Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_Cu__MO_759493141826_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=3.614958965778353
cohesive_energy=3.5402732499842564
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: 0.01373537905557827
Energy: 0.014445847173191226
Energy: 0.3348543358737565
Energy: 0.014445847173818457
Energy: 0.014445847173818457
Energy: 0.5725306489849656
Energy: 0.014445847173818457
Energy: 0.5725306489849656
Energy: 0.3348543358737565
Energy: 0.014445847173818457
Energy: 0.01373537905557827
Energy: 0.014445847173818457
Energy: 0.014445847173818457
Energy: 0.5725306489849656
Energy: 0.014445847173191226
Energy: 0.5725306489843385

minimum gb energy = 0.01373537905557827 eV
minimum distance =  2.4831995829058 Angstroms
sigma value = 1


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

Energy: 0.8155934609438542
Energy: 0.7930786424953895
Energy: 0.843339568028441
Energy: 0.7930786424946288
Energy: 0.7706576038992782
Energy: 0.8016627230423782
Energy: 0.7709575025717976
Energy: 0.8016627230400961
Energy: 0.7399328020271355
Energy: 0.7857768123445344
Energy: 0.7699244770196306
Energy: 0.7857768123445344
Energy: 0.7690754719388357
Energy: 0.8029028702028789
Energy: 0.7548185851813155
Energy: 0.8029028702005969
Energy: 0.7713993766132575
Energy: 0.7938908748897338
Energy: 0.7706447501656565
Energy: 0.7938908748882124
Energy: 0.7391080079547582
Energy: 0.7946717159145782
Energy: 0.736829093234467
Energy: 0.7946717159130567
Energy: 0.771946064086816
Energy: 0.7868743276922319
Energy: 0.7398734200049027
Energy: 0.7868743276922319
Energy: 0.7041884888308545
Energy: 0.7933599031775765
Energy: 0.7403569987713837
Energy: 0.7933599031775765
Energy: 0.7558798513604151
Energy: 0.8027934752585061
Energy: 0.768405053707985
Energy: 0.8027934752585061
Energy: 0.7332161431800017
Energy: 0.7853681395133586
Energy: 0.7055370717318411
Energy: 0.7853681395133586
Energy: 0.7685766944690852
Energy: 0.8054695720894391
Energy: 0.756086652556859
Energy: 0.8054695720894391
Energy: 0.7859025617675846
Energy: 0.7932347750250132
Energy: 0.7352415011580283
Energy: 0.7932347750250132
Energy: 0.7698439513895949
Energy: 0.785802311511303
Energy: 0.7721686017756143
Energy: 0.7858023115097814
Energy: 0.7742785766593483
Energy: 0.7926989397636965
Energy: 0.7519468488055244
Energy: 0.7926989397644572
Energy: 0.7790506699241068
Energy: 0.7940075308125728
Energy: 0.7691085781863011
Energy: 0.7940075308125728
Energy: 0.7686923491606232
Energy: 0.7943584473172559
Energy: 0.7694325867944805
Energy: 0.7943584473157345
Energy: 0.7700200176470552
Energy: 0.7858463209282956
Energy: 0.7240860454891537
Energy: 0.7858463209282956
Energy: 0.7710657964900797
Energy: 0.7859493044316178
Energy: 0.76992665994928
Energy: 0.7859493044323785
Energy: 0.7154036993424747
Energy: 0.7929764196081759
Energy: 0.7348245186706852
Energy: 0.7929764196074153
Energy: 0.7713145354408759
Energy: 0.7739246539508828
Energy: 0.7586741959198783
Energy: 0.7739246539516434
Energy: 0.7342486735446845
Energy: 0.7853147133412697
Energy: 0.7131430501887057
Energy: 0.7853147133412697
Energy: 0.75500938450467
Energy: 0.813716761524853
Energy: 0.7690307713096394
Energy: 0.8137167615240923
Energy: 0.7709870914585121
Energy: 0.7938521178830918
Energy: 0.7376014908806859
Energy: 0.7938521178838527
Energy: 0.7371729078836579
Energy: 0.7865543822107469
Energy: 0.7387475172500297
Energy: 0.7865543822122684
Energy: 0.7399244369481938
Energy: 0.7920220082169185
Energy: 0.771790565448306
Energy: 0.7920220082161925
Energy: 0.7734884527422835
Energy: 0.7936135911271295
Energy: 0.7361964578750976
Energy: 0.7936135911263688
Energy: 0.7718569353141913
Energy: 0.7917711219418205
Energy: 0.7558418945814656
Energy: 0.791771121940299
Energy: 0.7426105876557675
Energy: 0.7851448752192433
Energy: 0.807147052707404
Energy: 0.7851448752192433
Energy: 0.7693842217047291
Energy: 0.7981101852160893
Energy: 0.7684820636878315
Energy: 0.7981101852153287
Energy: 0.8125375717921
Energy: 0.7930143479109799
Energy: 0.7865516278394395
Energy: 0.7930143479094586
Energy: 0.7742771442582612
Energy: 0.7913711188341637
Energy: 0.7696384889851806
Energy: 0.7913711188341637
Energy: 0.7555056122754512
Energy: 0.785942969854473
Energy: 0.7743058307200447
Energy: 0.785942969852191
Energy: 0.7713310572226646
Energy: 0.803546452251086
Energy: 0.7555484089633623
Energy: 0.8035464522518468

