343
Energy: 1.425945983665099
Energy: 1.4732679116868046
Energy: 1.6229518707814983
Energy: 1.4438244158777995
Energy: 1.4224622434331669
Energy: 1.720360151760884
Energy: 1.4103741011011957
Energy: 1.4438244158676568
Energy: 1.4224622434264047
Energy: 1.720360151771027
Energy: 1.3877284340094709
Energy: 1.463683230429897
Energy: 1.6228535346551949
Energy: 1.4902357609418406
Energy: 1.387728433992566
Energy: 1.4636832304332783
Energy: 1.6228535346450517

minimum gb energy = 1.3825444932335667 eV
minimum distance =  2.13293362650879 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.3667327221114611
Energy: 1.3101061146543231
Energy: 1.269730302480862
Energy: 1.310106114648225
Energy: 1.3667327221145102
Energy: 1.310106114648225
Energy: 1.4211392893160888
Energy: 1.3667327221175594
Energy: 1.310106114648225
Energy: 1.5696424045064776
Energy: 1.3101061146512742
Energy: 1.3667327221145102
Energy: 1.3101061146520363
Energy: 1.4211392893183756
Energy: 1.366732722116035
Energy: 1.3101061146505117
Energy: 1.4917774040951268
Energy: 1.3101061146520363
Energy: 1.366732722113748
Energy: 1.3101061146512742
Energy: 1.4211392893130395
Energy: 1.3667327221129855
Energy: 1.3101061146543231
Energy: 1.2604200358761855
Energy: 1.3101061146489872
Energy: 1.3667327221152725
Energy: 1.3101061146489872
Energy: 1.421139289314564
Energy: 1.366732722116035
Energy: 1.3101061146467003
Energy: 1.5738047276037705
Energy: 1.3101061146512742
Energy: 1.3667327221129855
Energy: 1.3101061146527988
Energy: 1.4211392893214247
Energy: 1.3667327221152725
Energy: 1.3101061146505117
Energy: 1.4985975663549302
Energy: 1.3101061146520363
Energy: 1.3667327221175594
Energy: 1.3101061146520363
Energy: 1.42113928932981
Energy: 1.3667327221122234
Energy: 1.3101061146543231
Energy: 1.260419981363595
Energy: 1.310106114648225
Energy: 1.3667327221129855
Energy: 1.3101061146474626
Energy: 1.4211392893282853
Energy: 1.366732722113748
Energy: 1.310106114648225
Energy: 1.4211392893595394
Energy: 1.3101061146512742
Energy: 1.3667327221129855
Energy: 1.3101061146520363
Energy: 1.42113928932981
Energy: 1.3667327221122234
Energy: 1.3101061146505117
Energy: 1.4917774040943648
Energy: 1.3101061146527988
Energy: 1.3667327221122234
Energy: 1.3101061146520363
Energy: 1.4211392893488675
Energy: 1.3667327221114611
Energy: 1.3101061146543231
Energy: 1.4211392893816115
Energy: 1.310106114648225
Energy: 1.366732722113748
Energy: 1.3101061146489872
Energy: 1.4211392893542034
Energy: 1.3667327221145102
Energy: 1.3101061146467003
Energy: 1.4211392893778345
Energy: 1.3101061146512742
Energy: 1.366732722113748
Energy: 1.3101061146527988
Energy: 1.421139289355728
Energy: 1.366732722113748
Energy: 1.3101061146505117
Energy: 1.421139289380849
Energy: 1.3101061146520363
Energy: 1.3667327221114611
Energy: 1.3101061146512742
Energy: 1.4211392893633512
Energy: 1.3667327221122234
Energy: 1.3101061146543231
Energy: 1.421139289388472
Energy: 1.3101061146474626
Energy: 1.366732722116035
Energy: 1.310106114648225
Energy: 1.4211392893648755
Energy: 1.3667327221152725
Energy: 1.310106114648225
Energy: 1.4211392893915211
Energy: 1.3101061146512742
Energy: 1.3667327221152725
Energy: 1.3101061146520363
Energy: 1.4211392893694492
Energy: 1.366732722108412
Energy: 1.3101061146505117
Energy: 1.4211392893922834
Energy: 1.3101061146520363
Energy: 1.366732722113748
Energy: 1.3101061146512742
Energy: 1.421139289370974
Energy: 1.3667327221122234
Energy: 1.310106114653561
Energy: 1.42113928941439
Energy: 1.310106114648225
Energy: 1.366732722113748
Energy: 1.3101061146489872
Energy: 1.4211392893755475
Energy: 1.3667327221152725
Energy: 1.3101061146467003
Energy: 1.4211392894067671
Energy: 1.3101061146512742
Energy: 1.3667327221129855
Energy: 1.3101061146520363
Energy: 1.4211392893770722
Energy: 1.3667327221152725
Energy: 1.3101061146505117
Energy: 1.4211392894105785
Energy: 1.3101061146520363
Energy: 1.3667327221114611
Energy: 1.3101061146512742
Energy: 1.421139289380849
Energy: 1.3667327221129855
Energy: 1.310106114653561
Energy: 1.42113928941439
Energy: 1.3101061146474626
Energy: 1.3667327221152725
Energy: 1.310106114648225
Energy: 1.4211392893899968
Energy: 1.3667327221145102
Energy: 1.3101061146474626
Energy: 1.4211392894303982
Energy: 1.3101061146512742
Energy: 1.3667327221152725
Energy: 1.3101061146520363
Energy: 1.4211392893892343

minimum gb energy = 1.260419981363595 eV
minimum distance =  2.32205640738159 Angstroms
sigma value = 23