Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Ni__MO_580571659842_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5199998259544394
cohesive_energy=4.45034998140762
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
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: 0.020538263741688965
Energy: 0.4797131716659762
Energy: 0.4797131716659762
Energy: 0.020538263741688965
Energy: 0.4797131716659762
Energy: 0.4797131716659762
Energy: 0.020538263741688965
Energy: 0.4797131716659762
Energy: 0.4797131716659762
Energy: 0.020538263743213554
Energy: 0.4762582873029599
Energy: 0.02506044998874739
Energy: 0.47626629346818233
Energy: 0.4762582873029599
Energy: 0.02506044998874739
Energy: 0.4762662934666577
Energy: 0.4762582873029599
Energy: 0.02506044999027198
Energy: 0.4762662934666577
Energy: 0.4762582873029599
Energy: 0.9969448584924261
Energy: 0.876526141416166
Energy: 0.8642326228983811
Energy: 0.997010307537568
Energy: 0.8642326228983811
Energy: 0.8642326229014301
Energy: 0.9972240935020747
Energy: 0.8642326228968564
Energy: 0.8765261414176907
Energy: 0.9972083787915705
Energy: 0.4762582873029599
Energy: 0.4762662934666577
Energy: 0.025060449987222806
Energy: 0.4762582873029599
Energy: 0.47626629346818233
Energy: 0.02506044999179657
Energy: 0.4762582873014353
Energy: 0.47626629346818233
Energy: 0.02506044998874739
Energy: 0.4762582873014353
Energy: 0.020538263741688965
Energy: 0.4797131716675007
Energy: 0.47971317167055
Energy: 0.020538263741688965
Energy: 0.47971317167055
Energy: 0.4797131716675007
Energy: 0.020538263741688965
Energy: 0.4797131716675007
Energy: 0.47971317167055
Energy: 0.020538263741688965
Energy: 0.4762582873029599
Energy: 0.02506044998874739
Energy: 0.47626629346818233
Energy: 0.4762582873029599
Energy: 0.02506044998874739
Energy: 0.47626629346818233
Energy: 0.4762582873029599
Energy: 0.02506044999027198
Energy: 0.4762662934666577
Energy: 0.4762582873014353
Energy: 0.9970080938731127
Energy: 0.2889103058402102
Energy: 0.02162440948145516
Energy: 0.996998872717562
Energy: 0.2889103058402102
Energy: 0.021624409484504337
Energy: 0.9970060732958821
Energy: 0.2889103058402102
Energy: 0.2697442141103556
Energy: 0.9969832980027409

minimum gb energy = 0.020538263741688965 eV
minimum distance =  2.2950053028082 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 1.3305553668479855
Energy: 1.3305514354569128
Energy: 1.0990602125119124
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Energy: 1.3305514354531782
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Energy: 1.3305514354643817
Energy: 1.0990602125119124
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Energy: 1.349342190206317
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Energy: 1.2273089115922802
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Energy: 1.3520574031699564
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Energy: 1.145134800088987
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Energy: 1.3520574031699564
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Energy: 1.341997088508166
Energy: 1.1493354429339055
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Energy: 1.3638159324382433
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Energy: 0.9653513849461662
Energy: 1.3638179017098342
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Energy: 0.9653513849573016
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Energy: 1.3947536300758154
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Energy: 1.0109365367914394
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Energy: 1.328801681248496
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Energy: 1.3947536300683463
Energy: 1.3288016812522303
Energy: 1.16668393969242
Energy: 1.4113087229061112
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Energy: 1.1534945029554176
Energy: 1.1666839396774822
Energy: 1.411308722894908
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Energy: 1.175712054507332
Energy: 1.350791543066036
Energy: 1.14541090118905
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Energy: 1.350791543073505
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Energy: 1.14541090118905
Energy: 1.1757120544999309
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Energy: 1.3305553668479855
Energy: 1.3305514354606474
Energy: 1.103542830816303
Energy: 1.330555366859189
Energy: 1.3305514354494437
Energy: 1.190934201994982
Energy: 1.33055536685172
Energy: 1.3305514354606474
Energy: 1.1035428308125692
Energy: 1.1416976827321437
Energy: 1.1452764902198682
Energy: 1.3493421902025826
Energy: 1.1416976828068326
Energy: 1.145276490216134
Energy: 1.349342190198848
Energy: 1.1416976827508158
Energy: 1.145276490216134
Energy: 1.349342190191379
Energy: 1.1416976828628498
Energy: 1.2333352883422
Energy: 1.3233941455181957
Energy: 1.3047245290906595
Energy: 1.2621693267281002
Energy: 1.3233941455256644
Energy: 1.304724529079456
Energy: 1.2333352883422
Energy: 1.3233941455219298
Energy: 1.3047245290719873
Energy: 1.2621693267355694
Energy: 1.3310849290246984
Energy: 1.4365181157737696
Energy: 1.0108888619553804
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Energy: 1.436518115762634
Energy: 1.0108888619516458
Energy: 1.3310849290097604
Energy: 1.4365181157588995
Energy: 1.0108888619479115
Energy: 1.3310849290246984

minimum gb energy = 0.9648480820692664 eV
minimum distance =  2.32984279408859 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

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Energy: 1.1220945630981345
Energy: 1.1221937747652346
Energy: 1.3476850680660761
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minimum gb energy = 1.121988215972838 eV
