Model name: model_name=EAM_Dynamo_Ackland_1987_Au__MO_754413982908_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.078000083565712
cohesive_energy=3.78934329297956
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[7.82068878177786e-21, 1.174496409849942e-19, 1.9807068855488397e-19, 2.59502947232346e-19, 3.0889965503519997e-19, 3.500804010589019e-19, 3.85353921833046e-19, 4.1608206749653196e-19, 4.42644553911618e-19, 4.652112118015079e-19, 4.8492279092961e-19, 5.03077054369464e-19, 5.201290202851259e-19, 5.358431687113979e-19, 5.5003364715873595e-19, 5.62609131559002e-19, 5.73537578379516e-19, 5.828302028567159e-19, 5.90520650699916e-19, 5.96664998091306e-19, 6.013225255663439e-19, 6.04563728896926e-19, 6.0645589950168e-19, 6.0707273750577e-19, 6.063549623737379e-19, 6.038091037023119e-19, 5.987606451285779e-19, 5.904197135719739e-19, 5.77852240054878e-19, 5.59959131406366e-19, 5.354362158463619e-19, 5.02897610586456e-19, 4.622407763220719e-19, 4.1427801660664794e-19, 3.6004113319247993e-19, 2.9909112968185198e-19, 2.2933556339076e-19, 1.4811385980078359e-19, 5.206929864602939e-20, -6.351076242475019e-20, -2.0543108801148e-19, -3.8262861937861203e-19, -6.0624761653926e-19, -8.839801295132579e-19, -1.2232794840019739e-18, -1.64450614067028e-18, -2.18451977515998e-18, -2.88901286289612e-18, -3.77854133009292e-18, -4.95059762492928e-18, -6.5994456642776995e-18]
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: 0.011483840620825572
Energy: 0.01210598525106904
Energy: 0.49899168251606896
Energy: 0.01210598525106904
Energy: 0.01210598525106904
Energy: 0.6795505438674204
Energy: 0.01210598525106904
Energy: 0.6795505470674317
Energy: 0.49899168252088827
Energy: 0.01210598525106904
Energy: 0.011483840620825572
Energy: 0.01210598525106904
Energy: 0.012105985251561919
Energy: 0.6795505442961423
Energy: 0.01210598525106904
Energy: 0.6795505451068721

minimum gb energy = 0.011483840620825572 eV
minimum distance =  2.84298458241732 Angstroms
sigma value = 1


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

Energy: 0.9981263922250818
Energy: 0.6464719879710163
Energy: 0.6729663356981633
Energy: 0.6464719879728097
Energy: 0.6538027886647317
Energy: 0.7061441077924008
Energy: 0.6636705690079728
Energy: 0.7061441077906074
Energy: 0.6742525432105569
Energy: 0.674368660520654
Energy: 1.0776533589707427
Energy: 0.6743686605176653
Energy: 0.6624668644883891
Energy: 0.6519466580654204
Energy: 0.6750289213718665
Energy: 0.6519466580648228
Energy: 0.9275960241850356
Energy: 0.6495678720752236
Energy: 0.6497343095724307
Energy: 0.6495678720764191
Energy: 0.6701886952457528
Energy: 0.7207965982743821
Energy: 0.6497976091403066
Energy: 0.7207965983777666
Energy: 0.7000581961220722
Energy: 0.7447070227600594
Energy: 0.9290318293580315
Energy: 0.7447070227588639
Energy: 0.6993665647549756
Energy: 0.6532775222159507
Energy: 0.6803053310629351
Energy: 0.6532775222141576
Energy: 0.7970645657051135
Energy: 0.8272462822568828
Energy: 0.7289825363184602
Energy: 0.8272462822568828
Energy: 0.7050375289297152
Energy: 0.7036569216621932
Energy: 0.7113408082510965
Energy: 0.703656921662791
Energy: 0.8585041065867975
Energy: 0.8269585151693254
Energy: 0.7996754893130064
Energy: 0.8269585151693254
Energy: 0.703289757140918
Energy: 0.7845283419829687
Energy: 0.6790663434747485
Energy: 0.7845283419841642
Energy: 0.6969025493939516
Energy: 0.74394637108438
Energy: 1.0017969259929362
Energy: 0.7439463710855754
Energy: 0.6701980187934852
Energy: 0.7450735553091006
Energy: 0.6875474519231421
Energy: 0.7450735553091006
Energy: 1.0000809790988616
Energy: 0.6493738008345813
Energy: 0.6504019839317394
Energy: 0.649373800832788
Energy: 0.6435499271157246
Energy: 0.649177196210414
Energy: 0.6488600281182877
Energy: 0.6491771962110117
Energy: 0.6727545836565341
Energy: 0.6712228515509305
Energy: 0.6434167074234294
Energy: 0.6712228515515283
Energy: 0.6498940221871768
Energy: 0.6493362573520199
Energy: 0.6884115407848808
Energy: 0.6493362573532153
Energy: 1.0758991245548406
Energy: 0.6735339678166445
Energy: 0.6747078640572259
Energy: 0.6735339678148513
Energy: 0.6613105873761012
Energy: 0.6500550786271558
Energy: 0.6509423359667482
Energy: 0.6500550786271558
Energy: 0.6513196237973657
Energy: 0.6497283369392067
Energy: 0.927533439690046
Energy: 0.6497283369404022
Energy: 0.649295589571951
Energy: 0.6509622539112648
Energy: 0.67003634224021
Energy: 0.6509622539112648
Energy: 0.9291883320627984
Energy: 0.7446626221299811
Energy: 0.6990138010176681
Energy: 0.7446626221293834
Energy: 0.6778347826858162
Energy: 0.654306716823739
Energy: 0.689489801215988
Energy: 0.6543067168225434
Energy: 0.7305024345062825
Energy: 0.8275310451267309
Energy: 0.7969385343611312
Energy: 0.8275310451267309
Energy: 0.7122185699642287
Energy: 0.7450503783188389
Energy: 0.7059080275783708
Energy: 0.7450503783176434
Energy: 0.7992908797815144
Energy: 0.8295857862013721
Energy: 0.6527476254781325
Energy: 0.8295857862019699
Energy: 0.676332559310348
Energy: 0.8247301589470997
Energy: 0.700513863381118
Energy: 0.8247301589476974
Energy: 0.6951705773125615
Energy: 0.7440789121740555
Energy: 0.6962830767324583
Energy: 0.7440789121746533
Energy: 0.6948659838660569
Energy: 0.7446554452993699
Energy: 0.6630282772493711
Energy: 0.7446554453005653
Energy: 0.6498445037721975
Energy: 0.6493123541206396
Energy: 0.6948693094500834
Energy: 0.6493123541188464
Energy: 0.649011189373952
Energy: 0.6494615678860562
Energy: 0.6431434033524663
Energy: 0.649461567887252
Energy: 0.6426517422205523
Energy: 0.6530246643694134
Energy: 0.6701883397820106
Energy: 0.6530246643682179

minimum gb energy = 0.6426517422205523 eV
minimum distance =  2.63873615214516 Angstroms
sigma value = 1


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

Energy: 1.125281091486286
Energy: 0.6802277669395665
Energy: 0.7120389434216432
Energy: 0.6802277669382034
Energy: 0.7106861809774883
Energy: 0.7480886831395271
Energy: 0.6877072058448735
Energy: 0.7480886831442979
Energy: 0.7114600860339844
Energy: 0.7127483296947469
Energy: 1.040073995343439
Energy: 0.7127483296981546
Energy: 0.700828427423318
Energy: 0.7507815179735554
Energy: 0.7012437903620455
Energy: 0.7507815179756
Energy: 1.043219151704483
Energy: 0.6875766234634536
Energy: 0.6891161882852688
Energy: 0.6875766234634536
Energy: 0.7003539335922503
Energy: 0.6883995400456083
Energy: 0.7131509453376621
Energy: 0.6883995400456083
Energy: 0.7512373960187094
Energy: 0.7961516925525545
Energy: 0.8813699828050959
Energy: 0.7961516925484653
Energy: 0.7026719464083101
Energy: 0.690705370922308
Energy: 0.7177245590587047
Energy: 0.6907053709257157
Energy: 0.8830750767302583
Energy: 0.8790060045582316
Energy: 0.8063240525284631
Energy: 0.8790060045602763
Energy: 0.720409936034143
Energy: 0.7948271675471668
Energy: 0.6910615851569125
Energy: 0.7948271675451222
Energy: 0.7414000199196566
Energy: 0.7956324807061007
Energy: 0.7528558487344814
Energy: 0.7956324807047376
Energy: 0.7324535660184543
Energy: 0.7978822670474769
Energy: 0.7002898342608429
Energy: 0.7978822670427062
Energy: 0.6868086722819173
Energy: 0.6873455107186167
Energy: 0.9535148263332508
Energy: 0.6873455107206613
Energy: 0.687710097175048
Energy: 0.6876023243163271
Energy: 0.6771115758582847
Energy: 0.6876023243197037
Energy: 0.6764811390615545
Energy: 0.7100831606150098
Energy: 0.709808003724336
Energy: 0.7100831606088758
Energy: 0.6954869917389336
Energy: 0.6880949389253389
Energy: 0.6883639131919391
Energy: 0.6880949389246575
Energy: 0.7134553711373819
Energy: 0.7130192181851652
Energy: 1.0370561965339005
Energy: 0.7130192181858469
Energy: 0.6997626479905842
Energy: 0.6879663295426209
Energy: 0.7088101628807284
Energy: 0.6879663295439841
Energy: 0.7132403210867467
Energy: 0.688220625739503
Energy: 0.6878463515918586
Energy: 0.688220625739503
Energy: 0.7000877915253289
Energy: 0.6894782147959041
Energy: 0.6886199494066021
Energy: 0.6894782147952226
Energy: 0.6915260060513222
Energy: 0.7964778153811058
Energy: 0.880680042294934
Energy: 0.7964778153865583
Energy: 0.7321297988084589
Energy: 0.6911672398380311
Energy: 0.7134457824539089
Energy: 0.6911672398434834
Energy: 0.883256585463951
Energy: 0.8804134369985164
Energy: 0.8014476408248219
Energy: 0.8804134369917009
Energy: 0.7137018735201714
Energy: 0.8754837108879753
Energy: 0.6893893214655326
Energy: 0.8754837108893384
Energy: 0.7413327388068096
Energy: 0.7970794152387788
Energy: 0.7523198984223007
Energy: 0.7970794152408234
Energy: 0.7409200841803655
Energy: 0.7959039727686396
Energy: 0.6995855996899607
Energy: 0.7959039727727288
Energy: 0.6862667638553483
Energy: 0.6874735666079832
Energy: 0.729343926255364
Energy: 0.6874735666093462
Energy: 0.687957999336449
Energy: 0.6877630658901375
Energy: 0.6771846599120683
Energy: 0.6877630658853666
Energy: 0.6764543329510586
Energy: 0.6990449127001634
Energy: 0.7099476863518827
Energy: 0.6990449127035712

minimum gb energy = 0.6764543329510586 eV
minimum distance =  2.64324188616222 Angstroms
sigma value = 25


