Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Ni__MO_700541006254_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=3.5213917642831802
cohesive_energy=4.45034997785486
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: 0.020522209050948533
Energy: 0.5198518181053144
Energy: 0.5198518181053144
Energy: 0.020522209050948533
Energy: 0.5198518181053144
Energy: 0.5198518181053144
Energy: 0.020522209050948533
Energy: 0.5198518181053144
Energy: 0.5198518181053144
Energy: 0.020522209050948533
Energy: 1.7913710731976624
Energy: 0.02396040503182071
Energy: 0.5171165252492367
Energy: 1.7913711502740435
Energy: 0.02396040503029733
Energy: 0.5171165252492367
Energy: 1.7913711065845492
Energy: 0.02396040503182071
Energy: 0.5171165252507602
Energy: 1.791371020740404
Energy: 2.1226178351473943
Energy: 0.3773987862924679
Energy: 0.5642351607171764
Energy: 2.1226178351489176
Energy: 0.3773987862924679
Energy: 0.5642351607171764
Energy: 2.1226178351489176
Energy: 0.3773987862924679
Energy: 0.5642351607171764
Energy: 2.1226178351473943
Energy: 1.7913710730423464
Energy: 0.5171165252492367
Energy: 0.02396040503182071
Energy: 1.7913711219471093
Energy: 0.5171165252492367
Energy: 0.02396040503029733
Energy: 1.7913711141935031
Energy: 0.5171165252492367
Energy: 0.02396040503182071
Energy: 1.7913711044831802
Energy: 0.020522209050948533
Energy: 0.5198518181053144
Energy: 0.5198518181053144
Energy: 0.020522209050948533
Energy: 0.5198518181053144
Energy: 0.5198518181053144
Energy: 0.020522209050948533
Energy: 0.5198518181053144
Energy: 0.5198518181053144
Energy: 0.020522209050948533
Energy: 1.7913710367455549
Energy: 0.02396040503182071
Energy: 0.5171165252477135
Energy: 1.791371077037939
Energy: 0.02396040503182071
Energy: 0.5171165252492367
Energy: 1.7913710427526366
Energy: 0.02396040503182071
Energy: 0.5171165252477135
Energy: 1.7913710866797095
Energy: 1.1516172141186691
Energy: 0.020993714806118963
Energy: 0.8713834162485143
Energy: 1.151617216095155
Energy: 0.020993714807642345
Energy: 0.8713834162485143
Energy: 1.151617214095853
Energy: 0.020993714807642345
Energy: 0.8713834162485143
Energy: 1.1516172177503459

minimum gb energy = 0.020522209050948533 eV
minimum distance =  2.28653242427512 Angstroms
sigma value = 3


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

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Energy: 1.548772873158116
Energy: 1.4686012913821451
Energy: 1.2902000812765377
Energy: 1.5487728731543846
Energy: 1.4686012913821451
Energy: 1.3324910067104394
Energy: 1.548772873158116
Energy: 1.4686012913821451
Energy: 1.2902000812765377
Energy: 1.547657021615792
Energy: 1.275072116892143
Energy: 1.4385518582559063
Energy: 1.5476570205863018
Energy: 1.275072116892143
Energy: 1.4385518582484431
Energy: 1.547657020646006
Energy: 1.275072116892143
Energy: 1.4385518582521746
Energy: 1.5476570172779434
Energy: 1.5176234650404208
Energy: 1.4816480426465148
Energy: 1.5320926691096317
Energy: 1.544154223766493
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Energy: 1.544154223766493
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Energy: 1.4691767374820983
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Energy: 1.2902381110947874
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Energy: 1.4691767374820983
Energy: 1.2336479711921677
Energy: 1.4341678361483332
Energy: 1.5346677848808505
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Energy: 1.3126434629662396
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Energy: 1.4712659798768226
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Energy: 1.4940975101038898
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Energy: 1.466811623125188
Energy: 1.290399003263507
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Energy: 1.2903990032672386
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Energy: 1.4463822534070034
Energy: 1.6624437219519341
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Energy: 1.2754219623043221
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Energy: 1.275304059766355
Energy: 1.4463822534143989
Energy: 1.4453098960930224
Energy: 1.4238902542715057
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Energy: 1.4363942117305741
Energy: 1.2687832692153966
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Energy: 1.470783054264685
Energy: 1.5598865690238566
Energy: 1.299010727446418
Energy: 1.3034453877477157
Energy: 1.559886569020125
Energy: 1.2990107274501497
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Energy: 1.5598865690238566
Energy: 1.299010727446418
Energy: 1.3034453877477157
Energy: 1.559886569020125
Energy: 1.231265161599333
Energy: 1.5337839657426369
Energy: 1.434359550365067
Energy: 1.2312651615956018
Energy: 1.5337839657426369
Energy: 1.434359550365067
Energy: 1.231265161599333
Energy: 1.5337839657389052
Energy: 1.434359550365067
Energy: 1.231265161599333
Energy: 1.4778200092168075
Energy: 1.2902224077806577
Energy: 1.4778070686178226
Energy: 1.4778200092168075
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Energy: 1.4778070686140912
Energy: 1.4778200092168075
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Energy: 1.4778070686140912
Energy: 1.4778200092130758
Energy: 1.3061376140335548
Energy: 1.5116515540253666
Energy: 1.4283998987767303
Energy: 1.3061376140335548
Energy: 1.5116515540290978
Energy: 1.4283998987767303
Energy: 1.3061376140335548
Energy: 1.5116515540290978
Energy: 1.428399898780462
Energy: 1.3061376140335548
Energy: 1.448270240642858
Energy: 1.4346177614097748
Energy: 1.2763117160639277
Energy: 1.4482702406391266
Energy: 1.4346177614061113
Energy: 1.2762955017745796
Energy: 1.448270240642858
Energy: 1.4346177614097748
Energy: 1.2763117160639277
Energy: 1.4482702406391266
Energy: 1.290200081272806
Energy: 1.548772873158116
Energy: 1.4686012913858766
Energy: 1.3324910067067077
Energy: 1.5487728731543846
Energy: 1.4686012913821451
Energy: 1.2902000812765377
Energy: 1.548772873158116
Energy: 1.4686012913858766
Energy: 1.3324910067104394
Energy: 1.5476570220372496
Energy: 1.275072116892143
Energy: 1.4385518582521746
Energy: 1.5476570195419534
Energy: 1.275072116892143
Energy: 1.4385518582521746
Energy: 1.5476570191578114
Energy: 1.275072116892143
Energy: 1.4385518582559063
Energy: 1.5476570202953797
Energy: 1.544154223766493
Energy: 1.4816480426502465
Energy: 1.5320926691059005
Energy: 1.5176234650404208
Energy: 1.4816480426502465
Energy: 1.5320926691096317
Energy: 1.544154223766493
Energy: 1.4816480426502465
Energy: 1.5320926691096317
Energy: 1.5176234650404208
Energy: 1.46917673748583
Energy: 1.4233809669154396
Energy: 1.2902381110947874
Energy: 1.4691767374820983
Energy: 1.423380966911708
Energy: 1.2902381110947874
Energy: 1.4691767374820983
Energy: 1.4233809669154396
Energy: 1.2902381110947874
Energy: 1.4691767374820983

minimum gb energy = 1.2312651615956018 eV
minimum distance =  2.20502698401926 Angstroms
sigma value = 75


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

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Energy: 1.2587895923007972
Energy: 1.264976653480326
Energy: 1.3978731779900664
Energy: 1.2587895922989762
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minimum gb energy = 1.2564561375467524 eV
minimum distance =  2.19090220039808 Angstroms
sigma value = 105