minimum distance =  2.21333136175485 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 1.3062027178547733
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Energy: 1.2883722514787468
Energy: 1.359245577731597
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Energy: 1.359245577731597
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Energy: 1.2899699373296492
Energy: 1.285481985449317
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Energy: 1.3303813740321755
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Energy: 1.393297446627095
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Energy: 1.313554281231192
Energy: 1.4264570922816404
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Energy: 1.3182212368592632
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Energy: 1.3512004131531097
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Energy: 1.371200004110968
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Energy: 1.3512004131489979
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Energy: 1.393828667749979
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Energy: 1.3508352036171358
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Energy: 1.4963559920532923
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Energy: 1.2998229638137775
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Energy: 1.367770841421753
Energy: 1.3081190336824162
Energy: 1.3500778228246095
Energy: 1.367770841421753
Energy: 1.3081190336885835
Energy: 1.3500778228307768
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Energy: 1.3081190336885835
Energy: 1.3500778228246095
Energy: 1.367770841423809
Energy: 1.3227552628739723
Energy: 1.309060826016975
Energy: 1.379211540365686
Energy: 1.3227552628678054
Energy: 1.3090608260149195
Energy: 1.379211540365686
Energy: 1.3227552628636936
Energy: 1.3090608260149195
Energy: 1.3792115403677416
Energy: 1.3227552628678054
Energy: 1.3026141195289263
Energy: 1.3480475505927598
Energy: 1.3515310372436111
Energy: 1.3026141195289263
Energy: 1.3479019508561272
Energy: 1.3515310372456666
Energy: 1.302614119520703
Energy: 1.3480475505948155
Energy: 1.3515310372436111
Energy: 1.302614119520703
Energy: 1.4249054319696164
Energy: 1.3474412119276045
Energy: 1.2982620102315778
Energy: 1.4249054319634493
Energy: 1.347279602746557
Energy: 1.298262010223355
Energy: 1.4249054319552263
Energy: 1.3474412119317158
Energy: 1.2982620102254105
Energy: 1.4249054319696164
Energy: 1.3482474690000021
Energy: 1.361413219694407
Energy: 1.3165554241568753
Energy: 1.3482474689958905
Energy: 1.3614132196923514
Energy: 1.3165554241527637
Energy: 1.3482474690020576
Energy: 1.3614132196861843
Energy: 1.3165554241568753
Energy: 1.3482474690000021
Energy: 1.3760139149420434
Energy: 1.4556712215652676
Energy: 1.3292812437000612
Energy: 1.376013914937932
Energy: 1.4283932527142376
Energy: 1.3292812437041728
Energy: 1.3760139149440993
Energy: 1.4556712215652676
Energy: 1.3292812437041728
Energy: 1.3760139149482107
Energy: 1.2888662454823512
Energy: 1.3013426179344716
Energy: 1.3536791145433749
Energy: 1.2888662454741278
Energy: 1.3012701002925484
Energy: 1.3536791145413192
Energy: 1.2888662454741278
Energy: 1.3013426179283043
Energy: 1.3536791145351519
Energy: 1.2888662454761837
Energy: 1.2969291812421246
Energy: 1.2999471214387524
Energy: 1.4122128302880164
Energy: 1.2969291812400687
Energy: 1.3000278700461234
Energy: 1.4122128302921282
Energy: 1.2969291812400687
Energy: 1.2999471214408083
Energy: 1.4122128302880164
Energy: 1.2969291812421246

minimum gb energy = 1.2548118429197057 eV
minimum distance =  2.29550321412904 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.2345018069651643
Energy: 1.329866054894615
Energy: 1.3299259428517645
Energy: 1.2345018069651643
Energy: 1.3298660548840289
Energy: 1.3299259428383554
Energy: 1.2345018069658702
Energy: 1.3298660548939092
Energy: 1.3299259428383554
Energy: 1.2345018069651643
Energy: 1.2338544470502755
Energy: 1.2505187473649388
Energy: 1.369302317198231
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Energy: 1.3693023171996426
Energy: 1.233854447048158
Energy: 1.2505187473656447
Energy: 1.3693023172003482
Energy: 1.2338544470552155
Energy: 1.3144545101584617
Energy: 1.4451939244824588
Energy: 1.2067441252746485
Energy: 1.3144545101563445
Energy: 1.4451939244831644
Energy: 1.206744152778841
Energy: 1.314454510157756
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Energy: 1.3300967956373426
Energy: 1.3303431206296084
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Energy: 1.3300967956352252
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Energy: 1.3109140556960497
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Energy: 1.3302533280430826
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Energy: 1.4164130843784606
Energy: 1.329224935092885
Energy: 1.330311896882321
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Energy: 1.3292249350935907
Energy: 1.3303118968767396
Energy: 1.374438280532316
Energy: 1.3292249350992367
Energy: 1.3303118969154915
Energy: 1.3744382805252584
Energy: 1.329224935095708
Energy: 1.2496869850670265
Energy: 1.3304258469113974
Energy: 1.4752380976085948
Energy: 1.249686985068438
Energy: 1.3304258469170436
Energy: 1.4752380976093005
Energy: 1.2496869850691439
Energy: 1.3304258469106915
Energy: 1.4752380976093005
Energy: 1.2496869850691439
Energy: 1.3052608651658684
Energy: 1.3109259180243515
Energy: 1.3611956713246804
Energy: 1.305260865160928
Energy: 1.310925918025763
Energy: 1.361195671325386
Energy: 1.305260865161634
Energy: 1.3109259180243515
Energy: 1.3611956713218574
Energy: 1.305260865161634
Energy: 1.3300100981184233
Energy: 1.2484365619206848