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

Energy: 1.0808507328784835
Energy: 0.7188075703894021
Energy: 0.7569580220850438
Energy: 0.7188075703894021
Energy: 0.7690600687075344
Energy: 0.7945046884524282
Energy: 0.7347784900170261
Energy: 0.7945046884524282
Energy: 0.7563399410736139
Energy: 0.7568269971823203
Energy: 0.985562743276458
Energy: 0.7568269971823203
Energy: 0.7445664357241363
Energy: 0.7945115934261487
Energy: 0.7343276023144659
Energy: 0.7945115934253565
Energy: 0.7426528083905743
Energy: 0.7347322552204613
Energy: 0.7350800654417229
Energy: 0.7347322552204613
Energy: 0.7433169236179789
Energy: 0.7344469392525327
Energy: 0.7369710545529055
Energy: 0.7344469392517403
Energy: 0.8178858343128785
Energy: 0.8624475017063108
Energy: 0.8212720209746137
Energy: 0.8624475017031417
Energy: 0.7272709693269689
Energy: 0.7770455957255308
Energy: 0.7413416104957413
Energy: 0.7770455957263229
Energy: 0.822555590576718
Energy: 0.8613860173322319
Energy: 0.713224327481832
Energy: 0.8613860173314396
Energy: 0.7443233248545439
Energy: 0.863016542393214
Energy: 0.7335508036250444
Energy: 0.8630165423940064
Energy: 0.7140509156150432
Energy: 0.734491564600097
Energy: 0.7336827338771035
Energy: 0.7344915646008894
Energy: 0.7142814463150774
Energy: 0.7343767705528598
Energy: 0.7351480783242823
Energy: 0.7343767705528598
Energy: 0.7576703993883748
Energy: 0.7568617908361852
Energy: 0.7121465166919572
Energy: 0.756861790835393
Energy: 0.7348052000129388
Energy: 0.7347094666669322
Energy: 0.7692603740393489
Energy: 0.7347094666653476
Energy: 0.7429264060789701
Energy: 0.7564895617814726
Energy: 0.7565352884204498
Energy: 0.7564895617814726
Energy: 0.7545942987327586
Energy: 0.7341563205755586
Energy: 0.7655950486962244
Energy: 0.7341563205755586
Energy: 0.7343043109140399
Energy: 0.7350896819494335
Energy: 0.7427639111124431
Energy: 0.7350896819518102
Energy: 0.7340921463495843
Energy: 0.736110815708785
Energy: 0.7439833563705395
Energy: 0.736110815708785
Energy: 0.8212327456696918
Energy: 0.863135048887364
Energy: 0.7397232310691227
Energy: 0.863135048887364
Energy: 0.7413996403716001
Energy: 0.8641822849095264
Energy: 0.7244439886659589
Energy: 0.8641822849103187
Energy: 0.7695495500830878
Energy: 0.8617674173310628
Energy: 0.8236259410016951
Energy: 0.8617674173326474
Energy: 0.752445728367012
Energy: 0.8622668704798269
Energy: 0.7255974714254073
Energy: 0.8622668704806192
Energy: 0.7328028977082546
Energy: 0.733872165745122
Energy: 0.7142811513256488
Energy: 0.7338721657459144
Energy: 0.7344000828752473
Energy: 0.7339880330265706
Energy: 0.714055313335925
Energy: 0.7339880330265706
Energy: 0.7127977914097806
Energy: 0.7432774500656602
Energy: 0.756173585359819
Energy: 0.7432774500664525

minimum gb energy = 0.7121465166919572 eV
minimum distance =  2.64538068127064 Angstroms
sigma value = 9


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

Energy: 1.0057727347370888
Energy: 0.7567614880247432
Energy: 0.8152332226332873
Energy: 0.756761488022853
Energy: 0.8204181642775856
Energy: 0.8398125464311114
Energy: 0.7862048784301544
Energy: 0.8398125464320564
Energy: 0.8057656296239676
Energy: 0.8057430300137975
Energy: 0.7993733494826311
Energy: 0.8057430300119074
Energy: 0.8044918068340107
Energy: 0.8455686352993004
Energy: 0.8078988260680214
Energy: 0.8455686352964649
Energy: 0.7992087027432334
Energy: 0.786211634086689
Energy: 0.7855653530678732
Energy: 0.7862116340819634
Energy: 0.7979668124486341
Energy: 0.7980215019549531
Energy: 0.7990054580935013
Energy: 0.7980215019615475
Energy: 0.8140491933631694
Energy: 0.879288876996856
Energy: 0.8133874429865855
Energy: 0.879288876997801
Energy: 0.8034941876510048
Energy: 0.880240862747443
Energy: 0.8006978489630916
Energy: 0.8802408627464977
Energy: 0.7838778031375822
Energy: 0.7856727780905843
Energy: 0.7496327163518621
Energy: 0.7856727780820782
Energy: 0.8135240271553348
Energy: 0.7851152465847216
Energy: 0.7744918008499786
Energy: 0.7851152465856667
Energy: 0.7453497519465988
Energy: 0.8293917153116304
Energy: 0.8144297699300582
Energy: 0.8293917153116304
Energy: 0.8256696705302702
Energy: 0.7852780743942467
Energy: 0.7857337422468029
Energy: 0.7852780743933016
Energy: 0.8055857878641597
Energy: 0.8052244099439875
Energy: 0.8148968326955225
Energy: 0.805224409946823
Energy: 0.8051814011659332
Energy: 0.7852262156949033
Energy: 0.7939127383357093
Energy: 0.7852262156873423
Energy: 0.7990760825030899
Energy: 0.7862368104382096
Energy: 0.7856631999018443
Energy: 0.7862368104401
Energy: 0.7990291360366365
Energy: 0.7862543420773808
Energy: 0.7855876696220028
Energy: 0.7862543420811612
Energy: 0.8151142278078305
Energy: 0.8807465269457104
Energy: 0.802393882599258
Energy: 0.8807465269513811
Energy: 0.8154259604170828
Energy: 0.881812638040806
Energy: 0.8071891111905096
Energy: 0.8818126380417511
Energy: 0.7837277631057424
Energy: 0.7858339449726489
Energy: 0.7497236525820726
Energy: 0.7858339449726489
Energy: 0.8080811668560939
Energy: 0.7852958449892835
Energy: 0.7503454470660493
Energy: 0.7852958449845578
Energy: 0.7457116908906197
Energy: 0.7886571051940102
Energy: 0.8289433350432084
Energy: 0.788657105198736

minimum gb energy = 0.7453497519465988 eV
minimum distance =  2.61814001455082 Angstroms
sigma value = 25


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

Energy: 0.8829466555977988
Energy: 0.7784451603251246
Energy: 0.8586872946516965
Energy: 0.7784451603251246
Energy: 0.7715358867429459
Energy: 0.8335803682612735
Energy: 0.7919061874593706
Energy: 0.8335803682519227
Energy: 0.8470905460443794
Energy: 0.8477929962665909
Energy: 0.843448683960833
Energy: 0.8477929962665909
Energy: 0.8551006255560936
Energy: 0.8338353379531772
Energy: 0.7921185338671878
Energy: 0.833835337962528
Energy: 0.7854594507486784
Energy: 0.7920415969626909
Energy: 0.7922794210147059
Energy: 0.7920415965970032
Energy: 0.7745999866404195
Energy: 0.7913541241846855
Energy: 0.7909864557456585
Energy: 0.7913541241835168
Energy: 0.770990339411337
Energy: 0.7920069775259252
Energy: 0.7919309140702919
Energy: 0.792006977527094
Energy: 0.7706324600570527
Energy: 0.8336662653205524
Energy: 0.7912599581017826
Energy: 0.8336662653123705
Energy: 0.8540568017075562
Energy: 0.775260126941067
Energy: 0.91395764328981
Energy: 0.7752601269480801
Energy: 0.7917488012142815
Energy: 0.8337914755168679
Energy: 0.8524598696598493
Energy: 0.833791475522712
Energy: 0.8451731342499115
Energy: 0.848016783361578
Energy: 0.8587025458733842
Energy: 0.848016783361578
Energy: 0.8499699362707208
Energy: 0.83394054447149
Energy: 0.7754588618279586
Energy: 0.8339405444726589
Energy: 0.7911976926685651
Energy: 0.9145221819744034
Energy: 0.7853087265768567
Energy: 0.9145221819744034
Energy: 0.7912937285741835
Energy: 0.7917387084780882
Energy: 0.7757440172580973
Energy: 0.7917387084687375
Energy: 0.7918976288754386
Energy: 0.7918447874253184
Energy: 0.7709289693704223
Energy: 0.7918447874253184
Energy: 0.7902987380886107
Energy: 0.901561883106591
Energy: 0.7715215246256508
Energy: 0.901561883103111
Energy: 0.9286490181851538
Energy: 0.7761860591522731
Energy: 0.7765943223350245
Energy: 0.776186059139416

minimum gb energy = 0.7706324600570527 eV
minimum distance =  2.68297305308409 Angstroms
sigma value = 17


