Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_849011491644_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784093991264
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.013700240185093958
Energy: 0.01446937148087476
Energy: 0.8633264787458754
Energy: 0.01446937148087476
Energy: 0.01446937148087476
Energy: 0.7316223853844986
Energy: 0.01446937148087476
Energy: 0.7316223853851265
Energy: 0.8633264787465033
Energy: 0.01446937148087476
Energy: 0.013700240185093958
Energy: 0.01446937148087476
Energy: 0.01446937148087476
Energy: 0.7316223853851265
Energy: 0.01446937148087476
Energy: 0.7316223853844986

minimum gb energy = 0.013700240185093958 eV
minimum distance =  2.47126488356976 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 0.9547464475093289
Energy: 1.0030380889115158
Energy: 0.913121416302743
Energy: 1.0030380889115158
Energy: 0.8946260111646955
Energy: 1.1435577925412581
Energy: 0.8981557574206036
Energy: 1.1435577925412581
Energy: 1.0111097513321612
Energy: 0.9949293274255846
Energy: 0.9443190391854991
Energy: 0.9949293274255846
Energy: 0.8906627358755489
Energy: 0.8865512664717452
Energy: 0.8652572169243444
Energy: 0.8865512664671771
Energy: 0.912844916945837
Energy: 1.0622535203017909
Energy: 0.9010753852349714
Energy: 1.0622535203017909
Energy: 0.8569632168138502
Energy: 1.1809418648868542
Energy: 0.8400545117898051
Energy: 1.1809418648891037
Energy: 0.9316930423633683
Energy: 1.0836228754425938
Energy: 0.8759493909106716
Energy: 1.0836228754433554
Energy: 0.8196081877185012
Energy: 1.0626278527763786
Energy: 0.8285952915559177
Energy: 1.0626278527763786
Energy: 0.8784177693235743
Energy: 1.112007138769573
Energy: 1.007870912299546
Energy: 1.1120071387703343
Energy: 0.8325483010265962
Energy: 0.9958770844854882
Energy: 0.8125436636015851
Energy: 0.9958770844847268
Energy: 1.0182817967747297
Energy: 0.9577501930819967
Energy: 0.8784970175396758
Energy: 0.957750193084281
Energy: 0.9184875679629416
Energy: 1.0636296197085435
Energy: 0.8427116798103198
Energy: 1.0636296197093047
Energy: 0.8972509980214013
Energy: 1.1182211688653796
Energy: 0.9324429140483853
Energy: 1.1182211688653796
Energy: 0.9481996679894586
Energy: 0.9984451896882637
Energy: 0.858225576097023
Energy: 0.9984451896875023
Energy: 0.9234368821736813
Energy: 1.0621827048087442
Energy: 0.9973324078706813
Energy: 1.0621827048095054
Energy: 0.9218364378379698
Energy: 1.1199661592941852
Energy: 0.8935251528771363
Energy: 1.1199661592941852
Energy: 0.9448628521823514
Energy: 0.9966740079228912
Energy: 0.8564034364666485
Energy: 0.9966740079228912
Energy: 0.8983544084651807
Energy: 1.1167485957645185
Energy: 0.9327359685729507
Energy: 1.1167485957645185
Energy: 0.821311548386912
Energy: 1.0056829556357354
Energy: 0.8418213015888685
Energy: 1.0056829556357354
Energy: 1.0151364603428494
Energy: 0.8848771131521901
Energy: 0.879870350998508
Energy: 0.8848771131529515
Energy: 0.8354664708554802
Energy: 0.9954784671873588
Energy: 0.8176868443211845
Energy: 0.9954784671865975
Energy: 0.8792742019448124
Energy: 1.1797967553589104
Energy: 1.0043109318033516
Energy: 1.1797967553596715
Energy: 1.0252893549686035
Energy: 1.0628145189532168
Energy: 0.8823942968432966
Energy: 1.0628145189532168
Energy: 0.9636663511339759
Energy: 1.0486864188030658
Energy: 0.8761765309562678
Energy: 1.0486864188038272
Energy: 0.8759494061598078
Energy: 1.1750351292263752
Energy: 1.0304017352327246
Energy: 1.1750351292263752
Energy: 0.9410075670953421
Energy: 1.0579377001107897
Energy: 0.8614321186641931
Energy: 1.0579377001107897
Energy: 0.8926018967725641
Energy: 1.185341739591649
Energy: 0.8788789232279448
Energy: 1.185341739591649
Energy: 1.00508172985027
Energy: 0.9938161333771139
Energy: 0.9422223928579022
Energy: 0.9938161333771139
Energy: 0.8936017329964738
Energy: 1.0543520894231422
Energy: 0.8925044651821175
Energy: 1.0543520894239036
Energy: 0.956141331278112
Energy: 1.0037293351744399
Energy: 0.9201929357808266
Energy: 1.0037293351744399
Energy: 0.8923559518936525
Energy: 1.086208745275884
Energy: 0.8972052678472043
Energy: 1.086208745275884
Energy: 0.8684182658186083
Energy: 0.9927376686704232
Energy: 0.9413097220140987
Energy: 0.992737668669662
Energy: 0.9128091669485627
Energy: 1.075716496187937
Energy: 0.8652220302946042
Energy: 1.0757164961871757

minimum gb energy = 0.8125436636015851 eV
minimum distance =  2.32107645278834 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.0153159278739263
Energy: 1.0672447983375677
Energy: 0.9622597576875339
Energy: 1.0672447983375677
Energy: 0.9335498952851848
Energy: 1.1970014394819575
Energy: 0.9366868364416134
Energy: 1.1970014394828257
Energy: 1.0711806840185145
Energy: 1.052922466509347
Energy: 1.01067319083235
Energy: 1.0529224665101757
Energy: 0.9039950387466705
Energy: 0.904865114549201
Energy: 0.8902347653593904
Energy: 0.9048651145509373
Energy: 0.9037915355420441
Energy: 1.1306391737133001
Energy: 1.0491134348115705
Energy: 1.130639173709828
Energy: 0.9942854734936392
Energy: 1.1358393713236061
Energy: 1.011719626048961
Energy: 1.1358393713236061
Energy: 1.0282449905038724
Energy: 1.090529573763544
Energy: 0.9226429443941702
Energy: 1.0905295737626761
Energy: 0.8473103008142299
Energy: 1.0741673551212358
Energy: 0.8774478545193348
Energy: 1.0741673551212358
Energy: 0.917882871968654
Energy: 0.9323933606157244
Energy: 1.0868432792781257
Energy: 0.9323933606157244
Energy: 0.8771892981127448
Energy: 1.1449790222581722
Energy: 0.9050604835760389
Energy: 1.1449790222599086
Energy: 0.9195393608176454
Energy: 1.0902381023872074
Energy: 0.9431651324212416
Energy: 1.090238102386339
Energy: 0.8840717266402819
Energy: 1.0593780549537892
Energy: 0.9830916572212554
Energy: 1.0593780549537892
Energy: 0.982109761157998
Energy: 1.1287320343920775
Energy: 0.9214393780252184
Energy: 1.1287320343920775
Energy: 0.9819333878036844
Energy: 1.1288604438349175
Energy: 0.9110693290403924
Energy: 1.1288604438349175
Energy: 0.8841412577369987
Energy: 1.0592394739667963
Energy: 0.9815101708393851
Energy: 1.0592394739667963
Energy: 0.9188916299136449
Energy: 1.0899958098136697
Energy: 0.9366387638200578
Energy: 1.089995809815406
Energy: 0.8771618243090306
Energy: 1.145006022481838
Energy: 0.8547815290566428
Energy: 1.145006022481838
Energy: 0.9178668250043942
Energy: 0.9324514716231348
Energy: 0.9524120984719312
Energy: 0.9324514716222666
Energy: 0.8473029197615037
Energy: 1.073989482726415
Energy: 0.8689552238297718
Energy: 1.0739894827272833
Energy: 1.028202783021533
Energy: 1.0901801345284827
Energy: 0.9207425371011592
Energy: 1.0901801345267466
Energy: 0.9943186316381215
Energy: 1.1355371361316733
Energy: 0.8630547817778756
Energy: 1.1355371361325413
Energy: 0.9041822067575959
Energy: 1.130747716274366
Energy: 0.9226966063312615
Energy: 1.1307477162752344
Energy: 0.9038399612905715
Energy: 0.9051259208336803
Energy: 0.8903327971789505
Energy: 0.9051259208336803
Energy: 1.0713489996053955
Energy: 1.0529197288582781
Energy: 1.0110125954735627
Energy: 1.0529197288582781
Energy: 0.9335065418936112
Energy: 1.197056140439704
Energy: 0.9366159254314987
Energy: 1.1970561404405717
Energy: 1.0153159278739263
Energy: 1.0672447983375677
Energy: 0.9742665528223923
Energy: 1.0672447983375677
Energy: 0.9335498952851848
Energy: 1.1970014394836936
Energy: 0.9366868364416134
Energy: 1.1970014394828257
Energy: 1.0711806840193827
Energy: 1.0529224665101757
Energy: 0.9471760969857428
Energy: 1.0529224665101757
Energy: 0.9039950387458023
Energy: 0.904865114549201
Energy: 0.8980777672482817
Energy: 0.9048651145500692

