Model name: model_name=MEAM_LAMMPS_KimJungLee_2015_NiAlCo__MO_876687166519_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391749382019
cohesive_energy=4.450349977833563
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.02221872626611623
Energy: 0.6788957864796419
Energy: 0.7386176032796691
Energy: 0.6788522891339227
Energy: 0.02221872626611623
Energy: 0.6788957864796419
Energy: 0.7386176032823076
Energy: 0.737901396230259
Energy: 0.02239668713664011
Energy: 0.36401141635270806
Energy: 0.022440699103563912
Energy: 0.737901396230259
Energy: 0.02239668713664011
Energy: 0.36401141635270806
Energy: 0.02221872626611623
Energy: 0.6788957864796419
Energy: 0.7386176032823076
Energy: 0.6788522891339227
Energy: 0.02221872626611623
Energy: 0.6788957864796419
Energy: 0.7386176032823076
Energy: 0.737901396230259
Energy: 0.02239668713664011
Energy: 0.36401141635270806
Energy: 0.022440699103563912
Energy: 0.737901396230259
Energy: 0.02239668713664011
Energy: 0.36401141635270806
Energy: 0.02221872626611623
Energy: 0.6788957864796419
Energy: 0.7386176032823076
Energy: 0.6788522891339227
Energy: 0.02221872626611623
Energy: 0.6788957864796419
Energy: 0.7386176032823076
Energy: 0.737901396230259
Energy: 0.02239668713664011
Energy: 0.36401141635270806
Energy: 0.022440699103563912
Energy: 0.737901396230259
Energy: 0.02239668713664011
Energy: 0.36401141635270806

minimum gb energy = 0.02221872626611623 eV
minimum distance =  2.47155958207242 Angstroms
sigma value = 5


