Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987v2_Cu__MO_762798677854_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615000367164612
cohesive_energy=3.518260241115693
mass=63.546
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: 0.015387144173519836
Energy: 0.3374969745092223
Energy: 0.3374969745077768
Energy: 0.015387144173519836
Energy: 0.3374969745077768
Energy: 0.3374969745077768
Energy: 0.015387144173519836
Energy: 0.3374969745077768
Energy: 0.3374969745092223
Energy: 0.015387144174965346
Energy: 0.33330889737315317
Energy: 0.018206437531941323
Energy: 0.33383804137706213
Energy: 0.33330889737315317
Energy: 0.018206437530495813
Energy: 0.3338380413756166
Energy: 0.33330889737315317
Energy: 0.018206437531941323
Energy: 0.33383804137706213
Energy: 0.33330889737315317
Energy: 1.5438345980482977
Energy: 0.8782050162947044
Energy: 0.8782050162947044
Energy: 1.5438345980482977
Energy: 0.8782050162947044
Energy: 0.8782050162947044
Energy: 1.5438345980468522
Energy: 0.8782050162947044
Energy: 0.8782050162947044
Energy: 1.5438345980482977
Energy: 0.3333088973717077
Energy: 0.33383804137850764
Energy: 0.018206437529050302
Energy: 0.3333088973717077
Energy: 0.33383804137706213
Energy: 0.018206437530495813
Energy: 0.3333088973717077
Energy: 0.33383804137850764
Energy: 0.018206437529050302
Energy: 0.3333088973717077
Energy: 0.015387144173519836
Energy: 0.3374969745092223
Energy: 0.3374969745092223
Energy: 0.015387144173519836
Energy: 0.3374969745092223
Energy: 0.3374969745092223
Energy: 0.015387144173519836
Energy: 0.3374969745092223
Energy: 0.3374969745092223
Energy: 0.015387144173519836
Energy: 0.3333088973717077
Energy: 0.018206437529050302
Energy: 0.33383804137706213
Energy: 0.3333088973717077
Energy: 0.018206437530495813
Energy: 0.33383804137850764
Energy: 0.33330889737315317
Energy: 0.018206437530495813
Energy: 0.33383804137706213
Energy: 0.3333088973717077
Energy: 1.5438345980482977
Energy: 0.8782050162947044
Energy: 0.8782050162947044
Energy: 1.5438345980482977
Energy: 0.8782050162947044
Energy: 0.8782050162947044
Energy: 1.5438345980482977
Energy: 0.8782050162947044
Energy: 0.761162830409355
Energy: 1.5438345980482977

minimum gb energy = 0.015387144173519836 eV
minimum distance =  2.25571650580567 Angstroms
sigma value = 3


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

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Energy: 0.9513760714175147
Energy: 1.0425792621270034
Energy: 0.8358231931124319
Energy: 0.9513760714157764
Energy: 1.0425792621355012
Energy: 0.8912324472522614
Energy: 0.9513760714171928
Energy: 1.0425792621347931
Energy: 0.8358231931121101
Energy: 1.0004923653899724
Energy: 0.8609800041258798
Energy: 0.9465919932741793
Energy: 1.000492365392097
Energy: 0.86098000411603
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Energy: 1.0004923653913889
Energy: 0.8609800041265878
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Energy: 1.0133759779356888
Energy: 1.0620336487752084
Energy: 1.0518794111316299
Energy: 1.0269663645650213
Energy: 1.0620336487723758
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Energy: 1.0133759779282854
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Energy: 1.0518794111354925
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Energy: 0.778594157863094
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Energy: 1.083030690624824
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Energy: 1.083030690631519
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Energy: 0.9804149155774498
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Energy: 0.8603560766855358
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Energy: 0.778427536555782
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Energy: 1.0599873592888638
Energy: 0.883074553560013
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Energy: 0.9934801957862996
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Energy: 0.7785899957249777
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Energy: 1.0210588049210336
Energy: 1.0527577000145933
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Energy: 1.021058804930626
Energy: 0.8680803049663319
Energy: 0.9802678568177725
Energy: 0.8610447608976324
Energy: 0.8680803049705809
Energy: 0.9802678568301973
Energy: 0.8610513771337098
Energy: 0.8680803049659456
Energy: 0.9802678568231158
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Energy: 0.8680803049680701
Energy: 0.8351463843596453
Energy: 0.9513760714242743
Energy: 1.0425792621217245
Energy: 0.8359161372651986
Energy: 0.9513760714193171
Energy: 1.042579262133763
Energy: 0.8351463843504393
Energy: 0.9513760714203472
Energy: 1.0425792621316385
Energy: 0.8359161372662931
Energy: 1.0004923653881699
Energy: 0.8609800041241417
Energy: 0.946591993273793
Energy: 1.0004923653913889
Energy: 0.8609800041142275
Energy: 0.9465919932805527
Energy: 1.0004923653860454
Energy: 0.8609800041244635
Energy: 0.9465919932829989
Energy: 1.0004923653892643
Energy: 0.8734010048966377
Energy: 1.0620336487685131
Energy: 1.0518794111354925
Energy: 0.8662784035914021
Energy: 1.0620336487685131
Energy: 1.051879411136909
Energy: 0.8734010048930969
Energy: 1.0620336487699296
Energy: 1.0518794111387115
Energy: 0.8662784035832904
Energy: 0.9512903075636097
Energy: 0.9496168110110917
Energy: 0.7785941578609696
Energy: 0.9512903075671503
Energy: 0.94961681101283
Energy: 0.7785941578556262
Energy: 0.9512903075600688
Energy: 0.949616811016757
Energy: 0.7785941578560125
Energy: 0.9512903075639316

minimum gb energy = 0.7495528081741356 eV
minimum distance =  2.35350407567365 Angstroms
sigma value = 75


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

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Energy: 0.8097663512644656
Energy: 0.8057276305268032
Energy: 0.9938839776520138
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minimum gb energy = 0.8057229483001374 eV
minimum distance =  2.1398885620958 Angstroms
sigma value = 105