minimum gb energy = 0.8473029197615037 eV
minimum distance =  2.28078970192673 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 0.9551574984877221
Energy: 1.1182211618851414
Energy: 1.093357854426431
Energy: 1.1182211618851414
Energy: 0.9922286820563675
Energy: 1.1484820896725465
Energy: 1.0110948249283895
Energy: 1.1484820896705281
Energy: 0.945406269135049
Energy: 1.1773050296634069
Energy: 0.9312731020494697
Energy: 1.1773050296634069
Energy: 0.9242124128714776
Energy: 0.9585603827253766
Energy: 0.9349957726058163
Energy: 0.9585603827253766
Energy: 0.935533689361237
Energy: 1.1634201543909721
Energy: 1.0721252616999517
Energy: 1.163420154391981
Energy: 1.0407175098896226
Energy: 1.1815530091040665
Energy: 1.0853179890724458
Energy: 1.1815530091030573
Energy: 0.9799482102553257
Energy: 1.1994245750771266
Energy: 0.9793919614255369
Energy: 1.1994245750771266
Energy: 1.13762862930887
Energy: 1.1234265316612912
Energy: 0.8993796233817611
Energy: 1.1234265316612912
Energy: 0.9797044716388703
Energy: 1.1115826355226515
Energy: 0.9786227931849464
Energy: 1.1115826355226515
Energy: 0.9331340712567734
Energy: 1.182176013209537
Energy: 0.9152054096408806
Energy: 1.1821760132105463
Energy: 0.9698326835008351
Energy: 1.116787079045073
Energy: 0.990445577643636
Energy: 1.116787079045073
Energy: 0.9570530733162326
Energy: 1.1537301933363957
Energy: 1.103842976072183
Energy: 1.1537301933363957
Energy: 0.931389687993124
Energy: 1.0515398211644587
Energy: 0.9281664093974207
Energy: 1.0515398211644587
Energy: 0.9806068228021542
Energy: 1.0211443286124695
Energy: 0.97949822502796
Energy: 1.0211443286124695
Energy: 0.9714677148321933
Energy: 1.1651817863175513
Energy: 0.898396991334679
Energy: 1.1651817863175513
Energy: 1.0352567674575885
Energy: 0.9758828756488725
Energy: 0.9676446662413891
Energy: 0.9758828756488725
Energy: 0.8853596099135393
Energy: 1.1831564836027464
Energy: 0.883203438927298
Energy: 1.1831564836017372
Energy: 0.9352005438208907
Energy: 1.1733803555202196
Energy: 0.9707135542747036
Energy: 1.1733803555202196
Energy: 0.9240168677335365
Energy: 0.9584904758256931
Energy: 0.9359625865077559
Energy: 0.9584904758156474
Energy: 0.9794217676092231
Energy: 1.1787344129630435
Energy: 0.9567146317114268
Energy: 1.1787344129630435
Energy: 0.9598931407593608
Energy: 1.0892695037980824
Energy: 0.9564082847249464
Energy: 1.0892695037980824
Energy: 0.9571909133060317
Energy: 1.1283607357322456
Energy: 1.0415999489270416
Energy: 1.1283607357322456
Energy: 0.9906114812723997
Energy: 1.1145717428482889
Energy: 1.010909667694826
Energy: 1.1145717428482889
Energy: 1.1541495783973053
Energy: 1.1814979649659272
Energy: 0.9333289747528709
Energy: 1.1814979649659272
Energy: 1.1653457780563778
Energy: 0.9585481870527375
Energy: 0.9623258665559976
Energy: 0.9585481869861328

minimum gb energy = 0.883203438927298 eV
minimum distance =  2.28558819152528 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.0010865026991773
Energy: 1.189035232765156
Energy: 1.2313660036521477
Energy: 1.189035232765156
Energy: 1.0239454331070805
Energy: 1.1067813909225594
Energy: 1.0733238839173198
Energy: 1.1067813909141324
Energy: 0.9916580343511372
Energy: 1.050748798218566
Energy: 0.9889951749583477
Energy: 1.050748798218566
Energy: 1.2172841025112635
Energy: 1.0245230888023438
Energy: 0.9796367117685097
Energy: 1.024523088799936
Energy: 1.1327396439854105
Energy: 1.1077113030784076
Energy: 1.1693293352092538
Energy: 1.1077113030784076
Energy: 0.9140133056962945
Energy: 1.0510271733770957
Energy: 1.2681198245998582
Energy: 1.0510271733770957
Energy: 1.131274879051204
Energy: 0.9789580182739438
Energy: 1.014820185812632
Energy: 0.9789580182727402
Energy: 1.0686562728557825
Energy: 1.060408874430501
Energy: 0.9383369377991613
Energy: 1.060408874430501
Energy: 1.0795082881973197
Energy: 1.1067858722168789
Energy: 1.0341036577223728
Energy: 1.1067858544943205
Energy: 1.001393655653278
Energy: 1.048868643732342
Energy: 1.0133853448889079
Energy: 1.0488686437335457
Energy: 0.9722412760164498
Energy: 1.1143057060321402
Energy: 0.9965573071317305
Energy: 1.1143057060309363
Energy: 1.0789136431949007
Energy: 1.2268470268853573
Energy: 0.9806788901474492
Energy: 1.2268470268853573
Energy: 0.9124743892787353
Energy: 1.2621818913951381
Energy: 0.9978991992753675
Energy: 1.2621818913951381
Energy: 1.045617770400349
Energy: 1.036561282823122
Energy: 1.1156940484937943
Energy: 1.0365612828219182
Energy: 0.9124849530329037
Energy: 1.2622092066000703
Energy: 1.0690013838274295
Energy: 1.2622092066000703
Energy: 1.0788384380467595
Energy: 1.2283280427257586
Energy: 0.980423203330931
Energy: 1.2283280427257586
Energy: 0.9723876927680379
Energy: 1.114389602378291
Energy: 0.9891975572627368
Energy: 1.1143896023770872
Energy: 1.0008582876353338
Energy: 1.0487671353452475
Energy: 1.0131082353488041
Energy: 1.0487671353452475
Energy: 1.079396129382983
Energy: 1.106821551262572
Energy: 1.0619477241220578
Energy: 1.1068215504310883
Energy: 1.068628793081739
Energy: 1.0604525347030067
Energy: 0.9382173484571608
Energy: 1.0604525347030067
Energy: 1.1311320608938966
Energy: 0.9770916989461743
Energy: 1.0078182475191626
Energy: 0.9770916989473781

minimum gb energy = 0.9124743892787353 eV
minimum distance =  2.38010392641636 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 0.9651245057997674
Energy: 1.1597800046281967
Energy: 1.1803093179916366
Energy: 1.1597800046281967
Energy: 0.9466937200460993
Energy: 1.1731580591201662
Energy: 0.9322359314912068
Energy: 1.1731580591201662
Energy: 1.0638738917037414
Energy: 1.2957648872344418
Energy: 0.9351211206971877
Energy: 1.2957648872344418
Energy: 1.394172215102546
Energy: 1.1861721741661493
Energy: 1.1334877391463725
Energy: 1.1861721741661493
Energy: 1.1332968070827136
Energy: 1.0627624194413243
Energy: 1.0152843987134792
Energy: 1.0627624194413243
Energy: 0.9323225447162297
Energy: 1.2350769699467423
Energy: 1.359067604185322
Energy: 1.2350769699467423
Energy: 1.1474417832857604
Energy: 1.147055034437621
Energy: 1.0631338410781506
Energy: 1.147055034437621
Energy: 1.253580260773446
Energy: 1.207352632426374
Energy: 1.017698116677144
Energy: 1.207352632426374
Energy: 0.9327944014775724
Energy: 1.0615007432704455
Energy: 1.0014543524325206
Energy: 1.0615007432689567
Energy: 1.2084729665160492
Energy: 1.2601798490461273
Energy: 1.0627736405580732
Energy: 1.2601798490461273
Energy: 1.012728068352323
Energy: 1.2635236490136572
Energy: 1.3209967755619219
Energy: 1.2635236490136572
Energy: 1.0625910115390376
Energy: 1.0231465795501995
Energy: 1.1580583191451619
Energy: 1.0231465795501995
Energy: 1.1271272952103748
Energy: 1.2353104390395067
Energy: 0.9317205288936637
Energy: 1.2353104390395067
Energy: 1.0635228015168212
Energy: 1.1311819069086269
Energy: 1.093929141631099
Energy: 1.1311819069116045
Energy: 1.0164593010529408
Energy: 1.13166205593747
Energy: 1.2542904321965516
Energy: 1.13166205593747
Energy: 1.000752730709488
Energy: 1.2814103581814447
Energy: 0.9356953040156757
Energy: 1.2814103581829335
Energy: 1.0632539533036278
Energy: 1.0267844676259665
Energy: 1.2067927638155365
Energy: 1.0267844676259665

minimum gb energy = 0.9317205288936637 eV
minimum distance =  2.36426580370917 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.0438335214968808
Energy: 1.3077146939306226
Energy: 1.3534429719653749
Energy: 1.3077146939306226
Energy: 1.1254954146012195
Energy: 1.084105769928879
Energy: 0.9521268800263306
Energy: 1.0841057699280356
Energy: 1.2529688107708081
Energy: 1.249913508235011
Energy: 0.9542734075846059
Energy: 1.249913508235011
Energy: 1.043380852076358
Energy: 1.2573476710176128
Energy: 1.1366712331383289
Energy: 1.2573476710176128
Energy: 1.183882738310956
Energy: 1.1101186073116036
Energy: 1.1907115885476496
Energy: 1.1101186073116036
Energy: 0.9650796008155033
Energy: 1.0589636630495214
Energy: 1.4056036016604097
Energy: 1.0589636635232014
Energy: 1.0612491346019588
Energy: 1.0655155592886465
Energy: 1.0606466339352036
Energy: 1.0655155592886465
Energy: 1.257964309666598
Energy: 1.0592569343626108
Energy: 0.9651005747083169
Energy: 1.0592569321696321
Energy: 1.0415949228513677
Energy: 1.237192689339747
Energy: 1.215632641863073
Energy: 1.2371926893389034
Energy: 1.2970867618520223
Energy: 1.173781771067162
Energy: 1.0466421730386537
Energy: 1.173781771067162
Energy: 0.9542253524584253
Energy: 1.1022049961634246
Energy: 1.4023284408230183
Energy: 1.1022049961592086
Energy: 1.0719545433813777
Energy: 1.0650500727297463
Energy: 1.0580737894598808
Energy: 1.065050072728903
Energy: 1.372800155095812
Energy: 1.044009702041132
Energy: 1.0494790606502884
Energy: 1.044009702027641
Energy: 0.9562738552769067
Energy: 1.1627281080575678
Energy: 1.1660704508927924
Energy: 1.1627281080533518
Energy: 1.1125064091262304
Energy: 1.0656207710007437
Energy: 1.0816933437317708
Energy: 1.0656207709999004
Energy: 1.1635757909547089
Energy: 1.2295083184467543
Energy: 1.1642302664007138
Energy: 1.2295083184484408
Energy: 1.0596673137758854
Energy: 1.1506737421087474
Energy: 1.2559458616197878
Energy: 1.1506737421087474
Energy: 1.3703552155235423
Energy: 1.2887252735058428
Energy: 0.9649473750684079
Energy: 1.2887252735049997
Energy: 0.9987994532711827
Energy: 1.1809612077175353
Energy: 1.0280102276290721
Energy: 1.1809612077183786
Energy: 1.0720973203614899
Energy: 1.0584074139061819
Energy: 1.0698211854801516
Energy: 1.0584074138033894
Energy: 1.0583524405418416
Energy: 1.0941574575520494
Energy: 1.1620144337449423
Energy: 1.0941574575512063
Energy: 1.0345073279578372
Energy: 1.109318629201076
Energy: 1.2955873702943332
Energy: 1.1093186292019195
Energy: 1.1724016111665592
Energy: 1.2343867940715973
Energy: 0.9517055524429124
Energy: 1.2343867940715973
Energy: 1.0557951444147557
Energy: 1.1827820081605147
Energy: 1.2163846701467338
Energy: 1.1827820081605147
Energy: 1.044294514447188
Energy: 1.3233333007440606
Energy: 1.218182244250391
Energy: 1.3233333007440606
Energy: 1.2832169827597835
Energy: 1.102245426615522
Energy: 0.953133516093728
Energy: 1.102245426616365
Energy: 1.0163887642924871
Energy: 1.2561546423048586
Energy: 1.3139019321401715
Energy: 1.2561546423048586
Energy: 1.1629856106061853
Energy: 1.0584462734952251
Energy: 1.1631558479034727
Energy: 1.058446273606488
Energy: 1.2555336393250225
Energy: 1.1947955171535696
Energy: 1.0607269150746543
Energy: 1.1947955171535696
Energy: 0.9645614188637972
Energy: 1.1834638115325964
Energy: 1.2223177859562266
Energy: 1.1834638115317533