Energy: 1.3300929375109136
Energy: 1.3300100981163059
Energy: 1.2484365619185676
Energy: 1.3300929375102082
Energy: 1.3300100981198348
Energy: 1.248436561919979
Energy: 1.3300929375123252
Energy: 1.3300100981163059
Energy: 1.3143397933403043
Energy: 1.207084405645601
Energy: 1.4448715826158194
Energy: 1.314339793335364
Energy: 1.207084404948643
Energy: 1.4448715826242882
Energy: 1.314339793338893
Energy: 1.2070844041874624
Energy: 1.444871582613702
Energy: 1.3143397933374812
Energy: 1.233688175619622
Energy: 1.3696021382130317
Energy: 1.2504729849743534
Energy: 1.2336881756252682
Energy: 1.369602138212326
Energy: 1.2504729849750593
Energy: 1.233688175620328
Energy: 1.369602138208797
Energy: 1.2504729849743534
Energy: 1.2336881756259739
Energy: 1.234501806963753
Energy: 1.329866054894615
Energy: 1.32992594284259
Energy: 1.2345018069630471
Energy: 1.329866054883323
Energy: 1.3299259428404726
Energy: 1.2345018069630471
Energy: 1.329866054894615
Energy: 1.3299259428404726
Energy: 1.234501806963753

minimum gb energy = 1.2067441252746485 eV
minimum distance =  2.29719376335261 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 1.441661471448668
Energy: 1.227004080492696
Energy: 1.2269365299869408
Energy: 1.3276917969932056
Energy: 1.2270040805036488
Energy: 1.2269365299842026
Energy: 1.4416614714596208
Energy: 1.2270040805009108
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Energy: 1.1017665562780468
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Energy: 1.2563336348225436
Energy: 1.1914160112344527
Energy: 1.0932509780621111
Energy: 1.1990700988577458
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Energy: 1.0932509780566346
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Energy: 1.1187517769676607
Energy: 1.1186846720662393
Energy: 1.1633619533612705
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Energy: 1.11868467209631
Energy: 1.163361953342103
Energy: 1.11875177698409
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Energy: 1.2614649075634745
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Energy: 1.1432172826398475
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Energy: 1.1432172826371094
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Energy: 1.2616555736264936
Energy: 1.3597264512705673
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Energy: 1.1106575561206036
Energy: 1.2788875549911036
Energy: 1.173535273419438
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Energy: 1.1564804088920806
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Energy: 1.2372261558763185
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Energy: 1.2006946212184666
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Energy: 1.1101506029367039
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Energy: 1.181376983953628
Energy: 1.3275373462012992
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Energy: 1.1813769839563661
Energy: 1.327537346198561
Energy: 1.2756475906553428
Energy: 1.0912710748842223
Energy: 1.1999987188825725
Energy: 1.2756475906526046
Energy: 1.0912710749006518
Energy: 1.199998718890787
Energy: 1.2756475906608196
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Energy: 1.1999987188935253
Energy: 1.2756475906553428
Energy: 1.192996796464972
Energy: 1.1013744055308725
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Energy: 1.1443239387117545
Energy: 1.1929967964567574
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Energy: 1.1442992071717337
Energy: 1.1929967964622339
Energy: 1.216295260284154
Energy: 1.2982876974634194
Energy: 1.1568357505352658
Energy: 1.2162952602978452
Energy: 1.2982876974661577
Energy: 1.1568350152058386
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Energy: 1.2982876974688957
Energy: 1.1568357505462188
Energy: 1.2162952602923685
Energy: 1.1478047459843779
Energy: 1.405602756881189
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Energy: 1.1429259611603342
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Energy: 1.118120026520897
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Energy: 1.1646836605166042
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Energy: 1.1646836605111277
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Energy: 1.2089738507008625
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Energy: 1.2089738506981242
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Energy: 1.1553741364683032
Energy: 1.2089738507036007
Energy: 1.1949902228368103
Energy: 1.1553741364628267
Energy: 1.2397175200557695
Energy: 1.0979802172836097
Energy: 1.1848373172546869
Energy: 1.2397175200530313
Energy: 1.0979802172699185
Energy: 1.1848373172546869
Energy: 1.239717520050293
Energy: 1.097980217272657
Energy: 1.1848373172464723
Energy: 1.2397175200776753
Energy: 1.2364731881873
Energy: 1.2299133266414144
Energy: 1.3655276850424152
Energy: 1.2364731881873
Energy: 1.2299133266304612
Energy: 1.4030465252807676
Energy: 1.2364731881818234
Energy: 1.2299133266414144
Energy: 1.3655276850478417
Energy: 1.2364731881873
Energy: 1.1074578476694363
Energy: 1.2552763426637095
Energy: 1.1784859550035671
Energy: 1.1074578476749126
Energy: 1.2345645764096678
Energy: 1.20337870772913
Energy: 1.1074578476803894
Energy: 1.2552763426637095
Energy: 1.178485954992614
Energy: 1.1074578476749126
Energy: 1.109296914928838
Energy: 1.1720254752980297
Energy: 1.172093923827438
Energy: 1.109296914920623
Energy: 1.1724017295443547
Energy: 1.172153031951763
Energy: 1.1092969149315763
Energy: 1.1720254753062445
Energy: 1.1720939238192234
Energy: 1.1092969149260998
Energy: 1.108223587392355
Energy: 1.1606772601793096
Energy: 1.1191211078519456
Energy: 1.108223587389617
Energy: 1.1604250919583186