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

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Energy: 1.4875677896161419
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Energy: 1.4792542366657555
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Energy: 1.4792542366637011
Energy: 1.4104570434815091
Energy: 1.4516664726860495
Energy: 1.4792542366657555
Energy: 1.410457043479455
Energy: 1.4340612953659602
Energy: 1.457511347991784
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Energy: 1.4340612953680143
Energy: 1.4575277587745958
Energy: 1.4556271764155588
Energy: 1.4340612953700684
Energy: 1.457511347991784
Energy: 1.4556271764155588
Energy: 1.4340612953700684
Energy: 1.6389213689024131
Energy: 1.4589628632232174
Energy: 1.5259021525816323
Energy: 1.638921368900359
Energy: 1.4592006358253709
Energy: 1.5259021525836867
Energy: 1.638921368900359
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Energy: 1.5259021525836867
Energy: 1.638921368900359
Energy: 1.4775527342043526
Energy: 1.4379947862432776
Energy: 1.3788058591817662
Energy: 1.477552734206407
Energy: 1.4379947862392066
Energy: 1.3788058591817662
Energy: 1.4775527342043526
Energy: 1.4379947862412235
Energy: 1.3788058591797496
Energy: 1.4775527342043526
Energy: 1.485369497060076
Energy: 1.5387996116131037
Energy: 1.442296317966467
Energy: 1.485369497060076
Energy: 1.5387961710401015
Energy: 1.442296317966467
Energy: 1.4853694970580216
Energy: 1.5387996116131037
Energy: 1.4422963179644126
Energy: 1.485369497060076
Energy: 1.5348316903493353
Energy: 1.4806892716552476
Energy: 1.504893039836947
Energy: 1.5348316903493353
Energy: 1.4806660562704042
Energy: 1.5048930398348928
Energy: 1.5348316903513892
Energy: 1.4806892716531936
Energy: 1.5048930398348928
Energy: 1.5348316903493353
Energy: 1.4868623625723967
Energy: 1.3947755219158184
Energy: 1.551844805337336
Energy: 1.4868623625723967
Energy: 1.3949325140383795
Energy: 1.5518448053414067
Energy: 1.4868623625703425
Energy: 1.3947755219178726
Energy: 1.551844805337336
Energy: 1.4868623625703425

minimum gb energy = 1.3754115409241088 eV
minimum distance =  2.18555963675198 Angstroms
sigma value = 165


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

Energy: 1.2996566618124687
Energy: 1.424162195709491
Energy: 1.4244092934403758
Energy: 1.2996566618124687
Energy: 1.4241621957080806
Energy: 1.4244092934368497
Energy: 1.2996566618117635
Energy: 1.4241621957087858
Energy: 1.4244092934375552
Energy: 1.2996566618124687
Energy: 1.4249950842143257
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Energy: 1.3582346924542323
Energy: 1.374695622939994
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Energy: 1.4608473580926118
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Energy: 1.5347768884766793
Energy: 1.3664523022463415
Energy: 1.7551749674925752
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Energy: 1.5347768884766793
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Energy: 1.3410111704445478
Energy: 1.3408197679279414
Energy: 1.3639059570620329
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Energy: 1.3639059570606225
Energy: 1.3410111704438425
Energy: 1.3408197679279414
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Energy: 1.3410111704459582
Energy: 1.4591405564876279
Energy: 1.3140659589328814
Energy: 1.462869837130125
Energy: 1.4591405564855122
Energy: 1.3140659589321761
Energy: 1.462869837125894
Energy: 1.4591405564855122
Energy: 1.3140659589328814
Energy: 1.462869837125894
Energy: 1.4591405564862177
Energy: 1.3583656295674442
Energy: 1.2595374565465294
Energy: 1.3748688721405582
Energy: 1.3583656295674442
Energy: 1.2595374565465294
Energy: 1.3748688721426738
Energy: 1.3583656295674442
Energy: 1.2595374565465294
Energy: 1.3748688721412636
Energy: 1.3583656295674442
Energy: 1.4250409825542956
Energy: 1.4557983315544822
Energy: 1.5794713905222975
Energy: 1.4250409825521801
Energy: 1.4557983315551872
Energy: 1.5794713905230024
Energy: 1.4250409825528854
Energy: 1.4557983315565977
Energy: 1.5794713905230024
Energy: 1.4250409825514747
Energy: 1.2996566618124687
Energy: 1.4241621957073756
Energy: 1.4244092934396706
Energy: 1.2996566618124687
Energy: 1.4241621957073756
Energy: 1.4244092934396706
Energy: 1.2996566618124687
Energy: 1.4241621957080806
Energy: 1.4244092934382602
Energy: 1.2996566618124687

minimum gb energy = 1.2595374565465294 eV
minimum distance =  2.28161972069873 Angstroms
sigma value = 41


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

Energy: 1.2890815682089596
Energy: 1.3732995530054424
Energy: 1.3879486001130246
Energy: 1.251219485740819
Energy: 1.3732995530054424
Energy: 1.3879486001102885
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Energy: 1.422148850478563
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Energy: 1.3623768239714034
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Energy: 1.2514028410381561
Energy: 1.3623768239167318
Energy: 1.2079739042114737
Energy: 1.25140284103542
Energy: 1.3623768239139957
Energy: 1.2079739042087374
Energy: 1.230318735397909
Energy: 1.3060159985758275
Energy: 1.2585893503489942
Energy: 1.230318735397909
Energy: 1.3060159985758275
Energy: 1.2728896653709485
Energy: 1.2303187354006448
Energy: 1.3060159985758275
Energy: 1.2585893503489942
Energy: 1.2303187354006448
Energy: 1.278194316432732
Energy: 1.300321903238412
Energy: 1.1301678165612359
Energy: 1.2781943164299958
Energy: 1.3003218916590336
Energy: 1.1304510787120425
Energy: 1.2781943164354683
Energy: 1.300321909039095
Energy: 1.1301678165639721
Energy: 1.278194316438204
Energy: 1.1588796828531618
Energy: 1.5656701814539187
Energy: 1.1863073738140506
Energy: 1.1588796828558976
Energy: 1.5656701812898037
Energy: 1.1863073738167866
Energy: 1.1588796828531618
Energy: 1.5656701808713829
Energy: 1.1863073738113146
Energy: 1.1588796828531618
Energy: 1.183532992284335
Energy: 1.1606199413723852
Energy: 1.1545287070462897
Energy: 1.1835329922870712
Energy: 1.1606199413751215
Energy: 1.1545287070435537
Energy: 1.1835329922898075
Energy: 1.1606199413778575
Energy: 1.1545287070435537
Energy: 1.183532992284335
Energy: 1.2462308145147454
Energy: 1.3236057420635683
Energy: 1.2240119422130453
Energy: 1.2462308145147454
Energy: 1.3236057420608323
Energy: 1.2240119422185176
Energy: 1.2462308145147454
Energy: 1.3236057420635683
Energy: 1.2240119422185176
Energy: 1.2462308145120093
Energy: 1.35659746851417
Energy: 1.2812742293217394
Energy: 1.2683537957487192
Energy: 1.3565974685169062
Energy: 1.2812742293217394
Energy: 1.2683537957514552
Energy: 1.3565974685169062
Energy: 1.2812742293190034
Energy: 1.2683537957487192
Energy: 1.3565974685114341
Energy: 1.3744235443205113
Energy: 1.3863801124112465
Energy: 1.2521833331111671
Energy: 1.3744235443205113
Energy: 1.3863801124085104
Energy: 1.2521833331111671
Energy: 1.3744235443232475
Energy: 1.3863801124085104
Energy: 1.2521833331139034
Energy: 1.3744235443232475
Energy: 1.2679069699470848
Energy: 1.3680646155606184
Energy: 1.2510013282628274
Energy: 1.2679069699470848
Energy: 1.3683628739561329
Energy: 1.2510013282682997
Energy: 1.2679069699416126
Energy: 1.3680646155606184
Energy: 1.2510013282655634
Energy: 1.2679069699443488
Energy: 1.1401957283405468
Energy: 1.1521951455453545
Energy: 1.150112260609732
Energy: 1.1401957283405468
Energy: 1.1522460204042133
Energy: 1.1503829151502667
Energy: 1.1401957283405468
Energy: 1.1521951455535626
Energy: 1.150112260609732
Energy: 1.1401957283405468
Energy: 1.2768362610208206
Energy: 1.1569216744734763
Energy: 1.1520935761242934
Energy: 1.2768362610071402
Energy: 1.1568954685681518
Energy: 1.1520935761215572
Energy: 1.2768362610153485
Energy: 1.1569216744734763
Energy: 1.1520935761242934
Energy: 1.2768362610098762
Energy: 1.5663296947332015
Energy: 1.201826866203932
Energy: 1.3421427479570331
Energy: 1.5663296947332015
Energy: 1.2018229982219857
Energy: 1.3421427479570331
Energy: 1.5663296947332015
Energy: 1.201826866203932
Energy: 1.3421427479570331
Energy: 1.5663296947304652
Energy: 1.2662336180198739
Energy: 1.2561314941820634
Energy: 1.1328755173614826
Energy: 1.2662336191958399
Energy: 1.2561314941820634
Energy: 1.1328755173587466
Energy: 1.2662336184246143
Energy: 1.2561314941847994
Energy: 1.1328755173587466
Energy: 1.2662336176041395

minimum gb energy = 1.1288532106240499 eV
minimum distance =  2.19131187031343 Angstroms
sigma value = 185


