Model name: model_name=MEAM_LAMMPS_KimSeolJi_2017_PtCu__MO_070797404269_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.917371600866318
cohesive_energy=5.770453839330309
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.0 eV

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

Energy: 0.01900085407502033
Energy: 1.009665682065103
Energy: 0.01900085407502033
Energy: 1.0096656820653702
Energy: 0.01900085407502033
Energy: 1.0096656820659045
Energy: 1.0096656820656373
Energy: 1.197233402209694
Energy: 1.0096656820656373
Energy: 1.1972334022099316
Energy: 1.009665682065103
Energy: 1.197233402210733
Energy: 0.01900085407502033
Energy: 1.0096656820653702
Energy: 0.01900085407502033
Energy: 1.009665682065103
Energy: 0.01900085407502033
Energy: 1.0096656820653702
Energy: 1.0096656820653702
Energy: 1.197233402210733
Energy: 1.009665682065103
Energy: 1.1972334022099316
Energy: 1.0096656820653702
Energy: 1.19723340220916
Energy: 0.01900085407502033
Energy: 1.0096656820653702
Energy: 0.01900085407502033
Energy: 1.0096656820656373
Energy: 0.01900085407502033
Energy: 1.0096656820656373
Energy: 1.009665682065103
Energy: 1.197233402210733
Energy: 1.0096656820653702
Energy: 1.1972334022122757
Energy: 1.009665682065103
Energy: 1.19723340220916

minimum gb energy = 0.01900085407502033 eV
minimum distance =  2.58987744796577 Angstroms
sigma value = 1


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

Energy: 1.6162445688564195
Energy: 1.7546094469017361
Energy: 1.6162445688570624
Energy: 1.7546094469017361
Energy: 1.6162445688557767
Energy: 1.7546094469023792
Energy: 1.8155218909632485
Energy: 1.3873117826069563
Energy: 1.8155218909638913
Energy: 1.3873117826069563
Energy: 1.8155218909638913
Energy: 1.3873117826075991
Energy: 1.6230022580283057
Energy: 1.7890660735100279
Energy: 1.6230022580283057
Energy: 1.7890660735106707
Energy: 1.6230022580295913
Energy: 1.7890660735106707
Energy: 1.8934293679521677
Energy: 1.5362275666321596
Energy: 1.8934293679521677
Energy: 1.5362275666321596
Energy: 1.8934293679515248
Energy: 1.5362275666321596
Energy: 1.6289552072091538
Energy: 1.6765396424532601
Energy: 1.6289552072091538
Energy: 1.6765396424539027
Energy: 1.6289552072091538
Energy: 1.6765396424539027
Energy: 1.647428693915607
Energy: 1.6874271784490853
Energy: 1.647428693914964
Energy: 1.6874271784497281
Energy: 1.647428693915607
Energy: 1.6874271784497281
Energy: 1.6338820864611094
Energy: 1.742957013419467
Energy: 1.6338820864604666
Energy: 1.742957013419467
Energy: 1.6338820864604666
Energy: 1.742957013419467
Energy: 1.5810243443096796
Energy: 1.7810756798670535
Energy: 1.5810243443096796
Energy: 1.7810756798670535
Energy: 1.5810243443096796
Energy: 1.7810756798670535
Energy: 1.7106446728602538
Energy: 1.7754302312274235
Energy: 1.7106446728602538
Energy: 1.7754302312280663
Energy: 1.7106446728602538
Energy: 1.7754302312280663
Energy: 1.4751082238521458
Energy: 1.733380387956223
Energy: 1.4751082238521458
Energy: 1.733380387956223
Energy: 1.4751082238521458
Energy: 1.733380387956223
Energy: 1.8670415311118291
Energy: 1.4673122944816508
Energy: 1.8670415311111863
Energy: 1.4673122944816508
Energy: 1.8670415311111863
Energy: 1.4673122944816508
Energy: 1.5291762309663182
Energy: 1.9603171021553303
Energy: 1.529176230966961
Energy: 1.9603171021553303
Energy: 1.5291762309656758
Energy: 1.960317102155973
Energy: 1.7339587004199992
Energy: 1.3764175663746507
Energy: 1.733958700420642
Energy: 1.376417566374008
Energy: 1.7339587004199992
Energy: 1.3764175663746507
Energy: 1.6888160789356537
Energy: 1.7349659914816946
Energy: 1.6888160789356537
Energy: 1.7349659914816946
Energy: 1.6888160789356537
Energy: 1.7349659914816946
Energy: 1.8423735502150582
Energy: 1.514333508909212
Energy: 1.8423735502163439
Energy: 1.514333508909212
Energy: 1.842373550215701
Energy: 1.514333508909212
Energy: 1.9003414589890781
Energy: 1.721196268457059
Energy: 1.9003414589890781
Energy: 1.721196268457702
Energy: 1.9003414589890781
Energy: 1.721196268457702
Energy: 1.6682348432847078
Energy: 1.74655326974312
Energy: 1.668234843284065
Energy: 1.7465532697424773
Energy: 1.6682348432847078
Energy: 1.74655326974312
Energy: 1.6392577450512713
Energy: 1.585596925347848
Energy: 1.6392577450519146
Energy: 1.585596925347848
Energy: 1.6392577450512713
Energy: 1.585596925347205
Energy: 1.435771830855541
Energy: 1.7982884942854571
Energy: 1.4357718308561838
Energy: 1.7982884942854571
Energy: 1.435771830855541
Energy: 1.7982884942854571
Energy: 1.8037367418811538
Energy: 1.5715337779306224
Energy: 1.8037367418811538
Energy: 1.571533777931265
Energy: 1.8037367418817967
Energy: 1.5715337779306224
Energy: 1.5251307775557748
Energy: 1.7170129012956183
Energy: 1.525130777556418
Energy: 1.7170129012962612
Energy: 1.525130777556418
Energy: 1.7170129012962612
Energy: 1.6845163391187115
Energy: 1.6605173411614707
Energy: 1.6845163391187115
Energy: 1.6605173411621137
Energy: 1.6845163391180684
Energy: 1.6605173411621137
Energy: 1.3453925942265181
Energy: 1.7724862312930527
Energy: 1.3453925942265181
Energy: 1.7724862312943384
Energy: 1.3453925942258753
Energy: 1.7724862312930527

minimum gb energy = 1.3453925942258753 eV
minimum distance =  2.55918771089926 Angstroms
sigma value = 33


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

Energy: 1.594836079464494
Energy: 1.904395308109517
Energy: 1.519182267720093
Energy: 1.9043953081109797
Energy: 1.5948360794626326
Energy: 1.904395308109517
Energy: 2.0197667857802784
Energy: 1.6798642155076866
Energy: 2.0197667857810098
Energy: 1.6798642155066228
Energy: 2.019766785777353
Energy: 1.6798642155066228
Energy: 1.5407247799919168
Energy: 1.6428108238960641
Energy: 1.5407247799923156
Energy: 1.642810823898258
Energy: 1.540724779990454
Energy: 1.6428108238967951
Energy: 1.9289932626676822
Energy: 1.7907743380581937
Energy: 1.9289932626654882
Energy: 1.7907743380570635
Energy: 1.9289932626651558
Energy: 1.7907743380570635
Energy: 1.712409986528544
Energy: 1.662146348370006
Energy: 1.7124099865267488
Energy: 1.6621463483725987
Energy: 1.7124099865260178
Energy: 1.6621463483718677
Energy: 1.9967028801446802
Energy: 1.6594984730155216
Energy: 1.9967028801450792
Energy: 1.6597599626112451
Energy: 1.9967028801458104
Energy: 1.6594984730162525
Energy: 1.8063794044666914
Energy: 1.8878489730481613
Energy: 1.806379404467755
Energy: 1.791202589391221
Energy: 1.8063794044655612
Energy: 1.8878489730496237
Energy: 1.4379977278276377
Energy: 1.9086907052634614
Energy: 1.4379977278273055
Energy: 1.9086907052627302
Energy: 1.437997727826574
Energy: 1.9086907052627302
Energy: 1.7819851148845565
Energy: 1.70184016327312
Energy: 1.7819851148841577
Energy: 1.7018401632713247
Energy: 1.7819851148848886
Energy: 1.701840163270926
Energy: 1.4331570877607454
Energy: 2.0165001132945117
Energy: 1.42617357811136
Energy: 2.0165001132941134
Energy: 1.4331570877611441
Energy: 2.016500113295243
Energy: 1.8215977092710485
Energy: 1.4027963873973959
Energy: 1.8215977092699183
Energy: 1.4027963873969966
Energy: 1.8215977092710485
Energy: 1.4027963873984595
Energy: 1.813954409167882
Energy: 1.9967420210954843
Energy: 1.8138334335175281
Energy: 1.9967420210947529
Energy: 1.8139544091671504
Energy: 1.9967420210950855
Energy: 1.7398028289102798
Energy: 1.495894527988108
Energy: 1.885463419424921
Energy: 1.495894527988108
Energy: 1.7398028289106122
Energy: 1.4958945279899027
Energy: 1.5498576623387206
Energy: 1.8724774966437163
Energy: 1.7089002211299948
Energy: 1.8724774966437163
Energy: 1.549857662337258
Energy: 1.8724774966451787
Energy: 1.876135559035046
Energy: 1.6416169202839548
Energy: 1.8761355590365085
Energy: 1.6416169202839548
Energy: 1.8761355590375721
Energy: 1.6416169202850186
Energy: 1.6586593716277511
Energy: 1.5545992927496455
Energy: 1.6586593716295464
Energy: 1.5545992927477839
Energy: 1.6586593716251585
Energy: 1.5545992927496455
Energy: 1.7538472404083378
Energy: 1.7263606304491093
Energy: 1.7538472404079386
Energy: 1.7263606304494419
Energy: 1.7538472404090688
Energy: 1.726360630450173
Energy: 1.8072105591116299
Energy: 1.6197610922974666
Energy: 1.807210559112029
Energy: 1.616437605180182
Energy: 1.807210559110566
Energy: 1.6197610923003918
Energy: 1.915590068945463
Energy: 1.7854756776787304
Energy: 1.9155900689443328
Energy: 1.8092992558503422
Energy: 1.9155900689450642
Energy: 1.7854756776783982
Energy: 1.8140994403769244
Energy: 1.5487893750175923
Energy: 1.814099440377323
Energy: 1.5458626213655806
Energy: 1.8140994403787856
Energy: 1.548789375015731
Energy: 1.3628404733587627
Energy: 1.9179129509024575
Energy: 1.3628404733580317
Energy: 1.9179129509038537
Energy: 1.3628404733558375
Energy: 1.9179129509009951
Energy: 1.6415546439627646
Energy: 1.690438464924586
Energy: 1.6415546439638282
Energy: 1.6904384649253177
Energy: 1.6415546439645599
Energy: 1.6904384649260489
Energy: 1.3993465083023742
Energy: 2.0603688708137358
Energy: 1.421991763671851
Energy: 2.0603688708141346
Energy: 1.3993465083027066
Energy: 2.0603688708144667
Energy: 1.8368908891188318
Energy: 1.8428287305184836
Energy: 1.8368908891177016
Energy: 1.8428287305184836
Energy: 1.8368908891188318
Energy: 1.8428287305173534
Energy: 1.7740528813623349
Energy: 1.9951532503155396
Energy: 1.6544086263961755
Energy: 1.9951532503148746
Energy: 1.7740528813637972
Energy: 1.995153250312282
Energy: 1.892273159719992
Energy: 1.7925605460937142
Energy: 1.7357034530192208
Energy: 1.7925605460929825
Energy: 1.8922731597203244
Energy: 1.7925605460937142
Energy: 1.9191408744087097
Energy: 1.7988266423517074
Energy: 1.7355299628904286
Energy: 1.7988266423528376
Energy: 1.919140874410904
Energy: 1.798826642352106
Energy: 1.7295270738838573
Energy: 1.7783743593033632
Energy: 1.7295270738827935
Energy: 1.7783743593048258
Energy: 1.729527073883525
Energy: 1.7783743593019006
Energy: 1.835810386082981
Energy: 1.7719259914000693
Energy: 1.8358103860844435
Energy: 1.7719259914008005
Energy: 1.8358103860844435
Energy: 1.7719259914004017
Energy: 1.335304177441346
Energy: 1.8948437686546198
Energy: 1.3353041774398837
Energy: 1.8948437686546198
Energy: 1.33530417743882
Energy: 1.8948437686538886
Energy: 1.805467042306501
Energy: 1.7016239331912932
Energy: 1.8054670423057697
Energy: 1.70167459845635
Energy: 1.8054670423050385
Energy: 1.701623933193886
Energy: 1.4842626423449334
Energy: 1.886777635247427
Energy: 1.484262642343471
Energy: 1.7421822655851524
Energy: 1.4842626423431384
Energy: 1.8867776352459646
Energy: 1.8127831977124274
Energy: 1.6372184015683438
Energy: 1.8127831977112974
Energy: 1.5662668029180837
Energy: 1.8127831977105662
Energy: 1.6372184015661497
Energy: 1.6856933066907065
Energy: 1.9116995955002152
Energy: 1.6856933066925017
Energy: 1.91169959549842
Energy: 1.6856933066925017
Energy: 1.9116995954965588
Energy: 1.6418237755874334
Energy: 1.581707821622005
Energy: 1.6418237755867022
Energy: 1.581707821622005
Energy: 1.6418237755863698
Energy: 1.581707821624531
Energy: 1.7899176716481198
Energy: 1.72812501372491
Energy: 1.789917671647721
Energy: 1.72812501372491
Energy: 1.7899176716481198
Energy: 1.72812501372491
Energy: 1.4492592743062565
Energy: 1.7180180300281847
Energy: 1.4496825382441432
Energy: 1.7180180300278522
Energy: 1.4492592743080517
Energy: 1.7180180300278522
Energy: 1.6973747479531418
Energy: 1.8642013667041977
Energy: 1.723949190800114
Energy: 1.8642013667063915
Energy: 1.6973747479516792
Energy: 1.8642013667049286
Energy: 1.7910939007313982
Energy: 1.814357135695113
Energy: 1.887044034796238
Energy: 1.8143571356936503
Energy: 1.791093900732861
Energy: 1.8143571356929191
Energy: 1.9211477145922407
Energy: 1.36694096009649
Energy: 1.9211477145922407
Energy: 1.3669409600975537
Energy: 1.9211477145922407
Energy: 1.3669409600968223
Energy: 1.8140491218773502
Energy: 1.7784921870776902
Energy: 1.8140491218780819
Energy: 1.778492187077358
Energy: 1.8140491218770178
Energy: 1.7784921870780894

minimum gb energy = 1.33530417743882 eV
minimum distance =  2.57793678822923 Angstroms
sigma value = 51


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

Energy: 1.870458147183822
Energy: 1.644743257152863
Energy: 1.870458147182975
Energy: 1.6447432571520157
Energy: 1.870458147182975
Energy: 1.644743257152863
Energy: 1.9080914641937095
Energy: 1.4810159638943006
Energy: 1.9080914641937095
Energy: 1.4810159638943006
Energy: 1.9080914641937095
Energy: 1.4810159638943006
Energy: 1.4094945849852931
Energy: 1.9506177401326994
Energy: 1.4094945849852931
Energy: 1.9506177401326994
Energy: 1.4094945849852931
Energy: 1.9506177401326994
Energy: 1.6409816377155
Energy: 1.4791170165188927
Energy: 1.6409816377155
Energy: 1.4791170165188927
Energy: 1.6409816377146529
Energy: 1.4791170165188927
Energy: 1.7662097551524085
Energy: 1.7175335418527538
Energy: 1.7662097551532554
Energy: 1.7175335418527538
Energy: 1.7662097551532554
Energy: 1.7175335418527538
Energy: 1.8777782719430152
Energy: 1.7494023688140774
Energy: 1.877778271942168
Energy: 1.7494023688140774
Energy: 1.877778271942168
Energy: 1.7494023688140774
Energy: 1.6051317483124279
Energy: 1.6365030228532693
Energy: 1.6051317483124279
Energy: 1.6365030228524224
Energy: 1.6051317483124279
Energy: 1.6365030228532693
Energy: 1.7203487085651055
Energy: 1.8898502517362434
Energy: 1.7203487085651055
Energy: 1.8898502517362434
Energy: 1.7203487085651055
Energy: 1.8898502517362434
Energy: 1.881065867354417
Energy: 1.4149614209510857
Energy: 1.881065867354417
Energy: 1.4149614209510857
Energy: 1.881065867354417
Energy: 1.4149614209510857
Energy: 1.6062342178278102
Energy: 1.8759350172264206
Energy: 1.6062342178278102
Energy: 1.8759350172264206
Energy: 1.6062342178278102
Energy: 1.8759350172264206
Energy: 1.9001618920156607
Energy: 1.3260787491735064
Energy: 1.9001618920156607
Energy: 1.3260787491735064
Energy: 1.9001618920156607
Energy: 1.3260787491735064
Energy: 1.67562648418522
Energy: 1.7715707383934947
Energy: 1.67562648418522
Energy: 1.7715707383943033
Energy: 1.67562648418522
Energy: 1.7715707383943033
Energy: 1.81964417854611
Energy: 1.4794530151745662
Energy: 1.81964417854611
Energy: 1.4794530151745662
Energy: 1.81964417854611
Energy: 1.4794530151745662
Energy: 1.6646753829774128
Energy: 1.6176749516543896
Energy: 1.6646753829757184
Energy: 1.617674951655237
Energy: 1.6646753829774128
Energy: 1.6176749516526954
Energy: 1.5630692954959111
Energy: 1.6979657921785354
Energy: 1.5630692954950642
Energy: 1.6979657921785354
Energy: 1.5630692954950642
Energy: 1.697965792179383
Energy: 1.7522609352935312
Energy: 1.7497074503778687
Energy: 1.7522609352935312
Energy: 1.7497074503778687
Energy: 1.7522609352935312
Energy: 1.7497074503778687
Energy: 1.732982257448215
Energy: 1.844524679233215
Energy: 1.732982257449062
Energy: 1.844524679233215
Energy: 1.732982257449062
Energy: 1.844524679233215
Energy: 1.6064159485850826
Energy: 1.5725670979365187
Energy: 1.6064159485850826
Energy: 1.5725670979365187
Energy: 1.6064159485842353
Energy: 1.5725670979365187

minimum gb energy = 1.3260787491735064 eV
minimum distance =  2.49346281907867 Angstroms
sigma value = 19