minimum gb energy = 0.7041884888308545 eV
minimum distance =  2.3163051645554 Angstroms
sigma value = 1


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

Energy: 0.8737760575987269
Energy: 0.8494601927715979
Energy: 0.9005175498466724
Energy: 0.8494601927698632
Energy: 0.8065013043202561
Energy: 0.8424267330089978
Energy: 0.8063113153746592
Energy: 0.8424267330150691
Energy: 0.775968944899539
Energy: 0.8498481817555016
Energy: 0.8064168833144311
Energy: 0.8498481817563691
Energy: 0.7796767693309457
Energy: 0.8181780769376068
Energy: 0.7723069071658403
Energy: 0.8181780769384742
Energy: 0.7802839514820353
Energy: 0.8391508922309454
Energy: 0.7796447361694685
Energy: 0.8391508922283434
Energy: 0.8355389746214299
Energy: 0.8389235511460578
Energy: 0.7785308637727331
Energy: 0.8389235511486598
Energy: 0.7790246976496433
Energy: 0.8191910869849262
Energy: 0.7719660527851673
Energy: 0.8191910869823241
Energy: 0.7351324472648624
Energy: 0.8496801289411119
Energy: 0.7785324408234501
Energy: 0.8496801289428467
Energy: 0.7798735609322919
Energy: 0.8144426453447392
Energy: 0.8062453233906492
Energy: 0.81444264534127
Energy: 0.7727612303500462
Energy: 0.8496633418024835
Energy: 0.750030285520498
Energy: 0.8496633418033508
Energy: 0.7795884610464283
Energy: 0.8525061470492085
Energy: 0.8061440462420453
Energy: 0.8525061470492085
Energy: 0.7575362753773088
Energy: 0.8436172645843134
Energy: 0.8065029426507172
Energy: 0.8436172645817114
Energy: 0.8128647223480606
Energy: 0.838795612454966
Energy: 0.7797792280488365
Energy: 0.8387956124584354
Energy: 0.8139086191518882
Energy: 0.8387826421673609
Energy: 0.7797884212563815
Energy: 0.8387826421638914
Energy: 0.7574435313057493
Energy: 0.8435802775043587
Energy: 0.806516447114463
Energy: 0.8435802775026241
Energy: 0.7791326971518591
Energy: 0.8524610226152689
Energy: 0.8061239161518923
Energy: 0.8524610226117995
Energy: 0.7727461600823979
Energy: 0.849530527574555
Energy: 0.7500641090813942
Energy: 0.8495305275780243
Energy: 0.7795610174286496
Energy: 0.8144614183643736
Energy: 0.8060944129032248
Energy: 0.8144614183669756
Energy: 0.7351264034425872
Energy: 0.8496835770387392
Energy: 0.7784957079323764
Energy: 0.8496835770404738
Energy: 0.7795936425033783
Energy: 0.8194934719101171
Energy: 0.7720380358805751
Energy: 0.8194934719057806
Energy: 0.8354592382789584
Energy: 0.838929290242015
Energy: 0.7785311461501858
Energy: 0.8389292902402804
Energy: 0.7800229648296264
Energy: 0.83907136336045
Energy: 0.7798798616670886
Energy: 0.83907136336045
Energy: 0.7799538075493674
Energy: 0.8182186645762963
Energy: 0.7722085776194011
Energy: 0.8182186645788984
Energy: 0.7758589791334601
Energy: 0.8497394868720501
Energy: 0.80653567670513
Energy: 0.8497394868711828
Energy: 0.8063806202438213
Energy: 0.8424231089994996
Energy: 0.8060576456422643
Energy: 0.8424231089986322
Energy: 0.8737760575987269
Energy: 0.8494601927715979
Energy: 0.9005175498492745
Energy: 0.8494601927698632
Energy: 0.8065013043176541
Energy: 0.8424267330081304
Energy: 0.8063113153746592
Energy: 0.8424267330159364
Energy: 0.775968944899539
Energy: 0.8498481817563691
Energy: 0.8064168833144311
Energy: 0.8498481817563691
Energy: 0.7796767693318131
Energy: 0.8181780769376068
Energy: 0.7723069071658403
Energy: 0.8181780769384742