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

Energy: 1.7416590658072422
Energy: 1.7355779071455715
Energy: 1.8893277321995434
Energy: 1.7355695647404823
Energy: 1.7416590658040187
Energy: 1.7355779071455715
Energy: 1.889327732202767
Energy: 1.6274287070413336
Energy: 1.6311685422115738
Energy: 1.7523647503412596
Energy: 1.6627471662896989
Energy: 1.6274287070413336
Energy: 1.6311685422083502
Energy: 1.752364750344483
Energy: 1.6244577254927939
Energy: 1.642755343365895
Energy: 1.817066787400048
Energy: 1.6429217314729716
Energy: 1.6244577254895705
Energy: 1.6427553433626714
Energy: 1.8170667873968245
Energy: 1.742325041305359
Energy: 1.6914307344332766
Energy: 1.8086664124634875
Energy: 1.6558906967341789
Energy: 1.7423250413021354
Energy: 1.6914307344365
Energy: 1.8086664124634875
Energy: 1.6312193773709789
Energy: 1.605420834058554
Energy: 1.8545503543310633
Energy: 1.6848688952721138
Energy: 1.6312193773742023
Energy: 1.605420834058554
Energy: 1.847335450323751
Energy: 1.6991623336246415
Energy: 1.7255251977693926
Energy: 1.6922064500309901
Energy: 1.651803745416346
Energy: 1.6991623336375359
Energy: 1.7255251977726163
Energy: 1.6922064500309901
Energy: 1.6270728326653487
Energy: 1.7092195537203079
Energy: 1.9197102489993334
Energy: 1.7081917679459935
Energy: 1.6270728326653487
Energy: 1.709219553726755
Energy: 1.9197102490090039
Energy: 1.6271413725695363
Energy: 1.6490304044085355
Energy: 1.8477830979192214
Energy: 1.6911587927626859
Energy: 1.62714137257276
Energy: 1.6490304044085355
Energy: 1.8477830979224448
Energy: 1.6048514149067399
Energy: 1.649838963570872
Energy: 1.7150331824209202
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Energy: 1.6048514149035162
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Energy: 1.7150331824144731
Energy: 1.6270618879297627
Energy: 1.726617937048201
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Energy: 1.645424637701329
Energy: 1.6270618879329861
Energy: 1.726617937048201
Energy: 1.8118976887098446
Energy: 1.6420109276613615
Energy: 1.631938304541896
Energy: 1.7216134541691814
Energy: 1.6970878719792022
Energy: 1.642010927664585
Energy: 1.6319383045483429
Energy: 1.7216134541659578
Energy: 1.6745876184742574
Energy: 1.7296953698353594
Energy: 1.8086556038650734
Energy: 1.6742097365639401
Energy: 1.6745876184774808
Energy: 1.729695369832136
Energy: 1.8086556038682968
Energy: 1.7950738631769867
Energy: 1.692296503269575
Energy: 1.8792158409766087
Energy: 1.6720813520002553
Energy: 1.7950738631737633
Energy: 1.692296503266351
Energy: 1.8792158409766087
Energy: 1.6174433653269642
Energy: 1.6963758442401982
Energy: 1.8242759849101688
Energy: 1.6436481390468654
Energy: 1.6174433653172937
Energy: 1.696375844233751
Energy: 1.8242759849101688
Energy: 1.6435891778832323
Energy: 1.6335872529632933
Energy: 1.777981909828007
Energy: 1.6446293659892626
Energy: 1.6435891778800091
Energy: 1.6335872529600697
Energy: 1.777981909818336
Energy: 1.6860135157256781
Energy: 1.7964042799960849
Energy: 1.8919454927105315
Energy: 1.7521956436544974
Energy: 1.6860135157160074
Energy: 1.7964042799993087
Energy: 1.8919454927137551
Energy: 1.6351705940918104
Energy: 1.6539389145717918
Energy: 1.7120385512709968
Energy: 1.6630040918693543
Energy: 1.6351705940885868
Energy: 1.6539389145685681
Energy: 1.7120385512709968
Energy: 1.6293129339359544
Energy: 1.6044290729057293
Energy: 1.8014135287862492
Energy: 1.6523102694255944
Energy: 1.629312933932731
Energy: 1.6044290729057293
Energy: 1.8014135287830257
Energy: 1.6626627301090857
Energy: 1.6434291544622115
Energy: 1.8465746179063842
Energy: 1.650937543907266
Energy: 1.6626627301058625
Energy: 1.6434291544622115
Energy: 1.8465746179063842
Energy: 1.6264037180534858
Energy: 1.6072743694867897
Energy: 1.713568708949939
Energy: 1.7009636200406026
Energy: 1.6264037180534858
Energy: 1.6072743694867897
Energy: 1.7135687089467155
Energy: 1.626748898267446
Energy: 1.7367786146490773
Energy: 1.8012701814972971
Energy: 1.6524924909855543
Energy: 1.626748898267446
Energy: 1.7367786146555244
Energy: 1.8012701814940737
Energy: 1.6289849383655581
Energy: 1.710216778710425
Energy: 1.9058459673544905
Energy: 1.6251325131659313
Energy: 1.628984938359111
Energy: 1.710216778710425
Energy: 1.9058459673609376
Energy: 1.6384934384663605
Energy: 1.6478255170162877
Energy: 1.8519109259126378
Energy: 1.6832523861109598
Energy: 1.6384934384695842
Energy: 1.647825517013064
Energy: 1.8519109259061908
Energy: 1.6859621432009118
Energy: 1.6200005146238605
Energy: 1.7613170364705582
Energy: 1.6933252069452138
Energy: 1.6859621431944647
Energy: 1.6200005146238605
Energy: 1.7613170364641109
Energy: 1.6237752031892703
Energy: 1.727078356180213
Energy: 1.8331235152195817
Energy: 1.643890814674675
Energy: 1.6237752031860464
Energy: 1.727078356180213
Energy: 1.8466673059026506
Energy: 1.6630802853809494
Energy: 1.6293025213159382
Energy: 1.7503426909782407
Energy: 1.745602738567937
Energy: 1.663080285384173
Energy: 1.6293025213159382
Energy: 1.7503426909750173
Energy: 1.7274886422309987
Energy: 1.640239157988516
Energy: 1.7490034886233605
Energy: 1.6441949836610388
Energy: 1.7274886422406697
Energy: 1.6402391579917397
Energy: 1.7490034886233605
Energy: 1.7417335967472871
Energy: 1.6911457920356423
Energy: 1.8398192208770299
Energy: 1.688991105635117
Energy: 1.7417335967472871
Energy: 1.6911457920420307
Energy: 1.8398192208705828
Energy: 1.6745188129634039
Energy: 1.656967060149968
Energy: 1.8530269073954382
Energy: 1.640350657758765
Energy: 1.6745188129569568
Energy: 1.6569670601531916
Energy: 1.853026907398662
Energy: 1.6454759148045799
Energy: 1.6828352094965586
Energy: 1.8752984857444566
Energy: 1.6285587272423288
Energy: 1.6454759148013565
Energy: 1.682835209499782
Energy: 1.8752984857476802
Energy: 1.6237641887027057
Energy: 1.7328834290005555
Energy: 1.8684727640850687
Energy: 1.7755378484765243
Energy: 1.6237641887027057
Energy: 1.7328834290134496
Energy: 1.8684727640786216
Energy: 1.6725041265581175
Energy: 1.6965014727822085
Energy: 1.6787583897002332
Energy: 1.625188627781966
Energy: 1.6725041265581175
Energy: 1.6965014727853733
Energy: 1.6787583897034568
Energy: 1.6593906830749532
Energy: 1.6853884340470202
Energy: 1.9205652555249604
Energy: 1.6365463074394953
Energy: 1.6593906830749532
Energy: 1.6853884340502439
Energy: 1.9205652555249604
Energy: 1.6633847478955404
Energy: 1.6267060990125757
Energy: 1.9044518521833713
Energy: 1.6908144489791754
Energy: 1.6633847478955404
Energy: 1.6267060990093523
Energy: 1.9044518521769243
Energy: 1.6251571810231606
Energy: 1.633108339438985
Energy: 1.6841862294765408
Energy: 1.713116091282227
Energy: 1.6251571810231606
Energy: 1.6331083394357615
Energy: 1.684186229482988
Energy: 1.6266507287509195
Energy: 1.7263596513699473
Energy: 1.8572178113979607
Energy: 1.6478442147910508
Energy: 1.6266507287573664
Energy: 1.7263596513667239
Energy: 1.8572178113979607
Energy: 1.6198922813865655
Energy: 1.6510296766587438
Energy: 1.8200963295736332
Energy: 1.6433753121965318
Energy: 1.6198922813833418
Energy: 1.6510296766587438
Energy: 1.8200963295736332
Energy: 1.62247865678189
Energy: 1.655312147701487
Energy: 1.780786543470533
Energy: 1.6428856606078137
Energy: 1.6224786567883371
Energy: 1.6553121477047104
Energy: 1.7807865434673091
Energy: 1.6608850652462919
Energy: 1.6655766110475334
Energy: 1.8359888382263052
Energy: 1.6697704225964987
Energy: 1.6608850652398448
Energy: 1.66557661104431
Energy: 1.835988838223082
Energy: 1.6837107669429217
Energy: 1.8115803091097549
Energy: 1.8136018913940317
Energy: 1.7467203314690578
Energy: 1.683710766946145
Energy: 1.8115803091097549
Energy: 1.8136018913843612
Energy: 1.6901013708352444
Energy: 1.6457996778788968
Energy: 1.7783575817807298
Energy: 1.6836716644739085
Energy: 1.6901013708320212
Energy: 1.6457996778788968
Energy: 1.7783575817839532
Energy: 1.681744288009744
Energy: 1.6421350178815908
Energy: 1.8238028596063003
Energy: 1.6619617773055566
Energy: 1.6817442880129676
Energy: 1.6421350178815908
Energy: 1.8238028596063003
Energy: 1.7945848205294812
Energy: 1.6701434801788784
Energy: 1.8288218623701678
Energy: 1.6948913347255208
Energy: 1.7945848205294812
Energy: 1.670143480182102
Energy: 1.8288218623701678
Energy: 1.68090743361929
Energy: 1.6885701721942827
Energy: 1.808900275640166
Energy: 1.6988192877284254
Energy: 1.6809074336128431
Energy: 1.6885701721942827
Energy: 1.808900275633719
Energy: 1.6198877596689611
Energy: 1.6446069706134983
Energy: 1.880058317795269
Energy: 1.657323604026672
Energy: 1.6198877596721846
Energy: 1.6446069706167217
Energy: 1.8800583178017163
Energy: 1.6267026295214893
Energy: 1.7019503249823975
Energy: 1.885536744878084
Energy: 1.7754901102619804
Energy: 1.6267026295311011
Energy: 1.7019503249888446
Energy: 1.8855367448748603
Energy: 1.6047604057127007
Energy: 1.7084706086221115
Energy: 1.6951730426265759
Energy: 1.627504801589158
Energy: 1.6047604057127007
Energy: 1.7084706086188879
Energy: 1.6951730426265759

minimum gb energy = 1.6044290729057293 eV
minimum distance =  2.2193585417403 Angstroms
sigma value = 401