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

Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.5293446665926202
Energy: 1.579748769190688
Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.7695261965019926
Energy: 1.8407605992503464
Energy: 1.7695261965019926
Energy: 1.8407605992503464
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.2386620822700294
Energy: 1.6591562917085991
Energy: 1.2386620822700294
Energy: 1.6591562917085991
Energy: 1.2386620822695267
Energy: 1.6591562917085991
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.3347962715046173
Energy: 1.388001430998168
Energy: 1.3347962715041148
Energy: 1.3880014309996758
Energy: 1.3347962715041148
Energy: 1.3880014310001783
Energy: 1.3348265017972272
Energy: 1.3880195256746923
Energy: 1.3348265017977297
Energy: 1.388019525675195
Energy: 1.3348265017977297
Energy: 1.3880195256746923
Energy: 1.8328579657035846
Energy: 1.1875175057142573
Energy: 1.8328579657035846
Energy: 1.1875175057137548
Energy: 1.8328579657035846
Energy: 1.1875175057137548
Energy: 1.2382019086737326
Energy: 1.6592982252880915
Energy: 1.2382019086742353
Energy: 1.659298225288594
Energy: 1.2382019086737326
Energy: 1.6592982252880915
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.769686257060661
Energy: 1.8407803877823716
Energy: 1.5293446665926202
Energy: 1.579748769190688
Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.7695261965014901
Energy: 1.8407605992503464
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.2386620822700294
Energy: 1.6591562917085991
Energy: 1.2386620822700294
Energy: 1.6591562917091016
Energy: 1.2386620822700294
Energy: 1.6591562917085991
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.3347962715046173
Energy: 1.3880014310001783
Energy: 1.3347962715041148
Energy: 1.388001431000681
Energy: 1.3347962715036121
Energy: 1.3880014309986706
Energy: 1.3348265017977297
Energy: 1.3880195256756975
Energy: 1.3348265017977297
Energy: 1.3880195256726822
Energy: 1.3348265017972272
Energy: 1.3880195256746923
Energy: 1.8328579657040873
Energy: 1.1875175057142573
Energy: 1.8328579657040873
Energy: 1.1875175057147598
Energy: 1.8328579657040873
Energy: 1.1875175057142573
Energy: 1.2382019086742353
Energy: 1.6592982252880915
Energy: 1.2382019086737326
Energy: 1.659298225288594
Energy: 1.2382019086752403
Energy: 1.659298225288594
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.769686257060661
Energy: 1.8407803877823716
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.5293446665931227
Energy: 1.5797487691901853
Energy: 1.5293446665926202
Energy: 1.579748769190688
Energy: 1.7695261965019926
Energy: 1.8407605992503464
Energy: 1.7695261965014901
Energy: 1.8407605992503464
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.2386620822700294
Energy: 1.6591562917085991
Energy: 1.2386620822695267
Energy: 1.6591562917091016
Energy: 1.2386620822700294
Energy: 1.6591562917080966
Energy: 1.8328125477980035
Energy: 1.1874780141721497
Energy: 1.832812547798506
Energy: 1.1874780141716468
Energy: 1.832812547798506
Energy: 1.1874780141721497
Energy: 1.3347962715041148
Energy: 1.3880014310001783
Energy: 1.3347962715036121
Energy: 1.388001430998168
Energy: 1.3347962715041148
Energy: 1.3880014309991733
Energy: 1.3348265017977297
Energy: 1.3880195256741896
Energy: 1.3348265017977297
Energy: 1.3880195256711745
Energy: 1.3348265017972272
Energy: 1.3880195256736871
Energy: 1.8328579657035846
Energy: 1.1875175057142573
Energy: 1.8328579657035846
Energy: 1.1875175057142573
Energy: 1.8328579657040873
Energy: 1.1875175057142573
Energy: 1.2382019086747378
Energy: 1.6592982252890964
Energy: 1.23820190867323
Energy: 1.6592982252890964
Energy: 1.2382019086747378
Energy: 1.659298225289599
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.7696862570611636
Energy: 1.8407803877823716
Energy: 1.5293446665926202
Energy: 1.579748769190688
Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.5293446665926202
Energy: 1.5797487691901853
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.7695261965019926
Energy: 1.840760599249844
Energy: 1.2386620822695267
Energy: 1.6591562917085991
Energy: 1.2386620822695267
Energy: 1.6591562917080966
Energy: 1.2386620822700294
Energy: 1.6591562917085991

minimum gb energy = 1.1874780141716468 eV
minimum distance =  2.51353606874202 Angstroms
sigma value = 27


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

Energy: 1.2957322399231828
Energy: 1.2741477317044692
Energy: 1.2957322399231828
Energy: 1.2741477317032384
Energy: 1.2957322399231828
Energy: 1.2741477317044692
Energy: 2.162298304720232
Energy: 1.453167253993373
Energy: 2.162298304719001
Energy: 1.453167253992142
Energy: 2.162298304719001
Energy: 1.453167253993373
Energy: 1.2390210764321274
Energy: 2.2261763684439946
Energy: 1.2390210764321274
Energy: 2.226176368442763
Energy: 1.2390210764321274
Energy: 2.226176368442763
Energy: 1.892572674450559
Energy: 1.268480505567139
Energy: 1.892572674450559
Energy: 1.268480505567139
Energy: 1.892572674450559
Energy: 1.268480505567139
Energy: 1.891495069753272
Energy: 1.1942018117471718
Energy: 1.8914950697520407
Energy: 1.1942018117459408
Energy: 1.8914950697520407
Energy: 1.1942018117471718
Energy: 1.3897660243141334
Energy: 1.6494169685376467
Energy: 1.3897660243129026
Energy: 1.6494169685376467
Energy: 1.3897660243129026
Energy: 1.6494169685376467
Energy: 1.698833192141039
Energy: 1.4520837746490924
Energy: 1.698833192141039
Energy: 1.4520837746490924
Energy: 1.698833192141039
Energy: 1.4520837746490924
Energy: 1.2940294088688455
Energy: 1.276339977476718
Energy: 1.2940294088688455
Energy: 1.276339977476718
Energy: 1.2940294088688455
Energy: 1.276339977476718
Energy: 2.15852147736156
Energy: 1.4329279680612408
Energy: 2.15852147736156
Energy: 1.4329279680612408
Energy: 2.15852147736156
Energy: 1.432927968062472
Energy: 1.585697058943788
Energy: 1.549271701666204
Energy: 1.585697058943788
Energy: 1.549271701666204
Energy: 1.585697058943788
Energy: 1.549271701663742
Energy: 1.2581715201945936
Energy: 1.266883363287131
Energy: 1.2581715201945936
Energy: 1.266883363287131
Energy: 1.2581715201933625
Energy: 1.2668833632883618
Energy: 1.7903237236066158
Energy: 1.8045954176537942
Energy: 1.7903237236066158
Energy: 1.8045954176525634
Energy: 1.7903237236066158
Energy: 1.8045954176537942

minimum gb energy = 1.1942018117459408 eV
minimum distance =  2.59223032437923 Angstroms
sigma value = 9


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

Energy: 1.0531255658865692
Energy: 1.359110333325171
Energy: 1.0531255658865692
Energy: 1.359110333325171
Energy: 1.0531255658865692
Energy: 1.359110333325171
Energy: 1.7749346984777556
Energy: 1.3950450801209748
Energy: 1.7749346984777556
Energy: 1.3950450801209748
Energy: 1.7749346984812142
Energy: 1.3950450801209748
Energy: 1.11344994947687
Energy: 1.9745327321130117
Energy: 1.11344994947687
Energy: 1.9745327321095532
Energy: 1.11344994947687
Energy: 1.9745327321095532
Energy: 1.0617618964286393
Energy: 1.0370224124838745
Energy: 1.0617618964286393
Energy: 1.0370224124838745
Energy: 1.0617618964286393
Energy: 1.0370224124838745
Energy: 1.3636005525553054
Energy: 1.2971434851779866
Energy: 1.3636005525553054
Energy: 1.2971434851779866
Energy: 1.3636005525553054
Energy: 1.2971434851779866
Energy: 1.442098815633157
Energy: 1.8935298053632272
Energy: 1.442098815629698
Energy: 1.8935298053632272
Energy: 1.442098815629698
Energy: 1.8935298053632272
Energy: 1.1648243896815087
Energy: 1.6404502098040423
Energy: 1.1648243896815087
Energy: 1.6404502098040423
Energy: 1.1648243896815087
Energy: 1.6404502098040423
Energy: 1.0242789544346353
Energy: 1.3889177554572225
Energy: 1.0242789544346353
Energy: 1.3889177554572225
Energy: 1.0242789544346353
Energy: 1.3889177554572225
Energy: 1.9735071718787451
Energy: 1.2516180737346072
Energy: 1.9735071718787451
Energy: 1.2516180737346072
Energy: 1.9735071718787451
Energy: 1.2516180737346072
Energy: 1.3329005375600498
Energy: 1.8065647029704976
Energy: 1.3329005375600498
Energy: 1.8065647029704976
Energy: 1.3329005375600498
Energy: 1.8065647029704976
Energy: 1.0625360698669355
Energy: 1.0436243406083794
Energy: 1.0625360698669355
Energy: 1.0436243406083794
Energy: 1.062536069870394
Energy: 1.0436243406083794
Energy: 1.16394450870515
Energy: 1.1800886726708089
Energy: 1.16394450870515
Energy: 1.1800886726708089
Energy: 1.16394450870515
Energy: 1.1800886726708089
Energy: 1.5777126208793792
Energy: 1.1278497778250658
Energy: 1.577712620882838
Energy: 1.1278497778216072
Energy: 1.5777126208793792
Energy: 1.1278497778250658
Energy: 1.0526618870452162
Energy: 1.3594896616547152
Energy: 1.0526618870382987
Energy: 1.3594896616547152
Energy: 1.0526618870313813
Energy: 1.3594896616547152
Energy: 1.0477108925153564
Energy: 1.4053315125003776
Energy: 1.0477108925118976
Energy: 1.4053315125003776
Energy: 1.0477108925118976
Energy: 1.4053315125003776
Energy: 1.8154479204954905
Energy: 1.0329960449959645
Energy: 1.8154479204920315
Energy: 1.0329960449855884
Energy: 1.8154479204954905
Energy: 1.0329960449821296
Energy: 1.4886935656112723
Energy: 1.6150768307248098
Energy: 1.4886935656112723
Energy: 1.6150768307248098
Energy: 1.4886935656112723
Energy: 1.6150768307248098
Energy: 1.0629347549069998
Energy: 1.350896006716604
Energy: 1.0629347549069998
Energy: 1.350896006716604
Energy: 1.0629347549069998
Energy: 1.350896006716604
Energy: 0.9864461537053015
Energy: 1.4716807703107617
Energy: 0.9864461537053015
Energy: 1.4716807703107617
Energy: 0.9864461537053015
Energy: 1.4716807703107617
Energy: 2.4126902081940766
Energy: 1.3217236133360502
Energy: 2.4126902081940766
Energy: 1.3285171459373335
Energy: 2.4126902081940766
Energy: 1.3285171459373335
Energy: 0.9840111041298228
Energy: 1.4716688769040902
Energy: 0.9840111041298228
Energy: 1.4716688769040902
Energy: 0.9840111041298228
Energy: 1.4716688769040902
Energy: 1.0621392367686873
Energy: 1.3509174231259304
Energy: 1.0621392367686873
Energy: 1.3509174231259304
Energy: 1.0621392367652287
Energy: 1.3509174231224717
Energy: 1.4886263889208708
Energy: 1.6122933410927456
Energy: 1.4886263889208708
Energy: 1.6122933410927456
Energy: 1.4886263889208708
Energy: 1.6122933410927456
Energy: 1.8154787491698028
Energy: 1.0000983149640597
Energy: 1.8154787491698028
Energy: 1.0000983147047804
Energy: 1.8154787491698028
Energy: 1.0000983149951883
Energy: 1.047934508136591
Energy: 1.405333595867114
Energy: 1.047934508136591
Energy: 1.405333595867114
Energy: 1.047934508136591
Energy: 1.405333595867114
Energy: 1.0534282843377099
Energy: 1.3598962936538244
Energy: 1.0534282843377099
Energy: 1.3598962936538244
Energy: 1.0534282843377099
Energy: 1.3598962936538244
Energy: 1.577601591265183
Energy: 1.127574836482654
Energy: 1.577601591265183
Energy: 1.127574836482654
Energy: 1.577601591268642
Energy: 1.127574836482654
Energy: 1.1636753157853563
Energy: 1.0099319504341242
Energy: 1.1636753157853563
Energy: 1.0099319504341242
Energy: 1.1636753157853563
Energy: 1.0099319504341242
Energy: 1.063243969811419
Energy: 1.043710934973581
Energy: 1.063243969811419
Energy: 1.043710934973581
Energy: 1.063243969811419
Energy: 1.043710934973581
Energy: 1.332484989939767
Energy: 2.271910969772979
Energy: 1.332484989939767
Energy: 2.271910969772979
Energy: 1.3324849899363083
Energy: 2.271910969772979
Energy: 1.9154914488547545
Energy: 1.2492730520792619
Energy: 1.9154914488478372
Energy: 1.2492730520758033
Energy: 1.9154914488409194
Energy: 1.2492730520792619
Energy: 1.0243188670127652
Energy: 1.3889624928189406
Energy: 1.0243188670127652
Energy: 1.3889624928189406
Energy: 1.0243188670127652
Energy: 1.3889624928189406
Energy: 1.1652253845037246
Energy: 1.6403845393252787
Energy: 1.165225384500266
Energy: 1.6403845393252787
Energy: 1.1652253845037246
Energy: 1.6403845393252787
Energy: 1.4417705497071949
Energy: 2.2368868117332594
Energy: 1.4417705497037359
Energy: 2.2368868117332594
Energy: 1.4417705497071949
Energy: 2.2368868117332594
Energy: 1.363650877168533
Energy: 1.2969410530752206
Energy: 1.363650877168533
Energy: 1.2969410530752206
Energy: 1.363650877168533
Energy: 1.296941053071762
Energy: 1.06165612310828
Energy: 1.0371571772747745
Energy: 1.06165612310828
Energy: 1.0371571772747745
Energy: 1.06165612310828
Energy: 1.0371571772747745
Energy: 1.1133360967107102
Energy: 1.974416864183715
Energy: 1.1133360967072512
Energy: 1.974416864183715
Energy: 1.1133360967107102
Energy: 1.974416864183715
Energy: 1.775033496764861
Energy: 1.4043025904437572
Energy: 1.775033496764861
Energy: 1.4043025904437572
Energy: 1.775033496764861
Energy: 1.4043025904437572
Energy: 1.0531255658865692
Energy: 1.3591103333217123
Energy: 1.0531255658865692
Energy: 1.359110333325171
Energy: 1.0531255658865692
Energy: 1.3591103333217123
Energy: 1.774934698484673
Energy: 1.4505078368531248
Energy: 1.774934698484673
Energy: 1.4505078368531248
Energy: 1.774934698484673
Energy: 1.4505078368531248
Energy: 1.11344994947687
Energy: 1.9745327321130117
Energy: 1.1134499494803285
Energy: 1.9745327321130117
Energy: 1.11344994947687
Energy: 1.9745327321095532
Energy: 1.0617618964286393
Energy: 1.0370224124873333
Energy: 1.0617618964286393
Energy: 1.0370224124873333
Energy: 1.0617618964286393
Energy: 1.0370224124873333
Energy: 1.363600552558764
Energy: 1.2971434851779866
Energy: 1.363600552558764
Energy: 1.2971434851779866
Energy: 1.363600552558764
Energy: 1.2971434851779866

minimum gb energy = 0.9840111041298228 eV
minimum distance =  2.57355340352715 Angstroms
sigma value = 57


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

Energy: 0.41887426578055514
Energy: 0.4298762049629922
Energy: 0.4188742657813424
Energy: 0.4298762049629922
Energy: 0.4188742657813424
Energy: 0.4298762049629922
Energy: 1.3613915664118907
Energy: 1.374933079719389
Energy: 1.3613915664118907
Energy: 1.374933079719389
Energy: 1.3613915664111034
Energy: 1.3749330797201764
Energy: 0.4783486854501781
Energy: 1.3074345286722207
Energy: 0.47834868544939085
Energy: 1.307434528673008
Energy: 0.47834868544939085
Energy: 1.3074345286722207
Energy: 0.43210164300308196
Energy: 0.4186457955161737
Energy: 0.43210164300308196
Energy: 0.41864579551696096
Energy: 0.43210164300308196
Energy: 0.4186457955161737
Energy: 0.5439317652771316
Energy: 0.5455708517530378
Energy: 0.5439317652771316
Energy: 0.5455708517538251
Energy: 0.5439317652779191
Energy: 0.5455708517530378
Energy: 0.4188957133456423
Energy: 1.6026866045313033
Energy: 0.4188957133456423
Energy: 1.6026866045313033
Energy: 0.4188957133456423
Energy: 1.6026866045313033
Energy: 0.418885829345739
Energy: 1.6024938687963939
Energy: 0.418885829345739
Energy: 1.6024938687956067
Energy: 0.418885829345739
Energy: 1.6024938687963939
Energy: 0.5409267845698379
Energy: 0.5452538669177329
Energy: 0.5409267845706253
Energy: 0.5452538669185204
Energy: 0.5409267845698379
Energy: 0.5452538669185204
Energy: 0.4320855075395902
Energy: 0.41864054214397906
Energy: 0.43208550754037756
Energy: 0.41864054214397906
Energy: 0.43208550754037756
Energy: 0.41864054214397906
Energy: 0.4782939565339342
Energy: 1.3075170292729532
Energy: 0.4782939565339342
Energy: 1.3075170292729532
Energy: 0.4782939565339342
Energy: 1.3075170292737406
Energy: 1.3614087905194132
Energy: 1.3749112830218153
Energy: 1.3614087905194132
Energy: 1.3749112830218153
Energy: 1.3614087905194132
Energy: 1.3749112830218153
Energy: 0.4188742657813424
Energy: 0.4298762049629922
Energy: 0.4188742657813424
Energy: 0.4298762049629922
Energy: 0.4188742657813424
Energy: 0.4298762049629922
Energy: 1.3613915664118907
Energy: 1.3749330797178145
Energy: 1.3613915664111034
Energy: 1.3749330797186017
Energy: 1.3613915664118907
Energy: 1.3749330797186017
Energy: 0.4783486854501781
Energy: 1.3074345286706461
Energy: 0.4783486854501781
Energy: 1.3074345286706461
Energy: 0.4783486854501781
Energy: 1.3074345286714333
Energy: 0.43210164300229464
Energy: 0.4186457955161737
Energy: 0.43210164300308196
Energy: 0.41864579551696096
Energy: 0.43210164300308196
Energy: 0.41864579551696096
Energy: 0.5439317652771316
Energy: 0.5455708517530378
Energy: 0.5439317652771316
Energy: 0.5455708517530378
Energy: 0.5439317652779191
Energy: 0.5455708517530378
Energy: 0.418895713344855
Energy: 1.6026866045313033
Energy: 0.418895713344855
Energy: 1.6026866045313033
Energy: 0.4188957133456423
Energy: 1.6026866045313033
Energy: 0.418885829345739
Energy: 1.6024938687963939
Energy: 0.418885829345739
Energy: 1.6024938687956067
Energy: 0.41888582934652635
Energy: 1.6024938687963939
Energy: 0.5409267845706253
Energy: 0.5452538669185204
Energy: 0.5409267845706253
Energy: 0.5452538669185204
Energy: 0.5409267845706253
Energy: 0.5452538669185204

minimum gb energy = 0.41864054214397906 eV
minimum distance =  2.65471748726968 Angstroms
sigma value = 11