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

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Energy: 1.0338425737853227
Energy: 0.9800698516768349
Energy: 1.0537389976353861
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Energy: 0.9802553890724225
Energy: 1.0537389976355633
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Energy: 0.9800698516780045
Energy: 1.0537389976392846
Energy: 1.1177768800071155
Energy: 1.035837513098677
Energy: 1.1011288648211577
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Energy: 0.9479462579185158
Energy: 0.9495514842252815
Energy: 1.0684195816641848
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Energy: 0.9495514842309518
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Energy: 0.968507955826431
Energy: 0.9880434445776829
Energy: 0.8997535566520425
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Energy: 1.1292285397578945
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Energy: 1.1102775756219725
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Energy: 1.1102775756219725
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Energy: 1.064109188683643
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Energy: 1.0641091886748895
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Energy: 1.0641091886877536
Energy: 1.0112028662235335
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Energy: 0.9719040935253866
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Energy: 1.0112028662239236
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Energy: 0.9719040935224453
Energy: 1.0112028662235335
Energy: 1.0236311622929495
Energy: 1.046669637106168
Energy: 0.8999764328766732
Energy: 1.0236308788596098
Energy: 1.0467862348856645
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Energy: 1.04666963710188
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Energy: 1.0236308788578734
Energy: 1.004537088300518
Energy: 1.023103543543658
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Energy: 1.0231035435514544
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Energy: 1.0045370883028568
Energy: 1.0555579197641691
Energy: 1.0487240291416426
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Energy: 1.0555579197672877
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Energy: 1.0335587711202545
Energy: 1.0555579197694496
Energy: 1.0487240291414655
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Energy: 1.0555579197690594
Energy: 1.0582347973670678
Energy: 1.0500513561431373
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Energy: 1.0582347973628152
Energy: 1.0352954666580205
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Energy: 1.0582347973628152
Energy: 1.0500513561468585
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Energy: 1.0582347973668906
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Energy: 1.0481357458814335
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Energy: 1.0481357458843394
Energy: 1.002803872166542
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Energy: 0.9924649179172094
Energy: 0.9385105756489918
Energy: 1.0555788828618424
Energy: 0.9924649179191585
Energy: 0.9385105756449162
Energy: 1.0555788828624448
Energy: 0.9924649179173866
Energy: 0.9385105756447036
Energy: 1.0555788828595032
Energy: 0.9924649179144805
Energy: 0.9454854091994893
Energy: 1.0243764897067944
Energy: 1.0478660244499376
Energy: 0.9454854092008713
Energy: 1.0243764897083536
Energy: 1.047866024453056
Energy: 0.9454854092016156
Energy: 1.0243764897091332
Energy: 1.047866024450717
Energy: 0.9454854092008713
Energy: 1.0018865605601228
Energy: 0.9951079727812303
Energy: 1.0271115317246244
Energy: 1.0018865605593428
Energy: 0.992130778574341
Energy: 1.0271115317279202
Energy: 1.0018865605607252
Energy: 0.9951079727845262
Energy: 1.027111531725794
Energy: 1.0018865605576066
Energy: 1.1446979991641657
Energy: 1.0014773588491073
Energy: 0.9476623474722812
Energy: 1.1446979991637762
Energy: 1.0022236780419365
Energy: 0.9476623474724938
Energy: 1.144697999163209
Energy: 1.00147735884893
Energy: 0.947662347472104
Energy: 1.1446979991641657
Energy: 1.0180235615142474
Energy: 1.0354992077406866
Energy: 0.9311747354636456
Energy: 1.0180235615144246
Energy: 1.0354992077393044
Energy: 0.9311747354613068
Energy: 1.0180235615109159
Energy: 1.0354992077391272
Energy: 0.9311747354622636
Energy: 1.018023561508967
Energy: 1.0369234430036343
Energy: 1.1016402337169575
Energy: 0.96840245402463
Energy: 1.0369234430048038
Energy: 1.102579145626153
Energy: 0.9684024540234605
Energy: 1.0369234430003385
Energy: 1.1016402337163904
Energy: 0.9684024540228934
Energy: 1.0369234430026775
Energy: 1.0951680939798778
Energy: 1.0226594619992901
Energy: 0.9921648503518229
Energy: 1.095168093986682
Energy: 1.0635841483883857
Energy: 0.9921648503506534
Energy: 1.0951680939851225
Energy: 1.0226594619975182
Energy: 0.9921648503484914
Energy: 1.0951680939874615
Energy: 1.029525355876595
Energy: 0.9442761783319787
Energy: 1.0553168749711004
Energy: 1.02952535587213
Energy: 0.9444043813758372
Energy: 1.0553168749672022
Energy: 1.0295253558777646
Energy: 0.9442761783329356
Energy: 1.0553168749660329
Energy: 1.0295253558771977

minimum gb energy = 0.8997535566520425 eV
minimum distance =  2.15238423512491 Angstroms
sigma value = 165


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

Energy: 0.9343627216534
Energy: 0.9911846545445323
Energy: 0.9905042314543023
Energy: 0.8902791482216917
Energy: 0.9911846545472087
Energy: 0.9905042314556408
Energy: 0.9343627216527308
Energy: 0.9911846545425249
Energy: 0.9905042314569791
Energy: 0.8902791482210226
Energy: 1.0881364154361448
Energy: 0.8868502552458897
Energy: 1.0737419670452915
Energy: 1.0881364154361448
Energy: 0.8868502552472278
Energy: 1.0737419670426147
Energy: 1.0881364154348065
Energy: 0.886850255247897
Energy: 1.0737419670432837
Energy: 1.0881364154334987
Energy: 0.9724514821962367
Energy: 0.9400086139336724
Energy: 0.9132717424876734
Energy: 0.9724514821908835
Energy: 0.9400086139363488
Energy: 0.9272076338674894
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Energy: 0.9400086139350107
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Energy: 0.9724514821955675
Energy: 1.0986758564549837
Energy: 1.1339905617663826
Energy: 0.8988203276230442
Energy: 1.0986758564563222
Energy: 1.1339905617670518
Energy: 0.8988203276250516
Energy: 1.0986758564549837
Energy: 1.1339905617650443
Energy: 0.8988203276277282
Energy: 1.0986758564536454
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Energy: 1.02049147200075
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Energy: 1.02049147200075
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Energy: 0.9026313676078516
Energy: 1.1251993060431031
Energy: 1.1181117583251994
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Energy: 1.1181117583225229
Energy: 0.9026313676065133
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Energy: 0.8863035443979937
Energy: 0.9021945402826625
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Energy: 0.9021945402813243
Energy: 1.1125794841545324
Energy: 0.8863035443973246
Energy: 0.9021945402840008
Energy: 1.11257948415654
Energy: 0.9667620211258567
Energy: 1.024369572214195
Energy: 0.9865555893636824
Energy: 0.9667620211278641
Energy: 1.0243695722155335
Energy: 0.9864463684609138
Energy: 0.9667620211285333
Energy: 1.0243695722128567
Energy: 0.986555589362344
Energy: 0.9667620211278641
Energy: 0.9464892732872481
Energy: 1.1178970921312186
Energy: 1.1828600114143826
Energy: 0.9027426244496668
Energy: 1.1178970921345643
Energy: 1.1828600114157208
Energy: 0.9464892732885865
Energy: 1.1178970921352334
Energy: 1.1828600114143826
Energy: 0.9027426244489977
Energy: 1.0008550299009575
Energy: 0.8828650358265461
Energy: 1.132035724389671
Energy: 0.9399389891297325
Energy: 0.8828650358258769
Energy: 1.0764011175966492
Energy: 1.000855029898281
Energy: 0.8828650358245387
Energy: 1.1320357243916783
Energy: 0.9399389891263868
Energy: 1.1180389083776674
Energy: 0.8987241404106043
Energy: 1.0460587788831188
Energy: 1.1180389083763287
Energy: 0.8987241404065895
Energy: 1.0460587788804425
Energy: 1.1180389083790057
Energy: 0.8987241404085968
Energy: 1.0460587788817806
Energy: 1.1180389083776674
Energy: 1.0151473170883005
Energy: 0.929581865713861
Energy: 0.9679343147507914
Energy: 1.015147317090977
Energy: 0.9295818657185452
Energy: 0.9679343147501223
Energy: 1.0151473170896388
Energy: 0.9295818657192143
Energy: 0.9679343147514605
Energy: 1.0151473170903078
Energy: 1.031192507217854
Energy: 1.0166450185592006
Energy: 0.901897626516031
Energy: 1.031192507219192
Energy: 1.0166450185585316
Energy: 0.9018976265120465
Energy: 1.0311925072218686
Energy: 1.0166450185571934
Energy: 0.9018976265120465
Energy: 1.031192507218523
Energy: 0.8902791482203535
Energy: 0.9911846545438631
Energy: 0.9905042314549715
Energy: 0.89027914822303
Energy: 0.9911846545458706
Energy: 0.9905042314576482
Energy: 0.8902791482203535
Energy: 0.9911846545425249
Energy: 0.9905042314583173
Energy: 0.89027914822303

minimum gb energy = 0.8828650358245387 eV
minimum distance =  2.32687662396501 Angstroms
sigma value = 41