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

Energy: 1.6877478224319433
Energy: 1.6656808717926093
Energy: 1.8748231661845582
Energy: 1.6651491369904898
Energy: 1.687747822435602
Energy: 1.6656808717926093
Energy: 1.9159586482075253
Energy: 1.6263851907279812
Energy: 1.7561371047353567
Energy: 1.7694136904817703
Energy: 1.6583457352491602
Energy: 1.6263851907279812
Energy: 1.7561371047390155
Energy: 1.7694136904817703
Energy: 1.614168560592594
Energy: 1.634314251905647
Energy: 1.8087045094802172
Energy: 1.6343596863900787
Energy: 1.614168560592594
Energy: 1.634314251905647
Energy: 1.8087045094802172
Energy: 1.6752606008803317
Energy: 1.6665397855298982
Energy: 1.8117348864702478
Energy: 1.6430523755149407
Energy: 1.6752606008803317
Energy: 1.6665397855262394
Energy: 1.8117348864629297
Energy: 1.68889197914818
Energy: 1.6531210601846014
Energy: 1.729624688989364
Energy: 1.645607785933962
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Energy: 1.6531210601882604
Energy: 1.729624688985705
Energy: 1.6186612785991523
Energy: 1.6400610205231372
Energy: 1.7530627266395262
Energy: 1.6629553590883177
Energy: 1.6186612785991523
Energy: 1.6400610205231372
Energy: 1.7530627266358674
Energy: 1.6125078706076788
Energy: 1.6877740734436983
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Energy: 1.6556531834121844
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Energy: 1.68777407343638
Energy: 1.9149048156208177
Energy: 1.612007601457052
Energy: 1.6461728636750732
Energy: 1.9314166121421315
Energy: 1.6917601062499112
Energy: 1.612007601457052
Energy: 1.6461728636750732
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Energy: 1.6238005837490466
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Energy: 1.7054000538479048
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Energy: 1.764092054877877
Energy: 1.6741970525853904
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Energy: 1.6336065122804284
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Energy: 1.6380000410158457
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Energy: 1.6699050869442467
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Energy: 1.6380000410195046
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Energy: 1.647812110499022
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Energy: 1.625054683443921
Energy: 1.647812110499022
Energy: 1.794393769538772
Energy: 1.634364750523098
Energy: 1.6656808717962686
Energy: 1.9062473007317302
Energy: 1.6651491369904898
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Energy: 1.6656808717926093
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Energy: 1.614168560592594
Energy: 1.634314251905647
Energy: 1.8087045094802172
Energy: 1.6343596863937375
Energy: 1.614168560592594
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Energy: 1.8087045094802172
Energy: 1.6752606008803317
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Energy: 1.8117348864665888
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Energy: 1.8161697072878724
Energy: 1.645607785933962
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Energy: 1.7530627266358674
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Energy: 1.6120076014607108
Energy: 1.6461728636750732
Energy: 1.9524945531746174
Energy: 1.6917601062499112
Energy: 1.612007601457052
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Energy: 1.6238005837490466
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Energy: 1.7410370007356912
Energy: 1.6351973618870317
Energy: 1.6238005837453873
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Energy: 1.7410370007356912
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Energy: 1.6844859106146994
Energy: 1.748083365864648
Energy: 1.6346056423711177
Energy: 1.6833162172325355
Energy: 1.6844859106110401
Energy: 1.794618237961478
Energy: 1.6741970525853904
Energy: 1.672614631570078
Energy: 1.7704277341034433
Energy: 1.6336065122804284
Energy: 1.6741970525853904
Energy: 1.672614631566419
Energy: 1.7949466354271844
Energy: 1.6174697664983844
Energy: 1.6380000410158457
Energy: 1.7720198368276414
Energy: 1.6699050869442467
Energy: 1.6174697664983844
Energy: 1.6380000410158457
Energy: 1.7833783087947432
Energy: 1.620494529732487
Energy: 1.647812110499022
Energy: 1.8335566751661228
Energy: 1.64248214349143
Energy: 1.6204945297361464
Energy: 1.647812110499022
Energy: 1.8026207143424187
Energy: 1.687747822435602
Energy: 1.6656808717962686
Energy: 1.8840973784204902
Energy: 1.6651491369904898
Energy: 1.687747822435602
Energy: 1.6656808717926093
Energy: 1.8840973784241497
Energy: 1.6263851907279812
Energy: 1.7561371047390155
Energy: 1.7694136904817703
Energy: 1.6583457352491602
Energy: 1.6263851907279812
Energy: 1.7561371047390155
Energy: 1.7694136904854294
Energy: 1.614168560592594
Energy: 1.634314251905647
Energy: 1.8087045094802172
Energy: 1.6343596863937375
Energy: 1.614168560592594
Energy: 1.634314251905647
Energy: 1.8087045094802172
Energy: 1.6752606008803317
Energy: 1.6665397855262394
Energy: 1.8117348864702478
Energy: 1.6430523755149407
Energy: 1.675260600883991
Energy: 1.6665397855262394
Energy: 1.8117348864629297
Energy: 1.6888919791445212
Energy: 1.6531210601846014
Energy: 1.8161697072842133
Energy: 1.645607785933962
Energy: 1.68889197914818
Energy: 1.6531210601882604
Energy: 1.8161697072878724
Energy: 1.6186612785991523
Energy: 1.6400610205231372
Energy: 1.7530627266358674
Energy: 1.6629553590846589
Energy: 1.6186612785991523
Energy: 1.6400610205267965
Energy: 1.7530627266358674
Energy: 1.6125078706076788
Energy: 1.687774073440039
Energy: 1.9149048156281356
Energy: 1.6556531834121844
Energy: 1.6125078706113378
Energy: 1.68777407343638
Energy: 1.94237778687557
Energy: 1.612007601457052
Energy: 1.6461728636750732
Energy: 1.9524945531709583
Energy: 1.69176010625357
Energy: 1.612007601457052
Energy: 1.6461728636750732
Energy: 1.9524945531709583
Energy: 1.6238005837490466
Energy: 1.6469588943496594
Energy: 1.7195254504859774
Energy: 1.6351973618870317
Energy: 1.6238005837490466
Energy: 1.6469588943496594
Energy: 1.7195254504896365
Energy: 1.6833162172288767
Energy: 1.6844859106146994
Energy: 1.7281668473177878
Energy: 1.6346056423711177
Energy: 1.6833162172288767
Energy: 1.6844859106110401
Energy: 1.748083365868307
Energy: 1.6741970525853904
Energy: 1.6760226750927396
Energy: 1.7704277341034433
Energy: 1.6336065122804284
Energy: 1.6741970525853904
Energy: 1.6760226750927396
Energy: 1.7704277340924663
Energy: 1.6133994414669353
Energy: 1.6380000410195046
Energy: 1.7720198368313005
Energy: 1.6699050869442467
Energy: 1.6133994414669353
Energy: 1.6380000410195046
Energy: 1.7836833888136017
Energy: 1.6250546834475796
Energy: 1.647812110499022
Energy: 1.8200913049338014
Energy: 1.64248214349143
Energy: 1.6250546834475796
Energy: 1.647812110499022
Energy: 1.851822436942197
Energy: 1.634364750523098
Energy: 1.6656808717926093
Energy: 1.8840973784204902
Energy: 1.6651491369904898
Energy: 1.63436475051578
Energy: 1.6656808717926093
Energy: 1.8840973784241497
Energy: 1.6263851907243225
Energy: 1.7561371047390155
Energy: 1.7694136904817703
Energy: 1.6545657522447206
Energy: 1.6263851907279812
Energy: 1.7561371047390155
Energy: 1.7694136904854294

minimum gb energy = 1.612007601457052 eV
minimum distance =  2.23481453757091 Angstroms
sigma value = 311