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

Energy: 0.9304035668519502
Energy: 1.146658645835437
Energy: 0.9304035668531038
Energy: 1.146658645835437
Energy: 0.9304035668531038
Energy: 1.146658645835437
Energy: 1.1996476952590116
Energy: 1.0756275654145906
Energy: 1.199647695312019
Energy: 1.0756275654145906
Energy: 1.1996476952578583
Energy: 1.0756275654145906
Energy: 1.2716609117276834
Energy: 2.5018841182175553
Energy: 1.27166091172826
Energy: 2.5018841182175553
Energy: 1.2716609117276834
Energy: 2.5018841182175553
Energy: 1.466428050484809
Energy: 0.895594227703016
Energy: 1.466428050484809
Energy: 0.895594227703016
Energy: 1.466428050484809
Energy: 0.895594227703016
Energy: 1.1329100900897255
Energy: 0.8998043188926659
Energy: 1.1329100900897255
Energy: 0.8998043188926659
Energy: 1.1329100900897255
Energy: 0.8998043188938194
Energy: 1.0421457964119245
Energy: 1.3723819731716629
Energy: 1.0421457964073106
Energy: 1.3723819731710862
Energy: 1.0421457964073106
Energy: 1.3723819731710862
Energy: 1.2693639904485032
Energy: 2.06660499375863
Energy: 1.2693639904473497
Energy: 2.0666049937580535
Energy: 1.269363990446773
Energy: 2.0666049937580535
Energy: 1.1779397269316148
Energy: 0.8687362613674406
Energy: 1.1779397269316148
Energy: 0.8687362613662872
Energy: 1.1779397269316148
Energy: 0.8687362613662872
Energy: 1.1752914474645315
Energy: 0.866576590674873
Energy: 1.1752914474639549
Energy: 0.8665765906754499
Energy: 1.1752914474633782
Energy: 0.866576590674873
Energy: 0.8668351401475278
Energy: 2.0187590023935744
Energy: 0.8668351401423373
Energy: 2.0187590023929975
Energy: 0.8668351401515652
Energy: 2.0187590023929975
Energy: 1.6370556213185363
Energy: 1.592207997126288
Energy: 1.63705562131969
Energy: 1.5922079971257113
Energy: 1.6370556213191132
Energy: 1.5922079971257113
Energy: 1.134847351502788
Energy: 0.9038755563920278
Energy: 1.1348473515033644
Energy: 0.9038755563920278
Energy: 1.1348473515039412
Energy: 0.9038755563926044
Energy: 1.174185431373882
Energy: 0.8921790558998601
Energy: 1.1741854313733053
Energy: 0.8921790558987066
Energy: 1.174185431373882
Energy: 0.8921790559010137
Energy: 1.3543505029634626
Energy: 2.2724282967943727
Energy: 1.3543505029634626
Energy: 2.2724282967949496
Energy: 1.3543505029634626
Energy: 2.2724282967943727
Energy: 1.3923183002302166
Energy: 1.1109633715807743
Energy: 1.39231830022964
Energy: 1.1109633715807743
Energy: 1.3923183002302166
Energy: 1.1109633715801976
Energy: 0.9698333889915601
Energy: 1.150874741851362
Energy: 0.9698333889921369
Energy: 1.1508747418519387
Energy: 0.9698333889915601
Energy: 1.150874741851362
Energy: 1.0317509080458964
Energy: 1.0660662376855197
Energy: 1.0317509080458964
Energy: 1.066066237684943
Energy: 1.0317509080464733
Energy: 1.0660662376855197
Energy: 1.5445934986762337
Energy: 2.3153741269734964
Energy: 1.544593498675657
Energy: 2.3153741269729196
Energy: 1.5445934986762337
Energy: 2.3153741269734964
Energy: 1.7028844658532758
Energy: 0.8893859319316534
Energy: 1.7028844658532758
Energy: 0.8893859319333838
Energy: 1.7028844658526994
Energy: 0.8893859319305001
Energy: 1.1346274447269997
Energy: 1.032649097244914
Energy: 1.1346274447258464
Energy: 1.0326490972460676
Energy: 1.1346274447269997
Energy: 1.0326490972454911
Energy: 0.8707337398041122
Energy: 1.3710009539436119
Energy: 0.8707337398058425
Energy: 1.3710009539436119
Energy: 0.8707337398041122
Energy: 1.3710009539436119
Energy: 1.4274387581505692
Energy: 2.1174130055870366
Energy: 1.4274387581505692
Energy: 2.117413005587614
Energy: 1.427438758151146
Energy: 2.11741300558646
Energy: 1.3835523677443025
Energy: 1.0247250043126226
Energy: 1.3835523677443025
Energy: 1.0247250043126226
Energy: 1.3835523677437254
Energy: 1.0247250043126226
Energy: 1.175639662913349
Energy: 1.0008930943230812
Energy: 1.175639662912772
Energy: 1.0008930943225045
Energy: 1.175639662912772
Energy: 1.0008930943236578
Energy: 0.8705205937754631
Energy: 2.041265576475088
Energy: 0.8705205937754631
Energy: 2.041265576475088
Energy: 0.8705205937754631
Energy: 2.041265576475665
Energy: 2.394924729756998
Energy: 1.4581120517118014
Energy: 2.394924729756421
Energy: 1.4581120517118014
Energy: 2.394924729756421
Energy: 1.4581120517118014

minimum gb energy = 0.866576590674873 eV
minimum distance =  2.56261083221244 Angstroms
sigma value = 41


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

Energy: 1.1708521414093167
Energy: 1.0093017584909767
Energy: 1.1708521414093167
Energy: 1.0093017584905222
Energy: 1.1708521414084077
Energy: 1.0093017584905222
Energy: 1.2627854597388866
Energy: 1.3108717396932552
Energy: 1.262785459737523
Energy: 1.3108717396937097
Energy: 1.262785459737523
Energy: 1.3108717396937097
Energy: 1.5112103892494637
Energy: 2.5485724689279787
Energy: 1.5112103892499185
Energy: 2.5485724689279787
Energy: 1.5112103892499185
Energy: 2.5485724689279787
Energy: 1.8284537239709344
Energy: 0.9969814873711697
Energy: 1.8284537239709344
Energy: 0.9969814873711697
Energy: 1.8284537239709344
Energy: 0.996981487370715
Energy: 0.974666022327561
Energy: 1.0440524004930334
Energy: 0.9746660223280157
Energy: 1.0440524004925789
Energy: 0.9746660223280157
Energy: 1.0440524004930334
Energy: 1.6550252903135891
Energy: 1.5203517136445508
Energy: 1.6550252903135891
Energy: 1.5203517136445508
Energy: 1.6550252903140439
Energy: 1.520351713644096
Energy: 1.2301874328682985
Energy: 2.2576069563658354
Energy: 1.230187432868753
Energy: 2.257606956365381
Energy: 1.230187432868753
Energy: 2.2576069563658354
Energy: 1.3910539522563836
Energy: 0.9970082633682292
Energy: 1.3910539522554743
Energy: 0.9970082633682292
Energy: 1.391053952255929
Energy: 0.9970082633682292
Energy: 1.0179207351449684
Energy: 1.038071414419051
Energy: 1.0179207351449684
Energy: 1.0380714144195058
Energy: 1.0179207351449684
Energy: 1.038071414419051
Energy: 1.6368519953363756
Energy: 1.7375558287143933
Energy: 1.6368519953363756
Energy: 1.7375558287143933
Energy: 1.6368519953368303
Energy: 1.7375558287143933
Energy: 1.6432958505971675
Energy: 1.7835308504207623
Energy: 1.6432958505930764
Energy: 1.7835308504212168
Energy: 1.6432958506003497
Energy: 1.7835308504207623
Energy: 1.2417159636043613
Energy: 1.1330624711706856
Energy: 1.2417159636043613
Energy: 1.1330624711711401
Energy: 1.2417159636043613
Energy: 1.1330624711711401
Energy: 1.0266854769516296
Energy: 0.9973231690088579
Energy: 1.0266854769511748
Energy: 0.9973231690088579
Energy: 1.0266854769516296
Energy: 0.9973231690093124
Energy: 0.9668506255253543
Energy: 2.042654677354922
Energy: 0.9668506255253543
Energy: 2.042654677355377
Energy: 0.9668506255253543
Energy: 2.042654677355377
Energy: 1.6644156178053957
Energy: 1.6826420198164234
Energy: 1.6644156178053957
Energy: 1.6826420198159686
Energy: 1.6644156178049414
Energy: 1.6826420198164234
Energy: 0.9765329576516177
Energy: 1.1639833869599698
Energy: 0.9765329576511631
Energy: 1.1639833869622427
Energy: 0.9765329576516177
Energy: 1.1639833869613339
Energy: 1.0280868592401882
Energy: 0.9971575622334448
Energy: 1.0280868592397334
Energy: 0.9971575622334448
Energy: 1.0280868592397334
Energy: 0.9971575622334448
Energy: 1.3140941986888093
Energy: 1.9151912345974835
Energy: 1.3140941986888093
Energy: 1.9151912345974835
Energy: 1.3140941986888093
Energy: 1.9151912345974835
Energy: 1.266828959045079
Energy: 1.3186015657681722
Energy: 1.2668289590441697
Energy: 1.318601565768627
Energy: 1.2668289590482609
Energy: 1.318601565768627
Energy: 1.050512674159281
Energy: 1.2980340329119429
Energy: 1.050512674159281
Energy: 1.2980340329119429
Energy: 1.050512674158372
Energy: 1.2980340329114883
Energy: 1.0148963320543976
Energy: 1.3073885922743342
Energy: 1.0148963320534885
Energy: 1.3073885922738797
Energy: 1.0148963320539433
Energy: 1.3073885922738797
Energy: 1.530265050113632
Energy: 1.976607665699802
Energy: 1.530265050113632
Energy: 1.976607665699802
Energy: 1.5302650501140864
Energy: 1.976607665702075
Energy: 1.7844024804380032
Energy: 0.996366516687206
Energy: 1.784402480437549
Energy: 0.9963665166862968
Energy: 1.7844024804380032
Energy: 0.996366516687206
Energy: 0.9769294242785761
Energy: 1.387752490474576
Energy: 0.9769294242794854
Energy: 1.3877524904736667
Energy: 0.9769294242790308
Energy: 1.3877524904741214
Energy: 0.9750865548583552
Energy: 1.5211661801085874
Energy: 0.9750865548569915
Energy: 1.5211661801081329
Energy: 0.9750865548579006
Energy: 1.5211661801081329
Energy: 1.5512372263175922
Energy: 0.9978897458616371
Energy: 1.5512372263162284
Energy: 0.997889745860728
Energy: 1.5512372263175922
Energy: 0.9978897458625463
Energy: 0.9126303109162309
Energy: 0.9965079918708303
Energy: 0.9126303109153218
Energy: 0.9965079918712849
Energy: 0.9126303109153218
Energy: 0.9965079918708303
Energy: 1.0153038703479367
Energy: 1.280749257477593
Energy: 1.0153038703474822
Energy: 1.280749257477593
Energy: 1.0153038703479367
Energy: 1.280749257477593
Energy: 1.0513985840017226
Energy: 1.5415003420418494
Energy: 1.051398584002177
Energy: 1.54150034204094
Energy: 1.0513985840017226
Energy: 1.5415003420427584
Energy: 1.7900669372831994
Energy: 1.050173999841838
Energy: 1.7900669372831994
Energy: 1.050173999841838
Energy: 1.790066937282745
Energy: 1.050173999841838
Energy: 1.2607923981580538
Energy: 1.360892301162839
Energy: 1.2607923981580538
Energy: 1.360892301162839
Energy: 1.260792398158508
Energy: 1.3608923011623846
Energy: 1.027794748800527
Energy: 0.9983829670660263
Energy: 1.027794748801436
Energy: 0.9983829670660263
Energy: 1.027794748801436
Energy: 0.9983829670655717
Energy: 0.9648040609548878
Energy: 1.231200114578873
Energy: 0.9648040609553422
Energy: 1.2312001145784184
Energy: 0.9648040609548878
Energy: 1.231200114578873

minimum gb energy = 0.9126303109153218 eV
minimum distance =  2.5754712763073 Angstroms
sigma value = 33


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

Energy: 1.1909840738944548
Energy: 1.1435413118096154
Energy: 1.1416842394745903
Energy: 1.1435413118128055
Energy: 1.1909840738912645
Energy: 1.1435413118128055
Energy: 1.7132198402327141
Energy: 1.0313170619010217
Energy: 1.713219840229524
Energy: 1.0313170619010217
Energy: 1.7132198402327141
Energy: 1.0313170619010217
Energy: 1.6900959074501574
Energy: 2.4657192348487174
Energy: 1.6900959074501574
Energy: 2.4657192348519077
Energy: 1.6900959074501574
Energy: 2.4657192348519077
Energy: 1.8029912783578237
Energy: 1.138530984901235
Energy: 1.802991278361014
Energy: 1.1385309849044252
Energy: 1.8029912783642041
Energy: 1.1385309849044252
Energy: 1.1397851558167367
Energy: 1.611999920699686
Energy: 1.1397852027173017
Energy: 1.6119999207028761
Energy: 1.139785155819927
Energy: 1.6119999207028761
Energy: 1.6195226373968308
Energy: 1.3865324869855669
Energy: 1.6195226373968308
Energy: 1.3865324869855669
Energy: 1.6195226373936404
Energy: 1.386532486982377
Energy: 1.523579316663971
Energy: 1.7663973238684412
Energy: 1.523579316663971
Energy: 1.7663973238684412
Energy: 1.5235793166671614
Energy: 1.7663973238684412
Energy: 1.5917382571000727
Energy: 1.5597086826830837
Energy: 1.5917382570968825
Energy: 1.5597086826862738
Energy: 1.5917382570968825
Energy: 1.5597086826862738
Energy: 1.5840973067326904
Energy: 1.1967284414910608
Energy: 1.5854298350529248
Energy: 1.1967284414910608
Energy: 1.5840973067326904
Energy: 1.1967284414910608
Energy: 1.5056219467937964
Energy: 1.3222324746458287
Energy: 1.5056219455310011
Energy: 1.3222324746458287
Energy: 1.5056219467108511
Energy: 1.3222324746458287
Energy: 2.1853628629866497
Energy: 2.050353599965449
Energy: 2.18536286298984
Energy: 2.0503535999686395
Energy: 2.18536286298984
Energy: 2.0503535999686395
Energy: 1.936150464259879
Energy: 1.1385636653605633
Energy: 1.936150464256689
Energy: 1.138563665357373
Energy: 1.936150464259879
Energy: 1.138563665357373
Energy: 1.1517295456492485
Energy: 1.5921889479446627
Energy: 1.1517295456492485
Energy: 1.5921889479446627
Energy: 1.1517295456460581
Energy: 1.5921889479446627
Energy: 1.5448676234422103
Energy: 1.591612687097018
Energy: 1.5448676234422103
Energy: 1.5916126870938276
Energy: 1.5448676234422103
Energy: 1.5916126870938276
Energy: 1.5654159988025151
Energy: 1.3806799710470434
Energy: 1.565415998799325
Energy: 1.3806799710470434
Energy: 1.565415998799325
Energy: 1.380679971043853
Energy: 1.4099329854413754
Energy: 1.3749994631987614
Energy: 1.4099329854445652
Energy: 1.3749994631987614
Energy: 1.4099329854445652
Energy: 1.3749994631987614
Energy: 1.5821140021207998
Energy: 1.1413478483233892
Energy: 1.5821140021176094
Energy: 1.1413478483233892
Energy: 1.5821140021176094
Energy: 1.1413478483233892
Energy: 1.121537960403632
Energy: 1.847801154597592
Energy: 1.1214230142416453
Energy: 1.847801154597592
Energy: 1.121537960403632
Energy: 1.847801154597592
Energy: 1.8431758424500382
Energy: 1.6893543251691834
Energy: 1.8431758424500382
Energy: 1.6893543251723735
Energy: 1.8431758424500382
Energy: 1.6893543251723735
Energy: 1.6115107799420774
Energy: 1.163040041577313
Energy: 1.6115107799420774
Energy: 1.1630400415741229
Energy: 1.6115107799420774
Energy: 1.1630400415741229
Energy: 1.144665085910266
Energy: 1.1380773636155528
Energy: 1.144665085910266
Energy: 1.138077363618743
Energy: 1.144665085910266
Energy: 1.138077363618743
Energy: 1.0468865085757455
Energy: 1.550697254993759
Energy: 1.046962562916987
Energy: 1.550697254990569
Energy: 1.0468865085757455
Energy: 1.550697254993759
Energy: 1.6240934777704894
Energy: 1.5043466959417164
Energy: 1.6240934777736797
Energy: 1.504346695944906
Energy: 1.6240934777672993
Energy: 1.504346695944906
Energy: 1.1415598918797853
Energy: 1.8390396414438883
Energy: 1.1415598918829757
Energy: 1.8390396414438883
Energy: 1.1415598918829757
Energy: 1.8390396414438883
Energy: 1.6114109260494056
Energy: 1.1418319825805396
Energy: 1.6114109260494056
Energy: 1.1418319825805396
Energy: 1.6114109260494056
Energy: 1.1418319825805396
Energy: 1.6129385724703245
Energy: 1.620963841002343
Energy: 1.6129385724703245
Energy: 1.620963841002343
Energy: 1.6129385724671346
Energy: 1.620963841002343
Energy: 2.0171667204811583
Energy: 1.5172671834935978
Energy: 2.0171667204811583
Energy: 1.5172671834935978
Energy: 2.017166720477968
Energy: 1.5172671834935978
Energy: 1.1900289319300161
Energy: 1.1486064476397613
Energy: 1.1410803799341143
Energy: 1.1486064476365712
Energy: 1.1900289319300161
Energy: 1.1486064476365712
Energy: 1.197309922584839
Energy: 1.6835706335652674
Energy: 1.1973099225880293
Energy: 1.6835706335620775
Energy: 1.1973099225880293
Energy: 1.6835706335620775
Energy: 1.3443702961550943
Energy: 1.6724815513541538
Energy: 1.3443702961550943
Energy: 1.6724815513541538
Energy: 1.3443702961519042
Energy: 1.6724815513541538
Energy: 1.800608440125734
Energy: 1.1385979286722663
Energy: 1.8006084401289242
Energy: 1.138597928669076
Energy: 1.8006084401321145
Energy: 1.138597928669076
Energy: 1.141409836630412
Energy: 1.7342134535806109
Energy: 1.141406367385916
Energy: 1.734213453583801
Energy: 1.141409836630412
Energy: 1.734213453583801
Energy: 1.639714630263484
Energy: 1.1558306670796357
Energy: 1.639714630263484
Energy: 1.1558306670764456
Energy: 1.639714630263484
Energy: 1.1558306670764456
Energy: 1.8787948548726576
Energy: 1.546566521022008
Energy: 1.8787948548758477
Energy: 1.546566521022008
Energy: 1.8787948548726576
Energy: 1.546566521022008
Energy: 1.8330659412319434
Energy: 1.562266609294955
Energy: 1.8330659412351338
Energy: 1.5622666092981454
Energy: 1.8330659412351338
Energy: 1.5622666092981454
Energy: 1.644120485070154
Energy: 1.2044709554789375
Energy: 1.644122767900848
Energy: 1.2044709554789375
Energy: 1.6441204850669637
Energy: 1.2044709554789375
Energy: 1.1414531449541663
Energy: 1.6667168896103137
Energy: 1.1414531449541663
Energy: 1.6667168896103137
Energy: 1.1414531449573564
Energy: 1.6667168896103137
Energy: 1.8493042340610897
Energy: 1.1313501567421338
Energy: 1.8493042340642798
Energy: 1.131350156738944
Energy: 1.8493042340642798
Energy: 1.131350156738944
Energy: 1.3948809608101824
Energy: 1.4293857598902102
Energy: 1.3948831041605045
Energy: 1.4293857598902102
Energy: 1.3948809608101824
Energy: 1.4293857598902102
Energy: 1.157634538687831
Energy: 1.65321692021178
Energy: 1.1576345386910212
Energy: 1.65321692021497
Energy: 1.157634538687831
Energy: 1.65321692021178
Energy: 1.1408557693118422
Energy: 1.1480114745716374
Energy: 1.1408557693086523
Energy: 1.148011474568447
Energy: 1.1408557693118422
Energy: 1.148011474568447
Energy: 2.0569180886013574
Energy: 1.3836712400454518
Energy: 2.0569180886013574
Energy: 1.3836712400454518
Energy: 2.0569180886013574
Energy: 1.3836712400454518
Energy: 1.6752935168937533
Energy: 1.6228954732334406
Energy: 1.6752935168937533
Energy: 1.622895473236631
Energy: 1.6752935168937533
Energy: 1.622895473236631
Energy: 1.5633627875426281
Energy: 1.1419548824524959
Energy: 1.5633627875426281
Energy: 1.1419548824524959
Energy: 1.5633627875458183
Energy: 1.1419548824524959
Energy: 1.1416945789953867
Energy: 1.8891850851505116
Energy: 1.1416928022781097
Energy: 1.8891850851505116
Energy: 1.141694578998577
Energy: 1.8891850851505116
Energy: 1.623317558733897
Energy: 1.4757507499260798
Energy: 1.623317558733897
Energy: 1.4757507499228897
Energy: 1.6233175587370874
Energy: 1.4757507499228897
Energy: 1.0403577020612451
Energy: 1.483040021031515
Energy: 1.040357702058055
Energy: 1.483040021031515
Energy: 1.040357702058055
Energy: 1.483040021031515

minimum gb energy = 1.0313170619010217 eV
minimum distance =  2.52855444106499 Angstroms
sigma value = 67