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

Energy: 0.9768431545097738
Energy: 0.9009824700449113
Energy: 0.9009173818926176
Energy: 0.9768431545123698
Energy: 0.900982470042315
Energy: 0.9009173818926176
Energy: 0.9768431545097738
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Energy: 0.8012563789353438
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Energy: 0.8123378929848564
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Energy: 0.812425461820972
Energy: 0.8174176164430016
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Energy: 1.093609854233968
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Energy: 1.0936098542365642
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Energy: 0.8219929688149069
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Energy: 0.8051312114320729
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Energy: 0.9803383430383695
Energy: 0.9103288351144673
Energy: 0.8796741303912975
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Energy: 0.8796741303938936
Energy: 0.9803383430383695
Energy: 0.9103288351144673
Energy: 0.8796741303912975
Energy: 0.9803383430383695
Energy: 0.8285290375109785
Energy: 0.804141068012526
Energy: 0.9655324136606788
Energy: 0.8285290331382944
Energy: 0.8041410680099297
Energy: 0.9655324136606788
Energy: 0.82852903585011
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Energy: 0.9655324136606788
Energy: 0.828529035826744
Energy: 0.8829015515577842
Energy: 0.8086508842777577
Energy: 0.8032837320581154
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Energy: 0.8086508842803539
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Energy: 0.8086508842803539
Energy: 0.8032837320581154
Energy: 0.8829015515577842
Energy: 0.8801616464910769
Energy: 0.9113554986570881
Energy: 0.8010996981081097
Energy: 0.8801616464936731
Energy: 0.9113554986596842
Energy: 0.8010996981081097
Energy: 0.8801616464910769
Energy: 0.9113554986596842
Energy: 0.8010996981081097
Energy: 0.8801616464936731
Energy: 0.8049615620251863
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Energy: 0.8253520098460732
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Energy: 0.8049615620251863
Energy: 0.8353940730819013
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Energy: 0.8115784442016085
Energy: 0.8353940730793051
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Energy: 0.8115784441990124
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Energy: 0.8196667572816534
Energy: 0.9649197069929842
Energy: 0.8847672279436946
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Energy: 0.9649197069955804
Energy: 0.8847672279410983
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Energy: 0.9649197069929842
Energy: 0.8847672279436946
Energy: 0.8196667572816534
Energy: 0.9426210769694279
Energy: 0.8012429938095453
Energy: 0.8913163362692812
Energy: 0.9426210769694279
Energy: 0.8012429938095453
Energy: 0.8913163362718775
Energy: 0.9426210769694279
Energy: 0.8012429938095453
Energy: 0.8913163362692812
Energy: 0.9426210769694279
Energy: 0.9020060928044186
Energy: 0.9018448913425039
Energy: 0.9775422475400818
Energy: 0.9020060928044186
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Energy: 0.9775422475400818
Energy: 0.9020060928018224
Energy: 0.9018448913425039
Energy: 0.9775422475400818
Energy: 0.9020060928044186
Energy: 0.8013989431826051
Energy: 1.005660434787372
Energy: 0.8266674047303286
Energy: 0.8013989431826051
Energy: 1.005660434787372
Energy: 0.8266674047303286
Energy: 0.8013989431826051
Energy: 1.005660434787372
Energy: 0.8266674047303286
Energy: 0.8013989431826051
Energy: 0.8050771708294125
Energy: 0.8064857375172498
Energy: 0.8065308595061463
Energy: 0.8050771708294125
Energy: 0.8064857375172498
Energy: 0.8065308595087426
Energy: 0.8050771708294125
Energy: 0.8064857375172498
Energy: 0.8065308595087426
Energy: 0.8050771708294125
Energy: 0.8071077123660427
Energy: 0.8028205672553661
Energy: 0.8123515739787626
Energy: 0.8071077123634466
Energy: 0.8028205672579624
Energy: 0.8123515739761662
Energy: 0.8071077123634466
Energy: 0.8028205672553661
Energy: 0.8123515739787626
Energy: 0.8071077123634466
Energy: 1.0933058011996895
Energy: 0.8171385258217568
Energy: 0.9365039471331903
Energy: 1.0933058012022858
Energy: 0.8171385258243531
Energy: 0.9365039471357393
Energy: 1.0933058011996895
Energy: 0.8171385258217568
Energy: 0.9365039471331903
Energy: 1.0933058012022858
Energy: 0.9110927179922972
Energy: 0.8792465247891487
Energy: 0.8039579531704183
Energy: 0.9110927179897009
Energy: 0.8792465247891487
Energy: 0.8039579531652259
Energy: 0.9110927179974896
Energy: 0.8792465247865524
Energy: 0.8039579531704183
Energy: 0.9110927179922972

minimum gb energy = 0.8010996981081097 eV
minimum distance =  2.14457323264636 Angstroms
sigma value = 185


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

Energy: 0.6457046405155
Energy: 0.43540698760945507
Energy: 0.4347805848010812
Energy: 0.4126907856628612
Energy: 0.4354069876134615
Energy: 0.4347805847964585
Energy: 0.6457046405139591
Energy: 0.4354069876156188
Energy: 0.434780584805704
Energy: 0.4126907856628612
Energy: 0.6143158742209702
Energy: 0.42820197041366215
Energy: 0.5307402138957238
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Energy: 0.428201970415203
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Energy: 0.4118635535178848
Energy: 0.4755007734830791
Energy: 0.5092450047462925
Energy: 0.5274949480054675
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Energy: 0.443739339141913
Energy: 0.4118635535191175
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Energy: 0.5274949480036184
Energy: 0.6195407829547097
Energy: 0.4343764961654685
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Energy: 0.6195407829550179
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Energy: 0.4119264822961184
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Energy: 0.43698006950992385
Energy: 0.6353291835666027
Energy: 0.6769255962525262
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Energy: 0.6769255962589981
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Energy: 0.4364106955369116
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Energy: 0.6062105969209033
Energy: 0.6336645910962698
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Energy: 0.49794934661691315
Energy: 0.6353974389489907
Energy: 0.45063431078027383
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Energy: 0.6353974389474497
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Energy: 0.6353974389514562
Energy: 0.4232127218889599
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Energy: 0.43519625909624715
Energy: 0.42321272188865183
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Energy: 0.42321272188957637
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Energy: 0.42321272188957637
Energy: 0.489637722612496
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Energy: 0.4764932490895167
Energy: 0.4504206491994443
Energy: 0.4766452198141865
Energy: 0.47649324908982493
Energy: 0.48963772262174154
Energy: 0.5074478305179413
Energy: 0.4764932490913658
Energy: 0.4504206491963625
Energy: 0.6143577487856015
Energy: 0.5960033634563453
Energy: 0.428623425446997
Energy: 0.6143577487810066
Energy: 0.5960033634554207
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Energy: 0.6143577487797739
Energy: 0.5960033634538798
Energy: 0.428623425443607
Energy: 0.614357748783136
Energy: 0.4126907856628612
Energy: 0.4354069876088387
Energy: 0.4347805848035467
Energy: 0.4896577036675469
Energy: 0.43540698761469426
Energy: 0.4347805848001567
Energy: 0.4126907856628612
Energy: 0.43540698761685154
Energy: 0.43478058480508763
Energy: 0.48965770366323225
Energy: 0.6143158742234356
Energy: 0.42820197041304575
Energy: 0.5436992995309312
Energy: 0.6143158742246684
Energy: 0.42820197041273755
Energy: 0.5621987304856186
Energy: 0.6143158742271337
Energy: 0.42820197041674396
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Energy: 0.6143158742283665
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Energy: 0.47550077348338726
Energy: 0.48083813239942874
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Energy: 0.47550077348523634
Energy: 0.4976222292590494
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Energy: 0.47550077348677733
Energy: 0.4808381323978879
Energy: 0.4504025099603535
Energy: 0.6195407829587161
Energy: 0.43437649616762575
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Energy: 0.4343764961694748
Energy: 0.6187535188536348
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Energy: 0.43437649616731755
Energy: 0.6187535188508613
Energy: 0.6195407829617979
Energy: 0.43698006951331386
Energy: 0.47328095735821174
Energy: 0.4506812939294055
Energy: 0.4369800695096157
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Energy: 0.47328095735913633
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Energy: 0.4369800695114648
Energy: 0.6353291835672192
Energy: 0.5278901187657182
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Energy: 0.6353291835696846
Energy: 0.6769255962528343
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Energy: 0.6353291835687601
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Energy: 0.436410695537528
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Energy: 0.6336645910959616
Energy: 0.43641069553968526
Energy: 0.6062105969258343
Energy: 0.633664591094729
Energy: 0.4364106955390689
Energy: 0.6062105969288881
Energy: 0.6336645910971943
Energy: 0.4364106955381444
Energy: 0.6353974389499153
Energy: 0.41191730562375556
Energy: 0.49794934661722134
Energy: 0.6353974389499153
Energy: 0.4506448696879927
Energy: 0.49794934661568047
Energy: 0.6353974389465252
Energy: 0.41191730562745377
Energy: 0.49794934661475587
Energy: 0.6353974389517644
Energy: 0.4232127218868307
Energy: 0.6463257168823847
Energy: 0.43519625909408993
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Energy: 0.6463257168873155
Energy: 0.4351962590947063
Energy: 0.42321272188803544
Energy: 0.6463257168857748
Energy: 0.43519625909994536
Energy: 0.42321272188772724
Energy: 0.4119271650108834
Energy: 0.41559419511337203
Energy: 0.4764932490889004
Energy: 0.5275535269714159
Energy: 0.5388965124768653
Energy: 0.47649324908982493
Energy: 0.4119271650047197
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Energy: 0.47649324909383134
Energy: 0.5275535269621704
Energy: 0.6143577487856015
Energy: 0.5960033634578862
Energy: 0.42862342544607246
Energy: 0.614357748781623
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Energy: 0.6457046405114937
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Energy: 0.6143158742228192
Energy: 0.4282019704115049
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Energy: 0.6143158742271337
Energy: 0.4118635535160357
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Energy: 0.44373933914345387
Energy: 0.4118635535169602
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Energy: 0.6195407829630306
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Energy: 0.43698006951084845
Energy: 0.47328095735913633
Energy: 0.4119264822964266
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Energy: 0.47328095735543807
Energy: 0.45066860063527725
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Energy: 0.6353291835662946
Energy: 0.6769255962562244
Energy: 0.6063742900971815
Energy: 0.635329183570301
Energy: 0.5275467473025421
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Energy: 0.6353291835696846
Energy: 0.676925596257149
Energy: 0.6063742900953324
Energy: 0.6353291835675274
Energy: 0.4364106955350625
Energy: 0.6062105969224443
Energy: 0.6336645910968861
Energy: 0.4364106955381444
Energy: 0.6062105969255261
Energy: 0.6336645910950371
Energy: 0.4364106955390689
Energy: 0.6062105969295045
Energy: 0.6336645910983991
Energy: 0.4364106955384526
Energy: 0.6353974389492989
Energy: 0.5284521493448785
Energy: 0.4979493466187622
Energy: 0.6353974389514562
Energy: 0.45063431078089017
Energy: 0.49794934661598855
Energy: 0.6353974389492989
Energy: 0.5284521493430293
Energy: 0.4979493466187622
Energy: 0.635397438954538
Energy: 0.4232127218892682
Energy: 0.6463257168808437
Energy: 0.4351962590953226
Energy: 0.42321272188865183
Energy: 0.6463257168876239
Energy: 0.43519625909254894
Energy: 0.4232127218883436
Energy: 0.6463257168830011
Energy: 0.435196259095939
Energy: 0.4232127218905009
Energy: 0.4896377226118797
Energy: 0.5074478305182495
Energy: 0.4764932490876676
Energy: 0.45042064919790337
Energy: 0.476645219816652
Energy: 0.476493249088284
Energy: 0.48963772261958427
Energy: 0.5074478305204068
Energy: 0.4764932490925986
Energy: 0.4504206491951298
Energy: 0.6143577487834441
Energy: 0.5960033634541879
Energy: 0.42862342544915427
Energy: 0.6143577487834441
Energy: 0.5960033634551125
Energy: 0.4286234254442233
Energy: 0.6143577487797739
Energy: 0.5960033634538798
Energy: 0.4286234254429906
Energy: 0.614357748781623