Energy: 1.1191211084157742
Energy: 1.1082235873868787
Energy: 1.1606772601710948
Energy: 1.1191211082871766
Energy: 1.1082235873868787
Energy: 1.2627186837609994
Energy: 1.1576739965816982
Energy: 1.1915383170309046
Energy: 1.2627186837637376
Energy: 1.1582900192208783
Energy: 1.1915383170363811
Energy: 1.2627186837527848
Energy: 1.1576739965707947
Energy: 1.1915383170363811
Energy: 1.262718683755523
Energy: 1.1959866063498754
Energy: 1.223208069312523
Energy: 1.1512684537607765
Energy: 1.1865414825928164
Energy: 1.2356627457816023
Energy: 1.1512684537607765
Energy: 1.184696058680622
Energy: 1.2366786684263213
Energy: 1.1512684537553
Energy: 1.1846960586833604

minimum gb energy = 1.0912710748842223 eV
minimum distance =  2.24550964027899 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 1.1695388471063615
Energy: 0.6288380640827874
Energy: 0.6084210862790375
Energy: 0.8843894969548105
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Energy: 0.608421086278683
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Energy: 0.6288380640778822
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Energy: 0.8843894969557562
Energy: 0.9798273108179869
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Energy: 0.8557079947760712
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Energy: 0.8819692988523894
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Energy: 0.9885008629549998
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Energy: 0.8049953329648146
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Energy: 0.8049953329651103
Energy: 0.8874577541418561
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Energy: 0.9146441896722939
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Energy: 0.6315705654096041
Energy: 0.7412094716766692
Energy: 0.7969756710256851
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Energy: 0.8968041184909946
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Energy: 0.7969756710312405
Energy: 1.002726867852251
Energy: 0.6090829205790702
Energy: 0.8577732047330595
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Energy: 1.0027268678544965
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Energy: 1.0027268678509509
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Energy: 0.6088029979623704
Energy: 0.8457603069722528
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Energy: 0.9133179601581703
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Energy: 0.8949625344266158
Energy: 0.9714613347844905
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Energy: 0.9133179601568702
Energy: 0.9714613347890411
Energy: 0.6087751317589669
Energy: 0.8487652961631765
Energy: 0.8489012310138675
Energy: 0.6279492104605668
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Energy: 0.9084091396916325
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Energy: 0.848765296162881
Energy: 0.8489012310083124
Energy: 0.6279492104608622
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Energy: 0.6220908351858537
Energy: 1.0120214227303064
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Energy: 0.9389275205728063
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Energy: 0.6220908351858537
Energy: 1.0120214227322566
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Energy: 0.8578479962755976
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Energy: 1.0027268678557968
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Energy: 1.0027268678525463
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Energy: 0.5989315911703635
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Energy: 0.8488933545353927
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Energy: 0.9082297138661042
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Energy: 0.8457603069790491
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Energy: 0.8948954816510797
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Energy: 0.7593317970071675
Energy: 0.9019068909832464
Energy: 0.8457603069755032
Energy: 0.74068214523446
Energy: 0.8948954816494841
Energy: 0.8457603069781037
Energy: 0.6087751317641678
Energy: 0.8945930217829243
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Energy: 0.6087751317645224
Energy: 0.9022297655862372
Energy: 0.9714613347851405
Energy: 0.608775131761272
Energy: 0.8945930217861748
Energy: 0.9714613347844905
Energy: 0.608775131761922
Energy: 0.8487652961547254
Energy: 0.8648354466184466
Energy: 0.6279492104560161
Energy: 0.8487652961540754
Energy: 0.8605158578663625
Energy: 0.6279492104573163
Energy: 0.8487652961550799
Energy: 0.8648354466115911
Energy: 0.6279492104579665
Energy: 0.8487652961570301
Energy: 0.7856464460651108
Energy: 0.9317287986532694
Energy: 0.6078871130097173
Energy: 0.8059907115673797
Energy: 0.9024348184485852
Energy: 0.6078871130129678
Energy: 0.7856464460576643
Energy: 0.931728798653565
Energy: 0.6078871130129678
Energy: 0.8059907115683844
Energy: 0.8966919739700613
Energy: 0.8557079947763666
Energy: 0.5970753812906486
Energy: 0.7970094016945733
Energy: 0.7748868324425996
Energy: 0.5970753812912988
Energy: 0.8966919739677565
Energy: 0.8557079947747709
Energy: 0.5970753812923035
Energy: 0.7970094016922684
Energy: 0.881969298849789
Energy: 0.9885008629471987
Energy: 0.5980994371264761
Energy: 0.8513167769616958
Energy: 0.9885008629578959
Energy: 0.5980994371310265
Energy: 0.88196929885759
Energy: 0.9885008629576003
Energy: 0.5980994371375274
Energy: 0.851316776967192

minimum gb energy = 0.5969975287026664 eV
minimum distance =  2.33404539589332 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 1.077359625463378
Energy: 1.0930172635630764
Energy: 1.0925509012140209
Energy: 1.0205828704668403