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

Energy: 1.244758065220966
Energy: 0.9985512069995239
Energy: 1.244758065220966
Energy: 0.9985512069995239
Energy: 1.244758065220966
Energy: 0.9985512069995239
Energy: 1.233540065034934
Energy: 1.0414006083730998
Energy: 1.233540065034934
Energy: 1.0414006083730998
Energy: 1.233540065034934
Energy: 1.0414006083730998
Energy: 1.9285478483998468
Energy: 1.5324545845092836
Energy: 1.9285478483998468
Energy: 1.5324545845071518
Energy: 1.4589626631515569
Energy: 1.5324545845092836
Energy: 1.2335574943362806
Energy: 1.0414308698240067
Energy: 1.2335574943362806
Energy: 1.0414308698218744
Energy: 1.2335574943362806
Energy: 1.0414308698240067
Energy: 1.244758065223098
Energy: 0.9985512069995239
Energy: 1.244758065223098
Energy: 0.9985512069995239
Energy: 1.244758065223098
Energy: 0.9985512069995239
Energy: 1.233540065037066
Energy: 1.0414006083730998
Energy: 1.233540065037066
Energy: 1.0414006083730998
Energy: 1.233540065037066
Energy: 1.0414006083730998
Energy: 1.4589626631494248
Energy: 1.5324545845092836
Energy: 1.4589626631494248
Energy: 1.5324545845092836
Energy: 1.4589626631494248
Energy: 1.5324545845092836

minimum gb energy = 0.9985512069995239 eV
minimum distance =  2.50219477145671 Angstroms
sigma value = 3


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

Energy: 1.712345011330521
Energy: 1.3839227960396483
Energy: 1.712345011330521
Energy: 1.3839227960396483
Energy: 1.712345011330521
Energy: 1.3839227960396483
Energy: 1.6495683101362113
Energy: 1.5217357922857542
Energy: 1.6495683101362113
Energy: 1.5217357922857542
Energy: 1.6495683101362113
Energy: 1.5217357922857542
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Energy: 1.8106740921009548
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Energy: 1.924831187740687
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Energy: 1.6061993588327985
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Energy: 1.6061993588327985
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Energy: 1.6999499173730346
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Energy: 1.5616760344590694
Energy: 1.6999499173730346
Energy: 1.6363566322884662
Energy: 1.4677309044290106
Energy: 1.6363566322884662
Energy: 1.467730904431912
Energy: 1.6363566322884662
Energy: 1.4677309044290106
Energy: 2.0466993149341515
Energy: 1.3397796974123912
Energy: 2.0466993149341515
Energy: 1.3397796974123912
Energy: 2.04669931493125
Energy: 1.3397796974123912
Energy: 1.4309951512579042
Energy: 2.0127597018304173
Energy: 1.4309951512579042
Energy: 2.0127597018304173
Energy: 1.4309951512579042
Energy: 2.0127597018304173
Energy: 1.5404554089250984
Energy: 1.50491049850309
Energy: 1.5404554089250984
Energy: 1.50491049850309
Energy: 1.5404554089250984
Energy: 1.50491049850309
Energy: 1.7793411530907202
Energy: 1.5985038431669847
Energy: 1.7793411530907202
Energy: 1.5985038431669847
Energy: 1.7793411530907202
Energy: 1.5985038431669847
Energy: 2.0261806995180542
Energy: 1.487701926903006
Energy: 2.0261806995180542
Energy: 1.487701926903006
Energy: 2.0261806995180542
Energy: 1.487701926903006
Energy: 1.3782474286133166
Energy: 1.8826944874823996
Energy: 1.3782474286133166
Energy: 1.8826944874823996
Energy: 1.3782474286133166
Energy: 1.8826944874823996
Energy: 1.3782884146735488
Energy: 1.47602937195975
Energy: 1.3782884146735488
Energy: 1.47602937195975
Energy: 1.3782884146735488
Energy: 1.47602937195975
Energy: 1.68321651862692
Energy: 1.5536297748942902
Energy: 1.68321651862692
Energy: 1.5536297748942902
Energy: 1.68321651862692
Energy: 1.5536297748942902
Energy: 1.9423011028069004
Energy: 1.912491223975892
Energy: 1.9423011028069004
Energy: 1.912491223975892
Energy: 1.9423011028069004
Energy: 1.912491223975892
Energy: 1.3994545867884507
Energy: 1.9080803079733801
Energy: 1.3994545867884507
Energy: 1.9080803079733801
Energy: 1.3994545867855492
Energy: 1.9080803079733801

minimum gb energy = 1.218083345203283 eV
minimum distance =  2.46864913632091 Angstroms
sigma value = 81


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

Energy: 1.6444705108305482
Energy: 1.4700824580085035
Energy: 1.6444705108305482
Energy: 1.4700824580085035
Energy: 1.6444705108309463
Energy: 1.4700824580085035
Energy: 1.4024415265263879
Energy: 1.611860855945712
Energy: 1.40244152652599
Energy: 1.611860855945712
Energy: 1.4024415265267862
Energy: 1.6118608559453136
Energy: 1.3224729835552178
Energy: 1.7517311042483406
Energy: 1.3224729835548195
Energy: 1.7517311042483406
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Energy: 1.7517311042479422
Energy: 1.4820575776761098
Energy: 1.5391909613459405
Energy: 1.4820575776765081
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Energy: 1.4084148247050934
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Energy: 1.408414824704695
Energy: 1.4611934580419998
Energy: 1.7686399683819878
Energy: 1.4611934580416015
Energy: 1.7686399683819878
Energy: 1.4611934580416015
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Energy: 1.466211473901746
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Energy: 1.4575931258146646
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Energy: 1.6298261898528288
Energy: 1.4030928030141117
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Energy: 1.6298261898532267
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Energy: 1.4985115498327841
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Energy: 1.4985115498327841
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Energy: 1.3895335990013034
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Energy: 1.5434228171257538
Energy: 1.5369162013654087
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Energy: 1.6776941225766946
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Energy: 1.6776941225766946
Energy: 1.6152001893096464
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Energy: 1.7891731901096837
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Energy: 1.9082908091014865
Energy: 1.5922181071850792
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Energy: 1.9082908091018844
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Energy: 1.6373517271311486
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Energy: 1.4973615167357484
Energy: 1.5800690339507715
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Energy: 1.5800690339503731
Energy: 1.4973615167361465
Energy: 1.9224884466758347
Energy: 1.6107838570844415
Energy: 1.9224884466758347
Energy: 1.6107838570844415
Energy: 1.9224884466762333
Energy: 1.6107838570844415
Energy: 1.550986010321377
Energy: 1.5013159903985565
Energy: 1.5509860103217756
Energy: 1.5013159903989546
Energy: 1.550986010321377
Energy: 1.5013159903977598
Energy: 1.4970465534851038
Energy: 1.6016684305055806
Energy: 1.4970465534855022
Energy: 1.6016684305059785
Energy: 1.4970465534843076
Energy: 1.6016684305055806
Energy: 1.6117488449363904
Energy: 1.406142888506876
Energy: 1.6117488449367887
Energy: 1.406142888506478
Energy: 1.6117488449363904
Energy: 1.406142888506876
Energy: 1.7517154718749934
Energy: 1.3535416604605046
Energy: 1.7517154718749934
Energy: 1.353541660460903
Energy: 1.75171547187579
Energy: 1.353541660460903
Energy: 1.7529697773620272
Energy: 1.9282816485259937
Energy: 1.7529697773616288
Energy: 1.92828164852679
Energy: 1.7529697773620272
Energy: 1.9282816485259937
Energy: 1.4542485767203166
Energy: 1.6347035919017374
Energy: 1.4542485767199185
Energy: 1.634703591901339
Energy: 1.4542485767207152
Energy: 1.6347035919017374
Energy: 1.4730909317073266
Energy: 1.5117826779335457
Energy: 1.4730909317073266
Energy: 1.511782677933944
Energy: 1.4730909317073266
Energy: 1.5117826779335457
Energy: 1.718392234842429
Energy: 1.338520008651767
Energy: 1.718392234842429
Energy: 1.3385200086525635
Energy: 1.718392234842429
Energy: 1.3385200086529618
Energy: 1.366653836423325
Energy: 1.9910883650653812
Energy: 1.3666538364237233
Energy: 1.9910883650653812
Energy: 1.3666538364237233
Energy: 1.9910883650657794
Energy: 1.5824191561549477
Energy: 1.5604687041843557
Energy: 1.582419156155346
Energy: 1.5604687041843557
Energy: 1.582419156155346
Energy: 1.5604687041843557
Energy: 1.611336106059246
Energy: 1.6349249557576533
Energy: 1.6113361060588476
Energy: 1.6349249557576533
Energy: 1.6113361060588476
Energy: 1.6349249557580516
Energy: 1.7947245305795005
Energy: 1.7573311567958092
Energy: 1.7947245305791024
Energy: 1.7573311567962073
Energy: 1.7947245305787043
Energy: 1.7573311567958092

minimum gb energy = 1.3224729835548195 eV
minimum distance =  2.5408026191339 Angstroms
sigma value = 43


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

Energy: 1.9674366735100417
Energy: 1.3366423016626794
Energy: 1.9674366735095525
Energy: 1.3366423016626794
Energy: 1.9674366735095525
Energy: 1.3366423016621902
Energy: 1.6697001392922033
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Energy: 1.534614210601428
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Energy: 1.4761490294908752
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Energy: 1.5909808821816593
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Energy: 1.7121285644016233
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Energy: 1.9242245726399767
Energy: 1.521545229393295
Energy: 1.9242245726404659
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Energy: 1.8377162458009724
Energy: 1.389766605570139
Energy: 1.8377162458014613
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Energy: 1.5831613430056557
Energy: 1.4778564854216059
Energy: 1.583161343006145
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Energy: 1.583161343006145
Energy: 1.4778564854216059
Energy: 1.6114974084155531
Energy: 1.5334967009613616
Energy: 1.611497408416042
Energy: 1.5334967009608724
Energy: 1.6114974084165314
Energy: 1.5334967009613616
Energy: 1.8807810685623665
Energy: 1.695156254014805
Energy: 1.8807810685623665
Energy: 1.6951562540143161
Energy: 1.8807810685618775
Energy: 1.695156254014805
Energy: 1.8831599766805205
Energy: 1.6322023154842769
Energy: 1.8831599766805205
Energy: 1.6322023154842769
Energy: 1.883159976680031
Energy: 1.6322023154842769
Energy: 1.541331254257447
Energy: 1.627559384217629
Energy: 1.541331254257447
Energy: 1.6275593842181182
Energy: 1.541331254257447
Energy: 1.627559384217629
Energy: 1.625723206228721
Energy: 1.4588490858855445
Energy: 1.625723206228232
Energy: 1.4588490858850554
Energy: 1.625723206228721
Energy: 1.4588490858855445
Energy: 1.7930456613294605
Energy: 1.2728787496649128
Energy: 1.7930456613284822
Energy: 1.2728787496649128
Energy: 1.7930456613284822
Energy: 1.2728787496644236
Energy: 1.5017196363977081
Energy: 1.6677079218451971
Energy: 1.5017196363977081
Energy: 1.6677079218451971
Energy: 1.5017196363977081
Energy: 1.6677079218451971
Energy: 1.4507633937460611
Energy: 1.6869034245475873
Energy: 1.4507633937460611
Energy: 1.6869034245475873
Energy: 1.4507633937460611
Energy: 1.6869034245475873
Energy: 1.6590216216175895
Energy: 1.4966444231236045
Energy: 1.6590216216175895
Energy: 1.4966444231240936
Energy: 1.6590216216175895
Energy: 1.4966444231236045
Energy: 1.848557376346938
Energy: 1.3725986909977497
Energy: 1.8485573763464491
Energy: 1.3725986909977497
Energy: 1.848557376346938
Energy: 1.3725986909977497
Energy: 1.377807204542733
Energy: 1.6993199986637757
Energy: 1.377807204542733
Energy: 1.6993199986637757
Energy: 1.377807204542733
Energy: 1.6993199986637757
Energy: 1.5789221975430496
Energy: 1.5332866604894528
Energy: 1.578922197544517
Energy: 1.533286660489942
Energy: 1.5789221975435386
Energy: 1.533286660489942
Energy: 1.7540169172468745
Energy: 1.469278568903995
Energy: 1.7540169172473634
Energy: 1.4692785689044845
Energy: 1.7540169172473634
Energy: 1.4692785689044845
Energy: 1.645582629120347
Energy: 1.779545598718997
Energy: 1.645582629120347
Energy: 1.779545598718997
Energy: 1.645582629119858
Energy: 1.7795455987185078
Energy: 1.519969896235863
Energy: 1.7800895759976028
Energy: 1.519969896235863
Energy: 1.7800895759976028
Energy: 1.519969896235863
Energy: 1.7800895759976028

minimum gb energy = 1.2728787496644236 eV
minimum distance =  2.47678176031224 Angstroms
sigma value = 57


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

Energy: 1.8399704578061697
Energy: 1.3219777505714148
Energy: 1.8399704578061697
Energy: 1.3219777505714148
Energy: 1.8399704578061697
Energy: 1.3219777505714148
Energy: 1.4262018263999843
Energy: 1.5046270555068977
Energy: 1.4262018263999843
Energy: 1.504627055507531
Energy: 1.4262018263999843
Energy: 1.5046270555068977
Energy: 1.326275697392966
Energy: 1.6281486408718084
Energy: 1.3262756973923326
Energy: 1.6281486408749752
Energy: 1.326275697392966
Energy: 1.6281486408749752
Energy: 1.8189510861612577
Energy: 1.604659734350764
Energy: 1.8189510861625242
Energy: 1.604659734350764
Energy: 1.8189510861625242
Energy: 1.604659734350764
Energy: 1.7786326704104847
Energy: 1.5611933602780301
Energy: 1.7786326704104847
Energy: 1.5611933602780301
Energy: 1.7786326704104847
Energy: 1.5611933602786632
Energy: 1.3272884754661318
Energy: 1.6259550320737255
Energy: 1.3272884754654986
Energy: 1.625955032074359
Energy: 1.3272884754661318
Energy: 1.625955032074359
Energy: 1.6710846049500003
Energy: 1.5977268591120573
Energy: 1.671084604949367
Energy: 1.5977268591114242
Energy: 1.6710846049500003
Energy: 1.5977268591120573
Energy: 1.710406084097217
Energy: 1.5587454421797196
Energy: 1.7104060840965836
Energy: 1.5587454421797196
Energy: 1.710406084097217
Energy: 1.5587454421797196
Energy: 1.5049781627292553
Energy: 1.5102890278366492
Energy: 1.504978162724822
Energy: 1.510289027836016
Energy: 1.5049781627273553
Energy: 1.5102890278353829
Energy: 1.3112932047861336
Energy: 1.4070732305753066
Energy: 1.3112932047867671
Energy: 1.4070732305753066
Energy: 1.3112932047861336
Energy: 1.4070732305753066
Energy: 1.6656075574555302
Energy: 1.6048136790357455
Energy: 1.665607557454897
Energy: 1.6048136790363785
Energy: 1.6656075574555302
Energy: 1.6048136790357455
Energy: 1.4888128549515796
Energy: 1.6390560014238595
Energy: 1.4888128549560127
Energy: 1.6390560014244928
Energy: 1.4888128549515796
Energy: 1.6390560014244928
Energy: 1.3913917965504305
Energy: 1.6692633277833917
Energy: 1.3913917965504305
Energy: 1.6692633277827587
Energy: 1.3913917965504305
Energy: 1.6692633277827587
Energy: 1.593309073231538
Energy: 1.4081075386380106
Energy: 1.593309073231538
Energy: 1.4081075386380106
Energy: 1.593309073231538
Energy: 1.408107538638644
Energy: 1.8088648121646647
Energy: 1.6027225601728818
Energy: 1.8088648121646647
Energy: 1.6027225601728818
Energy: 1.8088648121646647
Energy: 1.6027225601728818
Energy: 1.5896616893542466
Energy: 1.8067644040233672
Energy: 1.5896616893542466
Energy: 1.8067644040233672
Energy: 1.5896616893542466
Energy: 1.8067644040240003
Energy: 1.4777881411967402
Energy: 1.4261890473580123
Energy: 1.4777881411961071
Energy: 1.4261890473580123
Energy: 1.4777881411967402
Energy: 1.4261890473586458
Energy: 1.6103222571514593
Energy: 1.481669955661962
Energy: 1.6103222571514593
Energy: 1.481669955661962
Energy: 1.6103222571514593
Energy: 1.481669955661962
Energy: 1.477788805863388
Energy: 1.4261807166176967
Energy: 1.4777888058640214
Energy: 1.4261807166176967
Energy: 1.477788805863388
Energy: 1.4261807166176967
Energy: 1.5895727564160769
Energy: 1.8067491388695225
Energy: 1.5895727564154436
Energy: 1.8067491388701558
Energy: 1.5895727564160769
Energy: 1.8067491388701558
Energy: 1.8085855800629815
Energy: 1.602695651662524
Energy: 1.8085855800636153
Energy: 1.6026956516631572
Energy: 1.8085855800629815
Energy: 1.6026956516631572
Energy: 1.5934653249527346
Energy: 1.5513458293406464
Energy: 1.593465324953368
Energy: 1.5513458293387465
Energy: 1.5934653249527346
Energy: 1.55134582933748
Energy: 1.3914017203490543
Energy: 1.6694291580711977
Energy: 1.3914017203484208
Energy: 1.6694291580711977
Energy: 1.3914017203484208
Energy: 1.6694291580711977
Energy: 1.4891897895347812
Energy: 1.63904602265949
Energy: 1.4891897895347812
Energy: 1.6390460226588566
Energy: 1.4891897895366812
Energy: 1.63904602265949

minimum gb energy = 1.3112932047861336 eV
minimum distance =  2.59245850310311 Angstroms
sigma value = 17


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

Energy: 1.7474314595168983
Energy: 1.4200916442042724
Energy: 1.7474314595168983
Energy: 1.4200916442042724
Energy: 1.7474314595168983
Energy: 1.4200916442042724
Energy: 1.3284147489778189
Energy: 1.525401808471948
Energy: 1.3284147489778189
Energy: 1.525401808472844
Energy: 1.3284147489778189
Energy: 1.525401808472844
Energy: 1.2221724098409892
Energy: 1.4049561800638741
Energy: 1.2221724098400937
Energy: 1.4049561800647699
Energy: 1.2221724098409892
Energy: 1.4049561800638741
Energy: 1.5002861667402425
Energy: 1.5911524733265985
Energy: 1.5002861667402425
Energy: 1.5911524733265985
Energy: 1.5002861667402425
Energy: 1.5911524733265985
Energy: 1.5105011716425607
Energy: 1.501120528238113
Energy: 1.5105011716425607
Energy: 1.501120528238113
Energy: 1.5105011716425607
Energy: 1.501120528238113
Energy: 1.392375039218859
Energy: 1.4594069881923397
Energy: 1.392375039218859
Energy: 1.4594069881914846
Energy: 1.392375039218859
Energy: 1.4594069881914846
Energy: 1.520641761620486
Energy: 1.2831297785808116
Energy: 1.520641761620486
Energy: 1.2831297785799156
Energy: 1.520641761620486
Energy: 1.2831297785808116
Energy: 1.5000894245370715
Energy: 1.5916245948315615
Energy: 1.5000894245370715
Energy: 1.5916245948315615
Energy: 1.5000894245370715
Energy: 1.5916245948324572
Energy: 1.2828672239664571
Energy: 1.4960194051906917
Energy: 1.2828672239664571
Energy: 1.4960194051906917
Energy: 1.2828672239664571
Energy: 1.4960194051906917
Energy: 1.4933677577885225
Energy: 1.294248566339356
Energy: 1.4933677577885225
Energy: 1.294248566339356
Energy: 1.4933677577885225
Energy: 1.2942485663384604
Energy: 1.6369469096437306
Energy: 1.2932783491652955
Energy: 1.6369469096428346
Energy: 1.2932783491652955
Energy: 1.6369469096437306
Energy: 1.2932783491652955
Energy: 1.3683375998330847
Energy: 1.507251829467463
Energy: 1.3683375998321892
Energy: 1.507251829467463
Energy: 1.3683375998321892
Energy: 1.507251829467463
Energy: 1.3856039888119607
Energy: 1.401637571285626
Energy: 1.3856039888119607
Energy: 1.401637571285626
Energy: 1.3856039888119607
Energy: 1.401637571285626
Energy: 1.4272682131883105
Energy: 1.1613212871204792
Energy: 1.4272682131874148
Energy: 1.1613212871204792
Energy: 1.4272682131883105
Energy: 1.1613212871204792
Energy: 1.5146642241912889
Energy: 1.522531481900364
Energy: 1.5146642241912889
Energy: 1.522531481900364
Energy: 1.5146642241912889
Energy: 1.522531481900364
Energy: 1.5209294633330104
Energy: 1.6839781357991719
Energy: 1.5209294633330104
Energy: 1.6839781357991719
Energy: 1.5209294633330104
Energy: 1.6839781357991719
Energy: 1.3499058604093799
Energy: 1.160450568564431
Energy: 1.3499058604093799
Energy: 1.160450568564431
Energy: 1.3499058604093799
Energy: 1.160450568564431

minimum gb energy = 1.160450568564431 eV
minimum distance =  2.57709565143508 Angstroms
sigma value = 17