minimum gb energy = 0.4118635535160357 eV
minimum distance =  2.43922777380506 Angstroms
sigma value = 33


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

Energy: 0.8086712517765222
Energy: 0.8214540875673977
Energy: 0.8207413886221582
Energy: 0.7940215555714052
Energy: 0.8214540875673977
Energy: 0.8207413886221582
Energy: 0.8086712517748305
Energy: 0.8214540875640141
Energy: 0.8207413886204663
Energy: 0.7940215555714052
Energy: 0.8166935935355103
Energy: 0.7693760822320065
Energy: 0.7908942537713378
Energy: 0.8166935935321268
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Energy: 0.7908942537730297
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Energy: 0.7693760822336982
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Energy: 0.8166935935321268
Energy: 0.8539065190301331
Energy: 0.8146348629610609
Energy: 0.8470343753010557
Energy: 0.8539065190318251
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Energy: 0.8470343753010557
Energy: 0.8539065190301331
Energy: 0.8146348629576773
Energy: 0.8470343753044394
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Energy: 0.8609408731845575
Energy: 0.7701406273808412
Energy: 0.7800563008150668
Energy: 0.8609408731828655
Energy: 0.7701406273825331
Energy: 0.7800563008167586
Energy: 0.8609408731862492
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Energy: 0.7800563008150668
Energy: 0.8609408731845575
Energy: 0.8262079665914248
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Energy: 0.8058426913872924
Energy: 0.846151185870647
Energy: 0.826207966589733
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Energy: 0.8461511858672633
Energy: 0.826207966589733
Energy: 0.7855079958924683
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Energy: 0.7733689122739335
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Energy: 0.7733699552288658
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Energy: 0.8317493656083705
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Energy: 0.8217124362552714
Energy: 0.7834326396049532
Energy: 0.8199055437031282
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Energy: 0.7834469228321058
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Energy: 0.7834326396049532
Energy: 0.8199055437065117
Energy: 0.7694629664324284
Energy: 0.7993147731244123
Energy: 0.8804261525261287
Energy: 0.7694629664341204
Energy: 0.7854155266667816
Energy: 0.880316143392446
Energy: 0.769462966424
Energy: 0.7993147731261042
Energy: 0.8804261525244369
Energy: 0.769462966424
Energy: 0.813189372883808
Energy: 0.8497918815892946
Energy: 0.8535215255928832
Energy: 0.8131893728854998
Energy: 0.8497947246072396
Energy: 0.8535104217822123
Energy: 0.8131893728821161
Energy: 0.8497918815909865
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Energy: 0.813189372883808
Energy: 0.7697159178736854
Energy: 0.8283755574774901
Energy: 0.8177161590214668
Energy: 0.7697159178703019
Energy: 0.8283809367850143
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Energy: 0.7697159178753774
Energy: 0.8208556205246531
Energy: 0.8372147413009312
Energy: 0.839832926173443
Energy: 0.8208556205212695
Energy: 0.8373441979149817
Energy: 0.8398329261785187
Energy: 0.8208556205246531
Energy: 0.8372147413009312
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Energy: 0.8263653070340896
Energy: 0.7940778463617058
Energy: 0.769362128740517
Energy: 0.8263653070340896
Energy: 0.794077846370165
Energy: 0.7693621287354415
Energy: 0.8263653070290142
Energy: 0.7940778463667812
Energy: 0.7693621287388251
Energy: 0.8263653070323979
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Energy: 0.7953841789653028
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Energy: 0.828227034873565
Energy: 0.7953841789703782

minimum gb energy = 0.7691535611637201 eV
minimum distance =  2.10267209920675 Angstroms
sigma value = 219


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

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Energy: 1.089552390788571
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Energy: 1.0892974716696744
Energy: 1.026388229126545
Energy: 1.0321693849045845
Energy: 1.0892974716685548
Energy: 1.0263882291254252

minimum gb energy = 0.9692430904687868 eV
minimum distance =  2.26245380470164 Angstroms
sigma value = 15


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

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Energy: 1.0710460842534872
Energy: 1.1841637789831805
Energy: 1.135697965872337
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minimum gb energy = 1.0698990042458563 eV
minimum distance =  2.13203905462378 Angstroms
sigma value = 293