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

Energy: 1.2770330133771814
Energy: 0.8729735048464463
Energy: 0.9224959761720247
Energy: 0.8729735048457844
Energy: 0.7761607068482946
Energy: 0.8463870737865582
Energy: 0.8890297071264429
Energy: 0.8463870737898681
Energy: 0.8294495827808229
Energy: 0.8303425194372256
Energy: 1.156696895895233
Energy: 0.8303425194372256
Energy: 0.8330685897073047
Energy: 0.8859587601966693
Energy: 0.8427574975394807
Energy: 0.8859587601986552
Energy: 0.8324843257753859
Energy: 0.8467229535876103
Energy: 0.7822955179578297
Energy: 0.8467229535869484
Energy: 0.8271397352413532
Energy: 0.857192046989035
Energy: 0.8324998976282066
Energy: 0.8571920469910209
Energy: 0.8706456433192562
Energy: 0.8263101284018499
Energy: 0.8263259833802052
Energy: 0.8263101284005261
Energy: 0.9866499359951509
Energy: 0.8319231339903986
Energy: 0.7888577666025735
Energy: 0.8319231339903986
Energy: 0.9261602393312847
Energy: 0.926311774105778
Energy: 0.940502021488004
Energy: 0.926311774105116
Energy: 0.9308785801164453
Energy: 0.8914769466261245
Energy: 0.8419837964677253
Energy: 0.8914769466254625
Energy: 0.8295891934461572
Energy: 0.7876464068092589
Energy: 0.7850229392422798
Energy: 0.7876464067986673
Energy: 0.8956109140901775
Energy: 0.789775712705759
Energy: 0.7890900436445367
Energy: 0.7897757127050969
Energy: 0.8804365425978401
Energy: 0.7885265716836732
Energy: 0.8036503305974352
Energy: 0.7885265716856591
Energy: 0.8724088780696122
Energy: 0.8326433543747163
Energy: 0.7865234614168604
Energy: 0.8326433543773641
Energy: 0.929769075778873
Energy: 0.8834025113935534
Energy: 0.8777688228858018
Energy: 0.8834025113955395
Energy: 0.887028464522841
Energy: 0.8738786176590365
Energy: 0.9841785282727332
Energy: 0.8738786176596985
Energy: 0.9245263218037459
Energy: 0.8319101790940414
Energy: 0.7876635187493194
Energy: 0.8319101790940414
Energy: 0.8792367239028501
Energy: 0.8251239608580474
Energy: 0.8233665203085535
Energy: 0.8251239608580474
Energy: 0.8325374212062081
Energy: 0.8494376691345638
Energy: 0.8301924764055564
Energy: 0.8494376691299299
Energy: 0.8347842181590697
Energy: 0.8259939617314477
Energy: 0.8327306527831582
Energy: 0.8259939617287998
Energy: 0.8275194263344334
Energy: 0.8450782465550023
Energy: 0.9594296751967745
Energy: 0.8450782465530164
Energy: 0.8351593256931686
Energy: 0.833739767084094
Energy: 0.8710811740370187
Energy: 0.833739767084094
Energy: 0.8756683442992396
Energy: 0.8888619252473303
Energy: 0.8853516135320563
Energy: 0.8888619252473303
Energy: 0.9404512667226445
Energy: 0.9263323543831258
Energy: 0.9268369678152137
Energy: 0.9263323543844497
Energy: 0.7894938609913009
Energy: 0.8051750079120742
Energy: 0.9292936059993947
Energy: 0.8051750079120742
Energy: 0.7896805897025684
Energy: 0.7904218563348334
Energy: 0.8266334242842934
Energy: 0.7904218563328477
Energy: 0.7845466367526295
Energy: 0.7894927729032513
Energy: 0.8894961811470604
Energy: 0.7894927728986174
Energy: 0.7887603492046386
Energy: 0.7900173073636595
Energy: 0.8790192347449861
Energy: 0.7900173073636595
Energy: 0.7892113051294019
Energy: 0.8337910683115839
Energy: 0.8803125087149661
Energy: 0.8337910683135697
Energy: 1.2799843371379163
Energy: 0.9245290579355592
Energy: 0.9228639237134957
Energy: 0.9245290579355592

minimum gb energy = 0.7761607068482946 eV
minimum distance =  2.63365451465868 Angstroms
sigma value = 53


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

Energy: 1.1821753239837245
Energy: 0.7024102043421397
Energy: 0.8511085542272047
Energy: 0.702410204340616
Energy: 0.962183000130451
Energy: 0.7589447122407101
Energy: 0.8427610239337764
Energy: 0.7589447122315663
Energy: 0.8497750753494948
Energy: 0.8511671599374615
Energy: 0.8343321789024781
Energy: 0.8511671599374615
Energy: 0.843242443283841
Energy: 0.7562423282024461
Energy: 0.8995661150230781
Energy: 0.7562423281918128
Energy: 0.8523598282693083
Energy: 0.7588091507340293
Energy: 0.70316206322911
Energy: 0.7588091507355532
Energy: 0.9002753206497441
Energy: 0.7555423841814831
Energy: 0.7005676046952409
Energy: 0.755542384184531
Energy: 0.9624999762676124
Energy: 0.8444916330639426
Energy: 0.8514123008265825
Energy: 0.8444916330669906
Energy: 0.9741265592670999
Energy: 0.7546128393139
Energy: 0.8394742765559416
Energy: 0.7546128393062799
Energy: 0.8504966240784054
Energy: 0.844448539461882
Energy: 0.8351000800214141
Energy: 0.844448539463406
Energy: 0.8400305979979555
Energy: 0.758489486096202
Energy: 0.9039528876755203
Energy: 0.7584894861114071
Energy: 0.9471076633527065
Energy: 0.7574052235377845
Energy: 0.7018183795442352
Energy: 0.7574052235393084
Energy: 0.8436551328790894
Energy: 0.7590857803896074
Energy: 0.7033095239165155
Energy: 0.7590857803896074
Energy: 0.9751266029354878
Energy: 0.755499537926061
Energy: 0.8371161119552389
Energy: 0.755499537926061

minimum gb energy = 0.7005676046952409 eV
minimum distance =  2.67891110947356 Angstroms
sigma value = 9


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

Energy: 1.1279810263229602
Energy: 0.8600117337984563
Energy: 0.9489640944230404
Energy: 0.8600117337939439
Energy: 0.8144153598950197
Energy: 0.7653354135799458
Energy: 0.9648372123496204
Energy: 0.7653354135822019
Energy: 0.7565455722464068
Energy: 0.7560279799486216
Energy: 0.9743373783048327
Energy: 0.7560279799480575
Energy: 0.7544560407147763
Energy: 0.7559021907358814
Energy: 1.0172767312003406
Energy: 0.7559021907364455
Energy: 0.7642316939037254
Energy: 0.7573625880857682
Energy: 0.983280541532468
Energy: 0.7573625880880243
Energy: 0.7612022282082483
Energy: 0.7603313110859119
Energy: 0.9814653543490994
Energy: 0.7603313110859119
Energy: 0.9600031441710335
Energy: 0.9185796341467762
Energy: 0.9630877445608703
Energy: 0.9185796341445199
Energy: 0.9598631011796925
Energy: 0.8433702143201266
Energy: 0.918300179347178
Energy: 0.8433702143195625
Energy: 0.8001829233069891
Energy: 0.8453017588499757
Energy: 0.7976669863909467
Energy: 0.8453017588437712
Energy: 0.7768706787108379
Energy: 0.8326377228282159
Energy: 0.9201459175679266
Energy: 0.8326377228276518
Energy: 0.7999296142487137
Energy: 0.8005364594066925
Energy: 0.9284719063527398
Energy: 0.8005364594157173
Energy: 0.8515095928077936
Energy: 0.8099737920459438
Energy: 0.980588512414821
Energy: 0.8099737920493282
Energy: 0.9620080099116142
Energy: 0.7998430130587612
Energy: 0.8118463484139367
Energy: 0.7998430130598893
Energy: 0.9625387224435669
Energy: 0.8017242745542248
Energy: 0.8011265451666512
Energy: 0.8017242745536608
Energy: 0.9169403072367781
Energy: 0.8054716332501932
Energy: 0.800921841406247
Energy: 0.8054716332518853
Energy: 0.8491761023015391
Energy: 0.9155221197408197
Energy: 0.8013275100877213
Energy: 0.9155221197419477
Energy: 0.9202960135109206
Energy: 0.8558608209906262
Energy: 0.8005234457099931
Energy: 0.8558608209889341
Energy: 0.9463412831972675
Energy: 0.944960338009831
Energy: 0.9790512515568585
Energy: 0.9449603380126513
Energy: 0.9639488568189736
Energy: 0.7564428628039962
Energy: 0.8145181118615334
Energy: 0.7564428628023041
Energy: 1.0386226884057972
Energy: 0.75531619351475
Energy: 0.7559818706596142
Energy: 0.7553161935186982
Energy: 0.9918129158278319
Energy: 0.7562208132265404
Energy: 0.7544770745789448
Energy: 0.7562208132271044
Energy: 0.9813629127676813
Energy: 0.7646516314375985
Energy: 0.7637668793575128
Energy: 0.7646516314364704
Energy: 0.9825165251186739
Energy: 0.7566409581183351
Energy: 0.7616639702438617
Energy: 0.7566409581188991
Energy: 0.9625759448441696
Energy: 0.9181269335174594
Energy: 0.9595918475116473
Energy: 0.9181269335174594
Energy: 0.9185782082960005
Energy: 0.8424005841381389
Energy: 0.9587683814991018
Energy: 0.8424005841353186
Energy: 0.8012995393740431
Energy: 0.8445886351158808
Energy: 0.8000676773876868
Energy: 0.8445886351147527
Energy: 0.9173334029308089
Energy: 0.824072442076443
Energy: 0.776784501000438
Energy: 0.8240724420894163
Energy: 0.9278793130283095
Energy: 0.8014079356922506
Energy: 0.8007618378926368
Energy: 0.8014079356894303
Energy: 0.9805741689169034
Energy: 0.8035630886914219
Energy: 0.8489459356759534
Energy: 0.803563088691986
Energy: 0.8108605352330585
Energy: 0.7874542914885196
Energy: 0.9629463386023245
Energy: 0.7874542914890837
Energy: 0.8012781552436642
Energy: 0.8024040237812117
Energy: 0.9122550611549417
Energy: 0.8024040237806477
Energy: 0.8054503118320163
Energy: 0.7890589483207981
Energy: 0.9172115929534764
Energy: 0.7890589483219262
Energy: 0.8048686082935801
Energy: 0.8047062149629133
Energy: 0.8487322359403718
Energy: 0.8047062149121487
Energy: 0.7976770754460607
Energy: 0.7635557399175193
Energy: 0.850794141430842
Energy: 0.7635557399152633
Energy: 0.9788389835654099
Energy: 0.9187536355525898
Energy: 0.9446577962125657
Energy: 0.9187536355537178

minimum gb energy = 0.7544560407147763 eV
minimum distance =  2.66124786510502 Angstroms
sigma value = 73