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

Energy: 1.6031776396309574
Energy: 1.1241429342361349
Energy: 1.6031776396309574
Energy: 1.124142934232676
Energy: 1.6031776396274984
Energy: 1.124142934232676
Energy: 1.2445603658938758
Energy: 1.3722387868793309
Energy: 1.2445603658938758
Energy: 1.3722387868793309
Energy: 1.2445603658938758
Energy: 1.3722387868827894
Energy: 1.069393515824041
Energy: 1.2388141828542159
Energy: 1.069393515824041
Energy: 1.2388141828542159
Energy: 1.069393515824041
Energy: 1.2388141828542159
Energy: 1.3931387044908856
Energy: 1.096453497821096
Energy: 1.3931387044908856
Energy: 1.096453497824555
Energy: 1.3931387044908856
Energy: 1.096453497821096
Energy: 1.598375619657132
Energy: 1.3446101759702063
Energy: 1.598375619657132
Energy: 1.3446101759667475
Energy: 1.598375619657132
Energy: 1.3446101759667475
Energy: 1.0335439470953731
Energy: 1.2868332864683683
Energy: 1.0335439470953731
Energy: 1.2868332864683683
Energy: 1.0335439470953731
Energy: 1.2868332864683683
Energy: 1.2784732851765412
Energy: 1.2698733242125615
Energy: 1.2784732851765412
Energy: 1.2698733242125615
Energy: 1.2784732851765412
Energy: 1.2698733242125615
Energy: 1.4591735616056658
Energy: 1.3448914939117593
Energy: 1.4591735616056658
Energy: 1.3448914939117593
Energy: 1.4591735616056658
Energy: 1.3448914939117593
Energy: 1.2142115074643909
Energy: 1.3086160874497312
Energy: 1.2142115074643909
Energy: 1.3086160874497312
Energy: 1.2142115074643909
Energy: 1.3086160874497312
Energy: 1.2870039234853228
Energy: 1.063388605051376
Energy: 1.287003923481864
Energy: 1.0633886050548345
Energy: 1.287003923481864
Energy: 1.0633886050548345
Energy: 1.380674277728221
Energy: 1.3744926191766487
Energy: 1.380674277728221
Energy: 1.3744926191766487
Energy: 1.380674277728221
Energy: 1.3744926191766487
Energy: 1.1760725253896733
Energy: 1.4091669320981388
Energy: 1.1760725253896733
Energy: 1.4091669320981388
Energy: 1.1760725253896733
Energy: 1.4091669320981388
Energy: 1.3384940801419758
Energy: 1.337256215334162
Energy: 1.3384940801419758
Energy: 1.337256215334162
Energy: 1.3384940801419758
Energy: 1.337256215334162
Energy: 1.5199802533668914
Energy: 1.1771167693403484
Energy: 1.5199802533668914
Energy: 1.1771167693403484
Energy: 1.5199802533668914
Energy: 1.1771167693403484
Energy: 1.3124444419295533
Energy: 1.4909495586544457
Energy: 1.3124444419295533
Energy: 1.4909495586544457
Energy: 1.3124444419295533
Energy: 1.4909495586544457
Energy: 1.2023352911452543
Energy: 1.2436002511195947
Energy: 1.2023352911452543
Energy: 1.2436002511195947
Energy: 1.2023352911452543
Energy: 1.2436002511195947
Energy: 1.3696237036550134
Energy: 1.0222366369364249
Energy: 1.3696237036550134
Energy: 1.0222366369364249
Energy: 1.3696237036550134
Energy: 1.0222366369364249
Energy: 1.4230725917133824
Energy: 1.400700518382721
Energy: 1.4230725917133824
Energy: 1.400700518382721
Energy: 1.4230725917133824
Energy: 1.400700518382721
Energy: 1.2743116487709785
Energy: 1.5580679499615484
Energy: 1.27431164876752
Energy: 1.5580679499650072
Energy: 1.2743116487709785
Energy: 1.5580679499650072
Energy: 1.2639558611728965
Energy: 1.0300146982419118
Energy: 1.2639558611728965
Energy: 0.9933909059188349
Energy: 1.2639558611728965
Energy: 0.9933909059222938
Energy: 1.2753564082591484
Energy: 1.5578388419197533
Energy: 1.275356408262607
Energy: 1.5578388419197533
Energy: 1.2753564082591484
Energy: 1.5578388419197533
Energy: 1.4233850851761574
Energy: 1.4006804207806822
Energy: 1.4233850851726988
Energy: 1.4006804207806822
Energy: 1.4233850851726988
Energy: 1.4006804207806822
Energy: 1.369430224165465
Energy: 1.022259194217822
Energy: 1.369430224165465
Energy: 1.022259194217822
Energy: 1.369430224165465
Energy: 1.022259194217822
Energy: 1.2021387233573575
Energy: 1.271994258762762
Energy: 1.2021387233573575
Energy: 1.271994258762762
Energy: 1.2021387233608163
Energy: 1.271994258762762
Energy: 1.312780369429737
Energy: 1.4909687031344492
Energy: 1.312780369429737
Energy: 1.4909687031344492
Energy: 1.312780369433133
Energy: 1.4909687031344492
Energy: 1.5202043687158722
Energy: 1.1770858749550515
Energy: 1.5202043687158722
Energy: 1.1770858749550515
Energy: 1.5202043687158722
Energy: 1.1770858749550515
Energy: 1.3385328094142694
Energy: 1.337066353595637
Energy: 1.3385328094142694
Energy: 1.337066353595637
Energy: 1.3385328094142694
Energy: 1.337066353595637
Energy: 1.1758058772378126
Energy: 1.409312964241969
Energy: 1.1758058772378126
Energy: 1.409312964241969
Energy: 1.1758058772378126
Energy: 1.409312964241969
Energy: 1.380629265591819
Energy: 1.374202108972339
Energy: 1.380629265591819
Energy: 1.374202108972339
Energy: 1.380629265591819
Energy: 1.374202108972339
Energy: 1.2869058285307113
Energy: 1.0983288766909367
Energy: 1.2869058285307113
Energy: 1.098328876687478
Energy: 1.2869058285307113
Energy: 1.0983288766909367
Energy: 1.2137670430179597
Energy: 1.3084099514217649
Energy: 1.2137670430179597
Energy: 1.3084099514183058
Energy: 1.2137670430179597
Energy: 1.3084099514183058
Energy: 1.4592082407835099
Energy: 1.3450524485077113
Energy: 1.4592082407835099
Energy: 1.3450524485077113
Energy: 1.4592082407835099
Energy: 1.3450524485077113
Energy: 1.2785112205135376
Energy: 1.2700590674628067
Energy: 1.2785112205135376
Energy: 1.2700590674628067
Energy: 1.2785112205135376
Energy: 1.2700590674628067
Energy: 1.0337386743501826
Energy: 1.2607096169131615
Energy: 1.0337386743536414
Energy: 1.2607096169131615
Energy: 1.0337386743501826
Energy: 1.2607096169131615
Energy: 1.5980709825851227
Energy: 1.254551326692227
Energy: 1.5980709825851227
Energy: 1.254551326692227
Energy: 1.5980709825851227
Energy: 1.2545513266956856
Energy: 1.3930715775529943
Energy: 1.0618835227664227
Energy: 1.3930715775529943
Energy: 1.0618835227664227
Energy: 1.3930715775529943
Energy: 1.0618835227664227
Energy: 1.06947033759759
Energy: 1.2389979036881698
Energy: 1.06947033759759
Energy: 1.2389979036881698
Energy: 1.06947033759759
Energy: 1.2389979036881698
Energy: 1.244790552083909
Energy: 1.4390485119632397
Energy: 1.244790552083909
Energy: 1.439048511959781
Energy: 1.244790552083909
Energy: 1.439048511959781
Energy: 1.6031776396274984
Energy: 1.1241429342361349
Energy: 1.6031776396309574
Energy: 1.1241429342361349
Energy: 1.6031776396274984
Energy: 1.1241429342361349
Energy: 1.2445603658938758
Energy: 1.3415587217853293
Energy: 1.2445603658938758
Energy: 1.341558721788788
Energy: 1.2445603658938758
Energy: 1.3415587217853293
Energy: 1.069393515824041
Energy: 1.2388141828542159
Energy: 1.069393515824041
Energy: 1.2388141828542159
Energy: 1.069393515824041
Energy: 1.2388141828542159
Energy: 1.3931387044908856
Energy: 1.0741498255757447
Energy: 1.3931387044908856
Energy: 1.0741498255757447
Energy: 1.3931387044908856
Energy: 1.0741498255757447
Energy: 1.598375619657132
Energy: 1.3446101759702063
Energy: 1.598375619657132
Energy: 1.3446101759702063
Energy: 1.598375619657132
Energy: 1.3446101759702063

minimum gb energy = 0.9933909059188349 eV
minimum distance =  2.51108144475522 Angstroms
sigma value = 57


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

Energy: 1.5032132410988739
Energy: 1.2167467026382552
Energy: 1.5032132410983108
Energy: 1.2167467026388183
Energy: 1.5032132410994372
Energy: 1.2167467026388183
Energy: 1.1060041483788174
Energy: 1.339417705607269
Energy: 1.1060041483799434
Energy: 1.3394177056067058
Energy: 1.1060041483799434
Energy: 1.3394177056067058
Energy: 1.03878305158624
Energy: 1.1273174305246298
Energy: 1.0387830515873664
Energy: 1.1273174305246298
Energy: 1.0387830515868033
Energy: 1.1273174305240667
Energy: 1.384795030187996
Energy: 1.0939568892949054
Energy: 1.384795030187996
Energy: 1.0939568892954687
Energy: 1.384795030187996
Energy: 1.0939568892949054
Energy: 1.4268072276261599
Energy: 1.31233021051478
Energy: 1.4268072276267232
Energy: 1.3123302105153432
Energy: 1.4268072276261599
Energy: 1.31233021051478
Energy: 0.9686391327048268
Energy: 1.1682760857687726
Energy: 0.968639132705902
Energy: 1.1682760857687726
Energy: 0.96863913270539
Energy: 1.168276085769336
Energy: 1.2408881167965229
Energy: 1.2038887960851101
Energy: 1.2408881167965229
Energy: 1.2038887960856735
Energy: 1.2408881167959598
Energy: 1.2038887960856735
Energy: 1.355015577544148
Energy: 1.2996128072890363
Energy: 1.355015577544148
Energy: 1.2996128072890363
Energy: 1.355015577544148
Energy: 1.2996128072895994
Energy: 1.0617108008599498
Energy: 1.210536372764211
Energy: 1.0617108008599498
Energy: 1.210536372764211
Energy: 1.0617108008599498
Energy: 1.2105363727647742
Energy: 1.1791921543585353
Energy: 1.2416873076051917
Energy: 1.1791921543585353
Energy: 1.2416873076051917
Energy: 1.1791921543585353
Energy: 1.2416873076051917
Energy: 1.240732084191956
Energy: 1.3221998755005957
Energy: 1.240732084191956
Energy: 1.322199875501159
Energy: 1.2407320841925193
Energy: 1.3221998755017221
Energy: 0.9553293067169033
Energy: 1.2821564316965155
Energy: 0.9553293067169033
Energy: 1.2821564316970786
Energy: 0.9553293067163401
Energy: 1.2821564316970786
Energy: 1.1825204536230374
Energy: 1.0379782905086439
Energy: 1.1825204536236005
Energy: 1.0379782905091557
Energy: 1.182520453622474
Energy: 1.0379782905080805
Energy: 1.3191550470083402
Energy: 1.1858159100724037
Energy: 1.319155047007777
Energy: 1.1858159100724037
Energy: 1.319155047007777
Energy: 1.1858159100712777
Energy: 1.0157302638421952
Energy: 1.404087010342157
Energy: 1.0157302638416321
Energy: 1.4040870103432834
Energy: 1.0157302638416321
Energy: 1.4040870103427203
Energy: 1.1898742491454979
Energy: 1.099222146482357
Energy: 1.1898742491454979
Energy: 1.0992221464829202
Energy: 1.1898742491454979
Energy: 1.099222146482357
Energy: 1.4414556751054146
Energy: 1.0832117741942449
Energy: 1.4414556751048513
Energy: 1.0832117741936818
Energy: 1.4414556751059777
Energy: 1.0832117741936818
Energy: 1.1906343080277242
Energy: 1.4106087752356211
Energy: 1.1906343080271609
Energy: 1.4106087752350578
Energy: 1.1906343080277242
Energy: 1.4106087752350578
Energy: 1.044921919470924
Energy: 1.2348686886269953
Energy: 1.044921919470361
Energy: 1.2348686886275586
Energy: 1.0449219194720503
Energy: 1.2348686886275586
Energy: 1.3054282900991268
Energy: 0.9807082484503948
Energy: 1.3054282900980005
Energy: 0.980708248450958
Energy: 1.3054282900980005
Energy: 0.9807082484503948
Energy: 1.2668373961458255
Energy: 1.3168494101131543
Energy: 1.2668373961463886
Energy: 1.316849410112028
Energy: 1.2668373961458255
Energy: 1.3168494101125912
Energy: 1.111303198634803
Energy: 1.4164880284916284
Energy: 1.111303198635366
Energy: 1.4164880284916284
Energy: 1.111303198634803
Energy: 1.4164880284916284
Energy: 1.1704773655866718
Energy: 0.9296367627989787
Energy: 1.1704773655866718
Energy: 0.9296367627984156
Energy: 1.1704773655866718
Energy: 0.9296367627989787
Energy: 1.315299469495974
Energy: 1.1766382228706178
Energy: 1.3152994694971003
Energy: 1.176638222871181
Energy: 1.3152994694965372
Energy: 1.1766382228700545
Energy: 1.1668862579911499
Energy: 1.272501462586302
Energy: 1.1668862579894606
Energy: 1.2725014625868654
Energy: 1.1668862579888974
Energy: 1.2725014625868654
Energy: 1.1737812573368813
Energy: 0.9296767441760301
Energy: 1.1737812573363184
Energy: 0.929676744175467
Energy: 1.1737812573363184
Energy: 0.929676744175467
Energy: 1.007710599045778
Energy: 1.245928199106745
Energy: 1.0077105990440884
Energy: 1.2459281991073083
Energy: 1.0077105990452147
Energy: 1.2459281991073083

minimum gb energy = 0.9296367627984156 eV
minimum distance =  2.52133796668342 Angstroms
sigma value = 43


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

Energy: 1.3800930359932118
Energy: 1.0773444470189346
Energy: 1.3800930359932118
Energy: 1.0773444470189346
Energy: 1.3800930359936223
Energy: 1.077344447019345
Energy: 0.9543857470689303
Energy: 1.247882413541508
Energy: 0.9543857470689303
Energy: 1.2478824135423288
Energy: 0.9543857470681096
Energy: 1.2478824135419184
Energy: 0.8980903925593458
Energy: 1.262935176232797
Energy: 0.8980903925593458
Energy: 1.262935176233207
Energy: 0.8980903925593458
Energy: 1.262935176233207
Energy: 1.2751366828472346
Energy: 0.9249679515614152
Energy: 1.2751366828472346
Energy: 0.9249679515614152
Energy: 1.2751366828468245
Energy: 0.9249679515605946
Energy: 1.1783923817873079
Energy: 1.1934312906162103
Energy: 1.1783923817868975
Energy: 1.1934312906166207
Energy: 1.1783923817873079
Energy: 1.1934312906166207
Energy: 0.8371618067939846
Energy: 1.0146421499575764
Energy: 0.8371618067939846
Energy: 1.0146421499575764
Energy: 0.8371618067935742
Energy: 1.014642149957166
Energy: 1.1838346384815663
Energy: 1.0007750869078809
Energy: 1.1838346384819767
Energy: 1.0007750869078809
Energy: 1.1838346384815663
Energy: 1.0007750869078809
Energy: 1.1880193459101969
Energy: 1.1224122473377853
Energy: 1.1880193459097868
Energy: 1.1224122473373748
Energy: 1.1880193459101969
Energy: 1.1224122473377853
Energy: 0.798419184260961
Energy: 1.0707650626254526
Energy: 0.798419184260961
Energy: 1.0707650626250422
Energy: 0.798419184260961
Energy: 1.0707650626254526
Energy: 1.1861790226803435
Energy: 0.9074919131864422
Energy: 1.186179022679933
Energy: 0.9074919131872629
Energy: 1.1861790226803435
Energy: 0.9074919131872629
Energy: 1.1709322594473657
Energy: 1.1755121647776843
Energy: 1.1709322594473657
Energy: 1.1755121647780948
Energy: 1.1709322594473657
Energy: 1.1755121647780948
Energy: 0.945552839239503
Energy: 1.2515969949831156
Energy: 0.9455528392403236
Energy: 1.2515969949831156
Energy: 0.9455528392399133
Energy: 1.251596994982705
Energy: 1.0119401800078436
Energy: 0.9476054848875662
Energy: 1.0119401800078436
Energy: 0.9476054848871559
Energy: 1.011940180008254
Energy: 0.9476054848875662
Energy: 1.07796160124391
Energy: 1.1762593714726206
Energy: 1.0779616012434994
Energy: 1.17625937147221
Energy: 1.0779616012434994
Energy: 1.1762593714726206
Energy: 0.9059338414442707
Energy: 1.2441987404569046
Energy: 0.905933841444681
Energy: 1.2441987404564945
Energy: 0.905933841444681
Energy: 1.2441987404564945
Energy: 1.0623720481748151
Energy: 0.8470716944455627
Energy: 1.0623720481744048
Energy: 0.8470716944455627
Energy: 1.0623720481776873
Energy: 0.8470716944455627
Energy: 1.1462705691159554
Energy: 1.2272824284814223
Energy: 1.1462705691155448
Energy: 1.2272824284814223
Energy: 1.1462705691159554
Energy: 1.2272824284814223
Energy: 0.8172832851260109
Energy: 1.2000599564070253
Energy: 0.8172832851260109
Energy: 1.200059956407436
Energy: 0.8172832851256006
Energy: 1.200059956407436
Energy: 1.034177879676636
Energy: 0.9050162730891531
Energy: 1.0341778796758154
Energy: 0.9050162730891531
Energy: 1.0341778796758154
Energy: 0.9050162730891531
Energy: 1.2684399814174763
Energy: 1.170254985688611
Energy: 1.2684399814174763
Energy: 1.1702549856882005
Energy: 1.2684399814178864
Energy: 1.170254985688611
Energy: 0.8761142053683041
Energy: 1.3379033538553868
Energy: 0.8761142053678938
Energy: 1.3379033538553868
Energy: 0.8761142053687144
Energy: 1.3379033538553868
Energy: 1.0693283749028601
Energy: 0.9507159296610921
Energy: 1.0693283749032707
Energy: 0.9507159296610921
Energy: 1.069328374904912
Energy: 0.9507159296606817
Energy: 1.3458435316262993
Energy: 0.9272665920928255
Energy: 1.3458435316254787
Energy: 0.9272665920932358
Energy: 1.34584353162712
Energy: 0.9272665920915945
Energy: 1.0573056323242649
Energy: 1.3436105862379017
Energy: 1.0573056323246752
Energy: 1.3436105862374916
Energy: 1.0573056323242649
Energy: 1.3436105862379017
Energy: 0.9556013117053611
Energy: 1.0165767397404477
Energy: 0.9556013117049508
Energy: 1.0165767397404477
Energy: 0.9556013117045404
Energy: 1.0165767397404477
Energy: 1.1705636901730758
Energy: 0.8596503972109615
Energy: 1.1705636901730758
Energy: 0.8596503972113718
Energy: 1.1705636901730758
Energy: 0.8596503972117822
Energy: 1.0597696800272933
Energy: 1.2471198225766806
Energy: 1.0552297852979378
Energy: 1.2471198225766806
Energy: 1.0597696800277039
Energy: 1.2471198225766806
Energy: 1.1059546933831492
Energy: 1.2081157026960514
Energy: 1.1059546933831492
Energy: 1.2081157026964617
Energy: 1.1059546933831492
Energy: 1.2081157026960514
Energy: 1.089116369651456
Energy: 0.7950584600505617
Energy: 1.0891163696518662
Energy: 0.7950584600505617
Energy: 1.089116369651456
Energy: 0.7950584600505617
Energy: 0.9635920995152701
Energy: 1.171389424813819
Energy: 0.9635920995156803
Energy: 1.171389424813819
Energy: 0.9635920995152701
Energy: 1.1713894248134087
Energy: 1.1205839601651104
Energy: 1.2088728582374504
Energy: 1.1205839601647
Energy: 1.2088728582378605
Energy: 1.1205839601651104
Energy: 1.2088728582378605
Energy: 1.0594512023612994
Energy: 0.7684589739518912
Energy: 1.059451202360889
Energy: 0.7684589739518912
Energy: 1.059451202360889
Energy: 0.7684589739518912
Energy: 0.9464086904218293
Energy: 1.212549447615388
Energy: 0.9464086904218293
Energy: 1.212549447615388
Energy: 0.9464086904218293
Energy: 1.212549447615388
Energy: 1.1323923103974858
Energy: 1.2586398224994477
Energy: 1.1323923103970754
Energy: 1.2586398224994477
Energy: 1.132392310396665
Energy: 1.2586398224998583
Energy: 1.1024015525181323
Energy: 0.8620626123554753
Energy: 1.1024015525185424
Energy: 0.8620626123558857
Energy: 1.1024015525181323
Energy: 0.8620626123554753
Energy: 0.8446223996226838
Energy: 0.9885016467213685
Energy: 0.8446223996222735
Energy: 0.9885016467209582
Energy: 0.8446223996226838
Energy: 0.9885016467209582