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

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Energy: 1.1325755994108446
Energy: 1.1277163370511434
Energy: 1.0482097976264475
Energy: 1.132575599412615
Energy: 1.1277163370536725
Energy: 1.0482097976261946
Energy: 1.1325755994116034
Energy: 1.1277163370508905
Energy: 1.0482097976261946
Energy: 1.132575599412362
Energy: 1.0997320510217616
Energy: 1.0784463310080161
Energy: 1.0578873844693328
Energy: 1.0997320510222675
Energy: 1.078446331008522
Energy: 1.0578873844693328
Energy: 1.0997320510220145
Energy: 1.0784463310080161
Energy: 1.0578873844695857
Energy: 1.0997320510220145
Energy: 1.1357495603350076
Energy: 1.1265533396378795
Energy: 1.0597200536653708
Energy: 1.1357495603370307
Energy: 1.1265533396373737
Energy: 1.0597200536656235
Energy: 1.1357495603350076
Energy: 1.1265533396378795
Energy: 1.0597200536656235
Energy: 1.1357495603367778
Energy: 1.0706618640575682
Energy: 1.1228988270400695
Energy: 1.122895227191206
Energy: 1.0706618640568093
Energy: 1.1228988270410811
Energy: 1.122895227191206
Energy: 1.0706618640568093
Energy: 1.1228988270400695
Energy: 1.1228952271894357
Energy: 1.0706618640563037
Energy: 1.135698368485505
Energy: 1.0594842823124506
Energy: 1.1265442385189353
Energy: 1.1356983684844935
Energy: 1.0594842823127035
Energy: 1.1265442385186821
Energy: 1.135698368485505
Energy: 1.0594842823124506
Energy: 1.1265442385181763
Energy: 1.1356983684849993
Energy: 1.0997423828738964
Energy: 1.0581907040269718
Energy: 1.0785068485070468
Energy: 1.099742382874655
Energy: 1.0581907040274776
Energy: 1.0785068485085643
Energy: 1.0997423828741493
Energy: 1.0581907040272247
Energy: 1.078506848506794
Energy: 1.099742382874655
Energy: 1.1327357357499974
Energy: 1.048646307057123
Energy: 1.127717783555622
Energy: 1.1327357357487329
Energy: 1.0486463070573762
Energy: 1.1277177835558747
Energy: 1.1327357357497445
Energy: 1.0486463070581347
Energy: 1.127717783555622
Energy: 1.13273573574848
Energy: 1.2606803469928738
Energy: 1.0480081729080852
Energy: 1.0820035424175605
Energy: 1.260680346992621
Energy: 1.0480081729073265
Energy: 1.082003542419078
Energy: 1.260680346993127
Energy: 1.0480081729075794
Energy: 1.0820035424168017
Energy: 1.2606803469921153
Energy: 1.0467348687193023
Energy: 1.180519260777703
Energy: 1.094406763861748
Energy: 1.0467348687190496
Energy: 1.1805192607769441
Energy: 1.0944067638607364
Energy: 1.0467348687195555
Energy: 1.18051926077745
Energy: 1.094406763861495
Energy: 1.0467348687185438
Energy: 1.058922823814603
Energy: 1.120800145923816
Energy: 1.1546841025852341
Energy: 1.05892282381435
Energy: 1.1208001459230572
Energy: 1.1546841025842225
Energy: 1.05892282381435
Energy: 1.1208001459245747
Energy: 1.1546841025854873
Energy: 1.0589228238148558
Energy: 1.199327039602555
Energy: 1.1265837651423498
Energy: 1.1265761418487144
Energy: 1.199327039602555
Energy: 1.1265837651433614
Energy: 1.126576141848967
Energy: 1.199327039602808
Energy: 1.1265837651426027
Energy: 1.126576141848967
Energy: 1.199327039602555
Energy: 1.0589167841322014
Energy: 1.1547403347143366
Energy: 1.1208297756859156
Energy: 1.0589167841316955
Energy: 1.1547403347143366
Energy: 1.1208297756859156
Energy: 1.0589167841322014
Energy: 1.1547403347143366
Energy: 1.1208297756861685
Energy: 1.0589167841319485
Energy: 1.0466900837156834
Energy: 1.0944474326950724
Energy: 1.1806063223128174
Energy: 1.046690083716189
Energy: 1.0944474326945666
Energy: 1.18060632231307
Energy: 1.0466900837159363
Energy: 1.094447432695325
Energy: 1.18060632231307
Energy: 1.0466900837164421
Energy: 1.2606399613067052
Energy: 1.0819569966773288
Energy: 1.0480191433573929
Energy: 1.2606399613082229
Energy: 1.081956996677076
Energy: 1.0480191433576458
Energy: 1.2606399613067052
Energy: 1.081956996677076
Energy: 1.0480191433573929
Energy: 1.2606399613082229
Energy: 1.132575599412362
Energy: 1.1277163370508905
Energy: 1.0482097976259417
Energy: 1.1325755994113504
Energy: 1.1277163370511434
Energy: 1.0482097976264475
Energy: 1.132575599412362
Energy: 1.127716337049373
Energy: 1.0482097976264475
Energy: 1.1325755994110975

minimum gb energy = 1.0466900837156834 eV
minimum distance =  2.31986072304888 Angstroms
sigma value = 293


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

Energy: 0.9509831276035036
Energy: 0.9475254397264932
Energy: 0.9475799882862669
Energy: 0.9509831276012181
Energy: 0.9475254397264932
Energy: 0.9475799882867242
Energy: 0.9509831276030466
Energy: 0.9475254397283215
Energy: 0.9475799882871812
Energy: 0.9509831276012181
Energy: 0.9471019113545751
Energy: 0.9483441560372714
Energy: 0.9473805079409678
Energy: 0.9471019113522895
Energy: 0.9483441560368143
Energy: 0.9473805079432535
Energy: 0.9471019113550323
Energy: 0.9483441560372714
Energy: 0.947380507941425
Energy: 0.9471019113527467
Energy: 0.9474313727697006
Energy: 0.9472419399908004
Energy: 1.0393428967522045
Energy: 0.9474313727729003
Energy: 0.9472419399898863
Energy: 1.0393428967517473
Energy: 0.9474313727701577
Energy: 0.9472419399885148
Energy: 1.0393428967522045
Energy: 0.9474313727710718
Energy: 1.0394009046136348
Energy: 0.9472544821414207
Energy: 0.9473697064497065
Energy: 1.0394009046136348
Energy: 0.9472544821414207
Energy: 0.9473697064506207
Energy: 1.0394009046136348
Energy: 0.9472544821418776
Energy: 0.9473697064501637
Energy: 1.0394009046118065
Energy: 0.9472572321438792
Energy: 0.9482153645642697
Energy: 0.94704434856999
Energy: 0.9472572321461646
Energy: 0.9482153645633555
Energy: 0.94704434856999
Energy: 0.9472572321438792
Energy: 0.9482153645647269
Energy: 0.9470443485690758
Energy: 0.9472572321461646
Energy: 0.9475254397520912
Energy: 0.9475799882853527
Energy: 0.9509831276035036
Energy: 0.9475254397484343
Energy: 0.9475799882862669
Energy: 0.950983127600761
Energy: 0.9475254397264932
Energy: 0.94757998828581
Energy: 0.9509831276030466
Energy: 0.9475254397534625
Energy: 0.9483441560372714
Energy: 0.9473805079423393
Energy: 0.9471019113550323
Energy: 0.9483441560372714
Energy: 0.9473805079409678
Energy: 0.9471019113532039
Energy: 0.9483441560368143
Energy: 0.9473805079437106
Energy: 0.9471019113545751
Energy: 0.9483441560377285
Energy: 0.9472419399898863
Energy: 1.0393428967522045
Energy: 0.9474313727697006
Energy: 0.9472419399889721
Energy: 1.0393428967522045
Energy: 0.9474313727697006
Energy: 0.9472419399898863
Energy: 1.0393428967517473
Energy: 0.9474313727687864
Energy: 0.9472419399889721
Energy: 0.9472544821414207
Energy: 0.9473697064510779
Energy: 1.039400904614092
Energy: 0.9472544821418776
Energy: 0.9473697064501637
Energy: 1.0394009046122632
Energy: 0.9472544821418776
Energy: 0.9473697064506207
Energy: 1.0394009046131776
Energy: 0.9472544821418776
Energy: 0.9482153645638127
Energy: 0.9470443485695329
Energy: 0.9472572321425079
Energy: 0.9482153645651838
Energy: 0.94704434856999
Energy: 0.9472572321447935
Energy: 0.9482153645633555
Energy: 0.9470443485686186
Energy: 0.9472572321425079
Energy: 0.9482153645647269
Energy: 0.94757998828581
Energy: 0.950983127600761
Energy: 0.9475254397525483
Energy: 0.9475799882835244
Energy: 0.9509831276035036
Energy: 0.9475254397520912
Energy: 0.9475799882862669
Energy: 0.9509831276016751
Energy: 0.9475254397552909
Energy: 0.9475799882848958
Energy: 0.947380507941425
Energy: 0.947101911353661
Energy: 0.9483441560372714
Energy: 0.9473805079437106
Energy: 0.9471019113559466
Energy: 0.9483441560377285
Energy: 0.947380507941425
Energy: 0.9471019113532039
Energy: 0.9483441560372714
Energy: 0.9473805079437106
Energy: 1.0393428967526614
Energy: 0.9474313727724433
Energy: 0.9472419399885148
Energy: 1.0393428967517473
Energy: 0.9474313727697006
Energy: 0.9472419399889721
Energy: 1.0393428967522045
Energy: 0.9474313727715291
Energy: 0.9472419399876006
Energy: 1.0393428967517473
Energy: 0.9473697064506207
Energy: 1.0394009046122632
Energy: 0.9472544821414207
Energy: 0.9473697064501637
Energy: 1.039400904614092
Energy: 0.9472544821409634
Energy: 0.9473697064492492
Energy: 1.0394009046118065
Energy: 0.9472544821414207
Energy: 0.9473697064510779
Energy: 0.9470443485695329
Energy: 0.9472572321457078
Energy: 0.9482153645642697
Energy: 0.9470443485690758
Energy: 0.9472572321425079
Energy: 0.9482153645642697
Energy: 0.9470443485695329
Energy: 0.9472572321452505
Energy: 0.9482153645633555
Energy: 0.9470443485704471
Energy: 0.9509831276039608
Energy: 0.9475254397520912
Energy: 0.9475799882867242
Energy: 0.9509831276012181
Energy: 0.9475254397525483
Energy: 0.9475799882844386
Energy: 0.9509831276030466
Energy: 0.9475254397520912
Energy: 0.9475799882871812
Energy: 0.950983127600761
Energy: 0.9471019113559466
Energy: 0.9483441560377285
Energy: 0.9473805079409678
Energy: 0.947101911353661
Energy: 0.9483441560372714
Energy: 0.9473805079437106
Energy: 0.9471019113559466
Energy: 0.9483441560377285
Energy: 0.947380507941882
Energy: 0.947101911353661
Energy: 0.9474313727683291
Energy: 0.9472419399903433
Energy: 1.0393428967522045
Energy: 0.9474313727701577
Energy: 0.9472419399898863
Energy: 1.0393428967517473
Energy: 0.9474313727683291
Energy: 0.9472419399889721
Energy: 1.0393428967526614
Energy: 0.9474313727706147
Energy: 1.039400904614549
Energy: 0.9472544821418776
Energy: 0.9473697064497065
Energy: 1.0394009046127206
Energy: 0.9472544821414207
Energy: 0.9473697064506207
Energy: 1.039400904614092
Energy: 0.9472544821423349
Energy: 0.9473697064501637
Energy: 1.0394009046136348
Energy: 0.9472572321429651
Energy: 0.9482153645642697
Energy: 0.9470443485695329
Energy: 0.9472572321447935
Energy: 0.9482153645647269
Energy: 0.9470443485695329
Energy: 0.9472572321425079
Energy: 0.9482153645647269
Energy: 0.94704434856999
Energy: 0.9472572321443363
Energy: 0.9475254397543766
Energy: 0.94757998828581
Energy: 0.9509831276039608
Energy: 0.9475254397493486
Energy: 0.94757998828581
Energy: 0.9509831276016751
Energy: 0.9475254397534625
Energy: 0.9475799882853527
Energy: 0.9509831276035036
Energy: 0.9475254397498056
Energy: 0.9483441560372714
Energy: 0.9473805079437106
Energy: 0.9471019113559466
Energy: 0.9483441560377285
Energy: 0.9473805079409678
Energy: 0.9471019113532039
Energy: 0.9483441560372714
Energy: 0.9473805079432535
Energy: 0.9471019113559466
Energy: 0.9483441560377285