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

Energy: 1.0615028116143643
Energy: 0.7554183488369395
Energy: 0.9004705001472398
Energy: 0.7554183488333598
Energy: 0.8596394916585084
Energy: 0.765872078525746
Energy: 0.8792569751872483
Energy: 0.7658720785230613
Energy: 0.7503853744458441
Energy: 0.7516244071706316
Energy: 0.8400756586060865
Energy: 0.7516244071831399
Energy: 0.7524165305962633
Energy: 0.7523135322612566
Energy: 0.9578640107191011
Energy: 0.7523135322836294
Energy: 0.7534187507804031
Energy: 0.7541103880998342
Energy: 0.9466898668998697
Energy: 0.7541103881007291
Energy: 0.759296384033909
Energy: 0.7544600429042897
Energy: 0.948670761288386
Energy: 0.7544600429051846
Energy: 0.865847270285174
Energy: 0.8519899787359738
Energy: 0.8633705441612702
Energy: 0.8519899787404485
Energy: 0.8657193965191398
Energy: 0.810937713418971
Energy: 0.8507978875356507
Energy: 0.8109377134162863
Energy: 0.8521792993272664
Energy: 0.8121969729470021
Energy: 0.8536724817406647
Energy: 0.8121969729443378
Energy: 0.7822284911212958
Energy: 0.8290670707946434
Energy: 0.85168645258295
Energy: 0.8290670707991179
Energy: 0.851578688207847
Energy: 0.8122065647468398
Energy: 0.7365363347813882
Energy: 0.8122065647468398
Energy: 0.9014204710411309
Energy: 0.8496542987928568
Energy: 0.9438460237150862
Energy: 0.8496542987874873
Energy: 0.8387942073087833
Energy: 0.7542331350408513
Energy: 0.7532635753076533
Energy: 0.7542331350363768
Energy: 0.8395193066097385
Energy: 0.7531103110798875
Energy: 0.7536647047940461
Energy: 0.7531103110816774
Energy: 0.957674647984515
Energy: 0.7521509006067747
Energy: 0.7504620683604611
Energy: 0.7521509005906662
Energy: 0.9466428348405981
Energy: 0.7518330912110409
Energy: 0.7508737301312763
Energy: 0.7518330912083561
Energy: 0.947308435748993
Energy: 0.766025364264815
Energy: 0.7530862669265467
Energy: 0.766025364264815
Energy: 0.894507971259013
Energy: 0.8929628251705625
Energy: 0.8461208377690964
Energy: 0.8929628251723523
Energy: 0.8529966873097781
Energy: 0.8287223622295145
Energy: 0.8568561511512565
Energy: 0.8287223622304094
Energy: 0.9390790851925261
Energy: 0.8309289070494493
Energy: 0.8535560197466673
Energy: 0.8309289070557139
Energy: 0.8507580627887253
Energy: 0.823305809819722
Energy: 0.7417056319652662
Energy: 0.823305809820617
Energy: 0.9413842467345859
Energy: 0.9418285119433004
Energy: 0.849766922829804
Energy: 0.9418285119424055

minimum gb energy = 0.7365363347813882 eV
minimum distance =  2.6069062859717 Angstroms
sigma value = 7


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

Energy: 1.3012480551196328
Energy: 0.7644007862508398
Energy: 0.9018931260047223
Energy: 0.7644007862514726
Energy: 0.7620921962248137
Energy: 0.8109808611671864
Energy: 0.9296654090665624
Energy: 0.8109808611728815
Energy: 0.7564110509171691
Energy: 0.7568206070750284
Energy: 0.8708049081303918
Energy: 0.756820607069362
Energy: 0.7576920377554517
Energy: 0.7587840316940515
Energy: 0.9407689591760232
Energy: 0.7587840316883563
Energy: 0.7553305787072944
Energy: 0.7565108334848898
Energy: 0.9065117807156124
Energy: 0.7565108334861553
Energy: 0.8547929675317719
Energy: 0.7575549773446262
Energy: 0.9063079436627285
Energy: 0.7575549773503214
Energy: 0.9279626521388048
Energy: 0.7574938827871208
Energy: 0.7671026118543294
Energy: 0.7574938827890193
Energy: 0.9257095057682196
Energy: 0.7564850256065244
Energy: 0.7558042833875542
Energy: 0.7564850256027276
Energy: 0.9431645631287434
Energy: 0.7934468989067396
Energy: 0.7901676546886188
Energy: 0.7934468989092708
Energy: 1.0318092598613835
Energy: 0.7565441013710292
Energy: 0.7554006043593775
Energy: 0.7565441013691309
Energy: 0.9413828705233641
Energy: 0.8307236631943203
Energy: 0.8503012971432455
Energy: 0.8307236631917891
Energy: 0.8920207392555667
Energy: 0.8318869561796505
Energy: 0.9244353661822331
Energy: 0.8318869561764866
Energy: 0.8334130970065311
Energy: 0.8093787044181248
Energy: 0.832112465411933
Energy: 0.8093787044263512
Energy: 0.8323043039390094
Energy: 0.8079029307777977
Energy: 0.7505856821119874
Energy: 0.8079029307765322
Energy: 0.8324533752774079
Energy: 0.8091880687731737
Energy: 0.7533582471160448
Energy: 0.809188068782033
Energy: 0.9423914470470373
Energy: 0.8334745817365304
Energy: 0.8924567062680242
Energy: 0.833474581737796
Energy: 0.9418922239956607
Energy: 0.8292522932432631
Energy: 0.9298642247726064
Energy: 0.8292522932413647
Energy: 0.7559938733797635
Energy: 0.7568720602576119
Energy: 0.9129724059003135
Energy: 0.7568720602664709
Energy: 0.792664231078395
Energy: 0.7932555273727061
Energy: 0.9430854849607456
Energy: 0.7932555273733389
Energy: 0.7560661163848869
Energy: 0.7566636338537293
Energy: 0.9588833753491481
Energy: 0.7566636338524637
Energy: 0.7647057890781289
Energy: 0.7566444295873435
Energy: 0.9073235867045787
Energy: 0.7566444295759531
Energy: 0.9271802526093964
Energy: 0.7586595125600121
Energy: 0.8555596357882738
Energy: 0.7586595125676057
Energy: 0.9280601548499826
Energy: 0.7573253691379757
Energy: 0.7545673226049151
Energy: 0.7573253691316477
Energy: 0.9402542669127748
Energy: 0.7590509442975156
Energy: 0.7608421505711762
Energy: 0.7590509442987812
Energy: 0.9089538927166491
Energy: 0.7572018068594032
Energy: 0.7558238659850985
Energy: 0.7572018068606687
Energy: 0.9095127569333952
Energy: 0.8308043708601136
Energy: 0.7574781553624369
Energy: 0.8308043708613793
Energy: 0.8950660908023713
Energy: 0.894268616517001
Energy: 1.1458187461755358
Energy: 0.8942686165226962
Energy: 0.8306721453880128
Energy: 0.8329006839799415
Energy: 0.8350074216571499
Energy: 0.8329006839812071
Energy: 0.8729054264381851
Energy: 0.8096615484579901
Energy: 0.8349746597360376
Energy: 0.8096615484598597
Energy: 0.829950426146605
Energy: 0.8082649042676832
Energy: 0.7505633051134432
Energy: 0.8082649042670503
Energy: 0.9452490590961581
Energy: 0.8324955362393953
Energy: 0.8315417544433179
Energy: 0.832495536240028

minimum gb energy = 0.7505633051134432 eV
minimum distance =  2.64430623523397 Angstroms
sigma value = 29


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

Energy: 0.7866873745257646
Energy: 0.9609146113418809
Energy: 0.7982154445169031
Energy: 0.9609146113425422
Energy: 0.6849229902864119
Energy: 0.7520748821990312
Energy: 0.6967113716257058
Energy: 0.7520748822035621
Energy: 0.7996492688198006
Energy: 0.6968737963308486
Energy: 0.6902749271207084
Energy: 0.6968737963310688
Energy: 0.6856600646870202
Energy: 0.6962279642624131
Energy: 0.6940678792937827
Energy: 0.6962279642656458
Energy: 0.6937155318184938
Energy: 0.6973221227517445
Energy: 0.6856841646001756
Energy: 0.6973221227472136
Energy: 0.6935674017680439
Energy: 0.7522961695896265
Energy: 0.685664843445029
Energy: 0.7522961695913654
Energy: 0.6889794894755112
Energy: 0.7566465325613144
Energy: 0.7999795235593715
Energy: 0.7566465325576407
Energy: 0.6965754243939385
Energy: 0.6994630256633111
Energy: 0.6849994968958301
Energy: 0.6994630256615723
Energy: 0.6845809996155513
Energy: 0.7441851254830534
Energy: 0.7424327497987249
Energy: 0.7441851254845475

minimum gb energy = 0.6845809996155513 eV
minimum distance =  2.63905745522067 Angstroms
sigma value = 5