minimum gb energy = 0.7684589739518912 eV
minimum distance =  2.51571508146154 Angstroms
sigma value = 81


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

Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033062708166436
Energy: 0.05059379803832229
Energy: 0.6033062708166436
Energy: 0.05059379803832229
Energy: 0.6033062708166436
Energy: 0.05059379803832229
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033062708166436
Energy: 0.050593798036814665
Energy: 0.6033062708166436
Energy: 0.050593798036814665
Energy: 0.6033062708181511
Energy: 0.05059379803832229
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033462292077785
Energy: 0.050564276737256775
Energy: 0.6033062708166436
Energy: 0.05059379803832229
Energy: 0.6033062708166436
Energy: 0.05059379803832229
Energy: 0.6033062708166436
Energy: 0.05059379803832229
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954
Energy: 0.049129155463601325
Energy: 0.09354412572618954

minimum gb energy = 0.049129155463601325 eV
minimum distance =  2.7448738941964 Angstroms
sigma value = 3


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

Energy: 1.3849079703822254
Energy: 0.8453225736225202
Energy: 1.384907970381774
Energy: 0.8453225736225202
Energy: 1.3849079703822254
Energy: 0.8453225736229713
Energy: 0.9561713531243804
Energy: 1.0370291250153731
Energy: 0.9561713531243804
Energy: 1.0370291250158241
Energy: 0.9561713531243804
Energy: 1.0370291250153731
Energy: 1.041434719435499
Energy: 1.320872838418624
Energy: 1.0282548117535428
Energy: 1.320872838418624
Energy: 1.0282548117535428
Energy: 1.320872838418624
Energy: 1.2851781742129285
Energy: 0.8497741040391265
Energy: 1.2851781742129285
Energy: 0.8497741040386753
Energy: 1.2851781742133797
Energy: 0.8497741040391265
Energy: 0.9003116970711714
Energy: 1.1235435477408815
Energy: 0.9003116970711714
Energy: 1.1235435477408815
Energy: 0.9003116970711714
Energy: 1.1235435477413327
Energy: 1.017659563809991
Energy: 1.18224422337613
Energy: 1.0176595638104422
Energy: 1.18224422337613
Energy: 1.0176595638104422
Energy: 1.18224422337613
Energy: 1.1412632198452943
Energy: 0.9505150940188482
Energy: 1.1412632198452943
Energy: 0.9505150940192993
Energy: 1.1412632198452943
Energy: 0.9505150940188482
Energy: 0.9011340590843904
Energy: 1.065383048400419
Energy: 0.9011340590839393
Energy: 1.06538304840087
Energy: 0.9011340590843904
Energy: 1.065383048400419
Energy: 1.145137624061894
Energy: 1.087615647653357
Energy: 1.145137624062345
Energy: 1.087615647653357
Energy: 1.145137624061894
Energy: 1.087615647653357
Energy: 1.2303200712374687
Energy: 0.9444614933591535
Energy: 1.2303200712379199
Energy: 0.9444614933591535
Energy: 1.230320071238371
Energy: 0.9444614933587023
Energy: 0.978329428537356
Energy: 1.3630739477691716
Energy: 0.978329428537356
Energy: 1.363073947767818
Energy: 0.9783294285378071
Energy: 1.3630739477682694
Energy: 1.1752623700527087
Energy: 1.1155783957074699
Energy: 1.1752623700527087
Energy: 1.1155783957074699
Energy: 1.1752623700522578
Energy: 1.1155783957079213
Energy: 1.100852738724428
Energy: 0.861828481080788
Energy: 1.100852738724428
Energy: 0.861828481080788
Energy: 1.100852738727135
Energy: 0.861828481080788
Energy: 0.8805759077185877
Energy: 1.1350171018417445
Energy: 0.8805759077181364
Energy: 1.1350171018417445
Energy: 0.8805759077181364
Energy: 1.1350171018417445
Energy: 1.0055319770949842
Energy: 1.1333029729478752
Energy: 1.0055319770954352
Energy: 1.1333029729474238
Energy: 1.0055319770954352
Energy: 1.1333029729478752
Energy: 1.2670217021938694
Energy: 0.903836027625146
Energy: 1.2670217021938694
Energy: 0.903836027625146
Energy: 1.2670217021938694
Energy: 0.903836027624695
Energy: 0.9507579189888316
Energy: 1.2377032390977671
Energy: 0.9507579189883806
Energy: 1.2377032390977671
Energy: 0.9507579189888316
Energy: 1.2377032390977671
Energy: 0.9586676565011415
Energy: 1.0474221677999378
Energy: 0.9586676565015926
Energy: 1.0474221678003892
Energy: 0.9586676565015926
Energy: 1.0474221677999378
Energy: 1.3079482242229474
Energy: 0.9690086118564716
Energy: 1.3079482242233986
Energy: 0.9690086118564716
Energy: 1.30794822422385
Energy: 0.9690086118564716
Energy: 0.9128898657274617
Energy: 1.327546385283592
Energy: 0.9128898657265592
Energy: 1.327546385283141
Energy: 0.9128898657274617
Energy: 1.327546385283141
Energy: 1.0219650789824102
Energy: 0.9910815784986214
Energy: 1.0219650789828612
Energy: 0.9910815784990725
Energy: 1.0219650789833123
Energy: 0.9910815784990725
Energy: 1.3552597872494572
Energy: 0.9677055730853317
Energy: 1.3552597872476524
Energy: 0.9677055730857829
Energy: 1.3552597872467502
Energy: 0.9677055730853317
Energy: 0.8997840609937198
Energy: 1.3295156925603735
Energy: 0.8997840609937198
Energy: 1.3295156925612754
Energy: 0.8997840609941711
Energy: 1.3295156925608242
Energy: 1.0723584651157507
Energy: 0.918258881097257
Energy: 1.0723584651162015
Energy: 0.918258881097257
Energy: 1.0723584651162015
Energy: 0.918258881097257
Energy: 1.235378291002859
Energy: 0.9975310858749529
Energy: 1.235378291005115
Energy: 0.9975310858745017
Energy: 1.2353782910006033
Energy: 0.9975310858749529
Energy: 0.8411123825337082
Energy: 1.1726522578489877
Energy: 0.8411123825341595
Energy: 1.1726522578489877
Energy: 0.8411123825337082
Energy: 1.1726522578489877
Energy: 1.2465456160517392
Energy: 0.9485586578866345
Energy: 1.2465456160517392
Energy: 0.9485586578875368
Energy: 1.2465456160503856
Energy: 0.9485586578870857
Energy: 1.1436966278679024
Energy: 0.9836748882851869
Energy: 1.1436966278679024
Energy: 0.9836748882860894
Energy: 1.1436966278679024
Energy: 0.9836748882865405
Energy: 0.8056577448571126
Energy: 1.2528586419432066
Energy: 0.8056577448571126
Energy: 1.2528586419436578
Energy: 0.8056577448566616
Energy: 1.2528586419432066
Energy: 1.2307670532219894
Energy: 1.0446539114865472
Energy: 1.2307670532215382
Energy: 1.0446539114869982
Energy: 1.2307670532219894
Energy: 1.0446539114869982
Energy: 1.1900220035539755
Energy: 0.9411918654394678
Energy: 1.190022003553073
Energy: 0.9411918654394678
Energy: 1.190022003553524
Energy: 0.9411918654394678
Energy: 0.9341575796138952
Energy: 1.3232676169916167
Energy: 0.9341575796134441
Energy: 1.3232676169911657
Energy: 0.9341575796138952
Energy: 1.323267616989812
Energy: 1.0988091139253673
Energy: 0.9779055979581519
Energy: 1.0988091139253673
Energy: 0.9779055979577007
Energy: 1.0988091139253673
Energy: 0.9779055979577007

minimum gb energy = 0.8056577448566616 eV
minimum distance =  2.582069846159 Angstroms
sigma value = 67


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

Energy: 1.5080070761491748
Energy: 0.998362954349138
Energy: 1.508007076148532
Energy: 0.9983629543497808
Energy: 1.508007076148532
Energy: 0.998362954349138
Energy: 1.1024524603417147
Energy: 1.2168261470967163
Energy: 1.1024524603417147
Energy: 1.2168261470960735
Energy: 1.1024524603417147
Energy: 1.2168261470960735
Energy: 1.2434539423395854
Energy: 1.3657079458911652
Energy: 1.2434539423395854
Energy: 1.365707945891808
Energy: 1.2434539423395854
Energy: 1.3657079458905221
Energy: 1.3815075056604296
Energy: 0.982689690303365
Energy: 1.3815075056597867
Energy: 0.982689690303365
Energy: 1.3815075056597867
Energy: 0.982689690303365
Energy: 1.067533919608762
Energy: 1.2649465577376429
Energy: 1.067533919609405
Energy: 1.2649465577382857
Energy: 1.067533919609405
Energy: 1.2649465577382857
Energy: 1.2104340633600938
Energy: 1.2622160910189253
Energy: 1.2104340633594508
Energy: 1.2622160910163538
Energy: 1.2104340633600938
Energy: 1.2622160910349967
Energy: 1.5822508276590779
Energy: 1.086732323796049
Energy: 1.5822508276597207
Energy: 1.086732323795406
Energy: 1.5822508276590779
Energy: 1.086732323796049
Energy: 1.2530880344748248
Energy: 1.4729221581236547
Energy: 1.2530880344761106
Energy: 1.4729221581236547
Energy: 1.2530880344754678
Energy: 1.4729221581236547
Energy: 1.1930186949153634
Energy: 1.294255579948631
Energy: 1.1930186949147206
Energy: 1.2942555799492739
Energy: 1.1930186949153634
Energy: 1.2942555799492739
Energy: 1.3210614734158745
Energy: 1.078838256314263
Energy: 1.3210614734158745
Energy: 1.0788382563149062
Energy: 1.3210614734158745
Energy: 1.0788382563149062
Energy: 1.0957951544707694
Energy: 1.3560701626228457
Energy: 1.0957951544707694
Energy: 1.3560701626228457
Energy: 1.0957951544707694
Energy: 1.3560701626234886
Energy: 1.1113637708499613
Energy: 1.235688449682975
Energy: 1.1113637708499613
Energy: 1.2356884496823322
Energy: 1.1113637708506041
Energy: 1.2356884496823322
Energy: 1.325893127081773
Energy: 1.1608332386027878
Energy: 1.3258931270811303
Energy: 1.160833238602145
Energy: 1.3258931270811303
Energy: 1.1608332386027878
Energy: 1.06137053342287
Energy: 1.4299381053294058
Energy: 1.06137053342287
Energy: 1.4299381053300486
Energy: 1.06137053342287
Energy: 1.4299381053294058
Energy: 1.1592697493397026
Energy: 1.1529945303758247
Energy: 1.159269749337774
Energy: 1.1529945303751818
Energy: 1.1592697493384168
Energy: 1.1529945303751818
Energy: 1.4842021701432735
Energy: 1.1379639548507565
Energy: 1.4842021701432735
Energy: 1.1379639548513993
Energy: 1.4842021701439163
Energy: 1.1379639548513993
Energy: 1.012820891257964
Energy: 1.3602470786852716
Energy: 1.012820891257964
Energy: 1.3602470786859144
Energy: 1.012820891257964
Energy: 1.3602470786852716
Energy: 1.3096484023597346
Energy: 1.0725436867536213
Energy: 1.3096484023597346
Energy: 1.0725436867536213
Energy: 1.3096484023603774
Energy: 1.0725436867536213
Energy: 1.3352166715955711
Energy: 1.1777339156566742
Energy: 1.3352166715955711
Energy: 1.1777339156560316
Energy: 1.335216671596214
Energy: 1.1777339156560316
Energy: 1.1490363539486936
Energy: 1.4816517933347693
Energy: 1.1490363539486936
Energy: 1.4816517933347693
Energy: 1.1490363539480508
Energy: 1.481651793335412
Energy: 1.2411486998053933
Energy: 1.0406069796442947
Energy: 1.2411486998047505
Energy: 1.0406069796449375
Energy: 1.2411486998041077
Energy: 1.0406069796449375
Energy: 1.2951323904473167
Energy: 1.237512602156317
Energy: 1.2951323904473167
Energy: 1.237512602155674
Energy: 1.2951323904473167
Energy: 1.237512602156317
Energy: 1.0622162174106355
Energy: 1.3990091682115602
Energy: 1.0622162174099927
Energy: 1.3990091682109174
Energy: 1.0622162174106355
Energy: 1.3990091682115602

minimum gb energy = 0.982689690303365 eV
minimum distance =  2.48690259808292 Angstroms
sigma value = 33


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

Energy: 1.6094830665788202
Energy: 1.069628169819801
Energy: 1.6094830665784126
Energy: 1.069628169819801
Energy: 1.6094830665780047
Energy: 1.0696281698202086
Energy: 1.2429660129515405
Energy: 1.2829170768555198
Energy: 1.2429660129511328
Energy: 1.2829170768555198
Energy: 1.2429660129515405
Energy: 1.2829170768555198
Energy: 1.2675941264098678
Energy: 1.4207961014422663
Energy: 1.2675941264098678
Energy: 1.4207961014422663
Energy: 1.2675941264098678
Energy: 1.4207961014426744
Energy: 1.4735401167546145
Energy: 1.0752417657214568
Energy: 1.4735401167550222
Energy: 1.0752417657210491
Energy: 1.4735401167546145
Energy: 1.0752417657214568
Energy: 1.225980364330378
Energy: 1.4507377251950158
Energy: 1.2259803643311933
Energy: 1.4507377251950158
Energy: 1.2259803643316012
Energy: 1.4507377251946079
Energy: 1.4018892683071058
Energy: 1.3235622482487506
Energy: 1.4018892683071058
Energy: 1.334708435451086
Energy: 1.4018892683071058
Energy: 1.334708435451086
Energy: 1.5107515716136173
Energy: 1.3673098861974833
Energy: 1.5107515716136173
Energy: 1.3673098861978912
Energy: 1.5107515716136173
Energy: 1.3673098861974833
Energy: 1.1971594321456507
Energy: 1.4617460033263088
Energy: 1.1971594321452428
Energy: 1.4617460033263088
Energy: 1.1971594321456507
Energy: 1.4617460033263088
Energy: 1.1761327723380377
Energy: 1.264975515000481
Energy: 1.1761327723380377
Energy: 1.2649755150008888
Energy: 1.1761327723380377
Energy: 1.2649755149996653
Energy: 1.7101915342917218
Energy: 1.2013965832067999
Energy: 1.710191534292945
Energy: 1.2013965832072075
Energy: 1.7101915342909064
Energy: 1.2013965832072075
Energy: 1.163362511765351
Energy: 1.4212414496931938
Energy: 1.163362511765351
Energy: 1.4212414496927859
Energy: 1.1633625117657587
Energy: 1.4212414496936017
Energy: 1.242159055031578
Energy: 1.2525682599455599
Energy: 1.2421590550319859
Energy: 1.252568259945152
Energy: 1.242159055031578
Energy: 1.252568259945152
Energy: 1.605186758507249
Energy: 1.2607841676617424
Energy: 1.605186758507249
Energy: 1.2607841676617424
Energy: 1.6051867585076567
Energy: 1.2607841676613347
Energy: 1.2076714678605862
Energy: 1.423318566334295
Energy: 1.207671467860178
Energy: 1.4233185663338872
Energy: 1.207671467860178
Energy: 1.423318566334295
Energy: 1.3754697753791987
Energy: 1.232824810940692
Energy: 1.3754697753800142
Energy: 1.232824810940692
Energy: 1.3754697753800142
Energy: 1.2328248109402842
Energy: 1.4737482018873966
Energy: 1.2149783497601816
Energy: 1.4737482018882122
Energy: 1.2149783497601816
Energy: 1.4737482018882122
Energy: 1.2149783497609972
Energy: 1.2819423208547642
Energy: 1.601922679091323
Energy: 1.2819423208547642
Energy: 1.601922679091323
Energy: 1.2819423208547642
Energy: 1.6019226790909153
Energy: 1.3886136040410324
Energy: 1.2979741364168864
Energy: 1.3886136040402168
Energy: 1.297974136417294
Energy: 1.3886136040410324
Energy: 1.297974136417294
Energy: 1.6797757342797766
Energy: 1.349700905672327
Energy: 1.6797757342793689
Energy: 1.3497009056715115
Energy: 1.6797757342793689
Energy: 1.3497009056719194
Energy: 1.2413615512820464
Energy: 1.5738157074673378
Energy: 1.2413615512816387
Energy: 1.5738157074669301
Energy: 1.2413615512820464
Energy: 1.5738157074677457
Energy: 1.3543756659779649
Energy: 1.303045988413983
Energy: 1.3543756659775572
Energy: 1.303045988413983
Energy: 1.3543756659771493
Energy: 1.303045988413983
Energy: 1.4462867469323832
Energy: 1.0871572251979211
Energy: 1.446286746932791
Energy: 1.0871572251979211
Energy: 1.4462867469331988
Energy: 1.0871572251979211
Energy: 1.106738670661858
Energy: 1.4210342107720564
Energy: 1.1067386706622657
Energy: 1.4210342107724643
Energy: 1.1067386706622657
Energy: 1.4210342107724643
Energy: 1.6050974042006396
Energy: 1.2191230745684443
Energy: 1.6050974042006396
Energy: 1.2191230745684443
Energy: 1.6050974042014552
Energy: 1.2191230745684443
Energy: 1.164302123703669
Energy: 1.2199349559907287
Energy: 1.1643021237032611
Energy: 1.2199349559907287
Energy: 1.1643021237028532
Energy: 1.2199349559907287
Energy: 1.108668788514439
Energy: 1.5587816499861533
Energy: 1.1086687885140314
Energy: 1.5587816499861533
Energy: 1.108668788514439
Energy: 1.5587816499861533
Energy: 1.3850205894188277
Energy: 1.0842504907291257
Energy: 1.3850205894184198
Energy: 1.0842504907291257
Energy: 1.3850205894184198
Energy: 1.0842504907295336
Energy: 1.3511667341078675
Energy: 1.4272020992006333
Energy: 1.3511667341078675
Energy: 1.4272020992002254
Energy: 1.3511667341078675
Energy: 1.4272020992002254
Energy: 1.2438788390813287
Energy: 1.5742681704217443
Energy: 1.243878839080921
Energy: 1.5742681704213366
Energy: 1.2438788390817366
Energy: 1.5742681704217443
Energy: 1.5224012050206879
Energy: 1.3232416021351854
Energy: 1.5224012050206879
Energy: 1.3232416021347775
Energy: 1.5224012050206879
Energy: 1.3232416021347775
Energy: 1.3930314123143246
Energy: 1.3849703625641818
Energy: 1.3930314123139167
Energy: 1.3849703625641818
Energy: 1.393031412313509
Energy: 1.3849703625641818
Energy: 1.224038566763627
Energy: 1.4514952406686108
Energy: 1.2240385667632194
Energy: 1.4514952406686108
Energy: 1.224038566763627
Energy: 1.4514952406686108
Energy: 1.4694797043135486
Energy: 1.2204662233034462
Energy: 1.4694797043131407
Energy: 1.2204662233034462
Energy: 1.4694797043131407
Energy: 1.2204662233034462
Energy: 1.313283026563887
Energy: 1.2460826515053545
Energy: 1.313283026563887
Energy: 1.2460826515053545
Energy: 1.3132830265634794
Energy: 1.2460826515053545
Energy: 1.2191677333022304
Energy: 1.5503743070864082
Energy: 1.2191677333030462
Energy: 1.5503743070860003
Energy: 1.2191677333022304
Energy: 1.5503743070864082
Energy: 1.6120121958497953
Energy: 1.1207484584165375
Energy: 1.6120121958506106
Energy: 1.1207484584165375
Energy: 1.6120121958493876
Energy: 1.1207484584165375
Energy: 1.2435745624581425
Energy: 1.2349532278771544
Energy: 1.2435745624581425
Energy: 1.23495322787797
Energy: 1.2435745624581425
Energy: 1.23495322787797