minimum gb energy = 0.9470443485686186 eV
minimum distance =  2.36875216908513 Angstroms
sigma value = 15


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

Energy: 1.0922483113546084
Energy: 1.1359106244735515
Energy: 1.1072092134409766
Energy: 1.0733527280279005
Energy: 1.1359106244714794
Energy: 1.1072092134471927
Energy: 1.0922483113546084
Energy: 1.1359106244714794
Energy: 1.1072092134451206
Energy: 1.0733527280279005
Energy: 1.03579381532941
Energy: 1.02387496076745
Energy: 1.022961708507314
Energy: 1.035793815325266
Energy: 1.0238749607715942
Energy: 1.02296170851353
Energy: 1.0357938153190496
Energy: 1.0238749607715942
Energy: 1.022961708507314
Energy: 1.035793815325266
Energy: 1.1148690861117432
Energy: 1.0803201539086738
Energy: 1.2387788562896787
Energy: 1.1148690861158874
Energy: 1.0803201539024576
Energy: 1.2387788562876068
Energy: 1.1148690861138153
Energy: 1.0803201539024576
Energy: 1.2387788562917508
Energy: 1.1148690861158874
Energy: 1.025069833170646
Energy: 1.0801333984617678
Energy: 1.018737622618927
Energy: 1.0250698331768622
Energy: 1.0801333984534796
Energy: 1.0187376226272156
Energy: 1.02506983317479
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Energy: 1.0187376226168552
Energy: 1.02506983317479
Energy: 1.0888381577897004
Energy: 1.0219403721749163
Energy: 1.1286151090436358
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Energy: 1.0219403721749163
Energy: 1.1286151090394916
Energy: 1.088838157781412
Energy: 1.0219403721749163
Energy: 1.1286151090436358
Energy: 1.0888381577897004
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Energy: 1.0821743654735698
Energy: 1.0133412508398285
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Energy: 1.0821743654797862
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Energy: 1.0629353177194896
Energy: 1.0821743654756422
Energy: 1.0133412508398285
Energy: 1.0629353177215617
Energy: 1.0666850127836223
Energy: 1.0792989223192042
Energy: 1.0361532767371129
Energy: 1.0664703194795013
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Energy: 1.036153276739185
Energy: 1.0666850127877667
Energy: 1.0792989223192042
Energy: 1.0361532767371129
Energy: 1.066470319471213
Energy: 1.0237498643340959
Energy: 1.1579152657958216
Energy: 1.0998868261337331
Energy: 1.0237498643340959
Energy: 1.1579152657978937
Energy: 1.0998868261295887
Energy: 1.0237498643340959
Energy: 1.157915265804072
Energy: 1.0998868261337331
Energy: 1.0237498643320238
Energy: 1.3270529836032607
Energy: 1.0521191259624594
Energy: 1.05377583278995
Energy: 1.327052983607405
Energy: 1.052118022169506
Energy: 1.0537748547554342
Energy: 1.3270529836053329
Energy: 1.0521191259666034
Energy: 1.0537758327920221
Energy: 1.3270529836094769
Energy: 1.0252511020037105
Energy: 1.2803472522284942
Energy: 1.1035583479484907
Energy: 1.0252480742860097
Energy: 1.2803472522305663
Energy: 1.1037214102830515
Energy: 1.0252511020037105
Energy: 1.2803472522284942
Energy: 1.1035583479464188
Energy: 1.0252480742818655
Energy: 1.081567522005102
Energy: 1.0043653589816834
Energy: 1.086081826725796
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Energy: 1.0043653589796113
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Energy: 1.081567522005102
Energy: 1.0043653589796113
Energy: 1.086081826723724
Energy: 1.08156752201339
Energy: 1.0838577219087353
Energy: 1.01180180860054
Energy: 1.1786062133326076
Energy: 1.0838577219066632
Energy: 1.011802933910747
Energy: 1.1786062133284636
Energy: 1.083857721904591
Energy: 1.0118018086088285
Energy: 1.1786062133263913
Energy: 1.0838577219108074
Energy: 1.172666454860885
Energy: 1.0209276915832939
Energy: 1.1012355753122318
Energy: 1.1726664548650294
Energy: 1.0209276915832939
Energy: 1.1012355753184482
Energy: 1.1726664548671013
Energy: 1.0209276915832939
Energy: 1.101235575316376
Energy: 1.1726664548629573
Energy: 1.0114180149697471
Energy: 1.0115633919783094
Energy: 1.22502159182524
Energy: 1.011418014967675
Energy: 1.011563391972131
Energy: 1.2250215918293843
Energy: 1.011418014967675
Energy: 1.0115633919700586
Energy: 1.22502159182524
Energy: 1.0114180149718193
Energy: 1.1157608841265374
Energy: 1.1050253918976514
Energy: 1.0240392500769844
Energy: 1.115760884124465
Energy: 1.1050253919059394
Energy: 1.0240394145183835
Energy: 1.115760884124465
Energy: 1.1050253918997233
Energy: 1.024039250066624
Energy: 1.1157608841286095
Energy: 1.018881888879598
Energy: 1.0714766382970446
Energy: 1.131645617181831
Energy: 1.018881888875454
Energy: 1.0714766382991165
Energy: 1.1316456171797589
Energy: 1.0188818888775262
Energy: 1.0714766382991165
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Energy: 1.0188818888837423
Energy: 1.034618219546833
Energy: 1.1021333971727434
Energy: 1.1401554948915764
Energy: 1.0346182195530491
Energy: 1.1021333971706715
Energy: 1.1401554948936485
Energy: 1.0346182195509772
Energy: 1.1021333971748155
Energy: 1.1401554948874324
Energy: 1.0346182195551215
Energy: 1.093772132146642
Energy: 1.0240493313816237
Energy: 1.108963628254782
Energy: 1.0937721321549303
Energy: 1.0240493313857677
Energy: 1.108963628256854
Energy: 1.0937721321549303
Energy: 1.0240493313795516
Energy: 1.108963628254782
Energy: 1.093772132146642
Energy: 1.0191294127921162
Energy: 1.0687938154813983
Energy: 1.0613963793647085
Energy: 1.0191294127983326
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Energy: 1.0613963793647085
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Energy: 1.0191294127921162
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Energy: 1.0236572698623307
Energy: 1.0627991642519563
Energy: 1.1383863080428736
Energy: 1.0236572698644029
Energy: 1.0627991642457402
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Energy: 1.023657269866475
Energy: 1.062799164247812
Energy: 1.1383863080428736
Energy: 1.0663715220434735
Energy: 1.0220044265028057
Energy: 1.1504141715186256
Energy: 1.0663715220496897
Energy: 1.0220044265048778
Energy: 1.1504141715144816
Energy: 1.0663715220414016
Energy: 1.0220044265007333
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Energy: 1.0663715220434735
Energy: 1.118419096350314
Energy: 1.0745551461707188
Energy: 1.0132701587754689
Energy: 1.118419096348242
Energy: 1.074555146172791
Energy: 1.0132701587733968
Energy: 1.118419096348242
Energy: 1.0745551461748628
Energy: 1.0132701587837571
Energy: 1.11841909634617
Energy: 1.0670380916066986
Energy: 1.0673258371803358
Energy: 1.1675493647010298
Energy: 1.067037807665846
Energy: 1.0673250454689693
Energy: 1.1675493646989576
Energy: 1.0670380916149866
Energy: 1.0673258371844798
Energy: 1.1675493647031019
Energy: 1.0670378076617018
Energy: 1.0262854783792295
Energy: 1.067122172460807
Energy: 1.0051763994713747
Energy: 1.0262854783771573
Energy: 1.0671221724525186
Energy: 1.0051763994589424