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

Energy: 1.7784419824411475
Energy: 1.6584010548240526
Energy: 1.8087282910809588
Energy: 1.6615098017594236
Energy: 1.778441982440725
Energy: 1.6584010548232078
Energy: 1.825015011151407
Energy: 1.7239063432537363
Energy: 1.6461990108702076
Energy: 1.7470104888200444
Energy: 1.6635638462272742
Energy: 1.7239063432524686
Energy: 1.6461990108710525
Energy: 1.7470104888187765
Energy: 1.6773459903022105
Energy: 1.7135285644280482
Energy: 1.8805840962016054
Energy: 1.6913154415459397
Energy: 1.6773459903022105
Energy: 1.7135285644280482
Energy: 1.8500882674399062
Energy: 1.6814369511638108
Energy: 1.658428277812507
Energy: 1.8396957297513068
Energy: 1.7107034279296798
Energy: 1.6814369511629657
Energy: 1.6584282778116624
Energy: 1.8396957297517296
Energy: 1.6893991866452596
Energy: 1.6800718122728067
Energy: 1.833764318531797
Energy: 1.6986330392726812
Energy: 1.6893991866477946
Energy: 1.6800718122723841
Energy: 1.833764318531797
Energy: 1.7144280662145188
Energy: 1.6370748010511997
Energy: 1.6969022937614466
Energy: 1.6368193317418103
Energy: 1.714428066215364
Energy: 1.6370748010537346
Energy: 1.6969022937614466
Energy: 1.7016098642543895
Energy: 1.7759903540439659
Energy: 1.8364661765774748
Energy: 1.7002897547864844
Energy: 1.7016098642543895
Energy: 1.7759903540435436
Energy: 1.8364661765791648
Energy: 1.70396233042076
Energy: 1.673051098034016
Energy: 1.74773569925238
Energy: 1.7074381394144251
Energy: 1.70396233042245
Energy: 1.6730510980352835
Energy: 1.747735699233367
Energy: 1.6890439093952863
Energy: 1.6446028309078216
Energy: 1.8136897552731264
Energy: 1.649977536863814
Energy: 1.689043909394019
Energy: 1.6446028309073992
Energy: 1.843200767747098
Energy: 1.6934803657805244
Energy: 1.716065117083837
Energy: 1.8651014267309354
Energy: 1.7299359575150413
Energy: 1.6934803657792568
Energy: 1.7160651170851045
Energy: 1.8651014267309354
Energy: 1.7660499753593204
Energy: 1.7230171759146786
Energy: 1.8352796177741388
Energy: 1.6519068960783656
Energy: 1.7660499753593204
Energy: 1.7230171759134114
Energy: 1.8352796177741388
Energy: 1.6959076766595476
Energy: 1.7252074437585239
Energy: 1.7833004179403389
Energy: 1.702028733456677
Energy: 1.6959076766587027
Energy: 1.7252074437572567
Energy: 1.7833004179399163
Energy: 1.6737636914412322
Energy: 1.6391515456145545
Energy: 1.8054834521108385
Energy: 1.701884696015814
Energy: 1.6737636914416547
Energy: 1.6391515456137093
Energy: 1.8054834521095708
Energy: 1.6786343887789015
Energy: 1.7207684826924623
Energy: 1.7475016958090166
Energy: 1.7127981228381126
Energy: 1.6786343887801694
Energy: 1.7207684826933072
Energy: 1.7475016958102843
Energy: 1.7347086351498036
Energy: 1.6609184680341742
Energy: 1.768275436037933
Energy: 1.666153346128943
Energy: 1.7347086351498036
Energy: 1.6609184680350193
Energy: 1.768275436036243
Energy: 1.7388835902316118
Energy: 1.7169770420480106
Energy: 1.7715154306134218
Energy: 1.7177744617468513
Energy: 1.7388835902320345
Energy: 1.7169770420484334
Energy: 1.7715154306129992
Energy: 1.7543108859055758
Energy: 1.6336457238857531
Energy: 1.7848089356793952
Energy: 1.6894564752363006
Energy: 1.7543108859051537
Energy: 1.6336457238865978
Energy: 1.7848089356810852
Energy: 1.6686462092318461
Energy: 1.7604083065008207
Energy: 1.7038441898910723
Energy: 1.7160124888778998
Energy: 1.6686462092301562
Energy: 1.7604083065008207
Energy: 1.7038441898919174
Energy: 1.6713718077505946
Energy: 1.6705328905165089
Energy: 1.8586058779689867
Energy: 1.7022965380179416
Energy: 1.6713718077501722
Energy: 1.6705328905160866
Energy: 1.8586058779694095
Energy: 1.7028788949725822
Energy: 1.6732480942267196
Energy: 1.7658336491354676
Energy: 1.7054991671835364
Energy: 1.7028788949721596
Energy: 1.6732480942258747
Energy: 1.765833649135045
Energy: 1.698412004983025
Energy: 1.700575644391341
Energy: 1.844911637915174
Energy: 1.7353989314197351
Energy: 1.6984120049842926
Energy: 1.7005756443926086
Energy: 1.8449116379155963
Energy: 1.7153756271304237
Energy: 1.7247238048609934
Energy: 1.8736193677763435
Energy: 1.654494668481168
Energy: 1.7153756271304237
Energy: 1.7247238048580358
Energy: 1.873619367776766
Energy: 1.7316743473157667
Energy: 1.6903373484643371
Energy: 1.7703228457062266
Energy: 1.6799136513961659
Energy: 1.7316743473166116
Energy: 1.6903373484651822
Energy: 1.770322845706649
Energy: 1.688681221627375
Energy: 1.6664725524548805
Energy: 1.8019161811098348
Energy: 1.6607209811678336
Energy: 1.6886812216269524
Energy: 1.6664725524548805
Energy: 1.8019161811089897
Energy: 1.70528255768837
Energy: 1.696225190974432
Energy: 1.7928912338541036
Energy: 1.6716483223338519
Energy: 1.7052825576887927
Energy: 1.6962251909735873
Energy: 1.7928912338519911
Energy: 1.7846186211594537
Energy: 1.7279795888504021
Energy: 1.6894515037703923
Energy: 1.7612892087525278
Energy: 1.7846186211594537
Energy: 1.7279795888499798
Energy: 1.6894515037687021
Energy: 1.7799988887044305
Energy: 1.6597108410545176
Energy: 1.82841979764974
Energy: 1.656643756325727
Energy: 1.7799988887048528
Energy: 1.6597108410553627
Energy: 1.8284197976518526
Energy: 1.7433774321492874
Energy: 1.6466640967858017
Energy: 1.741493989749748
Energy: 1.7081510288800827
Energy: 1.7433774321492874
Energy: 1.646664096786224
Energy: 1.741493989748903
Energy: 1.6767326102870317
Energy: 1.7137268140180737
Energy: 1.8813228810713816
Energy: 1.7031237662098315
Energy: 1.6767326102870317
Energy: 1.7137268140180737
Energy: 1.8813228810718043
Energy: 1.6812366456392633
Energy: 1.65999473627569
Energy: 1.9044260252644913
Energy: 1.711592994250825
Energy: 1.6812366456392633
Energy: 1.6599947362773801
Energy: 1.904426025263646
Energy: 1.6911118176403714
Energy: 1.6802197709529443
Energy: 1.8479595645255973
Energy: 1.6983932775035022
Energy: 1.691111817639949
Energy: 1.6802197709533668
Energy: 1.84795956452433
Energy: 1.7110467172847996
Energy: 1.659382149511006
Energy: 1.774003208353787
Energy: 1.6367150417139604
Energy: 1.7110467172856447
Energy: 1.6593821495101608
Energy: 1.774003208353787
Energy: 1.7015432232798637
Energy: 1.7787594193470677
Energy: 1.8351257526193177
Energy: 1.695589361107375
Energy: 1.701543223278596
Energy: 1.7787594193474905
Energy: 1.8351257526193177
Energy: 1.7040303160298043
Energy: 1.6738628752318345
Energy: 1.7474360944914469
Energy: 1.6994746185224527
Energy: 1.7040303160306491
Energy: 1.6738628752309896
Energy: 1.7474360944910243
Energy: 1.6876962185043307
Energy: 1.6373592875582925
Energy: 1.803179735842773
Energy: 1.6646080362065063
Energy: 1.6876962185077107
Energy: 1.6373592875557572
Energy: 1.8031797358423507
Energy: 1.690396909977951
Energy: 1.715890225984775
Energy: 1.801802711817166
Energy: 1.7346757714792937
Energy: 1.6903969099775287
Energy: 1.7158902259843527
Energy: 1.8018027118163207

minimum gb energy = 1.6336457238857531 eV
minimum distance =  2.2395935008464 Angstroms
sigma value = 39