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

Energy: 0.6943966926011481
Energy: 0.5626661843062832
Energy: 0.56273022416991
Energy: 0.39322901505931473
Energy: 0.5626661843056335
Energy: 0.5627302241709139
Energy: 0.6943966926015024
Energy: 0.5626661843049839
Energy: 0.5627302241722131
Energy: 0.39322901505960994
Energy: 0.6531895980028762
Energy: 0.5943294266735658
Energy: 0.9245106918907487
Energy: 0.625893537748941
Energy: 0.594329426671617
Energy: 0.9243184358848398
Energy: 0.6531895980045297
Energy: 0.5943294266713218
Energy: 0.9245106918926974
Energy: 0.6258935377476418
Energy: 0.4795908808275345
Energy: 0.5945600480393881
Energy: 0.480256934371792
Energy: 0.4796579888509205
Energy: 0.5945600480393881
Energy: 0.4803512401527826
Energy: 0.47959088082948326
Energy: 0.5945600480403921
Energy: 0.4802569343711424
Energy: 0.47965798885156996
Energy: 0.717347999150495
Energy: 0.5629640950253547
Energy: 0.6308133625772638
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Energy: 0.5629640950273035
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Energy: 0.5629640950279531
Energy: 0.6308133625779132
Energy: 0.7173479991517941
Energy: 0.5627285098390781
Energy: 1.2692018307147683
Energy: 0.4364552534035385
Energy: 0.5627285098420306
Energy: 1.2692018307125243
Energy: 0.47970929964739994
Energy: 0.5627285098426802
Energy: 1.269201830714473
Energy: 0.4364552534038338
Energy: 0.5627285098407315
Energy: 0.7879939036623484
Energy: 0.9726929118649704
Energy: 0.6257082888103873
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Energy: 0.6257082888116864
Energy: 0.7879939036626437
Energy: 0.9726929118653249
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Energy: 0.7879939036639428
Energy: 0.5628720806575718
Energy: 0.6386400547184706
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Energy: 0.5628720806562725
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Energy: 0.787770020688079
Energy: 0.4796343393820332
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Energy: 0.787770020687075
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Energy: 0.7877700206857758
Energy: 0.4796343393790807
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Energy: 0.787770020687075
Energy: 0.656126788823665
Energy: 0.5860018801216768
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Energy: 0.5620581506323539
Energy: 0.6189250705657371
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Energy: 0.5860018801200824
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Energy: 0.5620581506284565
Energy: 0.47966326336019277
Energy: 0.4804632679817644
Energy: 0.5948465857973471
Energy: 0.47965565308570357
Energy: 0.4804810931241165
Energy: 0.5948465857957527
Energy: 0.4796632633611376
Energy: 0.4804632679817644
Energy: 0.5948465857953983
Energy: 0.4796556530853492
Energy: 0.6514227860466157
Energy: 0.7386919870639529
Energy: 0.5943328379253182
Energy: 0.6259294302815751
Energy: 0.7386919870626538
Energy: 0.5943328379249639
Energy: 0.651422786046911
Energy: 0.7386919870623586
Energy: 0.5943328379240191
Energy: 0.6259294302822247
Energy: 0.6513630092087319
Energy: 0.5626661843056335
Energy: 0.5627302241705596
Energy: 0.39322901505960994
Energy: 0.5626661843062832
Energy: 0.5627302241705596
Energy: 0.6513630092103263
Energy: 0.5626661843046297
Energy: 0.5627302241715635
Energy: 0.39322901505931473
Energy: 0.6531895980019314
Energy: 0.5943294266732706
Energy: 0.9136805957070653
Energy: 0.625893537748941
Energy: 0.5943294266722666
Energy: 0.9243184358841902
Energy: 0.6531895980045297
Energy: 0.5943294266732706
Energy: 0.9136805957096635
Energy: 0.6258935377466378
Energy: 0.47959088082782975
Energy: 0.5945600480400378
Energy: 0.4803433997728885
Energy: 0.4796469136243118
Energy: 0.5945600480397425
Energy: 0.4803512401505387
Energy: 0.4795908808284794
Energy: 0.5945600480397425
Energy: 0.48034339977188456
Energy: 0.4796469136236622
Energy: 0.7173479991507902
Energy: 0.5629640950263587
Energy: 0.6308133625769093
Energy: 0.7173479991520892
Energy: 0.5629640950266539
Energy: 0.6308133625795077
Energy: 0.717347999148192
Energy: 0.5629640950263587
Energy: 0.6308133625772638
Energy: 0.7173479991507902
Energy: 0.5627285098407315
Energy: 1.269201830714473
Energy: 0.4364552534038338
Energy: 0.5627285098423259
Energy: 1.2692018307134691
Energy: 0.4797092996477543
Energy: 0.5627285098423259
Energy: 1.269201830715418
Energy: 0.43645525340418806
Energy: 0.5627285098416763
Energy: 0.7879939036623484
Energy: 0.9726929118666239
Energy: 0.6257082888107417
Energy: 0.7879939036623484
Energy: 0.8723451954548372
Energy: 0.6257082888129856
Energy: 0.7879939036626437
Energy: 0.9726929118640258
Energy: 0.6257082888126904
Energy: 0.7879939036623484
Energy: 0.5628720806569221
Energy: 0.6386400547197697
Energy: 0.7382769008673836
Energy: 0.562872080655623
Energy: 0.5727757034210031
Energy: 0.7382769008673836
Energy: 0.5628720806553277
Energy: 0.638640054720065
Energy: 0.738276900865435
Energy: 0.5628720806585755
Energy: 0.787770020688079
Energy: 0.47963433938167893
Energy: 0.5627684886140706
Energy: 0.787770020687075
Energy: 0.4364580024444999
Energy: 0.5627684886131258
Energy: 0.7877700206864254
Energy: 0.47963433938037975
Energy: 0.5627684886140706
Energy: 0.7877700206867798
Energy: 0.6561267888230154
Energy: 0.5860018801216768
Energy: 0.5629411984342867
Energy: 0.5621341668797675
Energy: 0.6188097139662317
Energy: 0.5629411984375344
Energy: 0.6561267888223659
Energy: 0.586001880120732
Energy: 0.5629411984352904
Energy: 0.5621341668830154
Energy: 0.47966326335954323
Energy: 0.4804632679811148
Energy: 0.5948465857977013
Energy: 0.47957565631923227
Energy: 0.48037069862056764
Energy: 0.5948465857957527
Energy: 0.47966326336048803
Energy: 0.48046326798211875
Energy: 0.5948465857957527
Energy: 0.47957565631793303
Energy: 0.651422786046911
Energy: 0.7386919870652521
Energy: 0.5943328379236649
Energy: 0.6259294302809256
Energy: 0.7386919870633034
Energy: 0.5943328379253182
Energy: 0.6514227860482101
Energy: 0.7386919870633034
Energy: 0.5943328379240191
Energy: 0.6259294302822247
Energy: 0.6943966926011481
Energy: 0.5626661843056335
Energy: 0.5627302241692604
Energy: 0.39322901505960994
Energy: 0.5626661843056335
Energy: 0.56273022416991
Energy: 0.694396692602152
Energy: 0.5626661843043345
Energy: 0.5627302241709139
Energy: 0.39322901505960994
Energy: 0.653189598002581
Energy: 0.5943294266739201
Energy: 0.9245106918913983
Energy: 0.6258935377498857
Energy: 0.5943294266722666
Energy: 0.9243184358844855
Energy: 0.6531895980038801
Energy: 0.594329426672621
Energy: 0.9245106918926974
Energy: 0.6258935377472874
Energy: 0.47959088082782975
Energy: 0.5945600480403921
Energy: 0.48025693437244166
Energy: 0.4796579888505661
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Energy: 0.4803512401511882
Energy: 0.47959088082948326
Energy: 0.5945600480400378
Energy: 0.4802569343720873
Energy: 0.4796579888518653
Energy: 0.7173479991501406
Energy: 0.5629640950257092
Energy: 0.6308133625779132
Energy: 0.7173479991511446
Energy: 0.5629640950266539
Energy: 0.6308133625795077
Energy: 0.7173479991485462
Energy: 0.5629640950276579
Energy: 0.6308133625762598
Energy: 0.7173479991520892
Energy: 0.5627285098397276
Energy: 1.269201830714473
Energy: 0.436455253401885
Energy: 0.5627285098420306
Energy: 1.26920183071217
Energy: 0.4797092996477543
Energy: 0.5627285098439793
Energy: 1.2692018307141189
Energy: 0.4364552534048376
Energy: 0.5627285098410267
Energy: 0.7879939036619942
Energy: 0.9726929118601282
Energy: 0.6257082888107417
Energy: 0.7879939036619942
Energy: 0.8723451954545418
Energy: 0.6257082888126904
Energy: 0.7879939036632932
Energy: 0.9726929118610731
Energy: 0.625708288812336
Energy: 0.787993903662998
Energy: 0.5628720806575718
Energy: 0.638640054720065
Energy: 0.7382769008660846
Energy: 0.562872080655623
Energy: 0.5727757034212985
Energy: 0.7382769008664389
Energy: 0.5628720806569221
Energy: 0.6386400547191202
Energy: 0.738276900866734
Energy: 0.56287208066017
Energy: 0.7877700206883742
Energy: 0.47963433938167893
Energy: 0.562768488613421
Energy: 0.787770020687075
Energy: 0.43645132632803024
Energy: 0.562768488613421
Energy: 0.7877700206874294
Energy: 0.47963433937973027
Energy: 0.5627684886131258
Energy: 0.7877700206887286
Energy: 0.656126788823665
Energy: 0.5860018801220311
Energy: 0.5629411984352904
Energy: 0.5620581506323539
Energy: 0.6189250705670364
Energy: 0.562941198438184
Energy: 0.6561267888220117
Energy: 0.5860018801194328
Energy: 0.5629411984352904
Energy: 0.562058150627807
Energy: 0.47966326335918885
Energy: 0.4804632679811148
Energy: 0.5948465857977013
Energy: 0.4796556530850539
Energy: 0.48048109312346704
Energy: 0.5948465857973471
Energy: 0.4796632633608423
Energy: 0.4804632679830636
Energy: 0.5948465857977013
Energy: 0.4796556530850539
Energy: 0.6514227860466157
Energy: 0.7386919870646025
Energy: 0.5943328379249639
Energy: 0.6259294302822247
Energy: 0.7386919870630082
Energy: 0.5943328379253182
Energy: 0.6514227860495093
Energy: 0.7386919870639529
Energy: 0.5943328379236649
Energy: 0.6259294302818704