Energy: 1.0262854783813016
Energy: 1.0671221724587352
Energy: 1.0051763994610146
Energy: 1.0262854783771573
Energy: 1.0624509345833075
Energy: 1.0531127770247255
Energy: 1.0810161683857193
Energy: 1.0624509345874518
Energy: 1.0531127770288693
Energy: 1.0810161683877915
Energy: 1.0624509345895239
Energy: 1.0531127770267976
Energy: 1.0810161683857193
Energy: 1.0624509345895239
Energy: 1.0254388173128481
Energy: 1.2030006851328967
Energy: 1.087155768360753
Energy: 1.0254574266576506
Energy: 1.2030006851328967
Energy: 1.087155768362825
Energy: 1.025438817308704
Energy: 1.203000685139113
Energy: 1.0871557683586808
Energy: 1.0254574266576506
Energy: 1.111228623529606
Energy: 1.0043303728354487
Energy: 1.0884210687962685
Energy: 1.1112286235254618
Energy: 1.0043303728375208
Energy: 1.0884210688024847
Energy: 1.1112286235213178
Energy: 1.004330372839593
Energy: 1.0884210688024847
Energy: 1.111228623527534
Energy: 1.1784029609862876
Energy: 1.0352956392072215
Energy: 1.1791779085750045
Energy: 1.1784029609800712
Energy: 1.0352956392072215
Energy: 1.1791779085770764
Energy: 1.1784029609862876
Energy: 1.0352956392030772
Energy: 1.1791779085791485
Energy: 1.178402960990394
Energy: 1.1236863594424622
Energy: 1.0126653637780973
Energy: 1.064832785672357
Energy: 1.115674998901084
Energy: 1.0126751849581985
Energy: 1.064832785676501
Energy: 1.1236863594403903
Energy: 1.012665363773953
Energy: 1.0648327856702848
Energy: 1.1156749988969399
Energy: 1.0358261508676043
Energy: 1.0119600995101132
Energy: 1.0860931644303025
Energy: 1.035826150875855
Energy: 1.0119600995121851
Energy: 1.0860931644344465
Energy: 1.035826150875855
Energy: 1.0119600995121851
Energy: 1.0860931644303025
Energy: 1.0358261508696764
Energy: 1.219332782031428
Energy: 1.1201278300848012
Energy: 1.0248767427058123
Energy: 1.2193327820231397
Energy: 1.120127830082729
Energy: 1.0248443605189985
Energy: 1.2193327820231397
Energy: 1.1201278300868736
Energy: 1.0248767427099188
Energy: 1.219332782031428
Energy: 1.0063187618431844
Energy: 1.036395789672794
Energy: 1.13901571690264
Energy: 1.006318761836968
Energy: 1.0363957896686498
Energy: 1.13901571690264
Energy: 1.006318761841112
Energy: 1.0363957896707219
Energy: 1.1390157169047121
Energy: 1.0063187618431844
Energy: 1.0869654638801776
Energy: 1.1271921549001576
Energy: 1.1127282059499743
Energy: 1.0692055836488972
Energy: 1.1271921548980854
Energy: 1.1127282059520467
Energy: 1.0869654638843218
Energy: 1.1271921549022295
Energy: 1.1127282059499743
Energy: 1.069205583650969
Energy: 1.0877588765495214
Energy: 1.0790232481525384
Energy: 1.1307248511585941
Energy: 1.0701488075760597
Energy: 1.0790232481587547
Energy: 1.1279698891499852
Energy: 1.0877588765515935
Energy: 1.0790232481566826
Energy: 1.1307248511585941
Energy: 1.0701488075739876
Energy: 1.0047439029681895
Energy: 1.1242890716481337
Energy: 1.0710035862998681
Energy: 1.0047439029661174
Energy: 1.1242890716564218
Energy: 1.071003586297796
Energy: 1.0047439029744056
Energy: 1.1242890716502059
Energy: 1.0710035862998681
Energy: 1.0047439029723337
Energy: 1.2658713304402383
Energy: 1.0257179818424613
Energy: 1.0593536544855882
Energy: 1.2658713304402383
Energy: 1.025717981838317
Energy: 1.0593536544876603
Energy: 1.2658713304381661
Energy: 1.025717981832101
Energy: 1.059353654481444
Energy: 1.265871330436094
Energy: 1.035432007228717
Energy: 1.136982705302135
Energy: 1.0106273621784405
Energy: 1.035432007228717
Energy: 1.136982705306279
Energy: 1.0107602189918792
Energy: 1.0354320072307892
Energy: 1.136982705302135
Energy: 1.0106273621825848
Energy: 1.035432007224573
Energy: 1.1975423852734248
Energy: 1.0922160583632015
Energy: 1.011926734245504
Energy: 1.1975423852713527
Energy: 1.0922160583569855
Energy: 1.011926734245504
Energy: 1.1975423852692806
Energy: 1.0922160583611296
Energy: 1.0119267342517202
Energy: 1.1975423852754967
Energy: 1.1337749497281233
Energy: 1.1347266415676818
Energy: 1.0362818561021632
Energy: 1.1337749497343395
Energy: 1.1347266415656097
Energy: 1.0362818560980191
Energy: 1.1337749497343395
Energy: 1.1347266415676818
Energy: 1.036281856095947
Energy: 1.1337749497260512
Energy: 1.249986986467505
Energy: 1.0984886045172828
Energy: 1.0062961907023307
Energy: 1.2499869864654332
Energy: 1.0984886045172828
Energy: 1.0062961907064747
Energy: 1.2499869864654332
Energy: 1.0984886045172828
Energy: 1.0062961907023307
Energy: 1.249986986467505
Energy: 1.023688777277229
Energy: 1.1335223465968314
Energy: 1.0822095261170959
Energy: 1.023688777279301
Energy: 1.1335223465989035
Energy: 1.0822095261212399
Energy: 1.0236887772751568
Energy: 1.1335223465926871
Energy: 1.0822095261212399
Energy: 1.0236887772834449
Energy: 1.1314713590851984
Energy: 1.0515751531751205
Energy: 1.052283581627086
Energy: 1.1314713590893426
Energy: 1.0515652747379423
Energy: 1.052334139612129
Energy: 1.1314713590872705
Energy: 1.0515751531812991
Energy: 1.052283581627086
Energy: 1.1314713590914147
Energy: 1.1504449511996508
Energy: 1.0046511086786811
Energy: 1.1027310079957497
Energy: 1.1504449511996508
Energy: 1.0046511086786811
Energy: 1.1027310080019659
Energy: 1.1504449511955068
Energy: 1.0046511086807532
Energy: 1.102731008004038
Energy: 1.1504449511996508
Energy: 1.0674727301458187
Energy: 1.2374308012363389
Energy: 1.0675411196907496
Energy: 1.0674727301437466
Energy: 1.2374308012363389
Energy: 1.0675411196866056
Energy: 1.0674727301437466
Energy: 1.2374308012342667
Energy: 1.0675411196907496
Energy: 1.0674727301458187
Energy: 1.1392776139559568
Energy: 1.0118655155522884
Energy: 1.2120026125312184
Energy: 1.139277613958029
Energy: 1.0118653901376644
Energy: 1.2120026125332903
Energy: 1.1392776139621732
Energy: 1.0118655155460723
Energy: 1.2120026125312184
Energy: 1.1392776139642453
Energy: 1.0359933625744433
Energy: 1.025931499779155
Energy: 1.1319649737063673
Energy: 1.0359933625765154
Energy: 1.0259314997729387
Energy: 1.1319649737105115
Energy: 1.0359933625765154
Energy: 1.025931499779155
Energy: 1.1319649737125836
Energy: 1.0359933625765154
Energy: 1.0319342060486778
Energy: 1.0503885190546955
Energy: 1.0235750900321352
Energy: 1.0319342060548942
Energy: 1.0503885190546955
Energy: 1.0235747072330095
Energy: 1.0319342060528218
Energy: 1.0503885190588396
Energy: 1.023575090027991
Energy: 1.0319342060548942
Energy: 1.0054925863957906
Energy: 1.088700178397289
Energy: 1.2073000586586713
Energy: 1.0054925863957906
Energy: 1.088700178401433
Energy: 1.2073000586565992
Energy: 1.0054925863978628
Energy: 1.088700178397289
Energy: 1.2073000586586713
Energy: 1.0054925863937185
Energy: 1.0362248442205326
Energy: 1.1274098191474695
Energy: 1.1345462195113334
Energy: 1.0362248442205326
Energy: 1.1274098191474695
Energy: 1.1345462195216938
Energy: 1.0362248442226047
Energy: 1.1274098191495416
Energy: 1.1345462195113334
Energy: 1.0362248442184983