Energy: 1.0930172635559385
Energy: 1.0925509012158054
Energy: 1.0773596254598092
Energy: 1.0930172635684292
Energy: 1.0925509012104524
Energy: 1.0205828704668403
Energy: 1.089085414879715
Energy: 1.0451151879668619
Energy: 1.0860176290756185
Energy: 1.0890854148904214
Energy: 1.0451151879704308
Energy: 1.0860176290756185
Energy: 1.0890854148814995
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Energy: 1.089085414879715
Energy: 1.1016882235751853
Energy: 1.0440398776706763
Energy: 1.0858362779461768
Energy: 1.0733982228352386
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Energy: 1.079199788911664
Energy: 1.070700072309668
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Energy: 1.079199788908095
Energy: 1.0724323054454719
Energy: 1.2469539565538148
Energy: 1.0338175919014443
Energy: 1.0551339523108634
Energy: 1.2469539565466772
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Energy: 1.0551339523108634
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Energy: 1.0338175919085817
Energy: 1.0551339523233216
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Energy: 1.1543230768870996
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Energy: 1.0496522586615207
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Energy: 1.1171417417018072
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Energy: 1.098111000434749
Energy: 1.1000144884439171
Energy: 1.043261800637706
Energy: 1.1683103513646353
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Energy: 1.043261800634137
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Energy: 1.1277330820479814
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Energy: 1.048177866341233
Energy: 1.1092979869645991
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Energy: 1.0481778663358798
Energy: 1.0364112572368451
Energy: 1.0761439361422105
Energy: 1.079371513408003
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Energy: 1.0761439361493481
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Energy: 1.0364112572368451
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Energy: 1.0992988774864667
Energy: 1.0748190032212854
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Energy: 1.0992988774953887
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Energy: 1.0480578309169657
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Energy: 1.09239717090594
Energy: 1.0480578309151811
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Energy: 1.0923971709005866
Energy: 1.0843612396580808
Energy: 1.110378711872957
Energy: 1.0435912526814939
Energy: 1.0843612396509432
Energy: 1.1103787118765256
Energy: 1.0435912526761406
Energy: 1.0843612396473743
Energy: 1.1103787118747412
Energy: 1.043591252669003
Energy: 1.0843612396527276
Energy: 1.10022539283825
Energy: 1.1825659021810115
Energy: 0.9949040832011657
Energy: 1.1002253928507408
Energy: 1.1825659021720893
Energy: 0.9949040831975973
Energy: 1.100225392847172
Energy: 1.1825659021774426
Energy: 0.9949040832065191
Energy: 1.1002253928507408
Energy: 1.0611686986375641
Energy: 1.1104799779227377
Energy: 1.0321948977793967
Energy: 1.0611686986357798
Energy: 1.1104799779245222
Energy: 1.0321948977776123
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Energy: 1.0987540530109627
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Energy: 1.0963368207964235
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Energy: 1.0935054182308341
Energy: 1.0963368208053452
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Energy: 1.1151978381383223
Energy: 1.0258460097589188
Energy: 1.0445953772109544
Energy: 1.1151978381294003
Energy: 1.0258460097464281

minimum gb energy = 0.9924299038603099 eV
minimum distance =  2.24438941914693 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

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Energy: 1.407650364095077
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Energy: 1.2700710987101893
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Energy: 1.2681565263566332
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Energy: 1.3188159873559149
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Energy: 1.2681565263589951
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Energy: 1.4631399282593907
Energy: 1.4563031674144122
Energy: 1.2681037182854078
Energy: 1.4631399282546669
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Energy: 1.2681037182889507
Energy: 1.4631399282593907
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Energy: 1.3838377999369553
Energy: 1.4085615638193885
Energy: 1.3622459470902568
Energy: 1.3838377999393172
Energy: 1.4085615638217506
Energy: 1.362245947087895

minimum gb energy = 1.2681037182854078 eV
minimum distance =  2.27704393840085 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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minimum gb energy = 1.4443809886353498 eV
minimum distance =  2.2259664994055 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.4343594630253031
Energy: 1.4644572972256105
Energy: 1.4645163816972926
Energy: 1.4343594630253031
Energy: 1.464457297222943
Energy: 1.530274220283633
Energy: 1.5100610816987858
Energy: 1.433415160314003
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Energy: 1.4334151603166705
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Energy: 1.4757585163853437
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Energy: 1.4921404404780694
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Energy: 1.4757585163853437
Energy: 1.5306611887690922
Energy: 1.4334024773329803
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Energy: 1.5306611887690922
Energy: 1.4334024773329803
Energy: 1.5103030727653566