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

Energy: 1.6514562244071271
Energy: 1.679388295794269
Energy: 1.8247569526483252
Energy: 1.6758900881682508
Energy: 1.65145622440613
Energy: 1.6793882957982584
Energy: 1.7802026111148654
Energy: 1.630758143966876
Energy: 1.6554963225719155
Energy: 1.7350307804709997
Energy: 1.6553370783773456
Energy: 1.63075814396538
Energy: 1.6554963225704198
Energy: 1.735030780470501
Energy: 1.6512867752823421
Energy: 1.5770451049492058
Energy: 1.6554128059205593
Energy: 1.6049918440898692
Energy: 1.6512867752838383
Energy: 1.5770451049452163
Energy: 1.6802914847990533
Energy: 1.6320719905605896
Energy: 1.6554498087862128
Energy: 1.7353997757833168
Energy: 1.7280974154430022
Energy: 1.6320719905566006
Energy: 1.6554498087852156
Energy: 1.7353997757828183
Energy: 1.700544474688376
Energy: 1.6011341715026624
Energy: 1.6030485050904886
Energy: 1.6030769020001696
Energy: 1.700544474688376
Energy: 1.6011341715041585
Energy: 1.6030485050889927
Energy: 1.6474588824618674
Energy: 1.6546909071777889
Energy: 1.6621462240610871
Energy: 1.7232185925832058
Energy: 1.6474588824648595
Energy: 1.6546909071728022
Energy: 1.6621462240635805
Energy: 1.842422161325474
Energy: 1.6025175446808029
Energy: 1.625879720054192
Energy: 1.6049333090796056
Energy: 1.84242216132697
Energy: 1.6025175446837947
Energy: 1.6258797200556878
Energy: 1.632399693545111
Energy: 1.6485617292154608
Energy: 1.7277077951935986
Energy: 1.6485237015376655
Energy: 1.632399693542119
Energy: 1.6485617292169572
Energy: 1.727707795188612
Energy: 1.8424497124695383
Energy: 1.6019428219474916
Energy: 1.7564838257989517
Energy: 1.6025070934932961
Energy: 1.8424497124690395
Energy: 1.6019428219489875
Energy: 1.7284565301995565
Energy: 1.6473383246005178
Energy: 1.7235002190354438
Energy: 1.6621975449950799
Energy: 1.6546772243732444
Energy: 1.6473383245990216
Energy: 1.7235002190314546
Energy: 1.6621975449940825
Energy: 1.700559693133899
Energy: 1.603252624002391
Energy: 1.8789309035413817
Energy: 1.6012173028605121
Energy: 1.700559693132403
Energy: 1.6032526240078762
Energy: 1.6923247238887058
Energy: 1.6321639192908963
Energy: 1.7280888079487575
Energy: 1.7356355208603136
Energy: 1.6553893249962608
Energy: 1.6321639192918937
Energy: 1.7280888079462644
Energy: 1.7356355208578202
Energy: 1.6514133149531678
Energy: 1.6049826930868654
Energy: 1.6523116766973893
Energy: 1.5769867334325711
Energy: 1.651413314952669
Energy: 1.6049826930868654
Energy: 1.6523116766953947
Energy: 1.6307726356444774
Energy: 1.6552378410667066
Energy: 1.7351471645270768
Energy: 1.6554633085748875
Energy: 1.6307726356454748
Energy: 1.65523784106376
Energy: 1.7351471645250824
Energy: 1.6514562244081246
Energy: 1.679388295794269
Energy: 1.730333254386282
Energy: 1.6758900881702452
Energy: 1.651456224408623
Energy: 1.6793882957977597
Energy: 1.7303332543917669
Energy: 1.630758143965879
Energy: 1.655496322572913
Energy: 1.7350307804709997
Energy: 1.6553370783768466
Energy: 1.63075814396538
Energy: 1.6554963225709185
Energy: 1.7350307804719973
Energy: 1.6512867752818432
Energy: 1.5770451049497043
Energy: 1.6618221966077773
Energy: 1.6049918440893702
Energy: 1.6512867752833396
Energy: 1.5770451049457153
Energy: 1.6618221966097717
Energy: 1.6320719905610885
Energy: 1.6554498087872103
Energy: 1.7353997757838155
Energy: 1.7280974154430022
Energy: 1.6320719905580965
Energy: 1.6554498087862128
Energy: 1.7353997757833168
Energy: 1.7005444746878773
Energy: 1.6011341715036598
Energy: 1.6043165196755607
Energy: 1.6030769020001696
Energy: 1.700544474688376
Energy: 1.6011341715051555
Energy: 1.6030485050894911
Energy: 1.6474588824623662
Energy: 1.6546909071772902
Energy: 1.6621462240596365
Energy: 1.7232185925832058
Energy: 1.6474588824643608
Energy: 1.6546909071723035
Energy: 1.6621462240630818
Energy: 1.8424221613264715
Energy: 1.6025175446803042
Energy: 1.6114975296357315
Energy: 1.6049333090791071
Energy: 1.8424221613279672
Energy: 1.6025175446842934
Energy: 1.62259705444227
Energy: 1.632399693545111
Energy: 1.6485617292154608
Energy: 1.7277077951926012
Energy: 1.648523701536668
Energy: 1.6323996935426177
Energy: 1.6485617292164585
Energy: 1.7277077951876145
Energy: 1.8424497124705352
Energy: 1.6019428219479899
Energy: 1.6796503004739183
Energy: 1.6025070934937944
Energy: 1.8424497124700365
Energy: 1.6019428219494862
Energy: 1.7361957227507268
Energy: 1.6473383245995206
Energy: 1.7235002190354438
Energy: 1.6621975449950799
Energy: 1.6546772243732444
Energy: 1.6473383245990216
Energy: 1.7235002190304571
Energy: 1.6621975449950799
Energy: 1.700559693135395
Energy: 1.6032526240033884
Energy: 1.926067152340916
Energy: 1.6012173028595151
Energy: 1.700559693133899
Energy: 1.6032526240078762
Energy: 1.9260671523414148
Energy: 1.6321639192908963
Energy: 1.728088807949755
Energy: 1.7356355208603136
Energy: 1.6553893249962608
Energy: 1.6321639192908963
Energy: 1.7280888079467631
Energy: 1.7356355208578202
Energy: 1.651413314952669
Energy: 1.6049826930873639
Energy: 1.6523116766963917
Energy: 1.5769867334325711
Energy: 1.6514133149516719
Energy: 1.6049826930873639
Energy: 1.652311676694896
Energy: 1.6307726356444774
Energy: 1.6552378410667066
Energy: 1.7351471645280743
Energy: 1.6554633085758848
Energy: 1.6307726356454748
Energy: 1.6552378410632616
Energy: 1.7351471645255812
Energy: 1.6514562244076259
Energy: 1.679388295794269
Energy: 1.7303332543912684
Energy: 1.6758900881672534
Energy: 1.6514562244066286
Energy: 1.6793882957982584
Energy: 1.7303332543902712
Energy: 1.6307581439663772
Energy: 1.6554963225724142
Energy: 1.7350307804709997
Energy: 1.6553370783783428
Energy: 1.63075814396538
Energy: 1.6554963225704198
Energy: 1.735030780470501

minimum gb energy = 1.5769867334325711 eV
minimum distance =  2.28154054692938 Angstroms
sigma value = 21