minimum gb energy = 0.39322901505931473 eV
minimum distance =  2.33912714993219 Angstroms
sigma value = 33


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

Energy: 1.126612974740138
Energy: 1.1782596369393183
Energy: 1.1786219076079945
Energy: 1.085795006691717
Energy: 1.1782596369393183
Energy: 1.1786219076079945
Energy: 1.1266129747419211
Energy: 1.1782596369393183
Energy: 1.1786219076062114
Energy: 1.085795006691717
Energy: 1.2786321169563033
Energy: 1.0252578710762104
Energy: 1.1326612324083198
Energy: 1.2786321169563033
Energy: 1.0252578710726443
Energy: 1.1326612324065368
Energy: 1.2786321169563033
Energy: 1.0252578710744273
Energy: 1.1326612324047538
Energy: 1.2786321169580863
Energy: 1.140741099306853
Energy: 1.0852466044611058
Energy: 1.158984353548451
Energy: 1.140741099310419
Energy: 1.0852466044593228
Energy: 1.158984353548451
Energy: 1.140741099310419
Energy: 1.0852466044593228
Energy: 1.158984353550234
Energy: 1.140741099308636
Energy: 1.3274516902149156
Energy: 1.0273632619203434
Energy: 1.2981466212942305
Energy: 1.3274516902149156
Energy: 1.0273632619167778
Energy: 1.2981466212960135
Energy: 1.3274516902131326
Energy: 1.0273632619149948
Energy: 1.2981466212960135
Energy: 1.3274516902149156
Energy: 1.2704647180788065
Energy: 1.1288980882209068
Energy: 1.0615354099014507
Energy: 1.2704647180805895
Energy: 1.1288980882226898
Energy: 1.0615354099032337
Energy: 1.2704647180788065
Energy: 1.1288980882244728
Energy: 1.0615354099032337
Energy: 1.2704647180788065
Energy: 1.1555146688404072
Energy: 1.1946645710817156
Energy: 1.2293355149452854
Energy: 1.1555146688404072
Energy: 1.1946645710834987
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Energy: 1.1946645710817156
Energy: 1.2293355149452854
Energy: 1.15551466884219
Energy: 1.016824407791514
Energy: 1.1461635878838623
Energy: 1.1938697436772112
Energy: 1.0168370336796437
Energy: 1.1461635878838623
Energy: 1.1938697436736452
Energy: 1.016824407789731
Energy: 1.1461635878838623
Energy: 1.1938697436754282
Energy: 1.0168370336778607
Energy: 1.1544122377493178
Energy: 1.0790773533524065
Energy: 1.1735022828827453
Energy: 1.1544122377742796
Energy: 1.0790773533559723
Energy: 1.1735022828827453
Energy: 1.1544122379685275
Energy: 1.0790773533506235
Energy: 1.1735022828845283
Energy: 1.1544122377921093
Energy: 1.154681792858419
Energy: 1.025718366167135
Energy: 1.1607175469271533
Energy: 1.154681792858419
Energy: 1.025718366165352
Energy: 1.1607175469289364
Energy: 1.1546817928566684
Energy: 1.025718366163569
Energy: 1.1607175469253703
Energy: 1.1546817928566684
Energy: 1.1578511653759382
Energy: 1.0263097177899432
Energy: 1.3039785540334703
Energy: 1.1578511653759382
Energy: 1.0263097177899432
Energy: 1.3039785540334703
Energy: 1.157851165374155
Energy: 1.0263097177917262
Energy: 1.3039785540334703
Energy: 1.157851165372372
Energy: 1.1630789715654262
Energy: 1.161825953423177
Energy: 1.062683052425857
Energy: 1.1630789715672092
Energy: 1.161825953421394
Energy: 1.0626796451118183
Energy: 1.1630789715689922
Energy: 1.161825953423177
Energy: 1.062683052424074
Energy: 1.1630789715654262
Energy: 1.0250266381597244
Energy: 1.1556191237147757
Energy: 1.2741775726899456
Energy: 1.0250266381597244
Energy: 1.1506595130619204
Energy: 1.2317451332549947
Energy: 1.0250266381597244
Energy: 1.1556191237147757
Energy: 1.2741775726881626
Energy: 1.0250266381615074
Energy: 1.046192922237493
Energy: 1.1017858284248003
Energy: 1.1021354209799523
Energy: 1.04619292223571
Energy: 1.1014009189219536
Energy: 1.1020240351370902
Energy: 1.04619292223571
Energy: 1.1017858284158852
Energy: 1.1021354209781693
Energy: 1.046192922237493
Energy: 1.0255161733786176
Energy: 1.308253104793632
Energy: 1.1101036362371006
Energy: 1.0255161733786176
Energy: 1.2984985939243334
Energy: 1.1101036362353176
Energy: 1.0255161733768345
Energy: 1.308253104795415
Energy: 1.1101036362353176
Energy: 1.0255161733768345
Energy: 1.17982760455612
Energy: 1.1017497432850232
Energy: 1.3488724255438564
Energy: 1.179827604557903
Energy: 1.0812418154505377
Energy: 1.3488724255456395
Energy: 1.179827604557903
Energy: 1.1017497432850232
Energy: 1.3488724255420736
Energy: 1.179827604559686
Energy: 1.1658878590286461
Energy: 1.2852685076723132
Energy: 1.0253877094671917
Energy: 1.1658878590304291
Energy: 1.2852685076758794
Energy: 1.0253877094689747
Energy: 1.1658878590286461
Energy: 1.2852685076740964
Energy: 1.0253877094689747
Energy: 1.1658878590286461
Energy: 1.199066722803519
Energy: 1.2053283401277917
Energy: 1.087072967325239
Energy: 1.199066722801736
Energy: 1.2053283401277917
Energy: 1.087072967328805
Energy: 1.199066722803519
Energy: 1.2053283401277917
Energy: 1.087072967325239
Energy: 1.199066722805302
Energy: 1.1788800671746364
Energy: 1.2104368927121123
Energy: 1.034970702782454
Energy: 1.1788800671692874
Energy: 1.2104368927138953
Energy: 1.034970702780671
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Energy: 1.2444900510737322
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Energy: 1.2904799372783888
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Energy: 1.1681803888523208
Energy: 1.266584259061419
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Energy: 1.1681803888505378
Energy: 1.2904799372783888
Energy: 1.3504642324004135
Energy: 1.1681803888523208
Energy: 1.1813665419051227
Energy: 1.2279150876695804
Energy: 1.1312135100496532
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Energy: 1.2279150876677978
Energy: 1.1312135100496532
Energy: 1.1813665419033397
Energy: 1.2279150876695804
Energy: 1.1312135100514362
Energy: 1.1813665419015567
Energy: 1.2014481498445313
Energy: 1.254687613591119
Energy: 1.1416703695214612
Energy: 1.2014481498427483
Energy: 1.254687613592902
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Energy: 1.2014481498463143
Energy: 1.254687613594685
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Energy: 1.2014481498445313
Energy: 1.0608694580940707
Energy: 1.1765984522659314
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Energy: 1.0608694580940707
Energy: 1.1765984522659314
Energy: 1.1577139370393772
Energy: 1.0608694580940707