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

Energy: 1.0785068473013206
Energy: 0.7476756987412002
Energy: 0.872720101611376
Energy: 0.7476756987453846
Energy: 0.7905541659929068
Energy: 0.740461304801704
Energy: 0.8423438879452023
Energy: 0.740461304799938
Energy: 0.8402000573122599
Energy: 0.7908406740639948
Energy: 0.8394879755951432
Energy: 0.7908406740616037
Energy: 0.7944862521142405
Energy: 0.7416579068572082
Energy: 0.8449850442605703
Energy: 0.7416579068607947
Energy: 0.8460104364126622
Energy: 0.7420018396660031
Energy: 0.7932039267681382
Energy: 0.7420018396689919
Energy: 0.7434177220955173
Energy: 0.7421242395766487
Energy: 0.7928298995110185
Energy: 0.7421242395706711
Energy: 0.7457429467267853
Energy: 0.7445345959369739
Energy: 0.8454658376187094
Energy: 0.7445345959369739
Energy: 0.7409809045921002
Energy: 0.7422302009425488
Energy: 0.8846490621757147
Energy: 0.7422302009413532
Energy: 0.7968616890266119
Energy: 0.7813894942111963
Energy: 0.8881854984253945
Energy: 0.7813894942100009
Energy: 0.9571428167934106
Energy: 0.7447154592201648
Energy: 0.7454883559352627
Energy: 0.7447154592207625
Energy: 0.7943263503104446
Energy: 0.7437352278736978
Energy: 0.7467929434085919
Energy: 0.7437352278713067
Energy: 0.8849320754749533
Energy: 0.7390003382800446
Energy: 0.7433795811552707
Energy: 0.7390003382758604
Energy: 0.8887571173006453
Energy: 0.739674002366135
Energy: 0.7461382254930041
Energy: 0.739674002363744
Energy: 0.7893957150170097
Energy: 0.7814249316011357
Energy: 0.887613408775871
Energy: 0.7814249316035267
Energy: 0.7842969785483322
Energy: 0.7321357484633287
Energy: 0.8833466584907614
Energy: 0.7321357484591444
Energy: 0.7865557540129161
Energy: 0.7301977057589704
Energy: 0.743764543065058
Energy: 0.7301977057583726
Energy: 0.8211696204071353
Energy: 0.7937486897167373
Energy: 0.7483835687798331
Energy: 0.793748689717335
Energy: 0.8830443088993224
Energy: 0.730329414375098
Energy: 0.7336521236107735
Energy: 0.7303294143804779
Energy: 0.8801929911420173
Energy: 0.7799575323041347
Energy: 0.7438390836016768
Energy: 0.7799575323047324
Energy: 0.8834612232999887
Energy: 0.7517775235404031
Energy: 0.8437111807264929
Energy: 0.7517775235433918
Energy: 0.7925352631815724
Energy: 0.7442625732848337
Energy: 0.7477100328724114
Energy: 0.7442625732902135
Energy: 0.7942720853260948
Energy: 0.7453079574940364
Energy: 0.7485782092012636
Energy: 0.7453079574928411
Energy: 0.9357161477746084
Energy: 0.7445127418317813
Energy: 0.7459953862190161
Energy: 0.7445127418287926
Energy: 0.892188459795627
Energy: 0.7446591991923841
Energy: 0.7436578349085899
Energy: 0.7446591991917864
Energy: 0.8869149663574948
Energy: 0.8698692995238548
Energy: 0.7544360398671381
Energy: 0.8698692995220616
Energy: 0.7439845034202186
Energy: 0.741121201723364
Energy: 0.9572394955796505
Energy: 0.7411212017305371
Energy: 0.7439143109540656
Energy: 0.7426732109739271
Energy: 0.7429580953641626
Energy: 0.7426732109751226
Energy: 0.7405032921400109
Energy: 0.7403499226443508
Energy: 0.7409364533797982
Energy: 0.7403499226431554
Energy: 0.743246406590035
Energy: 0.7373688306815311
Energy: 0.883391620511145
Energy: 0.7373688306038775
Energy: 0.8852629904061099
Energy: 0.7743138593871315
Energy: 0.742830856720038
Energy: 0.7743138593799584
Energy: 0.885684477828382
Energy: 0.7419047523159458
Energy: 0.7404193092031331
Energy: 0.741904752312957
Energy: 0.8511622724007443
Energy: 0.7409986313459993
Energy: 0.7406573489450229
Energy: 0.7409986313477925
Energy: 0.7437296072430801
Energy: 0.7447080771955661
Energy: 0.7520132922885916
Energy: 0.7447080772033369

minimum gb energy = 0.7301977057583726 eV
minimum distance =  2.65548509605475 Angstroms
sigma value = 1


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

Energy: 1.068526363317798
Energy: 0.7070494363656216
Energy: 0.8436106225736673
Energy: 0.7070494363664481
Energy: 0.7333229722880772
Energy: 0.7150672624462522
Energy: 0.8557766017946719
Energy: 0.7150672624454257
Energy: 0.8539467612599733
Energy: 0.783295477297605
Energy: 0.8546259747642175
Energy: 0.783295477295952
Energy: 0.7230582550092007
Energy: 0.7172368348704323
Energy: 0.8600572388618146
Energy: 0.7172368348704323
Energy: 0.7218675357468392
Energy: 0.7172549555845064
Energy: 0.8659983405948201
Energy: 0.7172549555828535
Energy: 0.7168330614344485
Energy: 0.7166930193756427
Energy: 0.8482680828470427
Energy: 0.7166930193772957
Energy: 0.7280213193716748
Energy: 0.7297409200558526
Energy: 0.8590629265879737
Energy: 0.7297409200533732
Energy: 0.7154224636371626
Energy: 0.7161951610472053
Energy: 0.9783526400724228
Energy: 0.7161951610472053
Energy: 0.8557023334498775
Energy: 0.7639854777611335
Energy: 0.984186453973941
Energy: 0.7639854777635755
Energy: 0.9060683749342698
Energy: 0.7161475103653612
Energy: 0.7161075806304553
Energy: 0.7161475103653612
Energy: 0.8571136141841447
Energy: 0.7282131420489286
Energy: 0.7285500034398507
Energy: 0.7282131420489286
Energy: 0.9729994149657767
Energy: 0.7163887658967212
Energy: 0.7167077900428457
Energy: 0.7163887659000271
Energy: 0.97315479247097
Energy: 0.718589434614241
Energy: 0.7233332533517036
Energy: 0.7185894346158939
Energy: 0.7241744039520419
Energy: 0.7162891525789673
Energy: 0.8540233289108792
Energy: 0.7162891525756614
Energy: 0.7205245966550025
Energy: 0.7811874438656126
Energy: 0.8540510744534745
Energy: 0.7811874438672655
Energy: 0.7201980824069247
Energy: 0.7158869891443825
Energy: 0.7262175189926054
Energy: 0.7158869891468621
Energy: 0.8453304642733026
Energy: 0.7317520867643093
Energy: 0.8490288361136277
Energy: 0.7317520867692682
Energy: 0.7137234942604277
Energy: 0.7142597980723141
Energy: 0.8525838818788616
Energy: 0.714259798073967
Energy: 0.7272885324816175
Energy: 0.7312490211323697
Energy: 0.9826053184881555
Energy: 0.7312490211298902
Energy: 0.7174156277595505
Energy: 0.7173582676487398
Energy: 0.9795297346806402
Energy: 0.7173582676536987
Energy: 0.8481036054838909
Energy: 0.7640145773177507
Energy: 0.7196792048219757
Energy: 0.7640145773185771
Energy: 0.8484671630224266
Energy: 0.7163043504741904
Energy: 0.714822400040474
Energy: 0.7163043504741904
Energy: 0.7193411442664744
Energy: 0.716436062484311
Energy: 0.7155111720037345
Energy: 0.716436062485964
Energy: 0.97305103182
Energy: 0.7188348699745168
Energy: 0.719773713290205
Energy: 0.7188348699712109

minimum gb energy = 0.7070494363656216 eV
minimum distance =  2.64347173936314 Angstroms
sigma value = 17


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

Energy: 1.1830014964527122
Energy: 0.7117333100773022
Energy: 0.8505480424985936
Energy: 0.711733310083943
Energy: 0.7165856952771134
Energy: 0.7105865906656694
Energy: 0.8050472757941315
Energy: 0.710586590669756
Energy: 0.9232033430738688
Energy: 0.7179776533477138
Energy: 0.8025653905379846
Energy: 0.717977653350268
Energy: 0.9012352055581524
Energy: 0.7867200386914701
Energy: 0.8115822575446339
Energy: 0.7867200386935135
Energy: 0.8013673461805132
Energy: 0.7048844448001454
Energy: 0.7783118640986041
Energy: 0.7048844448032104
Energy: 0.707214787586871
Energy: 0.7040153635862064
Energy: 0.9209220924757157
Energy: 0.7040153635882498
Energy: 0.7066123340059486
Energy: 0.7037945636749782
Energy: 0.838434790726968
Energy: 0.7037945636775323
Energy: 0.7091681961081249
Energy: 0.7057750525339722
Energy: 0.7151024556949581
Energy: 0.7057750525324398
Energy: 0.8023445906201154
Energy: 0.7035402987383156
Energy: 0.847047684035204
Energy: 0.7035402987316747
Energy: 0.873625328989937
Energy: 0.8492871913282046
Energy: 0.8019566173392562
Energy: 0.8492871913343346
Energy: 0.7988370071082052
Energy: 0.8581648170201295
Energy: 0.7775147611862205
Energy: 0.8581648170165537
Energy: 0.9076392372862238
Energy: 0.7141670540880255
Energy: 0.7394402217073793
Energy: 0.7141670540854713
Energy: 0.7764801364073707
Energy: 0.7205567183652218
Energy: 0.7218128394799609
Energy: 0.720556718364711
Energy: 0.7756343562591027
Energy: 0.7250764733890575
Energy: 0.7192720526100783
Energy: 0.7250764733941659
Energy: 0.9184649386232356
Energy: 0.7141431954960961
Energy: 0.7140961710470564
Energy: 0.7141431954874118
Energy: 0.7675357592287134
Energy: 0.7448329370632253
Energy: 0.7972664050124343
Energy: 0.744832937061182
Energy: 0.7505803090565935
Energy: 0.7021687843637358
Energy: 1.0783333962016912
Energy: 0.7021687843713984
Energy: 0.7607632450647147
Energy: 0.7511243978072034
Energy: 0.8870219018883365
Energy: 0.7511243978087359
Energy: 0.747527843533142
Energy: 0.6998593468381764
Energy: 0.8833455190552928
Energy: 0.6998593468386873
Energy: 0.7593771850778976
Energy: 0.8458052820320732
Energy: 1.127682832455781
Energy: 0.8458052820315624
Energy: 0.8407199185978538
Energy: 0.7017349665950481
Energy: 0.840424671350615
Energy: 0.7017349666011781
Energy: 0.839552680759914
Energy: 0.7028555391644498
Energy: 0.9238762517800951
Energy: 0.7028555391618956
Energy: 0.8468384689131953
Energy: 0.7368892501429328
Energy: 0.9012766116197958
Energy: 0.7368892501429328
Energy: 0.7774955882645126
Energy: 0.7097974750102776
Energy: 0.805127369088629
Energy: 0.7097974750102776
Energy: 0.9112022358947849
Energy: 0.7088407196627977
Energy: 0.7105857502584956
Energy: 0.7088407196627977
Energy: 0.8421638801501343
Energy: 0.7063675956791998
Energy: 0.7081389594658132
Energy: 0.7063675956812433
Energy: 0.7160777208991332
Energy: 0.709440227486807
Energy: 0.7090043598424214
Energy: 0.7094402274806768
Energy: 0.8406608071487855
Energy: 0.7058800045039193
Energy: 0.734244167663901
Energy: 0.7058800045074952
Energy: 0.8008107642601943
Energy: 0.8586341847788369
Energy: 0.8774639040339491
Energy: 0.8586341847767935
Energy: 0.7803578648339375
Energy: 0.8316337169983808
Energy: 0.7362473686033087
Energy: 0.8316337169978701
Energy: 0.8109288979410864
Energy: 0.7124376845156442
Energy: 0.9182466201032584
Energy: 0.7124376845141117
Energy: 0.7186844905398749
Energy: 0.7131190773623555
Energy: 0.7775630989682382
Energy: 0.7131190773633772
Energy: 0.7225627231121724
Energy: 0.7182594230849693
Energy: 0.7766679195105314
Energy: 0.7182594230803718
Energy: 0.711526217835893
Energy: 0.7108445565624775
Energy: 0.9207447654894801
Energy: 0.7108445565558366
Energy: 0.7312412431490868
Energy: 0.7406491204349723
Energy: 0.8127721554867585
Energy: 0.7406491204293532
Energy: 1.0779592893596066
Energy: 0.7111142336053272
Energy: 0.7118717615743376
Energy: 0.711114233605838
Energy: 0.8025124021345087
Energy: 0.7184372293382024
Energy: 0.7197078408036467
Energy: 0.7184372293376917
Energy: 0.8415789932784056
Energy: 0.710155145466311
Energy: 0.71170774352017
Energy: 0.7101551454688652

minimum gb energy = 0.6998593468381764 eV
minimum distance =  2.64682228450568 Angstroms
sigma value = 89