minimum gb energy = 1.069628169819801 eV
minimum distance =  2.54051606127369 Angstroms
sigma value = 41


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

Energy: 1.7356416743476764
Energy: 1.2149158346908946
Energy: 1.7356416743476764
Energy: 1.2149158346908946
Energy: 1.7356416743465628
Energy: 1.2149158346908946
Energy: 1.3818919238330625
Energy: 1.375212392526712
Energy: 1.3818919238330625
Energy: 1.3752123925278255
Energy: 1.3818919238330625
Energy: 1.375212392526712
Energy: 1.6388034825301834
Energy: 1.5095744969589235
Energy: 1.553459523539128
Energy: 1.5095744969589235
Energy: 1.5534595235380144
Energy: 1.50957449695781
Energy: 1.852904621993992
Energy: 1.4269524968997926
Energy: 1.8529046219928784
Energy: 1.426952496898679
Energy: 1.852904621993992
Energy: 1.426952496898679
Energy: 1.5520100966086214
Energy: 1.7749550538997347
Energy: 1.5520100966086214
Energy: 1.7749550539008483
Energy: 1.5520100966086214
Energy: 1.7749550538997347
Energy: 1.6224497692986481
Energy: 1.435536221499989
Energy: 1.6224497692997615
Energy: 1.435536221499989
Energy: 1.6224497692997615
Energy: 1.435536221499989
Energy: 1.7760650121180404
Energy: 1.277594416593611
Energy: 1.7760650121180404
Energy: 1.277594416593611
Energy: 1.7760650121180404
Energy: 1.277594416593611
Energy: 1.3475555027036707
Energy: 1.5071134513802715
Energy: 1.3475555027036707
Energy: 1.5071134513802715
Energy: 1.3475555027036707
Energy: 1.5071134513802715
Energy: 1.3850623062931375
Energy: 1.4279291454118683
Energy: 1.385062306292024
Energy: 1.4279291454118683
Energy: 1.385062306292024
Energy: 1.4279291454118683
Energy: 1.6847539826757223
Energy: 1.249443371258059
Energy: 1.6847539826757223
Energy: 1.249443371258059
Energy: 1.6847539826757223
Energy: 1.249443371258059
Energy: 1.3640364154222073
Energy: 1.5775301138177218
Energy: 1.3640364154222073
Energy: 1.5775301138177218
Energy: 1.3640364154222073
Energy: 1.5775301138177218
Energy: 1.463579684434342
Energy: 1.3473874273560242
Energy: 1.463579684434342
Energy: 1.3473874273549107
Energy: 1.463579684434342
Energy: 1.3473874273549107
Energy: 1.6500375536892844
Energy: 1.3992215054412642
Energy: 1.6500375536892844
Energy: 1.3992215054412642
Energy: 1.6500375536892844
Energy: 1.3992215054412642
Energy: 1.57506328152544
Energy: 1.7716148618229028
Energy: 1.57506328152544
Energy: 1.7716148618240162
Energy: 1.575063281527667
Energy: 1.7716148618229028

minimum gb energy = 1.2149158346908946 eV
minimum distance =  2.51895321409119 Angstroms
sigma value = 11


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

Energy: 1.8739543473024765
Energy: 1.5351160414599723
Energy: 1.8739543473024765
Energy: 1.5351160414604617
Energy: 1.8739543473024765
Energy: 1.5351160414604617
Energy: 1.6185860938903072
Energy: 1.680904758050909
Energy: 1.6185860938903072
Energy: 1.680904758051398
Energy: 1.6185860938903072
Energy: 1.680904758051398
Energy: 1.5834140903267413
Energy: 1.6355048401666268
Energy: 1.5834140903267413
Energy: 1.6355048401671157
Energy: 1.5834140903262521
Energy: 1.6355048401671157
Energy: 1.9193606284224969
Energy: 1.419594573776358
Energy: 1.9193606284224969
Energy: 1.419594573776358
Energy: 1.9193606284220075
Energy: 1.419594573776358
Energy: 1.5705353580333263
Energy: 1.5796640498038417
Energy: 1.5705353580333263
Energy: 1.5796640498033523
Energy: 1.5705353580333263
Energy: 1.5796640498033523
Energy: 1.5444303231801617
Energy: 1.646704857558662
Energy: 1.5444303231801617
Energy: 1.646704857558662
Energy: 1.5444303231801617
Energy: 1.6467048575581729
Energy: 1.7349736242829858
Energy: 1.4617078341347356
Energy: 1.7349736242834752
Energy: 1.4617078341347356
Energy: 1.7349736242834752
Energy: 1.4617078341347356
Energy: 1.6031603167123887
Energy: 1.6562081701091984
Energy: 1.603160316712878
Energy: 1.6562081701091984
Energy: 1.6031603167123887
Energy: 1.6562081701096878
Energy: 1.5678659452904322
Energy: 1.5144354946765612
Energy: 1.5678659452904322
Energy: 1.5144354946765612
Energy: 1.5678659452904322
Energy: 1.5144354946765612
Energy: 1.6820753345035149
Energy: 1.4493028949791031
Energy: 1.6820753345035149
Energy: 1.4493028949786142
Energy: 1.682075334503026
Energy: 1.4493028949786142
Energy: 1.4195100441744208
Energy: 1.7896682593753368
Energy: 1.4195100441744208
Energy: 1.7896682593758257
Energy: 1.4195100441744208
Energy: 1.7896682593753368
Energy: 1.5828178410514906
Energy: 1.676699283053875
Energy: 1.5828178410514906
Energy: 1.6766992830533858
Energy: 1.5828178410514906
Energy: 1.676699283053875
Energy: 1.8124705042634925
Energy: 1.4406130251794005
Energy: 1.8124705042634925
Energy: 1.4406130251794005
Energy: 1.8124705042634925
Energy: 1.4406130251798897
Energy: 1.4758686605378346
Energy: 1.738810037400221
Energy: 1.4758686605378346
Energy: 1.738810037400221
Energy: 1.4758686605373457
Energy: 1.7388100374007105
Energy: 1.5795967468472623
Energy: 1.5898474638135434
Energy: 1.579596746846773
Energy: 1.5898474638130544
Energy: 1.5795967468472623
Energy: 1.5898474638135434
Energy: 1.7133193603807435
Energy: 1.4902441892363694
Energy: 1.713319360381233
Energy: 1.4902441892358804
Energy: 1.7133193603807435
Energy: 1.4902441892358804
Energy: 1.4646638511207455
Energy: 1.7725761602935568
Energy: 1.4646638511207455
Energy: 1.7725761602935568
Energy: 1.4646638511207455
Energy: 1.7725761602930676
Energy: 1.6461765992403996
Energy: 1.6188534226722877
Energy: 1.6461765992399104
Energy: 1.618853422672777
Energy: 1.6461765992399104
Energy: 1.618853422672777
Energy: 1.8352884529722084
Energy: 1.3819815650006353
Energy: 1.83528845297123
Energy: 1.3819815650006353
Energy: 1.8352884529717193
Energy: 1.3819815650001461
Energy: 1.5669911415663333
Energy: 1.7030270432910488
Energy: 1.5669911415663333
Energy: 1.7030270432910488
Energy: 1.5669911415663333
Energy: 1.7030270432910488
Energy: 1.6168785944415556
Energy: 1.5532721458633927
Energy: 1.6168785944420447
Energy: 1.5532721458629037
Energy: 1.6168785944415556
Energy: 1.5532721458629037
Energy: 1.7690646456495729
Energy: 1.520197791914447
Energy: 1.7690646456495729
Energy: 1.520197791914447
Energy: 1.7690646456490837
Energy: 1.520197791914447
Energy: 1.4886942892834896
Energy: 1.7282926196610833
Energy: 1.4886942892839787
Energy: 1.7282926196615727
Energy: 1.4886942892839787
Energy: 1.7282926196610833
Energy: 1.6791804247389377
Energy: 1.5302844291600781
Energy: 1.6791804247389377
Energy: 1.530284429159589
Energy: 1.679180424739427
Energy: 1.530284429159589
Energy: 1.7919892015213603
Energy: 1.480082040757509
Energy: 1.7919892015213603
Energy: 1.480082040757509
Energy: 1.7919892015208714
Energy: 1.4800820407570199
Energy: 1.3875687907019976
Energy: 1.8130482232632017
Energy: 1.3875687907019976
Energy: 1.8130482232632017
Energy: 1.3875687907019976
Energy: 1.8130482232627123
Energy: 1.497286792325339
Energy: 1.6794337439473068
Energy: 1.497286792325339
Energy: 1.6794337439477958
Energy: 1.497286792325339
Energy: 1.6794337439477958
Energy: 1.7403857388217931
Energy: 1.5730061723635154
Energy: 1.7403857388217931
Energy: 1.5730061723635154
Energy: 1.740385738822282
Energy: 1.5730061723635154
Energy: 1.4269458865234588
Energy: 1.775260190128002
Energy: 1.4269458865229696
Energy: 1.775260190127513
Energy: 1.4269458865234588
Energy: 1.775260190127513
Energy: 1.5272857471136285
Energy: 1.5640361247181402
Energy: 1.5272857471131396
Energy: 1.5640361247166732
Energy: 1.5272857471136285
Energy: 1.5640361247166732
Energy: 1.655575122647232
Energy: 1.5406051300799282
Energy: 1.655575122647232
Energy: 1.5406051300794392
Energy: 1.655575122646743
Energy: 1.5406051300789498

minimum gb energy = 1.3819815650001461 eV
minimum distance =  2.54588243242328 Angstroms
sigma value = 57


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

Energy: 1.4226286321457708
Energy: 1.2754308418311588
Energy: 1.4226286321457708
Energy: 1.2754308418311588
Energy: 1.4226286321457708
Energy: 1.2754308418311588
Energy: 1.7492107093226812
Energy: 1.7603643118824617
Energy: 1.7492107093226812
Energy: 1.760364311883332
Energy: 1.7492107093226812
Energy: 1.7603643118824617
Energy: 1.5239058855708392
Energy: 1.4290379912536348
Energy: 1.5239058855708392
Energy: 1.4290379912536348
Energy: 1.5239058855708392
Energy: 1.4290379912545053
Energy: 1.9046696831253254
Energy: 1.5760020985099568
Energy: 1.9046696831253254
Energy: 1.5760020985099568
Energy: 1.9046696831253254
Energy: 1.5760020985108272
Energy: 1.5237485975307505
Energy: 1.4290522858526136
Energy: 1.5237485975307505
Energy: 1.4290522858526136
Energy: 1.5237485975307505
Energy: 1.4290522858517434
Energy: 1.7492408542429534
Energy: 1.3986942634113477
Energy: 1.7492408542429534
Energy: 1.3986942634113477
Energy: 1.7492408542429534
Energy: 1.3986942634113477
Energy: 1.4226286321449004
Energy: 1.2754308418311588
Energy: 1.4226286321449004
Energy: 1.2754308418311588
Energy: 1.4226286321449004
Energy: 1.2754308418302887
Energy: 1.7492107093226812
Energy: 1.760364311883332
Energy: 1.7492107093226812
Energy: 1.760364311883332
Energy: 1.7492107093235516
Energy: 1.760364311883332
Energy: 1.5239058855708392
Energy: 1.4290379912545053
Energy: 1.5239058855708392
Energy: 1.4290379912536348
Energy: 1.5239058855708392
Energy: 1.4290379912545053
Energy: 1.9046696831235843
Energy: 1.5760020985108272
Energy: 1.9046696831235843
Energy: 1.5760020985108272
Energy: 1.9046696831235843
Energy: 1.5760020985108272
Energy: 1.5237485975298801
Energy: 1.4290522858517434
Energy: 1.5237485975307505
Energy: 1.4290522858517434
Energy: 1.5237485975307505
Energy: 1.429052285850873
Energy: 1.7492408542429534
Energy: 1.6217545280706755
Energy: 1.7492408542429534
Energy: 1.6217545280706755
Energy: 1.7492408542429534
Energy: 1.6217545280706755
Energy: 1.4226286321457708
Energy: 1.2754308418311588
Energy: 1.4226286321457708
Energy: 1.2754308418311588
Energy: 1.4226286321457708
Energy: 1.2754308418311588
Energy: 1.7492107093226812
Energy: 1.7603643118842025
Energy: 1.7492107093235516
Energy: 1.760364311883332
Energy: 1.7492107093226812
Energy: 1.7603643118824617
Energy: 1.5239058855699692
Energy: 1.4290379912536348
Energy: 1.5239058855708392
Energy: 1.4290379912536348
Energy: 1.5239058855699692
Energy: 1.4290379912536348
Energy: 1.9046696831253254
Energy: 1.5760020985108272
Energy: 1.9046696831253254
Energy: 1.5760020985099568
Energy: 1.9046696831253254
Energy: 1.5760020985099568
Energy: 1.5237485975307505
Energy: 1.4290522858526136
Energy: 1.5237485975307505
Energy: 1.4290522858517434
Energy: 1.5237485975307505
Energy: 1.4290522858517434

minimum gb energy = 1.2754308418302887 eV
minimum distance =  2.53164964600114 Angstroms
sigma value = 9


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

Energy: 1.450573713154472
Energy: 1.5166817422227694
Energy: 1.450573713153761
Energy: 1.51668174222348
Energy: 1.450573713153761
Energy: 1.51668174222348
Energy: 1.4869622607184847
Energy: 1.6484215336471537
Energy: 1.4869622607170632
Energy: 1.6484215336457322
Energy: 1.486962260719906
Energy: 1.6484215336464432
Energy: 1.5875337573328188
Energy: 1.4654577059646805
Energy: 1.6202022818459454
Energy: 1.4654577059639702
Energy: 1.6202022818452346
Energy: 1.4654577059632592
Energy: 1.5273622363249384
Energy: 1.6452961153060013
Energy: 1.5273622363249384
Energy: 1.6452961153067118
Energy: 1.527362236325649
Energy: 1.6452961153067118
Energy: 1.8639263972286604
Energy: 1.6689413600999927
Energy: 1.8639263972279494
Energy: 1.6689413600999927
Energy: 1.8639263972279494
Energy: 1.6689413600999927
Energy: 1.6671809301987874
Energy: 1.4600829086084437
Energy: 1.6671809301994982
Energy: 1.4600829086070222
Energy: 1.6671809301987874
Energy: 1.4600829086084437
Energy: 1.4351199549972755
Energy: 1.5089208968300805
Energy: 1.4351199549965648
Energy: 1.5089208968300805
Energy: 1.4351199549965648
Energy: 1.5089208968300805
Energy: 1.640888086242841
Energy: 1.742096043615795
Energy: 1.640888086242841
Energy: 1.7420960436165058
Energy: 1.640888086243552
Energy: 1.7420960436165058
Energy: 1.7882833612108004
Energy: 1.6039655397470078
Energy: 1.7882833612115112
Energy: 1.603965539746297
Energy: 1.7882833612115112
Energy: 1.603965539746297
Energy: 1.4300098517157271
Energy: 1.463699011630065
Energy: 1.4300098517164377
Energy: 1.4636990116293542
Energy: 1.4300098517164377
Energy: 1.463699011630065
Energy: 1.6603939453999677
Energy: 1.4902049094411893
Energy: 1.6603939454006784
Energy: 1.4902049094418999
Energy: 1.6603939454013892
Energy: 1.4902049094411893
Energy: 1.5339447733561915
Energy: 1.4449825910452234
Energy: 1.5339447733561915
Energy: 1.4449825910452234
Energy: 1.5339447733554803
Energy: 1.4449825910452234
Energy: 1.4742052607099132
Energy: 1.7798586783714003
Energy: 1.474205260710624
Energy: 1.7798586783706893
Energy: 1.4742052607099132
Energy: 1.7798586783714003
Energy: 1.8246455523528518
Energy: 1.6230433687819272
Energy: 1.8246455523528518
Energy: 1.6230433687819272
Energy: 1.8246455523528518
Energy: 1.6230433687819272
Energy: 1.5912996633719603
Energy: 1.7781145661325102
Energy: 1.5912996633719603
Energy: 1.7781145661325102
Energy: 1.5912996633719603
Energy: 1.7781145661325102
Energy: 1.7022870674609858
Energy: 1.545758066216591
Energy: 1.7022870674609858
Energy: 1.5457580662173016
Energy: 1.7022870674609858
Energy: 1.545758066216591
Energy: 1.652170674648419
Energy: 1.7089148344205682
Energy: 1.6521706746477083
Energy: 1.7089148344198575
Energy: 1.652170674648419
Energy: 1.7089148344205682
Energy: 1.6670779518250607
Energy: 1.5669783336851735
Energy: 1.6670779518250607
Energy: 1.5669783336851735
Energy: 1.6670779518250607
Energy: 1.566978333685884
Energy: 1.4607301626925036
Energy: 1.5725023021556441
Energy: 1.4607301626910822
Energy: 1.5725023021556441
Energy: 1.4607301626917932
Energy: 1.5725023021556441
Energy: 1.6260518862511752
Energy: 1.497532151789827
Energy: 1.6260518862490434
Energy: 1.4975321517905378
Energy: 1.6260518862504647
Energy: 1.497532151789827
Energy: 1.55056905969305
Energy: 1.4428676648391827
Energy: 1.55056905969305
Energy: 1.442867664838472
Energy: 1.5505690596937605
Energy: 1.4428676648391827

minimum gb energy = 1.4300098517157271 eV
minimum distance =  2.53296576709367 Angstroms
sigma value = 27