minimum gb energy = 0.9822034296508785 eV
minimum distance =  2.20010815275389 Angstroms
sigma value = 219


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

Energy: 1.2272404237556493
Energy: 1.487854170512802
Energy: 1.4878123005007349
Energy: 1.2272404237556493
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Energy: 1.3534734265347539
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Energy: 1.6427893414604917
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Energy: 1.2252976772882158
Energy: 1.305843005856887
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Energy: 1.3044133794664543
Energy: 1.2252976772870359
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Energy: 1.3044133794664543
Energy: 1.2252976772893958
Energy: 1.2252059498066485
Energy: 1.4800263355932624
Energy: 1.4875680347478004
Energy: 1.2252059498066485
Energy: 1.4800263355932624
Energy: 1.4875680347466205
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Energy: 1.4800263355932624
Energy: 1.4875680347466205
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Energy: 1.5146174345924646
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Energy: 1.389991461146861
Energy: 1.4593906334245261
Energy: 1.5146174345936445
Energy: 1.389991461145681
Energy: 1.4593906334245261
Energy: 1.5146174345924646

minimum gb energy = 1.2085761388390053 eV
minimum distance =  2.24569672855746 Angstroms
sigma value = 15


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

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Energy: 1.3896201891005933
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Energy: 1.5570447178274585
Energy: 1.3899885454995886
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Energy: 1.3899885455018044
Energy: 1.679166265357874
Energy: 1.5570447178274585
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minimum gb energy = 1.3826894036461674 eV
minimum distance =  2.18768360605528 Angstroms
sigma value = 293


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

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Energy: 1.4018342918856075
Energy: 1.370881219151271
Energy: 1.4792318129995146
Energy: 1.4851772245952994
Energy: 1.4501110578263559
Energy: 1.4792318129995146
Energy: 1.4851772245952994
Energy: 1.4501110578236904
Energy: 1.479231812996849
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Energy: 1.4501110578263559
Energy: 1.479231812996849
Energy: 1.4713985044872058
Energy: 1.6933081304696411
Energy: 1.6933836514547325
Energy: 1.4713985044872058
Energy: 1.6933081304696411
Energy: 1.6933836514520673
Energy: 1.4713985044872058
Energy: 1.6933081304696411
Energy: 1.6933836514547325
Energy: 1.4713985044872058
Energy: 1.4791469657933791
Energy: 1.4499442197826917
Energy: 1.4852747364215164
Energy: 1.4791469657907137
Energy: 1.4499442197826917
Energy: 1.4852747364161856
Energy: 1.4791469657933791
Energy: 1.4499442197826917
Energy: 1.4852747364268473
Energy: 1.4791469657933791
Energy: 1.3707003520531014
Energy: 1.4018692619974134
Energy: 1.3711828905483077
Energy: 1.3707003520531014
Energy: 1.4018692619974134
Energy: 1.3711828905483077
Energy: 1.3707003520531014
Energy: 1.4018692619974134
Energy: 1.3711828905509729
Energy: 1.3707003520531014
Energy: 1.4716350142186367
Energy: 1.4015216892015547
Energy: 1.67333372330963
Energy: 1.4716350142186367
Energy: 1.4015216892015547
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Energy: 1.4716350142186367
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Energy: 1.5643830602213458
Energy: 1.405005240889002
Energy: 1.444870862301366
Energy: 1.5643830602240112
Energy: 1.405005240889002
Energy: 1.444870862301366
Energy: 1.5643830602240112
Energy: 1.405005240889002
Energy: 1.444870862301366
Energy: 1.5643830602240112
Energy: 1.6510098455404967
Energy: 1.518517288757978
Energy: 1.4470849798007084
Energy: 1.6510098455404967
Energy: 1.518517288757978
Energy: 1.4470849798007084
Energy: 1.6510098455404967
Energy: 1.518517288757978
Energy: 1.4470849798007084
Energy: 1.6510098455404967
Energy: 1.4503905666304575
Energy: 1.5236636909691275
Energy: 1.463081009698179
Energy: 1.4503905666304575
Energy: 1.5236636909691275
Energy: 1.463081009698179
Energy: 1.4503905666304575
Energy: 1.5236636909691275
Energy: 1.463081009698179
Energy: 1.4503905666304575
Energy: 1.5093203538266668
Energy: 1.374999679885532
Energy: 1.3742890162010715
Energy: 1.5093203538266668
Energy: 1.374999679885532
Energy: 1.374289016198406
Energy: 1.5093203538266668
Energy: 1.374999679885532
Energy: 1.374289016198406
Energy: 1.5093203538266668
Energy: 1.4503354647493678
Energy: 1.4624968999620602
Energy: 1.5236659860823565
Energy: 1.4503354647493678
Energy: 1.4624968999646772
Energy: 1.5236659860823565
Energy: 1.4503354647493678
Energy: 1.4624968999620602
Energy: 1.5236659860823565
Energy: 1.4503354647493678
Energy: 1.6509173911158264
Energy: 1.4473746847479856
Energy: 1.5185557918287476
Energy: 1.6509173911158264
Energy: 1.4473746847453202
Energy: 1.5185557918287476
Energy: 1.6509173911158264
Energy: 1.4473746847453202
Energy: 1.5185557918287476
Energy: 1.6509173911158264
Energy: 1.564802480449115
Energy: 1.679763024897214
Energy: 1.4049696173251691
Energy: 1.564802480449115
Energy: 1.679763024897214
Energy: 1.4049696173251691
Energy: 1.564802480449115
Energy: 1.679763024897214
Energy: 1.4049696173251691
Energy: 1.564802480449115
Energy: 1.4716406299235467
Energy: 1.6733491053318645
Energy: 1.4014477293554148
Energy: 1.4716406299235467
Energy: 1.6733491053318645
Energy: 1.4014477293554148
Energy: 1.4716406299235467
Energy: 1.6733491053318645
Energy: 1.4014477293527492
Energy: 1.4716406299235467

minimum gb energy = 1.3707003520531014 eV
minimum distance =  2.19323392654062 Angstroms
sigma value = 293