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

Energy: 1.1684033479323035
Energy: 0.6495684545844802
Energy: 0.801636253302781
Energy: 0.6495684545858168
Energy: 0.6487827513211573
Energy: 0.7250557323294294
Energy: 0.6640900608332926
Energy: 0.7250557323267562
Energy: 0.6460518917154636
Energy: 0.7245294661606062
Energy: 0.6667347535046866
Energy: 0.724529466161943
Energy: 0.6439426852421622
Energy: 0.7193380028735326
Energy: 0.6493569572608121
Energy: 0.7193380028695228
Energy: 0.6478779197935111
Energy: 0.6571193533901524
Energy: 0.6541406038323229
Energy: 0.6571193533901524
Energy: 0.6639669996709125
Energy: 0.6634876010621094
Energy: 0.6495560400978834
Energy: 0.6634876010634461
Energy: 0.6564591655437474
Energy: 0.6542598439203606
Energy: 0.6496581232849974
Energy: 0.6542598439230338
Energy: 0.6524874674845088
Energy: 0.6527153925736785
Energy: 0.6500154676829337
Energy: 0.652715392575015
Energy: 0.6581512669288798
Energy: 0.6493430287390882
Energy: 0.6430503336786753
Energy: 0.649343028740425
Energy: 0.6563941617110213
Energy: 0.716785194005881
Energy: 0.6602115973356176
Energy: 0.7167851940045445
Energy: 0.6501006734647391
Energy: 0.7176984035490965
Energy: 0.6422540113696491
Energy: 0.7176984035531063
Energy: 0.6496350279428815
Energy: 0.6508999218100754
Energy: 0.6594344807313058
Energy: 0.6508999218100754
Energy: 0.657794693969242
Energy: 0.6547592477029864
Energy: 0.6541167131863417
Energy: 0.65475924770165
Energy: 0.6490360731656413
Energy: 0.6502529657394092
Energy: 0.6570403839676083
Energy: 0.6502529657447556
Energy: 0.6517962595245743
Energy: 0.6553660076635294
Energy: 0.650888620550335
Energy: 0.655366007664866

minimum gb energy = 0.6422540113696491 eV
minimum distance =  2.65460908890079 Angstroms
sigma value = 13


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

Energy: 1.087289849013763
Energy: 0.6136787788095744
Energy: 0.77781704316275
Energy: 0.6136787788106949
Energy: 0.6825936022639385
Energy: 0.6189121074240521
Energy: 0.7277365466183575
Energy: 0.6189121074257329
Energy: 0.668843612647296
Energy: 0.6156707510485099
Energy: 0.7244177774467242
Energy: 0.6156707510518712
Energy: 0.8745086523920687
Energy: 0.6638110686695659
Energy: 0.7263564895831901
Energy: 0.6638110686667648
Energy: 0.7259651614835155
Energy: 0.769438747740153
Energy: 0.6832357561739733
Energy: 0.7694387477334302
Energy: 0.7313898012924616
Energy: 0.6200987547935879
Energy: 0.6829639220979075
Energy: 0.6200987547958289
Energy: 0.724751780561106
Energy: 0.617995343652077
Energy: 0.7238153603388798
Energy: 0.617995343654878
Energy: 0.6224566075012128
Energy: 0.6184514482521456
Energy: 0.7700981746901537
Energy: 0.6184514482499046
Energy: 0.6232305154852159
Energy: 0.6221817330210522
Energy: 0.6836566717349482
Energy: 0.6221817330154499
Energy: 0.6183932489653108
Energy: 0.6173488893980515
Energy: 0.7299467574326527
Energy: 0.6173488893991719
Energy: 0.6276661021610459
Energy: 0.625050438843348
Energy: 1.0888727681856694
Energy: 0.6250504388416672
Energy: 0.633498476350321
Energy: 0.6184263694013744
Energy: 0.7294582204723219
Energy: 0.6184263693991334
Energy: 0.6361899583746722
Energy: 0.7679408541166729
Energy: 0.7270611897909391
Energy: 0.767940854114432
Energy: 0.6205550078416263
Energy: 0.9076662818267088
Energy: 0.8773300448024097
Energy: 0.9076662818216669
Energy: 0.7697842795311531
Energy: 0.6092174019831242
Energy: 0.7239389513499208
Energy: 0.6092174019831242
Energy: 0.7692029049496308
Energy: 0.6072480075090445
Energy: 0.6650428077941777
Energy: 0.6072480075118456
Energy: 0.6238036656738523
Energy: 0.6061587195513787
Energy: 0.6625283705954896
Energy: 0.6061587195519389
Energy: 1.0358210879000171
Energy: 0.6072075784951022
Energy: 0.6651720297976162
Energy: 0.6072075784945419
Energy: 0.8138199383017535
Energy: 0.6112167029698842
Energy: 0.7695479301221748
Energy: 0.6112167029743659
Energy: 0.6283475634507008
Energy: 0.6605507770479214
Energy: 0.7680426373000634
Energy: 0.6605507770428793
Energy: 0.8722915567951909
Energy: 0.6080541831721584
Energy: 0.7715059729013297
Energy: 0.608054183173279
Energy: 0.629358959112614
Energy: 0.6189727604214814
Energy: 0.6828010406785011
Energy: 0.6189727604231622
Energy: 0.7225014170467389
Energy: 0.6231644560992092
Energy: 0.6838196548408078
Energy: 0.6231644561020103
Energy: 0.669013911872858
Energy: 0.6187213205460108
Energy: 0.7268981727067154
Energy: 0.6187213205392882
Energy: 0.6219547841062081
Energy: 0.6180194230770021
Energy: 0.7700145724153783
Energy: 0.6180194230747612
Energy: 0.6178461394485287
Energy: 0.6229883020351107
Energy: 0.7705505666448298
Energy: 0.6229883020367912
Energy: 0.6173466630060342
Energy: 0.6164354736321968
Energy: 0.7264100365792595
Energy: 0.6164354736366785
Energy: 0.628282566315031
Energy: 0.6241348082709143
Energy: 0.8939432426055824
Energy: 0.6241348082681133
Energy: 0.7290008961392718
Energy: 0.6191273531721162
Energy: 0.7816655093303718
Energy: 0.6191273531687549
Energy: 0.7695723810417142
Energy: 0.6494979482483064
Energy: 0.725703859431701
Energy: 0.6494979482516678
Energy: 0.7262724861603359
Energy: 0.7603590374891455
Energy: 0.8732293783449486
Energy: 0.7603590374846636
Energy: 0.7692529704183428
Energy: 0.6174619426847886
Energy: 0.7257426151002639
Energy: 0.6174619426864694
Energy: 0.7743549155652013
Energy: 0.6221674781105141
Energy: 0.6210431172408165
Energy: 0.6221674781116346
Energy: 0.721975947267884
Energy: 0.6150484532746787
Energy: 0.6154741466992605
Energy: 0.6150484532718775
Energy: 0.8090427960771918
Energy: 0.6170948293287386
Energy: 0.6152060948284807
Energy: 0.617094829327618

minimum gb energy = 0.6061587195513787 eV
minimum distance =  2.62948200691899 Angstroms
sigma value = 37


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

Energy: 0.9929273550226643
Energy: 0.5650214941153426
Energy: 0.5752652056444565
Energy: 0.5650214941153426
Energy: 0.6521911929421447
Energy: 0.5767265196477264
Energy: 0.5884190491984078
Energy: 0.5767265196477264
Energy: 0.6482355342958351
Energy: 0.6480978559602468
Energy: 0.5814581078962442
Energy: 0.6480978559631384
Energy: 0.8465034523638855
Energy: 0.9149447869682639
Energy: 0.5827399977309417
Energy: 0.9149447869692278
Energy: 0.7345139003485865
Energy: 0.555425870420057
Energy: 0.8124330092482208
Energy: 0.5554258704219845
Energy: 0.736576690288066
Energy: 0.5588808462472364
Energy: 0.6466352667679435
Energy: 0.5588808462482002
Energy: 0.6423220371181555
Energy: 0.5617671628199965
Energy: 0.5561013070084254
Energy: 0.5617671628199965
Energy: 0.6566578338859083
Energy: 0.5585921926915628
Energy: 0.6544088497686085
Energy: 0.5585921926905989
Energy: 0.6481313175407559
Energy: 0.5552753342065413
Energy: 0.6522284631164336
Energy: 0.5552753342055775
Energy: 0.6496528484269971
Energy: 0.5557367299724429
Energy: 0.5548326635461033
Energy: 0.5557367299724429
Energy: 0.6845602255488638
Energy: 0.6841416263757724
Energy: 0.9015159581062574
Energy: 0.6841416263719388
Energy: 0.6658690845848645
Energy: 0.5557510165936567
Energy: 0.5547287231199479
Energy: 0.555751016591751
Energy: 0.6606329907274952
Energy: 0.6272183010700823
Energy: 0.6493394748656707
Energy: 0.627218301071046
Energy: 0.6583577357049173
Energy: 0.8162687102962406
Energy: 0.8428614507381078
Energy: 0.8162687102972045
Energy: 0.8124330092482208
Energy: 0.6314305464462302
Energy: 0.5557547755065478
Energy: 0.6314305464462302
Energy: 0.6466352667698712
Energy: 0.6281379282171018
Energy: 0.5562105189855159
Energy: 0.6281379282161379
Energy: 0.7374789414575598
Energy: 0.6270136891223347
Energy: 0.6458662058604437
Energy: 0.6270136891242624
Energy: 0.6544088497724638
Energy: 0.6555259399098399
Energy: 0.5814527870941666
Energy: 0.6555259399098399
Energy: 0.6522284631106504
Energy: 0.573732344653699
Energy: 0.5752118036923901
Energy: 0.5737323446508075
Energy: 0.7370819603091846
Energy: 0.5766443790711095
Energy: 0.5753258926805876
Energy: 0.5766443790711095

minimum gb energy = 0.5547287231199479 eV
minimum distance =  2.64252242838436 Angstroms
sigma value = 25