minimum gb energy = 0.9517055524429124 eV
minimum distance =  2.27236109901557 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 0.8986057709041346
Energy: 0.8984616343006194
Energy: 1.4185390392592612
Energy: 0.8984616343025607
Energy: 1.1825684286533105
Energy: 1.2020154006846007
Energy: 1.048423469643535
Energy: 1.2020154006846007
Energy: 0.9174915312956335
Energy: 0.9184450922172113
Energy: 1.1652802292377795
Energy: 0.9184450922172113
Energy: 0.9174582024507003
Energy: 1.164755771628023
Energy: 1.0586466974124453
Energy: 1.164755771628023
Energy: 1.1824956005949419
Energy: 1.201961165290521
Energy: 0.9310180359295528
Energy: 1.201961165290521
Energy: 0.8986057709041346
Energy: 0.8984616343006194
Energy: 1.3732541563250373
Energy: 0.8984616343006194
Energy: 1.1825684286552518
Energy: 1.2020154006826598
Energy: 1.1507234166248856
Energy: 1.2020154006846007
Energy: 0.9174915312956335
Energy: 0.9184450922172113
Energy: 1.1652802292377795
Energy: 0.9184450922153143
Energy: 0.9174582024507003
Energy: 1.1647557716260821
Energy: 1.0726340387392284
Energy: 1.164755771628023
Energy: 1.1824956005949419
Energy: 1.2019611652924622
Energy: 1.0501150936801895
Energy: 1.201961165290521
Energy: 0.8986057709041346
Energy: 0.8984616343006194
Energy: 1.4538131187259304
Energy: 0.8984616343025607
Energy: 1.1825684286533105
Energy: 1.2020154006826598
Energy: 1.1507234166248856
Energy: 1.2020154006846007
Energy: 0.9174915312956335
Energy: 0.9184450922172113
Energy: 1.1652802292377795
Energy: 0.9184450922172113

minimum gb energy = 0.8984616343006194 eV
minimum distance =  2.34353922197698 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 0.9906798705486101
Energy: 1.3351551078463486
Energy: 1.3886002439196867
Energy: 1.3351551078470674
Energy: 1.3220197284636266
Energy: 1.103149508674494
Energy: 1.0707718002695479
Energy: 1.103149508674494
Energy: 1.207448649448597
Energy: 1.19797236328116
Energy: 1.0123313808527328
Energy: 1.19797236328116
Energy: 1.4273850122627187
Energy: 1.2798782071125725
Energy: 1.0953331435078304
Energy: 1.2798782071118542
Energy: 1.3576135937960254
Energy: 1.0378519206851953
Energy: 1.0746633852364336
Energy: 1.0378519206859136
Energy: 0.9794868687486005
Energy: 0.9793770285533314
Energy: 1.473783160878849
Energy: 0.9793770285526129
Energy: 1.4849425566587215
Energy: 1.3927286493171935
Energy: 1.0567350516935612
Energy: 1.3927286493171935
Energy: 1.2084744170133705
Energy: 1.3163608719074775
Energy: 1.2563794893099747
Energy: 1.3163608719081958
Energy: 1.2142718555593084
Energy: 1.359971563389082
Energy: 0.9877784455689691
Energy: 1.359971563390519
Energy: 1.0602102473735762
Energy: 1.0820376839314163
Energy: 1.0440644436435864
Energy: 1.0820376839314163
Energy: 1.1157517076997858
Energy: 1.3555890800390995
Energy: 1.4416542866373423
Energy: 1.3555890800390995
Energy: 1.3173887794099646
Energy: 1.3290812210847587
Energy: 1.0180154609033802
Energy: 1.329081221085477
Energy: 1.073504170643933
Energy: 1.0863040670078197
Energy: 1.3495642978150106
Energy: 1.0863040670028232
Energy: 1.4267893470071251
Energy: 1.328778910835106
Energy: 0.9933672285371838
Energy: 1.328778910835106
Energy: 1.059172699988229
Energy: 1.2293121168906873
Energy: 1.2330687743682955
Energy: 1.229312116889969
Energy: 1.0411311628497448
Energy: 1.2881656165437219
Energy: 1.2486100968734875
Energy: 1.2881656165444404
Energy: 1.1801558027128394
Energy: 1.2305658153791192
Energy: 1.0593204128352167
Energy: 1.2305658153791192
Energy: 1.103886443735199
Energy: 1.034556733489737
Energy: 1.4738534694285303
Energy: 1.0345567334904555
Energy: 1.4698501033687548
Energy: 1.1719116213480387
Energy: 0.9822355545320332
Energy: 1.1719116213501943
Energy: 1.0178156054799516
Energy: 1.110861042623988
Energy: 1.2244355087756211
Energy: 1.110861042623988
Energy: 1.2593435062322607
Energy: 1.24376779577933
Energy: 1.2576949149792798
Energy: 1.243767795778612
Energy: 1.139390338002516
Energy: 1.1569317155984875
Energy: 1.0559937465507117
Energy: 1.1569317155984875
Energy: 0.9871122119739909
Energy: 1.171540748260887
Energy: 1.1428904838263148
Energy: 1.17154074825945
Energy: 1.4375188082380776
Energy: 1.3358250762358048
Energy: 1.1133703081799369
Energy: 1.3358250762365236
Energy: 1.0563000587279625
Energy: 1.2952179062640592
Energy: 1.4029940791838555
Energy: 1.2952179062640592
Energy: 1.189794691157465
Energy: 1.069696243075627
Energy: 1.110695154049918
Energy: 1.069696243075627
Energy: 1.133152561872672
Energy: 1.2303322764128075
Energy: 1.272395270395755
Energy: 1.2303322764128075
Energy: 0.9971033612536899
Energy: 1.263774891376625
Energy: 1.2767409417933235
Energy: 1.2637748913773434
Energy: 1.129207122817199
Energy: 0.9796003741801569
Energy: 1.1093175863165703
Energy: 0.9796003741794386
Energy: 1.0228519244145828
Energy: 1.3977263453636213
Energy: 1.4091518538830476
Energy: 1.397726345366495
Energy: 1.3588427003984387
Energy: 1.3525457617468322
Energy: 1.1125295583648436
Energy: 1.3525457617461136
Energy: 0.9929033731780055
Energy: 1.036134896603997
Energy: 1.1421878022926732
Energy: 1.0361348966018418
Energy: 0.9801799924872056
Energy: 1.1560057627107927
Energy: 1.189264840152296
Energy: 1.1560057627107927
Energy: 1.2615699318548839
Energy: 1.3666936996240977
Energy: 1.255612691499186
Energy: 1.3666936996240977
Energy: 1.0503825274442358
Energy: 1.2148554451961344
Energy: 1.4889828444163353
Energy: 1.2148554451954159