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

Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.2683307094803786
Energy: 1.2671333746049676
Energy: 1.2680752297331246
Energy: 1.268330709479897
Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.2683307094808605
Energy: 1.2671333746049676
Energy: 1.2652346160648824
Energy: 1.2675753402691878
Energy: 1.2679702220592728
Energy: 1.265234616063919
Energy: 1.267575340268706
Energy: 1.2679702220583093
Energy: 1.2652346160648824
Energy: 1.267575340268706
Energy: 1.2679702220587912
Energy: 1.2652346160644006
Energy: 1.2648805841488286
Energy: 1.2644438280205208
Energy: 1.4900953249420614
Energy: 1.2648805841483468
Energy: 1.2644438280205208
Energy: 1.490095324941098
Energy: 1.264880584147865
Energy: 1.2644438280210024
Energy: 1.490095324941098
Energy: 1.2648805841493103
Energy: 1.4900836432616242
Energy: 1.2644512018867664
Energy: 1.2648707484051644
Energy: 1.4900836432616242
Energy: 1.2644512018882115
Energy: 1.264870748405646
Energy: 1.4900836432601792
Energy: 1.2644512018867664
Energy: 1.2648707484051644
Energy: 1.4900836432625877
Energy: 1.2678289970541032
Energy: 1.2677462364680991
Energy: 1.2651273317620035
Energy: 1.2678289970541032
Energy: 1.2677462364676175
Energy: 1.2651273317620035
Energy: 1.267828997054585
Energy: 1.2677462364680991
Energy: 1.265127331762967
Energy: 1.2678289970541032
Energy: 1.2680752297336064
Energy: 1.268330709479897
Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.2683307094808605
Energy: 1.2671333746049676
Energy: 1.2680752297331246
Energy: 1.268330709479897
Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.2675753402682244
Energy: 1.2679702220583093
Energy: 1.2652346160648824
Energy: 1.2675753402691878
Energy: 1.2679702220592728
Energy: 1.2652346160644006
Energy: 1.2675753402691878
Energy: 1.2679702220587912
Energy: 1.2652346160648824
Energy: 1.2675753402691878
Energy: 1.2644438280210024
Energy: 1.4900953249420614
Energy: 1.2648805841483468
Energy: 1.2644438280205208
Energy: 1.4900953249425433
Energy: 1.2648805841483468
Energy: 1.2644438280205208
Energy: 1.4900953249435067
Energy: 1.2648805841488286
Energy: 1.2644438280205208
Energy: 1.2644512018877299
Energy: 1.264870748405646
Energy: 1.4900836432611424
Energy: 1.264451201887248
Energy: 1.264870748405646
Energy: 1.4900836432611424
Energy: 1.2644512018877299
Energy: 1.264870748405646
Energy: 1.4900836432621059
Energy: 1.264451201887248
Energy: 1.2677462364680991
Energy: 1.2651273317615217
Energy: 1.267828997054585
Energy: 1.2677462364676175
Energy: 1.2651273317624852
Energy: 1.2678289970541032
Energy: 1.2677462364680991
Energy: 1.2651273317620035
Energy: 1.2678289970541032
Energy: 1.2677462364676175
Energy: 1.2683307094808605
Energy: 1.2671333746049676
Energy: 1.2680752297336064
Energy: 1.2683307094794152
Energy: 1.267133374604004
Energy: 1.2680752297336064
Energy: 1.2683307094808605
Energy: 1.2671333746049676
Energy: 1.2680752297331246
Energy: 1.268330709479897
Energy: 1.2679702220583093
Energy: 1.2652346160648824
Energy: 1.267575340268706
Energy: 1.2679702220592728
Energy: 1.2652346160648824
Energy: 1.2675753402691878
Energy: 1.2679702220583093
Energy: 1.2652346160644006
Energy: 1.267575340268706
Energy: 1.2679702220587912
Energy: 1.4900953249430249
Energy: 1.2648805841493103
Energy: 1.2644438280210024
Energy: 1.490095324944952
Energy: 1.2648805841493103
Energy: 1.2644438280210024
Energy: 1.4900953249435067
Energy: 1.2648805841493103
Energy: 1.2644438280205208
Energy: 1.4900953249439886
Energy: 1.2648707484046826
Energy: 1.4900836432621059
Energy: 1.2644512018882115
Energy: 1.264870748405646
Energy: 1.4900836432616242
Energy: 1.2644512018867664
Energy: 1.264870748405646
Energy: 1.4900836432606608
Energy: 1.2644512018877299
Energy: 1.2648707484051644
Energy: 1.2651273317620035
Energy: 1.2678289970541032
Energy: 1.2677462364676175
Energy: 1.2651273317620035
Energy: 1.267828997054585
Energy: 1.2677462364680991
Energy: 1.2651273317624852
Energy: 1.2678289970541032
Energy: 1.2677462364676175
Energy: 1.2651273317615217
Energy: 1.267133374604004
Energy: 1.2680752297326428
Energy: 1.2683307094808605
Energy: 1.2671333746049676
Energy: 1.2680752297331246
Energy: 1.2683307094794152
Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.2683307094808605
Energy: 1.2671333746049676
Energy: 1.2652346160653642
Energy: 1.2675753402696694
Energy: 1.2679702220587912
Energy: 1.2652346160658459
Energy: 1.2675753402682244
Energy: 1.2679702220578277
Energy: 1.2652346160653642
Energy: 1.2675753402691878
Energy: 1.2679702220587912
Energy: 1.2652346160653642
Energy: 1.2648805841502737
Energy: 1.264443828020039
Energy: 1.4900953249430249
Energy: 1.2648805841493103
Energy: 1.2644438280205208
Energy: 1.4900953249444702
Energy: 1.2648805841493103
Energy: 1.264443828020039
Energy: 1.4900953249430249
Energy: 1.2648805841493103
Energy: 1.4900836432611424
Energy: 1.2644512018867664
Energy: 1.2648707484046826
Energy: 1.4900836432606608
Energy: 1.2644512018877299
Energy: 1.2648707484051644
Energy: 1.4900836432611424
Energy: 1.264451201887248
Energy: 1.2648707484046826
Energy: 1.4900836432611424
Energy: 1.267828997054585
Energy: 1.2677462364676175
Energy: 1.2651273317624852
Energy: 1.2678289970550667
Energy: 1.2677462364671357
Energy: 1.2651273317624852
Energy: 1.2678289970541032
Energy: 1.2677462364676175
Energy: 1.265127331762967
Energy: 1.2678289970541032
Energy: 1.2680752297331246
Energy: 1.268330709479897
Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.2683307094808605
Energy: 1.2671333746044857
Energy: 1.2680752297331246
Energy: 1.268330709479897
Energy: 1.267133374604004
Energy: 1.2680752297331246
Energy: 1.267575340268706
Energy: 1.2679702220587912
Energy: 1.2652346160653642
Energy: 1.2675753402691878
Energy: 1.2679702220587912
Energy: 1.2652346160653642
Energy: 1.267575340268706
Energy: 1.2679702220583093
Energy: 1.2652346160653642
Energy: 1.2675753402691878

minimum gb energy = 1.264443828020039 eV
minimum distance =  2.27395583808764 Angstroms
sigma value = 15