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

Energy: 1.0331092879549084
Energy: 0.5013655176718459
Energy: 0.49769166996625447
Energy: 0.5013655176718459
Energy: 0.7770193312139092
Energy: 0.4964955117614926
Energy: 0.6380402025381346
Energy: 0.49649551176073997
Energy: 0.7758604616369719
Energy: 0.4990548255604506
Energy: 0.6400402213259468
Energy: 0.4990548255604506
Energy: 0.7566359649261166
Energy: 0.5001654991760508
Energy: 0.6385004918430809
Energy: 0.500165499177556
Energy: 0.785840058580828
Energy: 0.5527217503812523
Energy: 0.7968082575201378
Energy: 0.5527217503842629
Energy: 0.7804793994252776
Energy: 0.5515444986012012
Energy: 0.7823676020811253
Energy: 0.5515444986019539
Energy: 0.7623980430908591
Energy: 0.5531763321866664
Energy: 0.7871199660559952
Energy: 0.553176332185161
Energy: 0.6391024514986812
Energy: 0.4998342093519584
Energy: 0.8997794288300272
Energy: 0.4998342093519584
Energy: 0.6395390990935754
Energy: 0.49664381168770805
Energy: 0.7903648136221065
Energy: 0.49664381169222377
Energy: 0.6404978431341964
Energy: 0.4999225425285739
Energy: 0.7895058891067298
Energy: 0.4999225425285739
Energy: 0.4969612968834427
Energy: 0.49818528006803475
Energy: 0.8930887874912566
Energy: 0.49818528006652946
Energy: 0.49772018499939874
Energy: 0.49961717967926156
Energy: 0.7886957206675924
Energy: 0.49961717967926156
Energy: 0.4987412684392674
Energy: 0.49887736212403333
Energy: 0.775776777078489
Energy: 0.49887736212403333
Energy: 0.5032657943459873
Energy: 0.4974061504087171
Energy: 1.035842878610987
Energy: 0.49740615041022235
Energy: 0.6341864261684391
Energy: 0.4960392202895113
Energy: 0.785948934316772
Energy: 0.4960392202857481
Energy: 0.6397789916486127
Energy: 0.4961041437847428
Energy: 0.7756943611001775
Energy: 0.4961041437847428
Energy: 0.6389697819189976
Energy: 0.4977228806669631
Energy: 0.7759593065797382
Energy: 0.49772288066771575
Energy: 0.6261931358885229
Energy: 0.6879277236204564
Energy: 0.7851735693949513
Energy: 0.687927723621209
Energy: 0.7848675691951786
Energy: 0.5525435917359998
Energy: 0.7764427615832061
Energy: 0.5525435917352471
Energy: 0.7873766180705487
Energy: 0.5507250060022963
Energy: 0.7751987304643765
Energy: 0.5507250060038016
Energy: 0.8960551943693699
Energy: 0.497710316402785
Energy: 0.6434724832056331
Energy: 0.49771031640504293
Energy: 0.7872601485411481
Energy: 0.4958902859701669
Energy: 0.4962129472662084
Energy: 0.4958902859701669
Energy: 0.7793407999252742
Energy: 0.49768189551481495
Energy: 0.6385131501915036
Energy: 0.49768189551632025
Energy: 0.8939752284948574
Energy: 0.4970727074889306
Energy: 0.5025724123484023
Energy: 0.49707270748968324
Energy: 0.786323031540041
Energy: 0.4963761635809815
Energy: 0.4970533834520077
Energy: 0.4963761635809815
Energy: 0.7717503170831281
Energy: 0.49982885394547416
Energy: 0.5009274384967036
Energy: 0.49982885394547416

minimum gb energy = 0.4958902859701669 eV
minimum distance =  2.65146869117957 Angstroms
sigma value = 41


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

Energy: 1.1145089999425055
Energy: 0.4550172124363321
Energy: 0.45234497912051036
Energy: 0.455017212435715
Energy: 0.8701376318925201
Energy: 0.45025410335633004
Energy: 0.5575066560311701
Energy: 0.4502541033594153
Energy: 0.8983381868024533
Energy: 0.4488669916590857
Energy: 0.5585522008670453
Energy: 0.4488669916590857
Energy: 0.8796232047890382
Energy: 0.4483930203992431
Energy: 0.5760268320105149
Energy: 0.448393020398009
Energy: 0.8868223757971644
Energy: 0.6598783772038692
Energy: 0.7722748581503379
Energy: 0.659878377202635
Energy: 0.8722904658564845
Energy: 0.6630842189092682
Energy: 0.7766818681729569
Energy: 0.6630842189080342
Energy: 0.8728899858655224
Energy: 0.6673353755471376
Energy: 0.7993236390156219
Energy: 0.6673353755471376
Energy: 0.7955870902718878
Energy: 0.6657891590497677
Energy: 0.7698463291709977
Energy: 0.6657891590491507
Energy: 0.6640753376715423
Energy: 0.45040717856574336
Energy: 0.8930742274214369
Energy: 0.450407178337522
Energy: 0.6659479286080917
Energy: 0.4500512218504629
Energy: 0.8870399349600714
Energy: 0.4500512218504629
Energy: 0.5769893663658004
Energy: 0.4494102644348112
Energy: 0.9979754253999783
Energy: 0.4494102644341942
Energy: 0.5557384337248746
Energy: 0.4486725222723825
Energy: 0.8847117834221901
Energy: 0.44867252227299953
Energy: 0.5637960955745938
Energy: 0.45287839384003964
Energy: 0.8825015555075226
Energy: 0.4528783938517354
Energy: 0.4549397963961709
Energy: 0.4507572747593959
Energy: 0.9992935041629624
Energy: 0.4507572747587789
Energy: 0.4493625136261139
Energy: 0.44997237947355545
Energy: 0.8858706228604484
Energy: 0.44997237947355545
Energy: 0.45350368988243744
Energy: 0.4521636921468787
Energy: 0.866919860041062
Energy: 0.45216369214811275
Energy: 0.5762338849302706
Energy: 0.44833641432588717
Energy: 0.8675569194080383
Energy: 0.4483364143240361
Energy: 0.5556396753594859
Energy: 0.5554115668179223
Energy: 0.886409489210221
Energy: 0.5554115668166881
Energy: 0.5610928706841679
Energy: 0.4505637107038061
Energy: 0.8736821852842791
Energy: 0.4505637107050402
Energy: 0.7891315054170359
Energy: 0.4496504669466608
Energy: 0.8712818231886849
Energy: 0.44965046694727784
Energy: 0.771375823337262
Energy: 0.4503639189614692
Energy: 0.8863928344683916
Energy: 0.45036391902684764
Energy: 0.7846114319018399
Energy: 0.6655398126961357
Energy: 0.893499584468778
Energy: 0.6655398126949016
Energy: 0.7919065674046555
Energy: 0.4916584958536824
Energy: 0.8728842828942336
Energy: 0.4916584958505971
Energy: 0.7697262358402354
Energy: 0.665566539931518
Energy: 0.7897907976188618
Energy: 0.665566539932135
Energy: 0.8872409045174022
Energy: 0.4499126353449918
Energy: 0.6594072702560267
Energy: 0.4499126353647372
Energy: 0.8831782511959684
Energy: 0.4500445501208176
Energy: 0.6916109253633125
Energy: 0.45004455013932887
Energy: 0.8850159379861994
Energy: 0.45049191283492307
Energy: 0.5656664785502945
Energy: 0.4504919128583426
Energy: 0.8835637370637557
Energy: 0.5547682457000536
Energy: 0.5538135539427195
Energy: 0.5547682456988196
Energy: 0.8754209911486872
Energy: 0.4500781691191007
Energy: 0.5764374914458712
Energy: 0.4500781691191007
Energy: 0.8796246948552658
Energy: 0.4502614238144131
Energy: 0.45085245647089717
Energy: 0.45026142381256196
Energy: 0.887030664311371
Energy: 0.4499646151737299
Energy: 0.44985603116575884
Energy: 0.44996461517434694
Energy: 0.8670217297784585
Energy: 0.45082903827244114
Energy: 0.4519297623119698
Energy: 0.4508290382742922

minimum gb energy = 0.4483364143240361 eV
minimum distance =  2.6460679883494 Angstroms
sigma value = 15