minimum gb energy = 0.9793770285526129 eV
minimum distance =  2.30396753835449 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.0532658485255106
Energy: 1.0741678274428206
Energy: 1.484698304915367
Energy: 1.0741678274564994
Energy: 1.32317868307961
Energy: 1.0772979573038737
Energy: 1.0532775651304642
Energy: 1.0772979573061534
Energy: 1.0997001513080094
Energy: 1.0572344751262162
Energy: 1.0046829057847988
Energy: 1.0572344751262162
Energy: 1.2522423992732339
Energy: 1.1439189305440407
Energy: 1.0918303390778514
Energy: 1.143918930542901
Energy: 1.1320880324441867
Energy: 1.124727021865202
Energy: 0.990780736379171
Energy: 1.124727021865202
Energy: 1.1557216401655672
Energy: 1.008390338466961
Energy: 1.409359997110999
Energy: 1.008390338466961
Energy: 1.4941970782062513
Energy: 1.2684159009497624
Energy: 1.102095845303662
Energy: 1.2684159009486227
Energy: 1.0849757156895492
Energy: 1.202215258420101
Energy: 1.337271012874908
Energy: 1.2022152584212409
Energy: 1.4200869614014073
Energy: 0.9803177954758822
Energy: 0.9799762040769318
Energy: 0.9803177954758822
Energy: 1.058451378017929
Energy: 1.1658586561787065
Energy: 0.9812113478940382
Energy: 1.1658586561798465
Energy: 1.0794346607458165
Energy: 1.05697120232654
Energy: 1.3780827079641416
Energy: 1.05697120232654
Energy: 1.2811117974030746
Energy: 1.1709866161007232
Energy: 1.0701041522507615
Energy: 1.1709866161007232
Energy: 1.1173249242800218
Energy: 1.1885427678804261
Energy: 1.5882856648846653
Energy: 1.1885427678804261
Energy: 1.3794193801580918
Energy: 1.170872386997301
Energy: 1.1408283143542928
Energy: 1.170872386997301
Energy: 0.9909517230099543
Energy: 1.2622758731565153
Energy: 1.3847676510470321
Energy: 1.2622758731553754
Energy: 1.3336558471116238
Energy: 1.1107960838500628
Energy: 1.0525269769849295
Energy: 1.1107960838500628
Energy: 1.0521396098276876
Energy: 1.1167193117344343
Energy: 1.0997962052146728
Energy: 1.1167193117344343
Energy: 1.0514844336743692
Energy: 1.0735299443365744
Energy: 1.1051911920138107
Energy: 1.073529944333155
Energy: 1.041156870003709
Energy: 0.9798075973001676
Energy: 1.143362482917894
Energy: 0.9798075973001676
Energy: 1.0608154333809139
Energy: 1.3759204393336837
Energy: 1.4553383569529599
Energy: 1.3759204393336837
Energy: 1.3829709857477868
Energy: 1.1422055622712015
Energy: 1.1548785312304346
Energy: 1.1422055622723415
Energy: 1.12542017637634
Energy: 1.1130846572131203
Energy: 1.4169404546628628
Energy: 1.1130846572131203

minimum gb energy = 0.9798075973001676 eV
minimum distance =  2.30342973083353 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.0005315883957753
Energy: 0.9997699348317913
Energy: 1.492932396698939
Energy: 0.9997699348301792
Energy: 1.4817829090068895
Energy: 1.120632226790931
Energy: 1.1125284846630863
Energy: 1.120632226790125
Energy: 1.1075126874304577
Energy: 1.1645259091458748
Energy: 1.0658834077822925
Energy: 1.164525909144263
Energy: 1.1372163686272503
Energy: 1.069133868387031
Energy: 1.1191624856484121
Energy: 1.0691338683862617
Energy: 1.0626924055171838
Energy: 1.1013993522512109
Energy: 1.0124192910810714
Energy: 1.1013993522504049
Energy: 1.1163162582574666
Energy: 1.1054915653987265
Energy: 1.3688282705691117
Energy: 1.1054915654019506
Energy: 1.3966094904370092
Energy: 1.3697998816722727
Energy: 1.1401946429477554
Energy: 1.3697998816698544
Energy: 1.1159645468859571
Energy: 1.0015748019541284
Energy: 1.5124109054537271
Energy: 1.0015748019533224
Energy: 1.394341546150856
Energy: 1.0609908416599512
Energy: 1.1164319856818654
Energy: 1.0609908416583391
Energy: 1.0667826413470556
Energy: 1.180355823221629
Energy: 1.288566457222119
Energy: 1.1803558232224352
Energy: 1.138212673282798
Energy: 1.1644939648915058
Energy: 1.1599647205113086
Energy: 1.1644939648923116
Energy: 1.002012322547765
Energy: 1.101390653763201
Energy: 1.1171975827070326
Energy: 1.101390653762395
Energy: 1.010912137438895
Energy: 1.0008403280006397
Energy: 1.2589034314096905
Energy: 1.0008403279974156
Energy: 1.1387537268929182
Energy: 0.9964435858919511
Energy: 1.2196181989355734
Energy: 0.9964435858927573
Energy: 1.0649829524173526
Energy: 1.313798121224277
Energy: 1.409108435636685
Energy: 1.313798121224277
Energy: 1.470408653814548
Energy: 0.9955894540386351
Energy: 1.1430332364507272
Energy: 0.9955894540370229
Energy: 1.0733709991660874
Energy: 1.101643427996092
Energy: 1.2631891513764406
Energy: 1.101643427996092
Energy: 1.0255279007248366
Energy: 1.0695304961413061
Energy: 1.1168208011075533
Energy: 1.0695304961437244
Energy: 1.0740597327084855
Energy: 1.1035796682509877
Energy: 1.036504996046292
Energy: 1.1035796682517938
Energy: 1.0758155287421154
Energy: 1.0877120983994315
Energy: 1.123640584041716
Energy: 1.0877120983994315
Energy: 1.1354885835194533
Energy: 1.2076915448492842
Energy: 1.1165638658979582
Energy: 1.2076915448517023
Energy: 1.1061938802592068
Energy: 1.261678827736323
Energy: 1.330767197274574
Energy: 1.2616788277355167
Energy: 1.4387395666622775
Energy: 1.1161961236543494
Energy: 1.1606371642009505
Energy: 1.1161961236535436
Energy: 1.0048952134961207
Energy: 1.0012070484369449
Energy: 1.530807551753074
Energy: 1.0012070484337208
Energy: 1.2064473198058285
Energy: 1.130308055962422
Energy: 1.05566986323489
Energy: 1.130308055962422
Energy: 1.1715553854318577
Energy: 1.162006482727715
Energy: 1.1384013423948003
Energy: 1.162006482729327
Energy: 1.061566591123771
Energy: 1.126984007180977
Energy: 1.092132787701349
Energy: 1.126984007180977
Energy: 1.2360375050441113
Energy: 1.101606501511398
Energy: 1.1190061365693664
Energy: 1.101606501510592
Energy: 1.0933772684593766
Energy: 1.1044938197112721
Energy: 1.3131363211637077
Energy: 1.10449381970966
Energy: 1.3046925351958447
Energy: 1.2833023861753063
Energy: 1.14812863501471
Energy: 1.2833023861753063
Energy: 1.0933211726370622
Energy: 1.1042285794277464
Energy: 1.356146669476563
Energy: 1.1042285794261344

minimum gb energy = 0.9955894540370229 eV
minimum distance =  2.29789581460357 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9428599829437213
Energy: 0.9423441408723253
Energy: 1.295780399131353
Energy: 0.9423441408720447
Energy: 1.4061204789251738
Energy: 1.1741710308363822
Energy: 0.9407402305862756
Energy: 1.1741710308377546
Energy: 1.0231692713011296
Energy: 1.1270016224141663
Energy: 1.1602106704895123
Energy: 1.1270016224138855
Energy: 0.9410280625905472
Energy: 0.9131081754522871
Energy: 1.173465253632139
Energy: 0.9131081754517254
Energy: 0.943474369495921
Energy: 0.9131167195184979
Energy: 1.1615637318778873
Energy: 0.9131167163074625
Energy: 1.171526227495517
Energy: 0.9931995321319499
Energy: 1.1714964774641714
Energy: 0.9931995321317003
Energy: 0.9126428503543388
Energy: 0.9132229769050824
Energy: 0.9434560586620087
Energy: 0.9132229769116645
Energy: 1.1748734783266406
Energy: 0.9170776372823856
Energy: 0.9407961299126324
Energy: 0.9170776372821049
Energy: 1.160047654010623
Energy: 1.1270088376414862
Energy: 1.1106612249190455
Energy: 1.127008837641767

minimum gb energy = 0.9126428503543388 eV
minimum distance =  2.33824435964538 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 0.9383796188834418
Energy: 0.9445722407738816
Energy: 1.3587834096622824
Energy: 0.944572240774643
Energy: 1.1360171656332554
Energy: 1.4110175084107204
Energy: 0.9552200800040355
Energy: 1.4110175084107204
Energy: 0.9241916044121717
Energy: 0.9415840279053604
Energy: 1.1722335492199443
Energy: 0.9415840279053604
Energy: 0.9939883000868117
Energy: 0.9921226275184828
Energy: 0.9265155393097251
Energy: 0.9921226275184828
Energy: 0.9368049742474155
Energy: 0.9971517777134902
Energy: 1.1421954944947057
Energy: 0.9971517776807851
Energy: 1.0931078429075034
Energy: 1.0658420709960914
Energy: 0.9243449445065754
Energy: 1.0658420709968528
Energy: 0.9209124300930661
Energy: 0.9954683638030376
Energy: 0.918513506175677
Energy: 0.9954683638030376
Energy: 0.9209135084330355
Energy: 0.9464423005594349
Energy: 0.9375555353766881
Energy: 0.9464423005548664
Energy: 0.9236314449533611
Energy: 0.9966373890968275
Energy: 0.9675975239417456
Energy: 0.9966373890983503
Energy: 0.923351597426834
Energy: 0.9959245073602102
Energy: 0.923893290583339
Energy: 0.9959245073602102
Energy: 0.9659928454910465
Energy: 1.1727551287076978
Energy: 0.9259556307455765
Energy: 1.1727551296970513
Energy: 0.9573222684133825
Energy: 0.9346117397501792
Energy: 0.9447331477477774
Energy: 0.9346117397600426
Energy: 1.0689797427153203
Energy: 0.9464263720861149
Energy: 0.9479721493795874
Energy: 0.9464263720868763
Energy: 0.9354277995387681
Energy: 1.2448496036105865
Energy: 1.2500423642633602
Energy: 1.2448496036105865
Energy: 1.491234917477511
Energy: 1.2638447642171473
Energy: 0.9253881584689613
Energy: 1.2638447642163857
Energy: 0.925112082134087
Energy: 0.9418910010525768
Energy: 1.2140753542810296
Energy: 0.941891001054861
Energy: 1.135616418436505
Energy: 0.9347712592587425
Energy: 0.9368285719603544
Energy: 0.9347712592602653
Energy: 0.9279873590919491
Energy: 0.9454057650663211
Energy: 1.3505329256898337
Energy: 0.94540576504123
Energy: 0.9223808643769557
Energy: 0.9959023095821222
Energy: 0.9254888022562094
Energy: 0.9959023095821222
Energy: 0.9347099241696214
Energy: 1.1310754581837223
Energy: 0.9328248751569015
Energy: 1.1310754575383428
Energy: 0.9423321429938063
Energy: 0.991146207708435
Energy: 0.9286841574657566
Energy: 0.991146207708435
Energy: 0.9600896553067096
Energy: 0.9955329026533069
Energy: 0.9234999603953796
Energy: 0.9955329026533069
Energy: 0.928436547837267
Energy: 1.1714486065796261
Energy: 0.9685332064707841
Energy: 1.1714486065796261
Energy: 0.9447613968424776
Energy: 0.9494148403179152
Energy: 0.9572183399301972
Energy: 0.9494148403179152
Energy: 0.9513892696647457
Energy: 0.9406853474911389
Energy: 0.9563067566609542
Energy: 0.9406853474934229
Energy: 0.9645160561284866
Energy: 0.9463394779692718
Energy: 0.9387264616304967
Energy: 0.9463394779433846
Energy: 0.9283798106776042
Energy: 0.9183277119164382
Energy: 1.0736122278136584
Energy: 0.9183277119171996
Energy: 1.2261692720269526
Energy: 1.177194193614721
Energy: 0.9250083009854906
Energy: 1.177194193614721
Energy: 0.931265514358869
Energy: 1.1687217162978716
Energy: 1.2582904370659715
Energy: 1.1687217163054853
Energy: 1.3131381020607302
Energy: 1.04069315602904
Energy: 0.9276273501913103
Energy: 1.0406931560298014
Energy: 0.9226339625821489
Energy: 0.9313168882834993
Energy: 1.2993660511293912
Energy: 0.9313168882842607
Energy: 1.135377855991921
Energy: 1.0024585494862055
Energy: 0.9316393867022331
Energy: 1.002458549485444
Energy: 0.9266407281499597
Energy: 1.1912075870133982
Energy: 1.0117510699550063
Energy: 1.1912075870133982