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

Energy: 1.6842492377797702
Energy: 1.8040802006083394
Energy: 1.7339018642937043
Energy: 1.8052908644194516
Energy: 1.6842492377815865
Energy: 1.804080200607734
Energy: 1.7746516492034703
Energy: 1.6859780596837108
Energy: 1.655442626417795
Energy: 1.7541008664215871
Energy: 1.6550379159148862
Energy: 1.6859780596849214
Energy: 1.6554426264171898
Energy: 1.7541008664221927
Energy: 1.6848453082651897
Energy: 1.7301885329582658
Energy: 1.7594812812852199
Energy: 1.6685832350987948
Energy: 1.6848453082651897
Energy: 1.7301885329564497
Energy: 1.7594812812858251
Energy: 1.6477084998747549
Energy: 1.6647361869256052
Energy: 1.7890101663014994
Energy: 1.6342438069117287
Energy: 1.647708499876571
Energy: 1.6647361869243948
Energy: 1.78901016630271
Energy: 1.6184834566544453
Energy: 1.5788541737212418
Energy: 1.6296283836126215
Energy: 1.6585843882272457
Energy: 1.6184834566562614
Energy: 1.5788541737218473
Energy: 1.6296283836156482
Energy: 1.6479616189818946
Energy: 1.5980757213744645
Energy: 1.7002208138184718
Energy: 1.6608545480621908
Energy: 1.6479616189831054
Energy: 1.5980757213744645
Energy: 1.7002208138196822
Energy: 1.736796843802471
Energy: 1.5795289382262854
Energy: 1.6352108682912516
Energy: 1.6575548648194942
Energy: 1.736796843802471
Energy: 1.5795289382268909
Energy: 1.6352108682912516
Energy: 1.674302325359558
Energy: 1.7134224077459945
Energy: 1.8015644645816709
Energy: 1.6608497266499227
Energy: 1.6743023253589526
Energy: 1.7134224077441789
Energy: 1.8015644645792495
Energy: 1.721561928596959
Energy: 1.6627520095281483
Energy: 1.7075276851712593
Energy: 1.78467892574408
Energy: 1.7215619285975645
Energy: 1.6627520095281483
Energy: 1.7075276851712593
Energy: 1.6561102444324418
Energy: 1.6624013718905108
Energy: 1.6245614388051162
Energy: 1.7406636794420136
Energy: 1.6561102444324418
Energy: 1.6624013718886947
Energy: 1.6245614388057215
Energy: 1.7737921624397197
Energy: 1.7895220153292657
Energy: 1.6774150289170962
Energy: 1.6671510437230825
Energy: 1.7737921624391142
Energy: 1.7895220153298708
Energy: 1.6774150289170962
Energy: 1.5651287667926026
Energy: 1.69139787052673
Energy: 1.6368446016439961
Energy: 1.6344802759675046
Energy: 1.565128766791392
Energy: 1.6913978705255193
Energy: 1.6368446016458118
Energy: 1.7740881352532574
Energy: 1.6473752960512056
Energy: 1.66425834431763
Energy: 1.6692214061837314
Energy: 1.7740881352502305
Energy: 1.6473752960493897
Energy: 1.6378064655134457
Energy: 1.5650662248466773
Energy: 1.6912194452836369
Energy: 1.6798996122618877
Energy: 1.6996830514317685
Energy: 1.565066224847888
Energy: 1.6912194452842424
Energy: 1.6798996122637038
Energy: 1.7524573427788854
Energy: 1.5923504290241726
Energy: 1.6257283213847984
Energy: 1.6333893309526677
Energy: 1.7524573427782801
Energy: 1.5923504290241726
Energy: 1.6257283213847984
Energy: 1.5569101621908574
Energy: 1.7320174532517905
Energy: 1.6142818438785818
Energy: 1.626226895346206
Energy: 1.5569101621896466
Energy: 1.7320174532517905
Energy: 1.6142818438803974
Energy: 1.7533238686164887
Energy: 1.5925594549206017
Energy: 1.6166367803005297
Energy: 1.6331499522770307
Energy: 1.7533238686158834
Energy: 1.5925594549206017
Energy: 1.616636780299319
Energy: 1.5569848246237143
Energy: 1.666362077766721
Energy: 1.6192807769277917
Energy: 1.72134356303359
Energy: 1.5569848246237143
Energy: 1.666362077766721
Energy: 1.6192807769271866
Energy: 1.683810187636498
Energy: 1.6379170583692968
Energy: 1.6945915154406557
Energy: 1.6334210806256564
Energy: 1.683810187638314
Energy: 1.6379170583680858
Energy: 1.6945915154400506
Energy: 1.5566559388168886
Energy: 1.715512341518718
Energy: 1.5999196293192182
Energy: 1.7154792166707085
Energy: 1.556655938815678
Energy: 1.7155123415199285
Energy: 1.599919629320429
Energy: 1.6840184470277284
Energy: 1.6334445946260254
Energy: 1.6944772268182604
Energy: 1.591451967058171
Energy: 1.6840184470265174
Energy: 1.6334445946254201
Energy: 1.6944772268176553
Energy: 1.5569353398521835
Energy: 1.721389843041038
Energy: 1.6193046147914687
Energy: 1.6661606073564554
Energy: 1.5569353398503674
Energy: 1.7213898430404324
Energy: 1.6193046147902583
Energy: 1.7531824134670606
Energy: 1.6332822424796203
Energy: 1.6165290800651615
Energy: 1.5925037529593897
Energy: 1.753182413466455
Energy: 1.6332822424790148
Energy: 1.6165290800657666
Energy: 1.5570412574652837
Energy: 1.6257985180458872
Energy: 1.6143262650404013
Energy: 1.7318782095947138
Energy: 1.5570412574658892
Energy: 1.6257985180452819
Energy: 1.6143262650397963
Energy: 1.7526415208214285
Energy: 1.6333472722414641
Energy: 1.651566865940409
Energy: 1.5921892347670075
Energy: 1.7526415208196124
Energy: 1.6333472722432802
Energy: 1.6515668659391984

minimum gb energy = 1.556655938815678 eV
minimum distance =  2.25630249603265 Angstroms
sigma value = 113