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Energy: 1.4643189670833285
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Energy: 1.4809536231615155
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Energy: 1.6374647493026822
Energy: 1.4335237527573461
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Energy: 1.6374647493000147
Energy: 1.4395046120857646
Energy: 1.5735881328010664
Energy: 1.540498714494689
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Energy: 1.5735881328010664
Energy: 1.5404987144973563
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Energy: 1.573588132798399
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Energy: 1.4360271415780184
Energy: 1.436203493331216
Energy: 1.5073999704539474
Energy: 1.4360271415780184
Energy: 1.436203493336551
Energy: 1.5073999704539474
Energy: 1.436027141580686
Energy: 1.436203493336551
Energy: 1.5073999704539474
Energy: 1.4360271415780184
Energy: 1.5935757446224552
Energy: 1.4932028201777696
Energy: 1.493269588603615
Energy: 1.5935757446224552
Energy: 1.4932028201751022
Energy: 1.4932695886009473
Energy: 1.5935757446251229
Energy: 1.4932028201777696
Energy: 1.4932695886009473
Energy: 1.5935757446197878
Energy: 1.4359458106901442
Energy: 1.5074975714079528
Energy: 1.4362355284014467
Energy: 1.4359458106928116
Energy: 1.5074975714079528
Energy: 1.4362355284014467
Energy: 1.4359458106901442
Energy: 1.5074975714079528
Energy: 1.4362355284014467
Energy: 1.4359458106901442
Energy: 1.4392751575729565
Energy: 1.5405911125226317
Energy: 1.5734745039920939
Energy: 1.4392751575729565
Energy: 1.5405911125199643
Energy: 1.5734745039920939
Energy: 1.4392751575729565
Energy: 1.5405911125199643
Energy: 1.5734745039920939
Energy: 1.4392751575755756
Energy: 1.6373882823194057
Energy: 1.4807389426141813
Energy: 1.4334696928422883
Energy: 1.6373882823220733
Energy: 1.4807389426141813
Energy: 1.4334696928422883
Energy: 1.6373882823194057
Energy: 1.4807389426141813
Energy: 1.4334696928422883
Energy: 1.6373882823220733
Energy: 1.5314627016516353
Energy: 1.601507556224794
Energy: 1.43514875371184
Energy: 1.5314627016516353
Energy: 1.6015075562221266
Energy: 1.4351487537091725
Energy: 1.5314627016516353
Energy: 1.6015075562221266
Energy: 1.4351487537091725
Energy: 1.5314627016516353

minimum gb energy = 1.4334024773329803 eV
minimum distance =  2.22478305926819 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.4496070678771544
Energy: 1.4513958315476339
Energy: 1.4514129094741985
Energy: 1.4496070678786006
Energy: 1.4513958315423305
Energy: 1.4514129094727521
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Energy: 1.4513958315457056
Energy: 1.451412909475645
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Energy: 1.4498955612846245
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Energy: 1.4471494415303223
Energy: 1.4485008197812326
Energy: 1.4481559805576127
Energy: 1.580279812748892
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Energy: 1.5802798127233397
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Energy: 1.4485008197831608
Energy: 1.580449873167876
Energy: 1.4480617961053455
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Energy: 1.5804498731813315
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Energy: 1.4498955612855888
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Energy: 1.4471494415303223
Energy: 1.4498955612846245
Energy: 1.4481559805571305
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Energy: 1.4485133085970094
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Energy: 1.4499001982368234
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Energy: 1.449900198239716
Energy: 1.4470322099963253
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Energy: 1.4471494415308044
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Energy: 1.5802798136288434
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Energy: 1.4502965763875018
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Energy: 1.4470322099963253
Energy: 1.4502965763865374
Energy: 1.4499001982377877
Energy: 1.4470322099992179
Energy: 1.4502965763865374
Energy: 1.449900198235859
Energy: 1.4470322099972894
Energy: 1.4496070678757078
Energy: 1.4513958315485982
Energy: 1.4514129094746808
Energy: 1.4496070678776363
Energy: 1.4513958315428128
Energy: 1.4514129094708237
Energy: 1.4496070678766722
Energy: 1.4513958315481161
Energy: 1.451412909475645
Energy: 1.4496070678781183
Energy: 1.447149441529358
Energy: 1.4498955612846245
Energy: 1.4502331941567868
Energy: 1.447149441529358
Energy: 1.4498955612846245
Energy: 1.4502331941543762
Energy: 1.4471494415303223
Energy: 1.4498955612841424
Energy: 1.4502331941558224
Energy: 1.44714944152984
Energy: 1.4485008197812326
Energy: 1.4481559805576127
Energy: 1.5802798141507135
Energy: 1.448500819783643
Energy: 1.4481559805542377
Energy: 1.5802798138697705
Energy: 1.4485008197812326
Energy: 1.448155980555684
Energy: 1.5802798138447443
Energy: 1.4485008197841251
Energy: 1.580449875151832
Energy: 1.4480617961067919
Energy: 1.4485133085984558
Energy: 1.5804498751957048
Energy: 1.4480617961029352
Energy: 1.4485133085984558
Energy: 1.580449875597133
Energy: 1.4480617961053455
Energy: 1.4485133085984558
Energy: 1.5804498751658136
Energy: 1.4502965763894302
Energy: 1.4499001982382698
Energy: 1.4470322099997002
Energy: 1.4502965763870195
Energy: 1.4499001982363413
Energy: 1.4470322099943969
Energy: 1.4502965763870195
Energy: 1.4499001982387518
Energy: 1.447032209994879
Energy: 1.4502965763884659
Energy: 1.4513958315442592
Energy: 1.4514129094708237
Energy: 1.44960706787619
Energy: 1.4513958315500446
Energy: 1.4514129094741985
Energy: 1.4496070678786006
Energy: 1.4513958315442592