minimum gb energy = 0.9183277119164382 eV
minimum distance =  2.26396346097432 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.0066465965446219
Energy: 1.0802015845608575
Energy: 1.285484193993413
Energy: 1.0802015845608575
Energy: 0.9233033871003509
Energy: 0.8777999273285664
Energy: 0.8972848591289415
Energy: 0.8777999273285664
Energy: 0.8899371001749843
Energy: 0.9064956009337333
Energy: 1.077828852311507
Energy: 0.906495600934786
Energy: 0.904490267257617
Energy: 0.9738405646830829
Energy: 0.8978072901243597
Energy: 0.9738405646830829
Energy: 0.8963063952177255
Energy: 0.9038837542206848
Energy: 1.1571190458740304
Energy: 0.9038837542206848
Energy: 0.8954086311582455
Energy: 1.1019968535916354
Energy: 0.8976598425625929
Energy: 1.1019968535926878
Energy: 0.8899800326392139
Energy: 1.0011532712057443
Energy: 0.9026934166475978
Energy: 1.0011532712057443
Energy: 0.8902679844659671
Energy: 0.909003341860903
Energy: 0.9375427503252638
Energy: 0.909003341860903
Energy: 0.9062571930197705
Energy: 0.912575401165694
Energy: 0.9532106795581007
Energy: 0.912575401165694
Energy: 0.9062918595572222
Energy: 1.130686922980585
Energy: 0.9260682128925688
Energy: 1.130686922980585
Energy: 0.8898878175941047
Energy: 1.071141445503826
Energy: 0.9156032764019812
Energy: 1.0711414455027732
Energy: 0.8901175998351548
Energy: 1.1033957684597144
Energy: 1.056339568797979
Energy: 1.1033957684597144
Energy: 0.8954887335193658
Energy: 1.2002962888300133
Energy: 0.8995005909589558
Energy: 1.2002962888310658
Energy: 0.8961648944412081
Energy: 0.9097256692192289
Energy: 1.2132849984044851
Energy: 0.9097256692192289
Energy: 0.95838825489928
Energy: 0.9706300439685154
Energy: 0.8995662725003069
Energy: 0.9706300439695681
Energy: 0.8896941808278419
Energy: 0.9069029718717901
Energy: 1.181937231231237
Energy: 0.9069029718717901
Energy: 1.0633617840307532
Energy: 1.3258171139997241
Energy: 0.8940271332596385
Energy: 1.3258171141891222
Energy: 1.0066465965446219
Energy: 1.0802015845608575
Energy: 1.2856113918146501
Energy: 1.0802015845608575
Energy: 0.9233033871024563
Energy: 0.8777999273285664
Energy: 0.8972848591289415
Energy: 0.8777999273275137
Energy: 0.8899371001749843
Energy: 0.906495600934786
Energy: 1.0778288523104544
Energy: 0.906495600934786
Energy: 0.9044902672586699
Energy: 0.9738405646830829
Energy: 0.8978072901243597
Energy: 0.9738405646841356
Energy: 0.8963063952187783
Energy: 0.9038837542217374
Energy: 1.1571190459024545
Energy: 0.9038837542217374
Energy: 0.8954086311582455
Energy: 1.1019968535926878
Energy: 0.8976598425636457
Energy: 1.1019968535926878
Energy: 0.8899800326392139
Energy: 1.0011532712057443
Energy: 0.9026934166475978
Energy: 1.0011532712057443

minimum gb energy = 0.8777999273275137 eV
minimum distance =  2.30848547816255 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 0.9016070169029939
Energy: 0.9021404834831349
Energy: 1.2288124971407854
Energy: 0.9021404834831349
Energy: 1.083612275684009
Energy: 0.8937051022086798
Energy: 0.8841194598279605
Energy: 0.8937051022080291
Energy: 0.881565733607052
Energy: 0.8950610386053068
Energy: 1.1106521495242792
Energy: 0.8950610386053068
Energy: 1.010718801270308
Energy: 1.0782616873640398
Energy: 0.8799529590616926
Energy: 1.0782616873627384
Energy: 0.8838601301511625
Energy: 0.8993049653480238
Energy: 1.1928229748775074
Energy: 0.8993049653408663
Energy: 0.9445475531285137
Energy: 1.2443647906326079
Energy: 0.8883875592480374
Energy: 1.2443647906358615
Energy: 0.8995241097126995
Energy: 1.0931367482100474
Energy: 0.8926440485949118
Energy: 1.093136748210698
Energy: 0.8874872811535935
Energy: 1.1111636197714219
Energy: 0.8808899015938194
Energy: 1.1111636197720725
Energy: 0.9025020368530281
Energy: 1.1284031943745856
Energy: 0.9301739990915625
Energy: 1.1284031943739348
Energy: 0.905976771348766
Energy: 1.112235978583114
Energy: 0.8906111239017446
Energy: 1.1122359785837646
Energy: 0.8862947965805774
Energy: 1.097418554142723
Energy: 0.8883629513922615
Energy: 1.0974185541420722
Energy: 0.8874695929706368
Energy: 0.942361424162734
Energy: 0.8747390463943496
Energy: 0.9423614241620835
Energy: 0.8902370414248113
Energy: 1.1054616573487348
Energy: 0.8827609936306927
Energy: 1.1054616573487348
Energy: 0.8992826275745553
Energy: 1.1052477845151425
Energy: 0.9012316058891022
Energy: 1.1052477845144917
Energy: 0.896294565545843
Energy: 1.1155205947183704
Energy: 0.9089971584289374
Energy: 1.1155205947183704
Energy: 0.8870722249512516
Energy: 0.8960574351260217
Energy: 1.1893214598199973
Energy: 0.8960574351208163
Energy: 0.8838456394027011
Energy: 1.0816854390168413
Energy: 0.8832743456095
Energy: 1.0816854390161907
Energy: 0.8766500670192632
Energy: 0.9868698870932751
Energy: 1.0822914622703956
Energy: 0.9868698870939258
Energy: 1.430110944594324
Energy: 1.3180261478168722
Energy: 0.883920797083787
Energy: 1.3180261478097146
Energy: 0.8854455219999268
Energy: 0.892714853795847
Energy: 1.0945114946494308
Energy: 0.8927148537951963
Energy: 1.3663207627962812
Energy: 0.8887678792763116
Energy: 0.8981870796097003
Energy: 0.8887678792763116
Energy: 0.8986836370562484
Energy: 0.9894544005075172
Energy: 1.2411287883161928
Energy: 0.9894544005088185
Energy: 0.9897916820150859
Energy: 1.0866931626689416
Energy: 0.8864553206331355
Energy: 1.0866931626695921
Energy: 0.883962962848308
Energy: 0.8871977376394246
Energy: 1.1346764905283753
Energy: 0.8871977376355206
Energy: 0.9483237290119384
Energy: 0.9871177300451864
Energy: 0.8783004376092299
Energy: 0.9871177300458371
Energy: 0.8847452696670276
Energy: 0.959252499986597
Energy: 0.8833522492281467
Energy: 0.9592524999859463
Energy: 1.0754115983658055
Energy: 1.1097894026483321
Energy: 0.8879653335956891
Energy: 1.109789402648983
Energy: 0.9122630635763846
Energy: 1.115674903411438
Energy: 0.8965952730174617
Energy: 1.115674903411438
Energy: 0.9154972982990187
Energy: 1.1051792488288261
Energy: 0.9020301266733434
Energy: 1.1051792488268741
Energy: 0.8845503223794969
Energy: 1.1060107428124708
Energy: 0.9049473313469414
Energy: 1.1060107428105186
Energy: 0.8747881195113034
Energy: 0.9568667971263257
Energy: 0.8763824538611071
Energy: 0.9568667971269764
Energy: 0.8862396073063703
Energy: 1.0968066130528074
Energy: 0.8838582370076378
Energy: 1.0968066130521568
Energy: 0.8881016313413208
Energy: 1.1132000573578484
Energy: 1.0819222903827268
Energy: 1.113200057358499
Energy: 0.9324862882563851
Energy: 1.1276623424716297
Energy: 0.8909727545419414
Energy: 1.1276623424722803
Energy: 0.879571252009332
Energy: 0.9025226353045185
Energy: 0.907261390562039
Energy: 0.9025226354222323
Energy: 0.8928593293363974
Energy: 1.093752208779463
Energy: 0.9008423806512569
Energy: 1.093752208779463
Energy: 0.8864563745000248
Energy: 1.2887070585191571
Energy: 0.9445261544999772
Energy: 1.2887070585211093
Energy: 1.190552916218373
Energy: 1.1006161973511999
Energy: 0.8849742433472205
Energy: 1.100616197336234