minimum gb energy = 1.0043303728354487 eV
minimum distance =  2.20266346981083 Angstroms
sigma value = 437


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

Energy: 0.9625929280398988
Energy: 1.132539598468764
Energy: 1.1322081286784862
Energy: 0.9625929280406539
Energy: 1.132539598469519
Energy: 1.1322081286784862
Energy: 0.9625929280398988
Energy: 1.1325395984680093
Energy: 1.132208128679996
Energy: 0.9625929280406539
Energy: 1.113863871859725
Energy: 0.9530696440595327
Energy: 0.9551782448417206
Energy: 1.1138638718604799
Energy: 0.9530696440587778
Energy: 0.9551782448402107
Energy: 1.1138638718589702
Energy: 0.9530696440595327
Energy: 0.9551782448432304
Energy: 1.1138638718604799
Energy: 1.0835486771725915
Energy: 0.9465252285752469
Energy: 1.2097569006223197
Energy: 1.0835486771741012
Energy: 0.9465252285729823
Energy: 1.2097569006253392
Energy: 1.0835486771733465
Energy: 0.9465252285752469
Energy: 1.2097569006238296
Energy: 1.0835486771741012
Energy: 1.0532887119713965
Energy: 1.1761035286765875
Energy: 1.0482829423099629
Energy: 1.0532887119683767
Energy: 1.1761035286750776
Energy: 1.0482829423144577
Energy: 1.0532887119691317
Energy: 1.1761035286773425
Energy: 1.0482829423114726
Energy: 1.0532887119691317
Energy: 0.9999852236177434
Energy: 0.9690469130671702
Energy: 1.1502110722063448
Energy: 0.9999852236215178
Energy: 0.9690469130671702
Energy: 1.1502110722070997
Energy: 0.9999852236184984
Energy: 0.9690469130671702
Energy: 1.1502110722078545
Energy: 0.999985223620008
Energy: 1.0064127906042188
Energy: 1.1189082685876224
Energy: 0.9532408338761988
Energy: 1.0064127906027434
Energy: 1.1189082685868674
Energy: 0.9532408338769537
Energy: 1.0064127906042188
Energy: 1.1189082685883773
Energy: 0.953240833875444
Energy: 1.0064127906027434
Energy: 1.0226962308701066
Energy: 0.9881152559928018
Energy: 0.9465580581339706
Energy: 1.0226962308716163
Energy: 0.9881152559920471
Energy: 0.9465580581347256
Energy: 1.0226962308716163
Energy: 0.9881152559920471
Energy: 0.9465580581339706
Energy: 1.0226962308716163
Energy: 1.043899605988567
Energy: 1.1594944004541086
Energy: 1.0450016265660163
Energy: 1.043899605989322
Energy: 1.1594944004541086
Energy: 1.0450016265697908
Energy: 1.043899605988567
Energy: 1.1594944004548635
Energy: 1.045001626566771
Energy: 1.043899605989322
Energy: 1.1764550138121015
Energy: 0.969505315952608
Energy: 0.9686639763066557
Energy: 1.1764550138098366
Energy: 0.9695053159548727
Energy: 0.96866397631043
Energy: 1.1764550138113463
Energy: 0.969505315952608
Energy: 0.9686639763066557
Energy: 1.1764550138128562
Energy: 1.0504775310445469
Energy: 1.0722818694827763
Energy: 1.2262586453195976
Energy: 1.0504775310422825
Energy: 1.072281869485041
Energy: 1.226258645321107
Energy: 1.0504775310445469
Energy: 1.072281869483531
Energy: 1.2262586453203521
Energy: 1.0504775310422825
Energy: 1.0383820858006234
Energy: 1.0384812494689366
Energy: 1.0556108361623315
Energy: 1.038382085802133
Energy: 1.0384812494681817
Energy: 1.0184927996412028
Energy: 1.038382085802133
Energy: 1.0384812494696916
Energy: 1.018492799639693
Energy: 1.038382085802133
Energy: 1.0954381937384257
Energy: 0.956168484102326
Energy: 1.1147328769921383
Energy: 1.095438193737671
Energy: 0.9561684841038358
Energy: 1.1147328769898734
Energy: 1.0954381937399011
Energy: 0.956168484102326
Energy: 1.1147328769921383
Energy: 1.0954381937384257
Energy: 0.9690782863696346
Energy: 1.3015077986486598
Energy: 0.9686747991627502
Energy: 0.9690782863673698
Energy: 1.3015077986494148
Energy: 0.968674799165015
Energy: 0.9690782863696346
Energy: 1.3015077986494148
Energy: 0.9686747991627502
Energy: 0.9690782863673698
Energy: 0.9535486839391243
Energy: 0.9533416619924225
Energy: 1.0463266729311516
Energy: 0.9535486839413888
Energy: 0.9533416619931774
Energy: 1.0463266729311516
Energy: 0.9535486839391243
Energy: 0.9533416619924225
Energy: 1.0463266729288871
Energy: 0.9535486839421436

minimum gb energy = 0.9465252285729823 eV
minimum distance =  2.25135788422363 Angstroms
sigma value = 33