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

Energy: 1.6824724106531321
Energy: 1.7880997442244924
Energy: 1.7257364713188386
Energy: 1.788488710177078
Energy: 1.6824724106565105
Energy: 1.7880997442177355
Energy: 1.7257364713188386
Energy: 1.7911826763000374
Energy: 1.713916176583326
Energy: 1.7665998045670865
Energy: 1.6963869682672794
Energy: 1.7911826763000374
Energy: 1.713916176583326
Energy: 1.7665998045670865
Energy: 1.6754921306780053
Energy: 1.7152292340652509
Energy: 1.785847794953036
Energy: 1.7203369516953355
Energy: 1.6754921306813837
Energy: 1.7152292340652509
Energy: 1.7858477949564144
Energy: 1.6239708669734905
Energy: 1.761317682555833
Energy: 1.8680754596494544
Energy: 1.706774003217704
Energy: 1.6239708669734905
Energy: 1.7613176825490762
Energy: 1.8680754596528328
Energy: 1.7445716320987819
Energy: 1.633848969594236
Energy: 1.6718980542319062
Energy: 1.6366126359505055
Energy: 1.7445716320987819
Energy: 1.6338489695976144
Energy: 1.6718980542352846
Energy: 1.6269802146147654
Energy: 1.7182509701174318
Energy: 1.7822055565463208
Energy: 1.6344702892101002
Energy: 1.626980214611387
Energy: 1.7182509701174318
Energy: 1.7822055565496993
Energy: 1.6198017283936397
Energy: 1.633357000518028
Energy: 1.6639046377266422
Energy: 1.6398538405200056
Energy: 1.619801728397018
Energy: 1.6333570005146496
Energy: 1.6639046377704996
Energy: 1.626614340622531
Energy: 1.7330131983482029
Energy: 1.7829651970503941
Energy: 1.6229244285673452
Energy: 1.6266143406259093
Energy: 1.7330131983482029
Energy: 1.7829651970436375
Energy: 1.620471128295258
Energy: 1.6700466324453018
Energy: 1.736653899264987
Energy: 1.6734425567247153
Energy: 1.6204711282918798
Energy: 1.6700466324453018
Energy: 1.7366538992683653
Energy: 1.646140814317572
Energy: 1.7311352344102724
Energy: 1.7311272787327079
Energy: 1.6599867991550141
Energy: 1.6461408143209504
Energy: 1.731135234406894
Energy: 1.7311272787327079
Energy: 1.6216613956805745
Energy: 1.7033588666144388
Energy: 1.7898965042242256
Energy: 1.6258052659006943
Energy: 1.6216613956771961
Energy: 1.7033588666144388
Energy: 1.8273793264364886
Energy: 1.6462653800825586
Energy: 1.685153742153324
Energy: 1.8423145672830503
Energy: 1.677527123605532
Energy: 1.6462653800825586
Energy: 1.6851537421600806
Energy: 1.8423145672830503
Energy: 1.754294256608027
Energy: 1.6951445256550426
Energy: 1.7783681343341937
Energy: 1.7069992256305409
Energy: 1.7542942566046487
Energy: 1.6951445256516642
Energy: 1.8163736829873878
Energy: 1.7023413268318754
Energy: 1.7941397952654796
Energy: 1.901733126068255
Energy: 1.7361130799649174
Energy: 1.7023413268318754
Energy: 1.794139795268858
Energy: 1.9017331260716335
Energy: 1.7548791538638262
Energy: 1.7294992369392344
Energy: 1.8898124156717329
Energy: 1.7589547648986197
Energy: 1.7548791538638262
Energy: 1.7294992369493691
Energy: 1.8898124156615979
Energy: 1.7023094771465177
Energy: 1.685164216251343
Energy: 1.7456477697544026
Energy: 1.6779806524203966
Energy: 1.702309477149896
Energy: 1.685164216251343
Energy: 1.7456477697544026
Energy: 1.7753248604268215
Energy: 1.7022468616238364
Energy: 1.8879844034486213
Energy: 1.7068422331740785
Energy: 1.775324860423443
Energy: 1.7022468616137014
Energy: 1.8879844034587565
Energy: 1.6458255936961739
Energy: 1.6873630588181074
Energy: 1.773192376828456
Energy: 1.6758129914298274
Energy: 1.6458255936927955
Energy: 1.6873630588214859
Energy: 1.773192376828456
Energy: 1.7758053548503139
Energy: 1.7084399175954466
Energy: 1.8185652242589518
Energy: 1.7316611987810384
Energy: 1.7758053548503139
Energy: 1.70843991758869
Energy: 1.8185652242589518
Energy: 1.5925576152219332
Energy: 1.7194888744753343
Energy: 1.7800583417354503
Energy: 1.6326120447678498
Energy: 1.5925576152219332
Energy: 1.7194888744820909
Energy: 1.7800583417354503
Energy: 1.6317959483011153
Energy: 1.6333852614039577
Energy: 1.7736825385840114
Energy: 1.6472388925564225
Energy: 1.6317959482943587
Energy: 1.6333852614039577
Energy: 1.7736825385840114
Energy: 1.592569967309102
Energy: 1.665402243492204
Energy: 1.7079725414151345
Energy: 1.627419660466858
Energy: 1.5925699673124807
Energy: 1.6654022435023392
Energy: 1.7079725414218911
Energy: 1.6323894313393272
Energy: 1.6091527305168063
Energy: 1.7541235950051983
Energy: 1.7789318655464317
Energy: 1.6323894313325706
Energy: 1.6091527305168063
Energy: 1.7541235949950633
Energy: 1.6636189399388186
Energy: 1.6627123559272448
Energy: 1.6892472546505128
Energy: 1.6284632551986065
Energy: 1.663618939932062
Energy: 1.6627123559238663
Energy: 1.6892472546505128
Energy: 1.616777779647702
Energy: 1.709455653098673
Energy: 1.7387640264207356
Energy: 1.8542295342321933
Energy: 1.616777779647702
Energy: 1.7094556530952947
Energy: 1.7387640264207356
Energy: 1.6481896002464074
Energy: 1.7442792667316351
Energy: 1.7659119197459607
Energy: 1.7073042902928068
Energy: 1.6481896002430292
Energy: 1.7442792667316351
Energy: 1.765911919739204
Energy: 1.7106110385629112
Energy: 1.6977805722007613
Energy: 1.6585381699154116
Energy: 1.8011293758891316
Energy: 1.7106110385662896
Energy: 1.6977805722041397
Energy: 1.6585381699154116
Energy: 1.6473767904364052
Energy: 1.8459932207794938
Energy: 1.7631058911438953
Energy: 1.749457354325188
Energy: 1.6473767904330268
Energy: 1.8459932207761156
Energy: 1.7631058911405169
Energy: 1.748015177261102
Energy: 1.6892045890294756
Energy: 1.7524342514039795
Energy: 1.800102116032713
Energy: 1.7480151772577235
Energy: 1.6892045890260972
Energy: 1.7524342514039795
Energy: 1.6560370968784803
Energy: 1.7391312744462373
Energy: 1.7555243222524515
Energy: 1.7897290178757324
Energy: 1.6560370968818587
Energy: 1.7391312744496157
Energy: 1.7555243222524515
Energy: 1.6213934302627762
Energy: 1.688408281127422
Energy: 1.800108735288207
Energy: 1.7928131842380783
Energy: 1.62139343031339
Energy: 1.688408281127422
Energy: 1.800108735278072
Energy: 1.6584451207947999
Energy: 1.6282227979506103
Energy: 1.6928954949115222
Energy: 1.6995844382022371
Energy: 1.6584451208015565
Energy: 1.6282227979539887
Energy: 1.6928954949047654
Energy: 1.6219531910124956
Energy: 1.6437924594412385
Energy: 1.8116459547468255
Energy: 1.7183686797597695
Energy: 1.621953191015874
Energy: 1.6437924594412385
Energy: 1.8116459547434471
Energy: 1.637111167414894
Energy: 1.6415334955455911
Energy: 1.6830128406066325
Energy: 1.6160045838016674
Energy: 1.6371111674216507
Energy: 1.6415334955455911
Energy: 1.6830128406066325
Energy: 1.6206076733023753
Energy: 1.611528426314232
Energy: 1.7902993885719938
Energy: 1.7082064467072406
Energy: 1.6206076733023753
Energy: 1.6115284263176102
Energy: 1.7902993885686154
Energy: 1.6218730691303322
Energy: 1.6397846001677947
Energy: 1.6481783796276064
Energy: 1.6210244543389827
Energy: 1.6218730691303322
Energy: 1.6397846001745513
Energy: 1.6481783796343632
Energy: 1.620433885546921
Energy: 1.6117482178331772
Energy: 1.759345241667386
Energy: 1.7128464116572124
Energy: 1.620433885540164
Energy: 1.6117482178365556
Energy: 1.7593452416606294
Energy: 1.6133302470877977
Energy: 1.6217875444463823
Energy: 1.73423951626494
Energy: 1.621402739489675
Energy: 1.6133302470911761
Energy: 1.6217875444430039
Energy: 1.73423951626494
Energy: 1.6255762012353456
Energy: 1.6845922764386128
Energy: 1.9043091071011842
Energy: 1.731113215678812
Energy: 1.6255762012421024
Energy: 1.6845922764487478
Energy: 1.9043091071011842
Energy: 1.6664767122116706
Energy: 1.7013496835847304
Energy: 1.7433407071410791
Energy: 1.696651792660761
Energy: 1.6664767122082922
Energy: 1.7013496835847304
Energy: 1.7433407071444573
Energy: 1.7633243667946041
Energy: 1.6805909457871477
Energy: 1.9045728764556231
Energy: 1.7413660171146847
Energy: 1.7633243667979825
Energy: 1.6805909457837693
Energy: 1.9045728764522447
Energy: 1.6662825226686813
Energy: 1.6821116547761188
Energy: 1.850959015725543
Energy: 1.7761484033663848
Energy: 1.6662825226653029
Energy: 1.682111654779497
Energy: 1.8509590157322997
Energy: 1.6622178565744083
Energy: 1.6802129190770925
Energy: 1.814262953905443
Energy: 1.745508210464129
Energy: 1.6622178565811034
Energy: 1.6802129190703357
Energy: 1.8142629539020645
Energy: 1.714095553210754
Energy: 1.7051370432087525
Energy: 1.8777385903356685
Energy: 1.6015068965406407
Energy: 1.7140955532073756
Energy: 1.7051370432053743
Energy: 1.8777385903289119
Energy: 1.5990972367655536
Energy: 1.6815752275713745
Energy: 1.8145675909850094
Energy: 1.734283119356516
Energy: 1.5990972367756886
Energy: 1.6815752275747529
Energy: 1.8145675909850094