minimum gb energy = 0.8747390463943496 eV
minimum distance =  2.28952688204505 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 0.8002610964359809
Energy: 0.8001413103386203
Energy: 0.8609487642652137
Energy: 0.8001413103386203
Energy: 0.801238019975047
Energy: 0.8225051597414609
Energy: 0.8119854242240366
Energy: 0.8225051597414609
Energy: 0.8102445669479069
Energy: 1.2467715360190612
Energy: 1.4725299911859524
Energy: 1.2467715360190612
Energy: 0.8637836155194027
Energy: 0.8221306655464101
Energy: 0.8121240129379674
Energy: 0.8221306655464101
Energy: 0.8096350373448802
Energy: 1.1494504582950589
Energy: 1.1481340078765674
Energy: 1.1494504582950589
Energy: 0.809787164795443
Energy: 0.8008936602115898
Energy: 0.8029090283457228
Energy: 0.8008936602098872
Energy: 0.8104221735363102
Energy: 0.9428873651947578
Energy: 0.800491175206233
Energy: 0.9428873651947578
Energy: 0.8306762537340067
Energy: 1.2075326888129343
Energy: 0.8119859540902704
Energy: 1.2075326888129343
Energy: 0.8110442538454198
Energy: 0.8860149958479339
Energy: 0.8036242915840829
Energy: 0.8860149958479339
Energy: 0.8216602670620609
Energy: 1.149276494209308
Energy: 0.8098700774156551
Energy: 1.1492764942110105
Energy: 0.7999718932127161
Energy: 0.8227364642030007
Energy: 0.8095788842296078
Energy: 0.8227364642030007
Energy: 0.800132787734838
Energy: 0.9438387905022502
Energy: 0.8121204982152198
Energy: 0.9438387905022502
Energy: 0.8111546012196216
Energy: 1.1508711495362065
Energy: 0.830604734045781
Energy: 1.1508711495362065
Energy: 0.8111448636456303
Energy: 0.8835857609110929
Energy: 0.810601212959138
Energy: 0.8835857609110929
Energy: 0.8034292642219623
Energy: 1.1508072605858988
Energy: 0.8110831783903965
Energy: 1.1508072605858988

minimum gb energy = 0.7999718932127161 eV
minimum distance =  2.29352042574854 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 0.7989848010029537
Energy: 1.1277409815137844
Energy: 1.229253644783576
Energy: 1.127740981513071
Energy: 1.2653299864917003
Energy: 1.155878780852069
Energy: 0.7741522612721795
Energy: 1.1558787808527824
Energy: 0.7784471829642811
Energy: 1.0359454572870705
Energy: 0.9705095637946699
Energy: 1.0359454572849296
Energy: 0.774804233634767
Energy: 1.026546940404393
Energy: 0.7720890246779648
Energy: 1.026546940402966
Energy: 0.7854814325154322
Energy: 1.2922219595026192
Energy: 0.8198043913075808
Energy: 1.2922219595069009
Energy: 0.7744936928290296
Energy: 0.908948232625807
Energy: 0.7835511466154053
Energy: 0.9089482326250935
Energy: 0.782645043009449
Energy: 1.292018444907231
Energy: 1.1157855569439925
Energy: 1.292018444907231
Energy: 0.7750288507471694
Energy: 1.0459607311718575
Energy: 0.7834973391805308
Energy: 1.0459607311575856
Energy: 0.782613789361296
Energy: 1.2460448365075087
Energy: 0.9846749605406248
Energy: 1.2460448365089358
Energy: 0.950955328196765
Energy: 1.3157328914614341
Energy: 0.7719817892704488
Energy: 1.3157328914621478
Energy: 0.7848463987271098
Energy: 0.8537466158644201
Energy: 0.7734029627275869
Energy: 0.853746615866561
Energy: 1.0557866243562943
Energy: 1.2582590906449784
Energy: 0.7767296965731655
Energy: 1.2582590906692404
Energy: 0.8073797354111539
Energy: 0.786817160769278
Energy: 0.8118870679252094
Energy: 0.7868171607699918
Energy: 1.048267922139503
Energy: 1.1550933718855751
Energy: 0.7766629088896052
Energy: 1.1550933726923172
Energy: 0.7847124825626519
Energy: 0.9177279337422866
Energy: 0.7879319337959422
Energy: 0.917727933745141
Energy: 0.7730187860863539
Energy: 0.9662470436248743
Energy: 0.7797708697409446
Energy: 0.9662470436248743
Energy: 0.7823494566618926
Energy: 1.1248821919805698
Energy: 0.7792040740261678
Energy: 1.1248821919848517
Energy: 0.8045426445153525
Energy: 0.8368616684158472
Energy: 0.792040382706187
Energy: 0.8368616683958667
Energy: 0.7828773403353996
Energy: 1.0971730593665985
Energy: 0.7923817549854876
Energy: 1.0971730593651714
Energy: 0.7828804648987602
Energy: 1.0978153324073574
Energy: 0.7921137914764441
Energy: 1.0978153324080708
Energy: 0.8043831318978154
Energy: 0.8373570762339952
Energy: 0.7924020314575241
Energy: 0.837357076231141
Energy: 0.7827238387722116
Energy: 1.1245533979598026
Energy: 0.7792277340118503
Energy: 1.1245533979605162
Energy: 0.7731178291721904
Energy: 0.9921071977007925
Energy: 0.7786897891357507
Energy: 0.9921071968997593
Energy: 0.7850345174227673
Energy: 0.9169222713216504
Energy: 0.7793147922542818
Energy: 0.91692227130167
Energy: 1.0494010923498291
Energy: 0.9666709582536205
Energy: 0.778082216976091
Energy: 0.9666709582764552
Energy: 0.8074237004082383
Energy: 0.7870292870874855
Energy: 0.7854939209494081
Energy: 0.7870292870860585
Energy: 1.055590721436111
Energy: 1.2779147679123373
Energy: 0.7779416082874868
Energy: 1.2779147679130507
Energy: 0.7840865157562593
Energy: 1.0149644792569796
Energy: 0.7700131346400123
Energy: 1.0149644792576933
Energy: 0.951641307750619
Energy: 1.3098239799088314
Energy: 0.7719297136132042
Energy: 1.3098239799102585
Energy: 0.7826644517976443
Energy: 0.9559975166768612
Energy: 0.9020173914807347
Energy: 0.9559975175534694
Energy: 0.7759909412914102
Energy: 1.0458570849820847
Energy: 0.7837407062417479
Energy: 1.0458570849841604
Energy: 0.786091170623476
Energy: 1.24967163855193
Energy: 1.1359406797147635
Energy: 1.2496716385512163
Energy: 0.7744816453278816
Energy: 0.9099588844314734
Energy: 0.7835467565180191
Energy: 0.9099588844407501
Energy: 0.7850589932410992
Energy: 1.286140051685956
Energy: 1.050523420283248
Energy: 1.2861400517986377
Energy: 0.7740528381293684
Energy: 1.1428395158278133
Energy: 0.7720941841812969
Energy: 1.1428395158270996

minimum gb energy = 0.7700131346400123 eV
minimum distance =  2.31181677016692 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 0.8416334251571334
Energy: 0.8417743472819934
Energy: 0.7322508340120781
Energy: 0.8417743472819934
Energy: 1.2815424334873535
Energy: 1.0399037459254499
Energy: 0.716671149062499
Energy: 1.0399037459254499
Energy: 0.7295665855507852
Energy: 1.1536405435525
Energy: 1.0094867064731674
Energy: 1.1536405435525
Energy: 0.8070321857836289
Energy: 0.8313007731232078
Energy: 0.7175056926796246
Energy: 0.8313007731232078
Energy: 0.716430909213849
Energy: 1.0430632539654474
Energy: 0.7878438982023493
Energy: 1.0430632539642195
Energy: 0.7220281301100775
Energy: 1.1452726534285094
Energy: 0.808371359483717
Energy: 1.1452726534297093
Energy: 0.7243817193773852
Energy: 1.2707021700008427
Energy: 1.0478771668154214
Energy: 1.2707021700008427
Energy: 0.705735238918571
Energy: 0.7331598605604907
Energy: 0.7356569796227257
Energy: 0.7331598605592631
Energy: 0.717348158380011
Energy: 1.0479183082635706
Energy: 1.052096775242918
Energy: 1.0479183082635706
Energy: 1.0146986887655545
Energy: 1.3180126317232745
Energy: 0.8079475761287761
Energy: 1.3180126317245022
Energy: 0.7164922035524637
Energy: 1.1701451396839642
Energy: 0.8064673801605934
Energy: 1.1701451396851916
Energy: 0.9644831133109295
Energy: 1.0276571166894304
Energy: 0.7170354086344664
Energy: 1.0276571166906578
Energy: 0.8113539042312977
Energy: 1.1422330956267697
Energy: 0.7087115854522308
Energy: 1.1422330956267697
Energy: 1.0495468516507078
Energy: 1.2974231804930167
Energy: 0.7054046171381387
Energy: 1.2974231804967
Energy: 0.8406469579869971
Energy: 0.8601150619943811
Energy: 0.7056854706244517
Energy: 0.8601150619943811
Energy: 0.8410081151913855
Energy: 1.0275817153804205
Energy: 0.7160057057199044
Energy: 1.0275817153791929
Energy: 0.811558709121028
Energy: 0.9535472512286225
Energy: 0.7210599648926228
Energy: 0.9535472512286225
Energy: 0.8061591331518341
Energy: 1.2231391559479083
Energy: 0.7164554560576728
Energy: 1.2231391559159883
Energy: 0.71666662621509
Energy: 1.0286418445989547
Energy: 0.7164463334335079
Energy: 1.028641844597727
Energy: 0.7164276850635062
Energy: 1.172252647581426
Energy: 0.8060199634647721
Energy: 1.172252647581426