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

Energy: 1.4067831352789666
Energy: 1.5113220922178179
Energy: 1.4175747964761631
Energy: 1.391002244044448
Energy: 1.511322092169816
Energy: 1.4175747964717955
Energy: 1.4067831352745994
Energy: 1.5113220921829182
Energy: 1.4175747964761631
Energy: 1.391002244044448
Energy: 1.501183178804749
Energy: 1.4334975309935374
Energy: 1.570359988141412
Energy: 1.5011831788069327
Energy: 1.433497530997905
Energy: 1.570359988141412
Energy: 1.501183178804749
Energy: 1.4334975309957214
Energy: 1.570359988141412
Energy: 1.501183178804749
Energy: 1.4440298507253824
Energy: 1.3902104208525823
Energy: 1.7961544587985672
Energy: 1.4440298507253824
Energy: 1.3902104208525823
Energy: 1.7961544588007508
Energy: 1.4440298507253824
Energy: 1.390210420854766
Energy: 1.7961544588007508
Energy: 1.4440298507231988
Energy: 1.3766187201479143
Energy: 1.3904989751826975
Energy: 1.3735875873793268
Energy: 1.3766187201479143
Energy: 1.39049897517833
Energy: 1.3735875873771433
Energy: 1.3766187201479143
Energy: 1.3904989751826975
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Energy: 1.376618720143547
Energy: 1.524742862356726
Energy: 1.407825448884937
Energy: 1.4945826891011407
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Energy: 1.407825448887121
Energy: 1.494582689098957
Energy: 1.524742862354542
Energy: 1.4078254488827535
Energy: 1.4945826891033245
Energy: 1.5247428623501749
Energy: 1.4536407016565576
Energy: 1.4660161581537519
Energy: 1.369008211094696
Energy: 1.4536407016587412
Energy: 1.4660161581515683
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Energy: 1.4536407016609252
Energy: 1.3899421840844883
Energy: 1.4835959669359384
Energy: 1.4979297887303593
Energy: 1.390463961916084
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Energy: 1.497929788725992
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Energy: 1.390463961916084
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Energy: 1.5904730454095934
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Energy: 1.5985955320470566
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Energy: 1.4112022828098216
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Energy: 1.39233128402408
Energy: 1.3898763549699245
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Energy: 1.389876354972108
Energy: 1.594670971715062
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Energy: 1.3898763549699245
Energy: 1.5946709717128784
Energy: 1.407555621822436
Energy: 1.6439755291253075
Energy: 1.4743550238127108
Energy: 1.407559821116503
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Energy: 1.4075598211143192
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Energy: 1.4195488149641344
Energy: 1.4826099641063568
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Energy: 1.4195488149663182
Energy: 1.4826099641085404
Energy: 1.4178109679707986
Energy: 1.4720135535592638
Energy: 1.3707995132852282
Energy: 1.4955195875330167
Energy: 1.4720135535570802
Energy: 1.3707982782012043
Energy: 1.4955195875352003
Energy: 1.4720135535570802
Energy: 1.3707995132852282
Energy: 1.4955195875330167
Energy: 1.4720135535570802
Energy: 1.6606486871380521
Energy: 1.3737040119574606
Energy: 1.5056970843119035
Energy: 1.660648687140236
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Energy: 1.6606486871380521
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Energy: 1.5056970843140873
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Energy: 1.371684350919386
Energy: 1.3728793468282854
Energy: 1.6619251362806713
Energy: 1.37168435092157
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Energy: 1.6619251362806713
Energy: 1.37168435092157
Energy: 1.481253306075639
Energy: 1.7080340242776224
Energy: 1.388164877963287
Energy: 1.4812533060778226
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Energy: 1.3881648779654707
Energy: 1.481253306075639
Energy: 1.3931905173436654
Energy: 1.5698138599333933
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Energy: 1.3931905173436654
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Energy: 1.5057085064936804
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Energy: 1.3926209205945441
Energy: 1.426760099577769
Energy: 1.5901619306823056
Energy: 1.3926209205945441
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Energy: 1.5901619306844892
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Energy: 1.3926209205945441
Energy: 1.6046119257328821
Energy: 1.435498736235513
Energy: 1.5878700114034876
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Energy: 1.5878700114034876
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Energy: 1.3957651366715873
Energy: 1.4975514200630293
Energy: 1.5174938904879716
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Energy: 1.4832032777880302
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Energy: 1.413287383628711
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Energy: 1.3692762515434291
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Energy: 1.3920901194950934
Energy: 1.3908592091430105
Energy: 1.3917584766226785
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Energy: 1.3910701966065935
Energy: 1.3918147955613094
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Energy: 1.3917584766226785
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Energy: 1.3910701966109609
Energy: 1.3747447036486975
Energy: 1.488763169736008
Energy: 1.3952535871855383
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Energy: 1.3747447036486975
Energy: 1.488763169736008
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Energy: 1.3747447036465135
Energy: 1.5303947893312317
Energy: 1.408043934689746
Energy: 1.4069108174912726
Energy: 1.5303947893334158
Energy: 1.4080439346853786
Energy: 1.406910817489089
Energy: 1.5303947893312317
Energy: 1.4080439346853786
Energy: 1.406910817489089
Energy: 1.5303947893290482
Energy: 1.4077671295818726
Energy: 1.5686589064972958
Energy: 1.4726840140420419
Energy: 1.4077734440204106
Energy: 1.5686589064994796
Energy: 1.4726840140398583
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Energy: 1.5686589064994796
Energy: 1.4726840140398583
Energy: 1.4077734440204106
Energy: 1.4636825970104212
Energy: 1.4174387378578104
Energy: 1.4811114726861059
Energy: 1.4636825970082374
Energy: 1.4174387378556266
Energy: 1.4811114726861059
Energy: 1.4636825970104212
Energy: 1.417438737853443
Energy: 1.4811114726839223
Energy: 1.4636825970082374
Energy: 1.496229123240938
Energy: 1.5619457609546807
Energy: 1.4981803173865704
Energy: 1.4962291232431215
Energy: 1.561945760952497
Energy: 1.4981803173865704
Energy: 1.4962291232431215
Energy: 1.5619457609546807
Energy: 1.498180317388754
Energy: 1.496229123240938
Energy: 1.8105566994542635
Energy: 1.370488640610777
Energy: 1.5554484878484596
Energy: 1.8134755871458257
Energy: 1.3705037334177383
Energy: 1.5554484878440922
Energy: 1.810556699456447
Energy: 1.3704886406129608
Energy: 1.5554484878462758
Energy: 1.8134755871458257
Energy: 1.5761806643107579
Energy: 1.3726185269534112
Energy: 1.5039958037265144
Energy: 1.5761806643151253
Energy: 1.3726185269534112
Energy: 1.5039958037243308
Energy: 1.5761806643173093
Energy: 1.3726185269534112
Energy: 1.5039958037265144
Energy: 1.5761806643129417
Energy: 1.6564873256669943
Energy: 1.734253959482806
Energy: 1.3862832690611788
Energy: 1.6564873256669943
Energy: 1.7342539425055135
Energy: 1.3863118561987986
Energy: 1.6564873256648107
Energy: 1.7342538975542798
Energy: 1.3862832690633626
Energy: 1.656487325660483
Energy: 1.3984732131429616
Energy: 1.6261212406239134
Energy: 1.4920159503353194
Energy: 1.398473213140778
Energy: 1.6261212406239134
Energy: 1.492015950330952
Energy: 1.3984732131429616
Energy: 1.6261212406239134
Energy: 1.4920159503331358
Energy: 1.3984732131451056
Energy: 1.4062867883577583
Energy: 1.4791444662035311
Energy: 1.4401131746740548
Energy: 1.3904816848085744
Energy: 1.4791444662057152
Energy: 1.4401131746740548
Energy: 1.4062867883555747
Energy: 1.4791444662035311
Energy: 1.4401131746740548
Energy: 1.3904816848042068
Energy: 1.4071437696812437
Energy: 1.5395440956994146
Energy: 1.4858377744553763
Energy: 1.3917646815246454
Energy: 1.5395440957015982
Energy: 1.4744051012746644
Energy: 1.4071437696812437
Energy: 1.539544095703782
Energy: 1.4858377744575604
Energy: 1.3917646815311568
Energy: 1.3950630398138537
Energy: 1.6135969668635521
Energy: 1.5425190307182168
Energy: 1.3950630398094863
Energy: 1.613596966865736
Energy: 1.5425190307160332
Energy: 1.3950630398116701
Energy: 1.6135969668679198
Energy: 1.5425190307182168
Energy: 1.3950630398116701
Energy: 1.6656230762723676
Energy: 1.3868763918685725
Energy: 1.5423656752903303
Energy: 1.6656230762701836
Energy: 1.386876391866389
Energy: 1.5423656681418818
Energy: 1.6656230762723676
Energy: 1.3868763918642049
Energy: 1.542365665826006
Energy: 1.6656230762723676
Energy: 1.5750546791894646
Energy: 1.4894189431856752
Energy: 1.3729885751176323
Energy: 1.5750546791894646
Energy: 1.4894189431922262
Energy: 1.3722882433346202
Energy: 1.5750546791916484
Energy: 1.4894189431900426
Energy: 1.3729885751198159
Energy: 1.5750546791894646
Energy: 1.72563532847606
Energy: 1.5857104777493147
Energy: 1.3706773187512555
Energy: 1.7256353284695087
Energy: 1.5857104777449473
Energy: 1.3706773187512555
Energy: 1.7256353284716923
Energy: 1.5857104777471311
Energy: 1.3706773187512555
Energy: 1.7256353284716923
Energy: 1.483489714632468
Energy: 1.4805986234774131
Energy: 1.5446265597699866
Energy: 1.4834897146346515
Energy: 1.4805986234774131
Energy: 1.5446265597699866
Energy: 1.4834897146368353
Energy: 1.4805986234774131
Energy: 1.5446265597743143
Energy: 1.4834897146346515
Energy: 1.7261058667536735
Energy: 1.5910242561985264
Energy: 1.4233294634152505
Energy: 1.726105866758041
Energy: 1.5910242562028936
Energy: 1.423329463417434
Energy: 1.7261058667558573
Energy: 1.5910242562050774
Energy: 1.423329463417434
Energy: 1.7261058667558573
Energy: 1.4094157114502341
Energy: 1.4081868215827809
Energy: 1.4198943943421845
Energy: 1.4094157114524177
Energy: 1.4081868215827809
Energy: 1.4198943943421845
Energy: 1.4094157114524177
Energy: 1.4081868215849649
Energy: 1.4198943943421845
Energy: 1.4094157114502341
Energy: 1.50147547993755
Energy: 1.3920190083763004
Energy: 1.391408906249991
Energy: 1.5014754799397336
Energy: 1.3920190083763004
Energy: 1.391408906249991
Energy: 1.50147547993755
Energy: 1.3920190083763004
Energy: 1.391408906252175
Energy: 1.50147547993755
Energy: 1.7384481974151493
Energy: 1.3983730045864131
Energy: 1.6298377137573719
Energy: 1.738448197417333
Energy: 1.398373004588597
Energy: 1.6298377137551878
Energy: 1.7384481974151493
Energy: 1.3983730045864131
Energy: 1.6298377137530042
Energy: 1.738448197417333
Energy: 1.3920002445931343
Energy: 1.5686153051032647
Energy: 1.390954802634136
Energy: 1.3920002445931343
Energy: 1.5686153051054486
Energy: 1.3909548026406475
Energy: 1.3920002445909505
Energy: 1.5686153051032647
Energy: 1.3909548026385035
Energy: 1.3920002445909505
Energy: 1.4206610266308073
Energy: 1.3705401030628739
Energy: 1.640482836417208
Energy: 1.4206610266308073
Energy: 1.3705404551682305
Energy: 1.6404828364150241
Energy: 1.4206610266329511
Energy: 1.3705401030606903
Energy: 1.640482836421575
Energy: 1.4206610266308073
Energy: 1.5628639187445201
Energy: 1.3809295035566063
Energy: 1.5007043548208057
Energy: 1.5628639187445201
Energy: 1.3809295035587899
Energy: 1.5007043548186219
Energy: 1.5628639187379691
Energy: 1.3809295035566063
Energy: 1.5007043548186219
Energy: 1.5628639187423365
Energy: 1.5481016237861447
Energy: 1.483112168157911
Energy: 1.3883191337247545
Energy: 1.548101623783961
Energy: 1.4831121681557273
Energy: 1.3883194385826951
Energy: 1.548101623783961
Energy: 1.483112168157911
Energy: 1.3883191337269383
Energy: 1.5481016237861447
Energy: 1.3965758156703343
Energy: 1.4976522256969047
Energy: 1.4826352903773834
Energy: 1.3965758156659667
Energy: 1.4976522256947211
Energy: 1.4825296453210588
Energy: 1.3965758156681505
Energy: 1.4976522256990883
Energy: 1.482337388481083
Energy: 1.3965758156681505
Energy: 1.3913535766961223
Energy: 1.478372907043799
Energy: 1.536375983335522
Energy: 1.391353576698306
Energy: 1.4783729070416152
Energy: 1.5363759833333384
Energy: 1.391353576698306
Energy: 1.478372907043799
Energy: 1.5363759833333384
Energy: 1.3913535766961223