minimum gb energy = 1.5925576152219332 eV
minimum distance =  2.19901774175116 Angstroms
sigma value = 365


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

Energy: 1.7268364989810308
Energy: 1.3400406051047278
Energy: 1.7509342825229488
Energy: 1.3400406051054896
Energy: 1.7268364989810308
Energy: 1.3400406051070126
Energy: 1.6858685478259212
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.4369400747458527
Energy: 1.340040605103966
Energy: 1.7268364989810308
Energy: 1.3400406051032043
Energy: 1.3127296847326966
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.7990170925397175
Energy: 1.3400406051054896
Energy: 1.7268364989810308
Energy: 1.3400406051062508
Energy: 1.312729792549502
Energy: 1.7268364989810308
Energy: 1.3400406051054896
Energy: 1.64849402872967
Energy: 1.3400406051054896
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.751664128462832
Energy: 1.7268364989795073
Energy: 1.3400406051047278
Energy: 1.3753996684540932
Energy: 1.340040605103966
Energy: 1.7268364989802691
Energy: 1.3400406051062508
Energy: 1.499300403836038
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.3794806796113317
Energy: 1.340040605103966
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.4014443048014207
Energy: 1.7268364989810308
Energy: 1.340040605103966
Energy: 1.7516641282450922
Energy: 1.3400406051070126
Energy: 1.7268364989810308
Energy: 1.3400406051054896
Energy: 1.685384476278178
Energy: 1.7268364989795073
Energy: 1.340040605103966
Energy: 1.3127288862167106
Energy: 1.3400406051047278
Energy: 1.7268364989810308
Energy: 1.3400406051047278
Energy: 1.3127288552821592
Energy: 1.7268364989802691
Energy: 1.3400406051062508
Energy: 1.3174939586259764
Energy: 1.3400406051070126
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.3127287607487033
Energy: 1.7268364989810308
Energy: 1.340040605103966
Energy: 1.6858685460055474
Energy: 1.3400406051047278
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.685868545940838
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.3796285178337835
Energy: 1.3400406051054896
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.3127285933011648
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.3174833957941008
Energy: 1.3400406051070126
Energy: 1.7268364989802691
Energy: 1.340040605103966
Energy: 1.3174931234493177
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.317473992709264
Energy: 1.3400406051054896
Energy: 1.7268364989810308
Energy: 1.3400406051062508
Energy: 1.3174694870288268
Energy: 1.7268364989802691
Energy: 1.340040605103966
Energy: 1.3174709195543945
Energy: 1.3400406051062508
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.3174908851962397
Energy: 1.7268364989802691
Energy: 1.3400406051062508
Energy: 1.3174833639177521
Energy: 1.3400406051054896
Energy: 1.7268364989810308
Energy: 1.3400406051062508
Energy: 1.3174810751580386
Energy: 1.7268364989810308
Energy: 1.3400406051054896
Energy: 1.3174911735840475
Energy: 1.3400406051047278
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.3174919109473366
Energy: 1.7268364989795073
Energy: 1.3400406051054896
Energy: 1.3174691445864926
Energy: 1.3400406051054896
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.3174909826997392
Energy: 1.7268364989795073
Energy: 1.3400406051062508
Energy: 1.3174885510202763
Energy: 1.3400406051047278
Energy: 1.7268364989802691
Energy: 1.3400406051047278
Energy: 1.317493075508406
Energy: 1.7268364989802691
Energy: 1.3400406051062508
Energy: 1.3174863463398345
Energy: 1.3400406051054896
Energy: 1.7268364989802691
Energy: 1.3400406051054896
Energy: 1.3174847304682142
Energy: 1.7268364989795073
Energy: 1.3400406051062508
Energy: 1.3174872432188895
Energy: 1.340040605103966
Energy: 1.7268364989802691
Energy: 1.3400406051032043
Energy: 1.317496682629462

minimum gb energy = 1.3127285933011648 eV
minimum distance =  2.37480857049216 Angstroms
sigma value = 23