minimum gb energy = 0.7054046171381387 eV
minimum distance =  2.25880458182476 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.7603032379890241
Energy: 1.157128409918535
Energy: 0.6447253057713898
Energy: 1.157128409917577
Energy: 1.2288289274648012
Energy: 1.0677122664973293
Energy: 0.6484373997865911
Energy: 1.0677122665002052
Energy: 0.7222472524882356
Energy: 0.7979460016443339
Energy: 0.8826408375444431
Energy: 0.7979460425892524
Energy: 0.8644563724619704
Energy: 0.9929160113777336
Energy: 0.6505503637446917
Energy: 0.9929160113786921
Energy: 0.6565986549681653
Energy: 1.0789896528808955
Energy: 0.6880525384849713
Energy: 1.0789896528799372
Energy: 0.7123924398166365
Energy: 1.0910004222407501
Energy: 0.6570242163351846
Energy: 1.0910004222417087
Energy: 0.6476167255417603
Energy: 0.7912593026407778
Energy: 0.9167140083159916
Energy: 0.7912593026407778
Energy: 0.6386780006670268
Energy: 1.0079980128914248
Energy: 0.7234167193725006
Energy: 1.0079980128914248
Energy: 0.647085643712804
Energy: 1.0670888169289516
Energy: 1.0499775631565413
Energy: 1.067088817064081
Energy: 0.63147188366533
Energy: 0.9403308402365865
Energy: 0.680139785298035
Energy: 0.9403308402346693
Energy: 0.6475615501492532
Energy: 0.790437118695642
Energy: 0.9452437411624903
Energy: 0.7904371187023527
Energy: 0.8826391920968873
Energy: 0.994930704727425
Energy: 0.7234195310682656
Energy: 0.9949307047149621
Energy: 0.6519526731101751
Energy: 0.8881421136220756
Energy: 0.8638641560781173
Energy: 0.8881421136211168
Energy: 0.8602304664704002
Energy: 1.058230304694004
Energy: 0.656747366308876
Energy: 1.0582303176533439
Energy: 0.6592958657047814
Energy: 0.9599607701277604
Energy: 0.7061068159503179
Energy: 0.9599607700625707
Energy: 0.916737967459105
Energy: 1.163245700745109
Energy: 0.6495396390135916
Energy: 1.1632457007441503
Energy: 0.7273093592421092
Energy: 0.8931230590612466
Energy: 0.7123873748683088
Energy: 0.8931230590593293
Energy: 0.8827951501102497
Energy: 0.9502619865042201
Energy: 0.6459027565960276
Energy: 0.950261930110419
Energy: 0.7645491755384272
Energy: 1.175483417281341
Energy: 0.631147929060908
Energy: 1.1754834172803823
Energy: 1.0566520749597803
Energy: 1.151431562919036
Energy: 0.6492318317377459
Energy: 1.1514315629180774
Energy: 0.7268864471623014
Energy: 0.9988341397122199
Energy: 0.6378279814590225
Energy: 0.9988341397131785
Energy: 0.7235261197995605
Energy: 1.0167963477969704
Energy: 0.6530952346061291
Energy: 1.0167963477969704
Energy: 0.6595264035391588
Energy: 0.8266343935714634
Energy: 0.8602659527941393
Energy: 0.8266343935724221
Energy: 0.7077282790099947
Energy: 1.1522979126809674
Energy: 0.6558795199180575
Energy: 1.152297912680009
Energy: 0.6465520991213467
Energy: 1.178778097708964
Energy: 0.9173123991238178
Energy: 1.1787780977022533
Energy: 0.6361839447987262
Energy: 1.0187554093217641
Energy: 0.728199083428515
Energy: 1.0187554093208053

minimum gb energy = 0.631147929060908 eV
minimum distance =  2.27798899363803 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 0.830718817802385
Energy: 1.0098777707507909
Energy: 0.8911634825092855
Energy: 1.0098777707507909
Energy: 1.1377894584914165
Energy: 0.9661943478648198
Energy: 0.5817475744631726
Energy: 0.9661943478648198
Energy: 0.5986601359570527
Energy: 0.9972836696560258
Energy: 1.1558490260914336
Energy: 0.9972836696560258
Energy: 0.8224012717685382
Energy: 0.8252458724514716
Energy: 0.5817547606398905
Energy: 0.8252458724561874
Energy: 0.5778941204634228
Energy: 0.933019587573178
Energy: 0.6152706804588077
Energy: 0.9330184684700991
Energy: 0.6983619512017841
Energy: 0.9787025757662124
Energy: 0.5817502375146498
Energy: 0.9787025757654263
Energy: 0.5808975101347335
Energy: 0.8270391034483636
Energy: 0.7502200694943391
Energy: 0.8270391034460058
Energy: 0.5712600385934069
Energy: 0.8268376249859797
Energy: 0.5788493061203738
Energy: 0.8268376249906956
Energy: 0.5837853042953377
Energy: 1.0745174139308649
Energy: 0.9607780368579734
Energy: 1.074517413931651
Energy: 0.5725097874992457
Energy: 0.8201987423459085
Energy: 0.5991080751588563
Energy: 0.8201987423466944
Energy: 0.5810921898860048
Energy: 0.9420208957079101
Energy: 0.9809685192899766
Energy: 0.9420208957079101
Energy: 0.573166610430921
Energy: 0.832703890905263
Energy: 0.8314323394482359
Energy: 0.8327038909060489
Energy: 0.5839141536173579
Energy: 0.9685392551039788
Energy: 0.9807034989883683
Energy: 0.9685392550254189
Energy: 0.7858479311627278
Energy: 1.0967681510175817
Energy: 0.5992122168481424
Energy: 1.0967681510175817
Energy: 0.5808860770446516
Energy: 0.9535963895134658
Energy: 0.822974348458091
Energy: 0.953596389510322
Energy: 0.7652544008094214
Energy: 0.8601750553585538
Energy: 0.5787069274885239
Energy: 0.8601750553593397
Energy: 0.5836875819358164
Energy: 0.9694926136071952
Energy: 0.6976055341055234
Energy: 0.9694926136071952
Energy: 0.7498679180447556
Energy: 1.2756472934967737
Energy: 0.5815821204388738
Energy: 1.2756472934818766
Energy: 0.5810696783101135
Energy: 0.8276770721504023
Energy: 0.5705570995394313
Energy: 0.8276770720781302
Energy: 0.7463141158685843
Energy: 0.9182569921734108
Energy: 0.586180878058234
Energy: 0.9182569921741969
Energy: 0.6014548318855776
Energy: 1.0440095242148282
Energy: 0.5724227258789208
Energy: 1.0440095242140421
Energy: 0.9827769249848601
Energy: 1.097900511471547
Energy: 0.5818706998523219
Energy: 1.097900511471547
Energy: 0.8338640183302773
Energy: 1.0176298786860865
Energy: 0.5730988745584282
Energy: 1.0176298786868725
Energy: 0.8312712022436026
Energy: 1.0183695172437535
Energy: 0.5857472679576066
Energy: 1.0183695172453255
Energy: 0.6014268386905779
Energy: 1.0926899907655128
Energy: 0.5785819612197655
Energy: 1.0926899907647267
Energy: 0.8203561163628202
Energy: 1.0958226019333808
Energy: 0.5819103387882401
Energy: 1.0958226019341666
Energy: 0.5810884763839381
Energy: 0.8707271806824092
Energy: 0.7656577341339112
Energy: 0.8707271806847671
Energy: 0.5787697358735764
Energy: 0.968348764315104
Energy: 0.5862328255702592
Energy: 0.968348764315104
Energy: 0.5837137650631985
Energy: 1.1055921980773498
Energy: 0.7498772228278511
Energy: 1.1055921980765637
Energy: 0.5709543302298388
Energy: 0.9960520686642699
Energy: 0.584487897455025
Energy: 0.9960520686658418
Energy: 0.5860086422484971
Energy: 1.0346387521350973
Energy: 0.7460734909112678
Energy: 1.0346387521288096
Energy: 0.5738733422671305
Energy: 1.0429805313105378
Energy: 0.6044907271465264
Energy: 1.0429805313097518