Energy: 1.4514129094708237
Energy: 1.4496070678766722
Energy: 1.4513958315485982
Energy: 1.4498955612851068
Energy: 1.4502331941543762
Energy: 1.4471494415308044
Energy: 1.4498955612836604
Energy: 1.4502331941563045
Energy: 1.4471494415327326
Energy: 1.4498955612846245
Energy: 1.4502331941538942
Energy: 1.44714944152984
Energy: 1.4498955612851068

minimum gb energy = 1.447032209991022 eV
minimum distance =  2.28344012227213 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.4210791425864506
Energy: 1.5116197030252765
Energy: 1.5116729472916
Energy: 1.4210791425842653
Energy: 1.511619703038389
Energy: 1.511672947293785
Energy: 1.4210791425864506
Energy: 1.5116197030252765
Energy: 1.5116729472916
Energy: 1.4210791425842653
Energy: 1.4303872812740153
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Energy: 1.4120018996327586
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Energy: 1.627617246421934
Energy: 1.3991406227748742
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Energy: 1.4252524844587422
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Energy: 1.42850416113045
Energy: 1.5260543832097233
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Energy: 1.5260543832097233
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Energy: 1.4285041611326357
Energy: 1.4596293955444146
Energy: 1.3851763644866497
Energy: 1.4978279573093358
Energy: 1.4596293955444146
Energy: 1.3851763644866497
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Energy: 1.4596293955444146
Energy: 1.5093643046920167
Energy: 1.5732119217772105
Energy: 1.5894890014551024
Energy: 1.509364304689831
Energy: 1.5732119217772105
Energy: 1.5894890014572878
Energy: 1.509364304687646
Energy: 1.5732119217793963
Energy: 1.5894890014551024
Energy: 1.5093643046920167
Energy: 1.489603580570901
Energy: 1.386362157046803
Energy: 1.4912027351744173
Energy: 1.4896035805730865
Energy: 1.386362157046803
Energy: 1.4912027351722321
Energy: 1.4896035805840135
Energy: 1.386362157046803
Energy: 1.4912027351744173
Energy: 1.4896035805883843
Energy: 1.4252415481113956
Energy: 1.3836668183571479
Energy: 1.5865345750240663
Energy: 1.4252415481266938
Energy: 1.3836668183571479
Energy: 1.5865345750240663
Energy: 1.425241548117952
Energy: 1.3836668183571479
Energy: 1.5865345750240663
Energy: 1.4252415481135812
Energy: 1.4745331811151867
Energy: 1.4833886676552426
Energy: 1.4063751318970463
Energy: 1.4745331811151867
Energy: 1.4833886676530572
Energy: 1.4063751318927151
Energy: 1.4745331811151867
Energy: 1.483388667657428
Energy: 1.406375131894901
Energy: 1.4745331811151867
Energy: 1.386887946879994
Energy: 1.5281670290117073
Energy: 1.5863843355513205
Energy: 1.3868879468821795
Energy: 1.528167029013893
Energy: 1.5863843355556915
Energy: 1.3868879468821795
Energy: 1.5281670290117073
Energy: 1.5863843355491354
Energy: 1.3868879468821795
Energy: 1.4195508729662705
Energy: 1.5718039905208736
Energy: 1.4536650861428906
Energy: 1.4195508729662705
Energy: 1.5718039905208736
Energy: 1.4536650861407054
Energy: 1.4195508729662705
Energy: 1.5718039905208736
Energy: 1.4536650861407054
Energy: 1.4195508729640849
Energy: 1.4193338621678726
Energy: 1.5112623094866733
Energy: 1.572083376289397
Energy: 1.4193338621700577
Energy: 1.5112623094866733
Energy: 1.572083376289397
Energy: 1.4193338621700577
Energy: 1.5112623094932296
Energy: 1.572083376285066
Energy: 1.4193338621678726
Energy: 1.3858480675909013
Energy: 1.528139938297593
Energy: 1.5275259826103835
Energy: 1.3858480675930867
Energy: 1.5281399382954077
Energy: 1.5275259826125689
Energy: 1.3858480675909013
Energy: 1.528139938297593
Energy: 1.5275259826060126
Energy: 1.3858480675930867
Energy: 1.394633161196154
Energy: 1.401015218921141
Energy: 1.4012060459571423
Energy: 1.3946331611939686
Energy: 1.4010152189233265
Energy: 1.401206045946215
Energy: 1.394633161200525
Energy: 1.4010152189189555
Energy: 1.401206045950586
Energy: 1.3946331611917833
Energy: 1.4260970647717524
Energy: 1.5867987601009135
Energy: 1.3838996845450071
Energy: 1.4260970647673814
Energy: 1.5867987601009135
Energy: 1.3838996845406362
Energy: 1.4260970647717524
Energy: 1.5867987601009135
Energy: 1.3838996845450071
Energy: 1.4260970647695668
Energy: 1.5641249304673486
Energy: 1.503342740807122
Energy: 1.386272670790637
Energy: 1.5641249304652032
Energy: 1.5033427408027513
Energy: 1.386272670790637
Energy: 1.5641249304673486
Energy: 1.5033427408027513
Energy: 1.386272670790637
Energy: 1.5641249304652032
Energy: 1.3992546535096058
Energy: 1.5949128233416126
Energy: 1.573709992470149
Energy: 1.3992546535096058
Energy: 1.5949128233416126
Energy: 1.5737099924679636
Energy: 1.3992546535096058
Energy: 1.594912823343798
Energy: 1.5737099924679636
Energy: 1.399254653520533
Energy: 1.5571496298031746
Energy: 1.5195519114421268
Energy: 1.3860346592637933
Energy: 1.5571496298053604
Energy: 1.5195519114421268
Energy: 1.3860346592616077
Energy: 1.5571496298031746
Energy: 1.5195519114421268
Energy: 1.3860346592637933
Energy: 1.5571496298053604
Energy: 1.429520934051399
Energy: 1.4275285347251994
Energy: 1.4271397174622698
Energy: 1.429520934051399
Energy: 1.4275285347251994
Energy: 1.4271397174600842
Energy: 1.429520934051399
Energy: 1.4275285347251994
Energy: 1.4271397174600842
Energy: 1.429520934051399
Energy: 1.587449963280203
Energy: 1.4260798046001881
Energy: 1.4257170156722951
Energy: 1.587449963280203
Energy: 1.4260798045980025
Energy: 1.4257170156701098
Energy: 1.5874499632780172
Energy: 1.4260798046001881
Energy: 1.425717015676666
Energy: 1.587449963280203
Energy: 1.3943146142879135
Energy: 1.3874887845491406
Energy: 1.5275596162871907
Energy: 1.3943146142857283
Energy: 1.3874887845491406
Energy: 1.5275596162893763
Energy: 1.3943146142879135