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

Energy: 1.4376446236270992
Energy: 1.6270349088344138
Energy: 1.4376446236276985
Energy: 1.6270349088344138
Energy: 1.4376446236270992
Energy: 1.6270349088344138
Energy: 1.4597492620744283
Energy: 1.4416434337082074
Energy: 1.4597492620738293
Energy: 1.4416434337082074
Energy: 1.4597492620738293
Energy: 1.4416434337082074
Energy: 1.5128352998869685
Energy: 1.3982258984818963
Energy: 1.5128352998863692
Energy: 1.3982258984818963
Energy: 1.5128352998869685
Energy: 1.3982258984824953
Energy: 1.3149692677798561
Energy: 1.405562703253222
Energy: 1.3149692677798561
Energy: 1.4055627032538212
Energy: 1.3149692677798561
Energy: 1.4055627032544202
Energy: 1.4310274329009722
Energy: 1.7067799844493685
Energy: 1.4310274329003734
Energy: 1.7067799844493685
Energy: 1.4310274329009722
Energy: 1.7067799844493685
Energy: 1.4706309814129122
Energy: 1.3998200747511196
Energy: 1.470630981413511
Energy: 1.399820074750521
Energy: 1.470630981391945
Energy: 1.3998200747511196
Energy: 1.4407952976012923
Energy: 1.4605795554818675
Energy: 1.4407952976012923
Energy: 1.4605795554818675
Energy: 1.4407952976006932
Energy: 1.4605795554818675
Energy: 1.4078454695894522
Energy: 1.5144397433325223
Energy: 1.407845469590051
Energy: 1.5144397433325223
Energy: 1.4078454695894522
Energy: 1.5144397433331216
Energy: 1.4131487879642355
Energy: 1.3200605701930546
Energy: 1.4131487879636362
Energy: 1.3200605701930546
Energy: 1.4131487879648346
Energy: 1.3200605701930546
Energy: 1.3151069383024232
Energy: 1.4975482893645136
Energy: 1.3151069383018241
Energy: 1.4975482893651126
Energy: 1.3151069383024232
Energy: 1.4975482893639145
Energy: 1.3150741953360041
Energy: 1.6685631570175952
Energy: 1.3150741953366032
Energy: 1.6685631570181942
Energy: 1.3150741953366032
Energy: 1.6685631570175952
Energy: 1.4602603428076626
Energy: 1.3680363906421553
Energy: 1.4602603428064642
Energy: 1.3680363906415562
Energy: 1.4602603428064642
Energy: 1.3680363906421553
Energy: 1.5251253622174157
Energy: 1.4076256866033852
Energy: 1.5251253622168168
Energy: 1.407625686602786
Energy: 1.5251253622168168
Energy: 1.407625686602786
Energy: 1.4384293330488949
Energy: 1.4206741362070703
Energy: 1.438429333048296
Energy: 1.4206741362082682
Energy: 1.4384293330488949
Energy: 1.4206741362070703
Energy: 1.5109000171402294
Energy: 1.406284120025465
Energy: 1.5109000171396303
Energy: 1.406284120025465
Energy: 1.5109000171396303
Energy: 1.406284120025465
Energy: 1.4432708380451031
Energy: 1.6081346960042258
Energy: 1.4432708380451031
Energy: 1.6081346960042258
Energy: 1.4432708380457022
Energy: 1.6081346960042258
Energy: 1.3700116349675886
Energy: 1.6512873622507669
Energy: 1.3700116349675886
Energy: 1.6512873622513655
Energy: 1.3700116349669897
Energy: 1.6512873622513655
Energy: 1.404793764978006
Energy: 1.3601322126635256
Energy: 1.4047937649786049
Energy: 1.3601322126635256
Energy: 1.404793764978006
Energy: 1.3601322126617283
Energy: 1.3981390917781664
Energy: 1.4292777575646491
Energy: 1.3981390917781664
Energy: 1.4292777575646491
Energy: 1.3981390917781664
Energy: 1.4292777575646491
Energy: 1.4376446236265004
Energy: 1.6270349088344138
Energy: 1.4376446236265004
Energy: 1.6270349088338145
Energy: 1.4376446236265004
Energy: 1.6270349088338145
Energy: 1.4597492620750274
Energy: 1.4416434337088064
Energy: 1.4597492620750274
Energy: 1.4416434337088064
Energy: 1.4597492620756267
Energy: 1.4416434337088064
Energy: 1.5128352998863692
Energy: 1.3982258984818963
Energy: 1.5128352998863692
Energy: 1.3982258984818963
Energy: 1.5128352998869685
Energy: 1.3982258984824953
Energy: 1.3149692677798561
Energy: 1.405562703252024
Energy: 1.3149692677804554
Energy: 1.405562703252024
Energy: 1.3149692677804554
Energy: 1.405562703252024
Energy: 1.4310274329003734
Energy: 1.7067799844481704
Energy: 1.4310274329003734
Energy: 1.7067799844481704
Energy: 1.4310274329009722
Energy: 1.7067799844481704
Energy: 1.4706309813589957
Energy: 1.399820074752318
Energy: 1.4706309813997327
Energy: 1.3998200747517189
Energy: 1.4706309813889495
Energy: 1.3998200747529168

minimum gb energy = 1.3149692677798561 eV
minimum distance =  2.54388252645635 Angstroms
sigma value = 19


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

Energy: 1.3402693272813813
Energy: 1.5686236020353745
Energy: 1.3402693272813813
Energy: 1.5686236020353745
Energy: 1.3402693272818982
Energy: 1.5686236020353745
Energy: 1.5582091786219883
Energy: 1.4922301564368627
Energy: 1.5582091786214711
Energy: 1.4922301564368627
Energy: 1.5582091786219883
Energy: 1.4922301564373797
Energy: 1.7283107284864514
Energy: 1.3030566195589064
Energy: 1.7283107284869688
Energy: 1.3030566195589064
Energy: 1.7283107284864514
Energy: 1.3030566195589064
Energy: 1.2885167381440914
Energy: 1.56968243652282
Energy: 1.2885167381446085
Energy: 1.56968243652282
Energy: 1.2885167381446085
Energy: 1.56968243652282
Energy: 1.4386239471957274
Energy: 1.4621101691945422
Energy: 1.438623947194693
Energy: 1.4621101691945422
Energy: 1.4386239471936588
Energy: 1.4621101691945422
Energy: 1.509991429523842
Energy: 1.2965364625544225
Energy: 1.5099914295243593
Energy: 1.2965364625539055
Energy: 1.5099914295243593
Energy: 1.2965364625549396
Energy: 1.3444178951911465
Energy: 1.587905302337583
Energy: 1.3444178951911465
Energy: 1.5879053023386174
Energy: 1.3444178951906294
Energy: 1.587905302337583
Energy: 1.3672256268606675
Energy: 1.6996778466270084
Energy: 1.3672256268606675
Energy: 1.6996778466275257
Energy: 1.3672256268606675
Energy: 1.6996778466275257
Energy: 1.4990717160494693
Energy: 1.2693323596945483
Energy: 1.4990717160494693
Energy: 1.2693323596945483
Energy: 1.4990717160499862
Energy: 1.2693323596950652
Energy: 1.4639460744351758
Energy: 1.6380260271834313
Energy: 1.4639460744351758
Energy: 1.6380260271834313
Energy: 1.4639460744351758
Energy: 1.638026027182914
Energy: 1.2728245686812554
Energy: 1.6284987893346021
Energy: 1.2728245686807385
Energy: 1.6284987893346021
Energy: 1.2728245686807385
Energy: 1.6284987893351195
Energy: 1.672752194448392
Energy: 1.2957720432865347
Energy: 1.672752194448392
Energy: 1.2957720432870519
Energy: 1.672752194448909
Energy: 1.2957720432865347
Energy: 1.637835669950226
Energy: 1.5678070332202456
Energy: 1.637835669950743
Energy: 1.5678070332202456
Energy: 1.637835669950743
Energy: 1.5678070332207628
Energy: 1.2967073116841508
Energy: 1.483569666612284
Energy: 1.2967073116841508
Energy: 1.483569666612284
Energy: 1.2967073116841508
Energy: 1.483569666612284
Energy: 1.657530218822843
Energy: 1.4039470325675285
Energy: 1.657530218822843
Energy: 1.4039470325675285
Energy: 1.657530218822843
Energy: 1.4039470325675285
Energy: 1.6356036359514454
Energy: 1.2695057701943748
Energy: 1.6356036359519626
Energy: 1.269505770194892
Energy: 1.6356036359519626
Energy: 1.2695057701943748
Energy: 1.3039052585338546
Energy: 1.667885814910111
Energy: 1.3039052585338546
Energy: 1.667885814910111
Energy: 1.3039052585338546
Energy: 1.6678858149095936
Energy: 1.5394366389430243
Energy: 1.5053382967804518
Energy: 1.5394366389435414
Energy: 1.5053382967804518
Energy: 1.5394366389435414
Energy: 1.5053382967804518
Energy: 1.57559092876844
Energy: 1.3005986514004535
Energy: 1.57559092876844
Energy: 1.3005986514004535
Energy: 1.575590928768957
Energy: 1.3005986514004535
Energy: 1.375628959287225
Energy: 1.6350823467747664
Energy: 1.375628959286708
Energy: 1.6350823467747664
Energy: 1.375628959287225
Energy: 1.635082346774249
Energy: 1.2627291534363412
Energy: 1.6431301856503364
Energy: 1.2627291534363412
Energy: 1.6431301856498193
Energy: 1.262729153436858
Energy: 1.6431301856498193
Energy: 1.6198372146608966
Energy: 1.302706329356226
Energy: 1.6198372146614135
Energy: 1.302706329356226
Energy: 1.6198372146608966
Energy: 1.3027063293567434
Energy: 1.5260058921303359
Energy: 1.672624494258821
Energy: 1.5260058921298187
Energy: 1.672624494259338
Energy: 1.5260058921303359
Energy: 1.672624494258821
Energy: 1.3292849954605626
Energy: 1.5918525849879115
Energy: 1.3292849954605626
Energy: 1.5918525849873941
Energy: 1.3292849954610797
Energy: 1.5918525849879115
Energy: 1.6065307238507458
Energy: 1.3031337277191861
Energy: 1.6065307238507458
Energy: 1.303133727718669
Energy: 1.6065307238507458
Energy: 1.303133727719703
Energy: 1.652163697124981
Energy: 1.677346806350983
Energy: 1.652163697124981
Energy: 1.6773468063515007
Energy: 1.652163697124981
Energy: 1.6773468063515007
Energy: 1.2659227832450497
Energy: 1.423378288189573
Energy: 1.2659227832450497
Energy: 1.423378288189573
Energy: 1.2659227832455666
Energy: 1.423378288189056
Energy: 1.7100198985276354
Energy: 1.5202392644410008
Energy: 1.7100198985276354
Energy: 1.5202392644410008
Energy: 1.7100198985276354
Energy: 1.5202392644410008
Energy: 1.6678961133681502
Energy: 1.3013880161197062
Energy: 1.6678961133681502
Energy: 1.3013880161212574
Energy: 1.6678961133681502
Energy: 1.3013880161202234

minimum gb energy = 1.2627291534363412 eV
minimum distance =  2.52598298034903 Angstroms
sigma value = 101


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

Energy: 1.26014225771729
Energy: 1.50790176648628
Energy: 1.26014225771729
Energy: 1.50790176648628
Energy: 1.2601422577177446
Energy: 1.5079017664858252
Energy: 1.5401007966792928
Energy: 1.3738454377513443
Energy: 1.540100796678838
Energy: 1.3738454377513443
Energy: 1.5401007966797469
Energy: 1.3738454377508895
Energy: 1.6666697835352668
Energy: 1.2457156586702582
Energy: 1.666669783534358
Energy: 1.2457156586707128
Energy: 1.6666697835352668
Energy: 1.2457156586707128
Energy: 1.206438040805513
Energy: 1.8137765820127432
Energy: 1.206438040804149
Energy: 1.6698878918142614
Energy: 1.2064380408046038
Energy: 1.6698878918142614
Energy: 1.4253900127191228
Energy: 1.572463118367616
Energy: 1.4253900127195773
Energy: 1.572463118367616
Energy: 1.4253900127186683
Energy: 1.5724631183671616
Energy: 1.5084683402166814
Energy: 1.2272761469554794
Energy: 1.508468340217136
Energy: 1.2272761469554794
Energy: 1.508468340217136
Energy: 1.227276146955025
Energy: 1.3730969025130977
Energy: 1.508388768701722
Energy: 1.3730969025135524
Energy: 1.5083887687071766
Energy: 1.3730969025135524
Energy: 1.508388768706722
Energy: 1.2234528872677115
Energy: 1.8992453264132327
Energy: 1.223452887267257
Energy: 1.8992453264132327
Energy: 1.2234528872677115
Energy: 1.8992453264132327
Energy: 1.508661502837542
Energy: 1.2295050028988288
Energy: 1.508661502837542
Energy: 1.2295050028983743
Energy: 1.508661502837542
Energy: 1.2295050028983743
Energy: 1.4251423657309243
Energy: 1.4374664443916
Energy: 1.42514236573047
Energy: 1.437466444392964
Energy: 1.4251423657309243
Energy: 1.4374664443925091
Energy: 1.2054055296510708
Energy: 1.5281944776439473
Energy: 1.2054055296510708
Energy: 1.5281944776439473
Energy: 1.2054055296515254
Energy: 1.5281944776434926
Energy: 1.8090850554675397
Energy: 1.2379947927077666
Energy: 1.8090850554675397
Energy: 1.2379947927073123
Energy: 1.8090850554679945
Energy: 1.2379947927068575
Energy: 1.5630704599428666
Energy: 1.2465807808396088
Energy: 1.5630704599428666
Energy: 1.2465807808396088
Energy: 1.5630704599428666
Energy: 1.2465807808400635
Energy: 1.264718537241218
Energy: 1.5643028659411153
Energy: 1.264718537241218
Energy: 1.5643028659411153
Energy: 1.2647185372416723
Energy: 1.5643028659415696
Energy: 1.517053509811877
Energy: 1.5534355120089665
Energy: 1.517053509811877
Energy: 1.553435512008057
Energy: 1.5170535098123312
Energy: 1.5534355120085117
Energy: 1.6774940281242154
Energy: 1.248573349901215
Energy: 1.6774940281237607
Energy: 1.248573349901215
Energy: 1.6774940281237607
Energy: 1.248573349901215
Energy: 1.2057376160697248
Energy: 1.7607640441778034
Energy: 1.2057376160701794
Energy: 1.7607640441782582
Energy: 1.2057376160697248
Energy: 1.7607640441782582
Energy: 1.2060881455316455
Energy: 1.7947311598224376
Energy: 1.2060881455325545
Energy: 1.794731159821983
Energy: 1.2060881455316455
Energy: 1.7947311598224376
Energy: 1.5085443062164337
Energy: 1.2291828383085985
Energy: 1.5085443062164337
Energy: 1.2291828383085985
Energy: 1.5085443062159791
Energy: 1.2291828383085985
Energy: 1.5301060687193833
Energy: 1.5086544244548283
Energy: 1.5301060687193833
Energy: 1.5086544244548283
Energy: 1.5301060687193833
Energy: 1.5086544244543736
Energy: 1.2274272083232933
Energy: 1.6742445205309404
Energy: 1.2274272083237479
Energy: 1.6742445205309404
Energy: 1.2274272083232933
Energy: 1.6742445205304857
Energy: 1.7749131040225368
Energy: 1.2272291794307324
Energy: 1.7749131040225368
Energy: 1.227229179431187
Energy: 1.7749131040225368
Energy: 1.2272291794316414
Energy: 1.5231940786528633
Energy: 1.4917022992140938
Energy: 1.523194078652409
Energy: 1.4917022992140938
Energy: 1.523194078652409
Energy: 1.4917022992145486
Energy: 1.207729765604862
Energy: 1.4103762642572886
Energy: 1.2077297656053163
Energy: 1.4103762642572886
Energy: 1.207729765604862
Energy: 1.410376264257743
Energy: 1.539629398825969
Energy: 1.4872740552104617
Energy: 1.53962939882506
Energy: 1.4872740552090982
Energy: 1.539629398825969
Energy: 1.4872740552090982
Energy: 1.6120792748462573
Energy: 1.248574398390575
Energy: 1.6120792748462573
Energy: 1.2485743983901203
Energy: 1.6120792748462573
Energy: 1.2485743983901203
Energy: 1.2606680000585067
Energy: 1.6695969435565174
Energy: 1.2606680000594155
Energy: 1.669596943556972
Energy: 1.2606680000585067
Energy: 1.669596943556972
Energy: 1.4523407559250352
Energy: 1.6837425306142442
Energy: 1.4523407559250352
Energy: 1.6837425306146987
Energy: 1.4523407559250352
Energy: 1.6837425306142442
Energy: 1.4203616696852754
Energy: 1.2456314305781315
Energy: 1.4203616696861845
Energy: 1.2456314305781315
Energy: 1.4203616696861845
Energy: 1.2456314305785858
Energy: 1.2058008278477619
Energy: 1.720546447104619
Energy: 1.2058008278477619
Energy: 1.720546447104619
Energy: 1.2058008278477619
Energy: 1.720546447104619
Energy: 1.2055999253820056
Energy: 1.4738033393762051
Energy: 1.20559992538246
Energy: 1.4738033393757504
Energy: 1.2055999253820056
Energy: 1.4738033393762051
Energy: 1.521914212822758
Energy: 1.2271422823899123
Energy: 1.521914212822758
Energy: 1.227142282390367
Energy: 1.521914212822758
Energy: 1.2271422823899123
Energy: 1.6799203752771303
Energy: 1.4098496940998173
Energy: 1.6799203752771303
Energy: 1.4098496940993626
Energy: 1.679920375277585
Energy: 1.4098496940993626

minimum gb energy = 1.2054055296510708 eV
minimum distance =  2.53769272402906 Angstroms
sigma value = 33


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

Energy: 0.02149669898010294
Energy: 1.383849287695589
Energy: 0.02149669898010294
Energy: 1.3838492877018418
Energy: 0.02149669898010294
Energy: 1.3838492877199287
Energy: 0.022180938375875748
Energy: 0.3549660300998831
Energy: 0.022180938375875748
Energy: 0.3549660300998831
Energy: 0.022180938375498064
Energy: 0.3549660300998831
Energy: 1.4915762441013045
Energy: 0.35639294691179657
Energy: 1.4934497416300385
Energy: 0.3563929469114189
Energy: 1.4909714644541592
Energy: 0.3563929469110412
Energy: 0.02218093837625343
Energy: 0.3549660300991277
Energy: 0.022180938375875748
Energy: 0.35496603009950534
Energy: 0.02218093837625343
Energy: 0.35496603009950534

minimum gb energy = 0.02149669898010294 eV
minimum distance =  2.75739251095356 Angstroms
sigma value = 1