minimum gb energy = 0.5705570995394313 eV
minimum distance =  2.27321373367864 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 0.7540663148819371
Energy: 0.9794308672955843
Energy: 0.8309412838303337
Energy: 0.9794308672955843
Energy: 1.1154844879433736
Energy: 0.9612272369845213
Energy: 0.544433448588429
Energy: 0.9612272369845213
Energy: 0.5616005534196493
Energy: 0.7443726002854415
Energy: 0.7268762681878186
Energy: 0.7443726002827783
Energy: 1.0855316673708106
Energy: 0.9678361542126704
Energy: 0.5445368942896455
Energy: 0.9678361542126704
Energy: 0.5420006276465503
Energy: 1.0461231407750688
Energy: 0.561801543595369
Energy: 1.0461231407744032
Energy: 0.7384535949445887
Energy: 0.867470443251746
Energy: 0.5443845003162281
Energy: 0.8674704432497485
Energy: 0.5437912052851762
Energy: 0.7485126524784622
Energy: 0.6819328192463202
Energy: 0.7485126524771305
Energy: 0.6313529723575667
Energy: 0.8439368509557409
Energy: 0.5443688475085454
Energy: 0.8439368396878683
Energy: 0.5454552243886972
Energy: 0.9877740152613825
Energy: 0.8159975708945335
Energy: 0.9877740152600509
Energy: 0.5257534500783785
Energy: 1.0335240420079046
Energy: 0.5426746532759269
Energy: 1.0335240420079046
Energy: 0.5442138105840271
Energy: 0.8636087221515679
Energy: 0.9268786490662854
Energy: 0.8636087221502363
Energy: 0.5269579070782673
Energy: 0.8913654509464483
Energy: 0.562258466089318
Energy: 0.8913654509477799
Energy: 0.5457499541714397
Energy: 0.9894021877860343
Energy: 0.992348908996285
Energy: 0.9894021877853685
Energy: 0.5286513761283407
Energy: 0.9795058889023374
Energy: 0.7543404628615897
Energy: 0.9795058889030032
Energy: 0.543978220497702
Energy: 0.8676773684031993
Energy: 1.0132574495217908
Energy: 0.8676773684178473
Energy: 0.7107734381909704
Energy: 0.7406244786862749
Energy: 0.5621531170289101
Energy: 0.7406244786689636
Energy: 0.5459466072132817
Energy: 0.9890179595385362
Energy: 0.8917048080793577
Energy: 0.9890179595385362
Energy: 0.6944961971936189
Energy: 1.0449369551877496
Energy: 0.5423907617932016
Energy: 1.0449369551884153
Energy: 0.5438115247056279
Energy: 0.943976513124317
Energy: 0.733886820910332
Energy: 0.9439765130850339
Energy: 0.6799172066799395
Energy: 0.868421770665817
Energy: 0.5445742045949175
Energy: 0.8684217706651512
Energy: 0.5456669049344307
Energy: 0.9990011783339598
Energy: 0.6851359951467173
Energy: 0.9990011783346257
Energy: 0.6786942609675912
Energy: 0.9843275970358901
Energy: 0.5480705798008982
Energy: 0.9843275970358901
Energy: 0.544032972208518
Energy: 0.9434491633105858
Energy: 0.5262726598663423
Energy: 0.9434491633112516
Energy: 0.9226258992949958
Energy: 0.8636794227112956
Energy: 0.5442481675504331
Energy: 0.8636794227086324
Energy: 0.5633533473238
Energy: 0.9588519435582342
Energy: 0.5267118898551137
Energy: 0.9588519435589
Energy: 0.8963062355294542
Energy: 0.9862233183000206
Energy: 0.5474715682565744
Energy: 0.9862233183006864
Energy: 0.7559976986452295
Energy: 0.9774221660250066
Energy: 0.5274123638154584
Energy: 0.9774221660250066
Energy: 1.0126938010272797
Energy: 0.8675478036663835
Energy: 0.5442056325865258
Energy: 0.8675478036663835
Energy: 0.5635841104713494
Energy: 1.058821619484754
Energy: 0.5316741859528483
Energy: 1.0588216194840883
Energy: 0.7420336848888591
Energy: 0.9864694373754006
Energy: 0.5477578049754968
Energy: 0.986469437374069
Energy: 0.5439197682165612
Energy: 1.0418150554276182
Energy: 0.7073346358278045
Energy: 1.0418150554276182
Energy: 0.734054019696534
Energy: 0.8676197196096531
Energy: 0.5444162647105288
Energy: 0.8676197196143138
Energy: 0.5455057858740985
Energy: 1.179504015742568
Energy: 0.680064490008706
Energy: 1.1795040157359098
Energy: 0.5300010809182357
Energy: 0.8830805628554746
Energy: 0.5477109400392671
Energy: 0.8830805628534772
Energy: 0.5403427879914289
Energy: 0.9834243824373676
Energy: 0.6783758267103602
Energy: 0.9834243824373676
Energy: 0.5259250955934355
Energy: 0.9405565563216929
Energy: 0.5460346596869212
Energy: 0.9405565563243562
Energy: 0.545589601816233
Energy: 1.0005806025094033
Energy: 0.9191679925905826
Energy: 1.0005806025094033

minimum gb energy = 0.5257534500783785 eV
minimum distance =  2.30917166173144 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 0.7646085392154381
Energy: 0.9629217566896424
Energy: 0.7249243250931022
Energy: 0.962921756689065
Energy: 1.1331290283049626
Energy: 0.7589817021136259
Energy: 0.49651176456988794
Energy: 0.7589817021136259
Energy: 0.7356319399716975
Energy: 0.8523317406584812
Energy: 0.6422242347993028
Energy: 0.8523317406584812
Energy: 1.1080369425629197
Energy: 0.8125339906105724
Energy: 0.49656236133550785
Energy: 0.812533990612305
Energy: 0.567286357036033
Energy: 0.7412442323660794
Energy: 0.5329229512830596
Energy: 0.7412442323510654
Energy: 0.8338823644389589
Energy: 0.6968352099576013
Energy: 0.4966090231260133
Energy: 0.6968352102069597
Energy: 0.5403115788658558
Energy: 0.6938282981129854
Energy: 0.6511677267209167
Energy: 0.6938282981118304
Energy: 0.7138850236855302
Energy: 0.9329604669400516
Energy: 0.5032039690652224
Energy: 0.9329604669308122
Energy: 0.5024321712477281
Energy: 0.6694349377774118
Energy: 0.740064726770603
Energy: 0.6694349377756794
Energy: 0.6054715885003572
Energy: 0.6874382666225417
Energy: 0.5406750346366404
Energy: 0.6874382666213866
Energy: 0.49764207241521025
Energy: 0.7537485759245613
Energy: 0.872975872594456
Energy: 0.7537485759262936
Energy: 0.5186100293415279
Energy: 0.9488844206987351
Energy: 0.5677449613400548
Energy: 0.9488844206987351
Energy: 0.49595714847138017
Energy: 0.6687139310820925
Energy: 0.9567893328154378
Energy: 0.6687139310803603
Energy: 0.47485580555163404
Energy: 0.7586400895247688
Energy: 0.7362393340720185
Energy: 0.7586410769255727
Energy: 0.4973731235770623
Energy: 0.8121170948181465
Energy: 1.0915041377213006
Energy: 0.8121170948193015
Energy: 0.47228418893621227
Energy: 0.9321242462901588
Energy: 0.7074262998907619
Energy: 0.9321242462913136
Energy: 0.4961267695769757
Energy: 0.668825717642045
Energy: 0.9829545137484699
Energy: 0.6688257177361188
Energy: 0.6206265191547865
Energy: 0.7587877968805501
Energy: 0.7361385432395378
Energy: 0.7587878155675504
Energy: 0.49743099491667175
Energy: 0.8843559829694553
Energy: 0.936603949567034
Energy: 0.8843559829688779
Energy: 0.6077977051459226
Energy: 0.9809685988793057
Energy: 0.5677701735010819
Energy: 0.9809685988793057
Energy: 0.4969160349973637
Energy: 0.6347415183390668
Energy: 0.8889401612713883
Energy: 0.6347415183379119
Energy: 0.6512241497763477
Energy: 0.6994872206763879
Energy: 0.5406988204288146
Energy: 0.6994872206769653
Energy: 0.5034337397812021
Energy: 0.8465097733082935
Energy: 0.7132804953019953
Energy: 0.8465097732488412
Energy: 0.6542281946362816
Energy: 0.9463127845847433
Energy: 0.5030660253709112
Energy: 0.9463127845853208
Energy: 0.5421438434404163
Energy: 0.6395921784152933
Energy: 0.6064471919933492
Energy: 0.6395921784158707
Energy: 0.8755592112682937
Energy: 0.8000174801781703
Energy: 0.49721178721583537
Energy: 0.8000174801775929
Energy: 0.569297323682368
Energy: 0.9000600670438542
Energy: 0.5157303203367912
Energy: 0.9000600670455865
Energy: 0.8773090755306089
Energy: 0.9473518901176936
Energy: 0.4964427727768133
Energy: 0.9473518901171161
Energy: 0.7376273112433629
Energy: 0.8254604662313497
Energy: 0.5203373383512029
Energy: 0.825460466123417
Energy: 1.0311253917256449
Energy: 0.8039579761867108
Energy: 0.4983493646561941
Energy: 0.803958068586874
Energy: 0.7665716701292481
Energy: 0.9394871062299935
Energy: 0.4719318230119821
Energy: 0.939487106230571
Energy: 0.9534671707810507
Energy: 0.9414339027726969
Energy: 0.49637612038226736
Energy: 0.9414339027721195
Energy: 0.7377211114672014
Energy: 0.7578566704497498
Energy: 0.4765923882564148
Energy: 0.7578566704491724
Energy: 0.9363454702823606
Energy: 0.8739531338697246
Energy: 0.49847770124387497
Energy: 0.8739531338714572
Energy: 0.5690530115194902
Energy: 0.9641489403549176
Energy: 0.6079141426977602
Energy: 0.9641489403560725
Energy: 0.7253901327162834
Energy: 0.9034062769762149
Energy: 0.4984495426657965
Energy: 0.9034062769739051
Energy: 0.5421981573652688
Energy: 0.6989968460576085
Energy: 0.651466231070886
Energy: 0.6989968460576085
Energy: 0.7143177755087078
Energy: 0.8380986510257794
Energy: 0.5049067845316858
Energy: 0.8380986510252019
Energy: 0.5037069704983282
Energy: 0.881806015533652
Energy: 0.6537238568494381
Energy: 0.8819297617446253
Energy: 0.523145058831764
Energy: 0.9250878254430027
Energy: 0.5440478264645662
Energy: 0.9250878254458902
Energy: 0.4960903208489889
Energy: 0.7542195055119923
Energy: 0.8735869830176348
Energy: 0.7542195055281612
Energy: 0.5163451110559673
Energy: 0.8885526051266692
Energy: 0.5712669654329373
Energy: 0.8885526051266692
Energy: 0.49727030371397046
Energy: 0.906006554835196
Energy: 0.8771092646425485
Energy: 0.9060065548357735

minimum gb energy = 0.4719318230119821 eV
minimum distance =  2.30642602815959 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.015499874342504369
Energy: 0.01616663727371118
Energy: 0.8070950605002839
Energy: 0.01616663727329192
Energy: 0.8064062231289698
Energy: 1.4242774549437724
Energy: 0.2554348670342487
Energy: 1.4242774549433286
Energy: 0.015499874342504369
Energy: 0.01616663727371118
Energy: 0.8070187259121706
Energy: 0.01616663727329192
Energy: 0.8064062231285258
Energy: 1.4242774549433286
Energy: 0.2554348670342487
Energy: 1.4242774549433286
Energy: 0.015499874342948292
Energy: 0.01616663727371118
Energy: 0.8071690663498178
Energy: 0.01616663727329192
Energy: 0.8064062231289698
Energy: 1.4242774549437724
Energy: 0.2554348670338048
Energy: 1.4242774549433286

minimum gb energy = 0.015499874342504369 eV
minimum distance =  2.51169336215928 Angstroms
sigma value = 1