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

Energy: 0.9642058452891951
Energy: 0.4161971794349208
Energy: 0.4142593100009375
Energy: 0.4161971794380571
Energy: 0.9388249900488219
Energy: 0.41267271269308864
Energy: 0.5017816281755096
Energy: 0.41267271281378975
Energy: 0.784310046072348
Energy: 0.4126075879072808
Energy: 0.5030915534621974
Energy: 0.41260758790571267
Energy: 0.9782686207776651
Energy: 0.4134271535653723
Energy: 0.5067324777728952
Energy: 0.41342715357216764
Energy: 0.9496017967444188
Energy: 0.5001352644173785
Energy: 0.6900141776026576
Energy: 0.5001352644158105
Energy: 0.9474418471563172
Energy: 0.4177596166554005
Energy: 0.690060868608175
Energy: 0.41775961653888116
Energy: 0.7828823980434985
Energy: 0.41761174849900007
Energy: 0.6951501310745236
Energy: 0.4176117481677373
Energy: 0.8694623007468609
Energy: 0.44888529737007277
Energy: 0.6798297562932539
Energy: 0.44888529736536825
Energy: 0.7860947186342684
Energy: 0.4472937546097103
Energy: 0.8636747158780561
Energy: 0.4472937546128467
Energy: 0.7848790794322437
Energy: 0.4483476666020232
Energy: 0.7852392978074018
Energy: 0.44834766659000064
Energy: 0.6964319493961351
Energy: 0.4146999183546286
Energy: 0.8682100962029744
Energy: 0.41469991829090413
Energy: 0.5902842654500087
Energy: 0.41612047811577874
Energy: 0.9514960228586107
Energy: 0.4161204780692565
Energy: 0.6900155768430524
Energy: 0.41183684494614475
Energy: 0.9512585501079877
Energy: 0.4118368449430084
Energy: 0.5095264600367523
Energy: 0.4134787914947213
Energy: 0.8680938067628716
Energy: 0.41347879149263045
Energy: 0.4998448009258829
Energy: 0.4120585726055861
Energy: 0.9481990499476455
Energy: 0.4120585726050634
Energy: 0.5076363729128639
Energy: 0.41351761574114965
Energy: 0.9478232795761437
Energy: 0.4135176157427178
Energy: 0.4171130601169203
Energy: 0.4119409279734391
Energy: 0.9512029985997078
Energy: 0.41194092797291637
Energy: 0.4121480788742105
Energy: 0.41202765459592217
Energy: 0.9490768955959539
Energy: 0.4120276545985358
Energy: 0.41541683384649797
Energy: 0.4115118607089152
Energy: 0.9402382766275963
Energy: 0.4115118607089152
Energy: 0.5076874032733892
Energy: 0.4129356790000609
Energy: 0.7811828616033426
Energy: 0.4129356789990155
Energy: 0.4997039586828442
Energy: 0.41175021198093054
Energy: 0.9491222759799767
Energy: 0.4117502119814532
Energy: 0.5087993164603445
Energy: 0.4133159138471982
Energy: 0.9470771333763863
Energy: 0.4133159138398801
Energy: 0.690924734483098
Energy: 0.41217680722011946
Energy: 0.9400659090667177
Energy: 0.41217680722116495
Energy: 0.6820998664867624
Energy: 0.4155279069532743
Energy: 0.950244135489214
Energy: 0.4155279069433425
Energy: 0.6978435606708717
Energy: 0.41799864658297026
Energy: 0.7703976327273709
Energy: 0.4179986465719931
Energy: 0.8682201211065761
Energy: 0.4482354369725314
Energy: 0.7901984966544604
Energy: 0.4482354369720086
Energy: 0.6863994832958892
Energy: 0.4482797975791713
Energy: 0.8664150974402913
Energy: 0.4482797975823077
Energy: 0.8671443740478716
Energy: 0.824515221811755
Energy: 0.7717855954787516
Energy: 0.8245152218122778
Energy: 0.8663001089070018
Energy: 0.4158245139965906
Energy: 0.7885389761244848
Energy: 0.4158245140482925
Energy: 0.8628733573397679
Energy: 0.4174400940508976
Energy: 0.6901669167458747
Energy: 0.41744009400385274
Energy: 0.8679237830449786
Energy: 0.5001768418521693
Energy: 0.5903449226488959
Energy: 0.5001768418526918
Energy: 0.8721729942335629
Energy: 0.41389926562983564
Energy: 0.6102683377017953
Energy: 0.41389926556402024
Energy: 0.9527390029007688
Energy: 0.41431651529186647
Energy: 0.5047964109191377
Energy: 0.41431651529186647
Energy: 0.9517489602768964
Energy: 0.4141305921384763
Energy: 0.5037086255662659
Energy: 0.414130592138999
Energy: 1.0664432111718691
Energy: 0.4131566743531581
Energy: 0.4143684940106405
Energy: 0.41315667435211273
Energy: 0.9464906447090917
Energy: 0.41495007003873213
Energy: 0.41431036413630334
Energy: 0.41495007003716394
Energy: 0.9530383098478953
Energy: 0.4139590918889452
Energy: 0.4147009766707839
Energy: 0.41395909188999064

minimum gb energy = 0.4115118607089152 eV
minimum distance =  2.65761552388112 Angstroms
sigma value = 85


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

Energy: 1.0188815171690915
Energy: 0.3447198870084984
Energy: 0.3748560925771851
Energy: 0.3447198913456428
Energy: 0.8506601618263726
Energy: 0.3723895947566721
Energy: 0.45272144503793776
Energy: 0.37238959475939226
Energy: 0.8385236739048502
Energy: 0.37229235816388734
Energy: 0.4527850280045765
Energy: 0.37229235816388734
Energy: 0.8464796621961902
Energy: 0.3732961624617509
Energy: 0.45680269982229377
Energy: 0.3732961624554039
Energy: 0.8504751756831377
Energy: 0.45063451752587963
Energy: 0.6157562607524208
Energy: 0.4506345175249729
Energy: 0.8367030398613793
Energy: 0.37221690277986513
Energy: 0.6225816849924724
Energy: 0.37221690277805164
Energy: 0.837206640722031
Energy: 0.3725352008836607
Energy: 0.7141693756124313
Energy: 0.37253520087958053
Energy: 0.8515885029372777
Energy: 0.37304494382557496
Energy: 0.6030160894483648
Energy: 0.37304494384731557
Energy: 0.8461424488601623
Energy: 0.5668282188029687
Energy: 0.7789392119745486
Energy: 0.5668282188075023
Energy: 0.8460658441704042
Energy: 0.567365735640306
Energy: 0.8529745994063317
Energy: 0.5673657356384926
Energy: 0.7806031665519864
Energy: 0.5678385574111787
Energy: 0.7660784697691078
Energy: 0.5678385574120854
Energy: 0.6866942295171825
Energy: 0.37324360601590034
Energy: 0.8528454396583051
Energy: 0.37324360599642653
Energy: 0.7801641196042618
Energy: 0.3723671649005473
Energy: 0.8423088437980741
Energy: 0.37236716491278793
Energy: 0.6270251005293589
Energy: 0.3726826764273239
Energy: 0.7644811456312914
Energy: 0.372682676386089
Energy: 0.524464549339485
Energy: 0.3732392329614261
Energy: 0.8511992278686116
Energy: 0.3732392329614261
Energy: 0.6256000405945387
Energy: 0.37231649985715376
Energy: 0.9093084765134772
Energy: 0.3723164998567004
Energy: 0.45633105080390346
Energy: 0.3728346482661975
Energy: 0.9073463197869158
Energy: 0.3728346482698244
Energy: 0.4498905417032696
Energy: 0.3721874541952014
Energy: 0.8501306145500744
Energy: 0.37218745419565474
Energy: 0.45615001924793036
Energy: 0.372766063113821
Energy: 0.9067081747527906
Energy: 0.37276606311608773
Energy: 0.3736190700835361
Energy: 0.3726839174128626
Energy: 0.9066921264010209
Energy: 0.37268391741376933
Energy: 0.3721613514453529
Energy: 0.37235593445778853
Energy: 0.8503096753505688
Energy: 0.37235593445778853
Energy: 0.373445244888496
Energy: 0.3734707792227131
Energy: 0.9777212791021918
Energy: 0.37347077922316646
Energy: 0.4535346258554147
Energy: 0.37250098992333364
Energy: 0.8373939472753248
Energy: 0.372500989923787
Energy: 0.45036900366122085
Energy: 0.3720336319817259
Energy: 0.8516832462201512
Energy: 0.37203363198625944
Energy: 0.4590751816045328
Energy: 0.3741096361579528
Energy: 0.8452020201010528
Energy: 0.3741096361579528
Energy: 0.6221094941500948
Energy: 0.3730641689877281
Energy: 0.8447657846528539
Energy: 0.37306416898364786
Energy: 0.6210310203447663
Energy: 0.37221209553408263
Energy: 0.8475359222076922
Energy: 0.372212095528189
Energy: 0.623381206489245
Energy: 0.3730487153224014
Energy: 0.8490775626986864
Energy: 0.3730487153228548
Energy: 0.7784011921350844
Energy: 0.3732236367228535
Energy: 0.8524789263090221
Energy: 0.3732236367237603
Energy: 0.779465032475933
Energy: 0.37236667398725093
Energy: 0.8493669005344291
Energy: 0.37236667397004397
Energy: 0.789071823545816
Energy: 0.5677570600235822
Energy: 0.6829238848586233
Energy: 0.5677570600231288
Energy: 0.7677508048683562
Energy: 0.5677443167434507
Energy: 0.7872111567196156
Energy: 0.5677443167420906
Energy: 0.8504343551378438
Energy: 0.3724271334436987
Energy: 0.7097370225330077
Energy: 0.37242713342103084
Energy: 0.8525442799070448
Energy: 0.3733890304223958
Energy: 0.7103609909757709
Energy: 0.3733890304672576
Energy: 0.7626530711379127
Energy: 0.3732284584424345
Energy: 0.6256639449891632
Energy: 0.3732284584496882
Energy: 0.8531257056354244
Energy: 0.37274969786969786
Energy: 0.6210515548564524
Energy: 0.3727496978864721
Energy: 0.8461645314017925
Energy: 0.37315151571834115
Energy: 0.6221120356363763
Energy: 0.37315151571743443
Energy: 0.9366621835028324
Energy: 0.3738151108649356
Energy: 0.4586113228035164
Energy: 0.3738151108649356
Energy: 0.8504590931792926
Energy: 0.3723196840861503
Energy: 0.4503164128933682
Energy: 0.37231968408660365
Energy: 0.907381923956889
Energy: 0.3726086079110578
Energy: 0.4535901603402483
Energy: 0.3726086079115112
Energy: 0.9011952892601631
Energy: 0.37340742869015126
Energy: 0.37368473888004644
Energy: 0.3734074286906046
Energy: 0.8510412327324016
Energy: 0.37245027413464193
Energy: 0.37237691234579895
Energy: 0.3724502741341886
Energy: 0.9783071486530486
Energy: 0.3727770324486099
Energy: 0.3730201014273234
Energy: 0.3727770324486099

minimum gb energy = 0.3447198870084984 eV
minimum distance =  2.65966235631628 Angstroms
sigma value = 113


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

Energy: 0.01299248255582973
Energy: 0.014307594590988014
Energy: 0.7711441964647963
Energy: 0.014307594590639497
Energy: 0.013946657047451698
Energy: 0.07920673275133908
Energy: 0.5857861597949641
Energy: 0.07920673274963522
Energy: 0.013570590160294452
Energy: 0.07870869780801631
Energy: 0.5847144153366206
Energy: 0.07870869780801631
Energy: 0.014214049967560255
Energy: 0.078093474759382
Energy: 0.5841245269974208
Energy: 0.07809347475971114
Energy: 0.5845873788206274
Energy: 0.07832549876986353
Energy: 0.5849723987969613
Energy: 0.0783254987708897
Energy: 0.013458458518781247
Energy: 0.07818792719316703
Energy: 0.5844461822388927
Energy: 0.07818792719316703

minimum gb energy = 0.01299248255582973 eV
minimum distance =  2.85041245706497 Angstroms
sigma value = 1