Energy: 1.3874887845513262
Energy: 1.5275596162871907
Energy: 1.3943146142857283
Energy: 1.4077941645353977
Energy: 1.5569063283890554
Energy: 1.4076420350443972
Energy: 1.4077941645375829
Energy: 1.5569063283956117
Energy: 1.4076420350443972
Energy: 1.4077941645353977
Energy: 1.5569063283934264
Energy: 1.4076420350443972
Energy: 1.4077941645375829
Energy: 1.4363471148961349
Energy: 1.3861924252782325
Energy: 1.4814189102300475
Energy: 1.4363471148961349
Energy: 1.3861924252826032
Energy: 1.4814189102300475
Energy: 1.4363471148961349
Energy: 1.3861924252826032
Energy: 1.4814189102300475
Energy: 1.4363471148961349
Energy: 1.4273395423991553
Energy: 1.4029927027748565
Energy: 1.5860550772784454
Energy: 1.4273395424035262
Energy: 1.402992702777042
Energy: 1.5860550772828164
Energy: 1.4273395424013409
Energy: 1.402992702777042
Energy: 1.5860550772806308
Energy: 1.4273395424013409
Energy: 1.3997638370257988
Energy: 1.4667967210121071
Energy: 1.4013875198196355
Energy: 1.39976383703013
Energy: 1.466796721009922
Energy: 1.4013875198218209
Energy: 1.3997638370366865
Energy: 1.466796721009922
Energy: 1.4013875198218209
Energy: 1.3997638370257988
Energy: 1.386568081174268
Energy: 1.4598642872447831
Energy: 1.395059570098401
Energy: 1.386568081169897
Energy: 1.4598642872447831
Energy: 1.3950595700962156
Energy: 1.386568081174268
Energy: 1.4598642872447831
Energy: 1.395059570102772
Energy: 1.386568081169897
Energy: 1.4192794620931684
Energy: 1.5706481324093058
Energy: 1.4372445257511448
Energy: 1.4192794620931684
Energy: 1.5706481324071204
Energy: 1.4372445257533302
Energy: 1.4192794620909832
Energy: 1.5706481324093058
Energy: 1.4372445257511448
Energy: 1.4192794620931684

minimum gb energy = 1.3836668183571479 eV
minimum distance =  2.23323543376476 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.3380325610713275
Energy: 1.3379560693389225
Energy: 1.337573823229904
Energy: 1.3380325610776969
Energy: 1.33795606933733
Energy: 1.337573823235477
Energy: 1.3380325610721235
Energy: 1.3379560693413108
Energy: 1.3375738232275152
Energy: 1.3380325610776969
Energy: 1.437050296499652
Energy: 1.3095222739111394
Energy: 1.3263411684079194
Energy: 1.4370502965068177
Energy: 1.3095222739103434
Energy: 1.3263411684087154
Energy: 1.4370502965028369
Energy: 1.309522273912732
Energy: 1.3263411684087154
Energy: 1.4370502964980598
Energy: 1.4828051408063858
Energy: 1.2978201072052962
Energy: 1.4669134469590472
Energy: 1.4713880710377523
Energy: 1.2978201072044997
Energy: 1.4466308476284957
Energy: 1.4713880710337712
Energy: 1.2978201072052962
Energy: 1.4655530364892972
Energy: 1.4713880710385483
Energy: 1.4526852453811723
Energy: 1.4720958330356833
Energy: 1.3723611183999198
Energy: 1.4526852453827646
Energy: 1.472095833038072
Energy: 1.3723611184023086
Energy: 1.4526852453795798
Energy: 1.4720958330372755
Energy: 1.3723611183991238
Energy: 1.452685245383561
Energy: 1.3709618915898076
Energy: 1.3231346242143067
Energy: 1.4554261820252035
Energy: 1.3709618915866228
Energy: 1.3231346242182878
Energy: 1.4554261820220185
Energy: 1.3709618915890114
Energy: 1.323134624215103
Energy: 1.4554261820252035
Energy: 1.3709618915866228
Energy: 1.3712237584540292
Energy: 1.5210105853420124
Energy: 1.3090816328630492
Energy: 1.3712237584540292
Energy: 1.521010585343605
Energy: 1.3090816328638455
Energy: 1.3712237584540292
Energy: 1.5210105853428086
Energy: 1.309081632857476
Energy: 1.3712237584540292
Energy: 1.3804912874738529
Energy: 1.3428347951214425
Energy: 1.297867445995618
Energy: 1.3804912874698718
Energy: 1.3428347951222388
Energy: 1.2978674459972106
Energy: 1.3804912874738529
Energy: 1.3428347951206467
Energy: 1.297867445995618
Energy: 1.3804912874722606
Energy: 1.3523581397431694
Energy: 1.5518542960568082
Energy: 1.318501699537391
Energy: 1.352358139741577
Energy: 1.5518542960591966
Energy: 1.3185016995334105
Energy: 1.3523581397431694
Energy: 1.5518542960552157
Energy: 1.3185016995357988
Energy: 1.352358139741577
Energy: 1.6089388724617792
Energy: 1.3235376675568198
Energy: 1.3227874688873058
Energy: 1.6089388724681488
Energy: 1.3235376675480617
Energy: 1.3227874688825287
Energy: 1.608938872460983
Energy: 1.3235376675536348
Energy: 1.3227874688873058
Energy: 1.6089388724649643
Energy: 1.4561196142978203
Energy: 1.3741224364048223
Energy: 1.4737694040964224
Energy: 1.4561196142962278
Energy: 1.3741224364056184
Energy: 1.4737694270125186
Energy: 1.4561196142962278
Energy: 1.374122436404026
Energy: 1.4737694508733301
Energy: 1.4561196142946353
Energy: 1.4377015933204915
Energy: 1.306261688548224
Energy: 1.3525599499820424
Energy: 1.437701593326861
Energy: 1.3062616885498166
Energy: 1.3525599499868197
Energy: 1.4377015933220838
Energy: 1.3062616885490201
Energy: 1.4273963984592601
Energy: 1.4377015933252686
Energy: 1.3740988167709438
Energy: 1.313793979016152
Energy: 1.3287586729350152
Energy: 1.3740988167733323
Energy: 1.3137939790177444
Energy: 1.3287586729334226
Energy: 1.3740988167709438
Energy: 1.313793979016152
Energy: 1.3287586729326266
Energy: 1.3740988167757209
Energy: 1.3233032637943893
Energy: 1.3909748190407212
Energy: 1.3231717382532742
Energy: 1.3233032637912046
Energy: 1.3909748190407212
Energy: 1.323171738247701
Energy: 1.3233032637951854
Energy: 1.3909748190439057
Energy: 1.3231717382524781
Energy: 1.3233032637920008
Energy: 1.3318124654635681
Energy: 1.3313132626850197
Energy: 1.32358315532448
Energy: 1.331812465455606
Energy: 1.3313132626889284
Energy: 1.3235831553260724
Energy: 1.3318124654611794
Energy: 1.3313132626850197
Energy: 1.3235831553268687
Energy: 1.3318124654564023

minimum gb energy = 1.2978201072044997 eV
minimum distance =  2.23987745345959 Angstroms
sigma value = 33