minimum gb energy = 1.369008211094696 eV
minimum distance =  2.20904472950526 Angstroms
sigma value = 437


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

Energy: 1.4035789815228847
Energy: 1.4015488574434003
Energy: 1.4013588429159782
Energy: 1.4035789815220892
Energy: 1.4015488574426047
Energy: 1.4013588429167736
Energy: 1.4035789815236805
Energy: 1.4015488574394226
Energy: 1.4013588429159782
Energy: 1.4035789815212936
Energy: 1.699707188786353
Energy: 1.375005912807049
Energy: 1.5929836127575148
Energy: 1.6997071887871487
Energy: 1.375005912805458
Energy: 1.592983612759106
Energy: 1.699707188786353
Energy: 1.3750059128062533
Energy: 1.5929836127575148
Energy: 1.6997071887855577
Energy: 1.555777363015281
Energy: 1.3597756277144086
Energy: 1.7069036505019173
Energy: 1.5557773630168719
Energy: 1.3597756277128175
Energy: 1.7069036505043038
Energy: 1.555777363015281
Energy: 1.3597756277144086
Energy: 1.7069036505027129
Energy: 1.5557773630168719
Energy: 1.4534482275470137
Energy: 1.5694615847108573
Energy: 1.4693773574586895
Energy: 1.453448227548605
Energy: 1.5694615847108573
Energy: 1.4693773574570987
Energy: 1.4534482275478091
Energy: 1.5694615847108573
Energy: 1.4693773574586895
Energy: 1.4534482275494005
Energy: 1.5102335053598706
Energy: 1.4043862589764189
Energy: 1.8219819152495613
Energy: 1.510233505359075
Energy: 1.4043862589772143
Energy: 1.8219819152495613
Energy: 1.510233505359075
Energy: 1.4043862589764189
Energy: 1.8219819152495613
Energy: 1.510233505359075
Energy: 1.5176311567637455
Energy: 1.5078286788767876
Energy: 1.3774817837789821
Energy: 1.517631156764541
Energy: 1.507828678878379
Energy: 1.3774817837781863
Energy: 1.51763115676295
Energy: 1.5078286788759923
Energy: 1.3774817837797777
Energy: 1.517631156764541
Energy: 1.5286460167270963
Energy: 1.4281160496122023
Energy: 1.3598717161975529
Energy: 1.5286460167270963
Energy: 1.4281160496129977
Energy: 1.3598717161983485
Energy: 1.5286460167270963
Energy: 1.4281160496114067
Energy: 1.3598717161975529
Energy: 1.5286460167270963
Energy: 1.450285063765019
Energy: 1.562164128608336
Energy: 1.4579430144245795
Energy: 1.4502850637658145
Energy: 1.562164128609927
Energy: 1.4579430144229886
Energy: 1.4502850637642235
Energy: 1.5621641286091317
Energy: 1.4579430144245795
Energy: 1.45028506376661
Energy: 1.8021608870162154
Energy: 1.5937531412660966
Energy: 1.4046777068492744
Energy: 1.8021608870472423
Energy: 1.593753141266892
Energy: 1.4046777068492744
Energy: 1.802160887033718
Energy: 1.5937531412660966
Energy: 1.4046777068492744
Energy: 1.802160886991553
Energy: 1.453432400553123
Energy: 1.5394887823411076
Energy: 1.5360813963885882
Energy: 1.453432400553123
Energy: 1.5394887823403118
Energy: 1.5360813963893836
Energy: 1.453432400553123
Energy: 1.5394887823403118
Energy: 1.5360813963877926
Energy: 1.453432400553123
Energy: 1.4410058898620717
Energy: 1.4402919541444672
Energy: 1.708380512840443
Energy: 1.4410058898636628
Energy: 1.4402919541650794
Energy: 1.7083805128396474
Energy: 1.4410058898620717
Energy: 1.4402919541650794
Energy: 1.708380512840443
Energy: 1.4410058898636628
Energy: 1.509170619855246
Energy: 1.3808902601141708
Energy: 1.517435581170627
Energy: 1.5091706197320063
Energy: 1.3808902601125796
Energy: 1.5174355811698315
Energy: 1.5091706182234779
Energy: 1.3808902601133752
Energy: 1.5174355811714226
Energy: 1.509170619670025
Energy: 1.3713048825356824
Energy: 1.6708227082010352
Energy: 1.3713149587812927
Energy: 1.371304882536478
Energy: 1.6708227082010352
Energy: 1.371314958782884
Energy: 1.3713048825356824
Energy: 1.6708227082002396
Energy: 1.3713149587812927
Energy: 1.371304882536478
Energy: 1.676303989311529
Energy: 1.44033739228317
Energy: 1.5916963832236344
Energy: 1.676303989311529
Energy: 1.4403373922823746
Energy: 1.5916963832236344
Energy: 1.676303989311529
Energy: 1.44033739228317
Energy: 1.5916963832220434
Energy: 1.676303989311529

minimum gb energy = 1.3597756277128175 eV
minimum distance =  2.20895118782558 Angstroms
sigma value = 33