minimum gb energy = 0.7351264034425872 eV
minimum distance =  2.283734344227 Angstroms
sigma value = 25


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

Energy: 0.8315677974792062
Energy: 0.8940780218537093
Energy: 0.9689157985712459
Energy: 0.8940780218547175
Energy: 0.8219225358175907
Energy: 0.9072126714385262
Energy: 0.8199677163949824
Energy: 0.9072126714385262
Energy: 0.802346141164238
Energy: 0.9148595389097144
Energy: 0.8197400030213723
Energy: 0.9148595389097144
Energy: 0.8278973130968413
Energy: 0.8788036696367494
Energy: 0.7983542129883393
Energy: 0.8788036696377576
Energy: 0.8003470372026328
Energy: 0.89472644530689
Energy: 0.8133486606006549
Energy: 0.8947264453078984
Energy: 0.8869635368932365
Energy: 0.9149731168525554
Energy: 0.8207638891762328
Energy: 0.9149731168525554
Energy: 0.8202846717703559
Energy: 0.8241648288906503
Energy: 0.8073663334753073
Energy: 0.8241648288896422
Energy: 0.9449783550684566
Energy: 0.8945828753181448
Energy: 0.767218334420262
Energy: 0.894582875319153
Energy: 0.8072632226374546
Energy: 0.875714577688993
Energy: 0.82219009487799
Energy: 0.8757145776900012
Energy: 0.8205104731033489
Energy: 0.9148835623717836
Energy: 0.7938666592554857
Energy: 0.9148835623707754
Energy: 0.8267660466454275
Energy: 0.8947148827440409
Energy: 0.8197259928365082
Energy: 0.8947148827430327
Energy: 0.799105200537607
Energy: 0.8942324952072479
Energy: 0.819834652056521
Energy: 0.8942324952072479
Energy: 0.8196153462831738
Energy: 0.8775581968257345
Energy: 0.7952627709856752
Energy: 0.8775581968257345
Energy: 0.8081602141881989
Energy: 0.8203352382421756
Energy: 0.821799833519142
Energy: 0.8203352382421756
Energy: 0.7989070687304914
Energy: 0.8944362937161315
Energy: 0.7660898877587989
Energy: 0.8944362937161315
Energy: 0.8200768005442218
Energy: 0.8248643145919956
Energy: 0.7980038917207946
Energy: 0.8248643145919956
Energy: 0.7661209504259788
Energy: 0.9147527156697431
Energy: 0.7659286697245863
Energy: 0.9147527156697431
Energy: 0.7981096233910228
Energy: 0.894905490236922
Energy: 0.8282155176787652
Energy: 0.894905490236922
Energy: 0.7941736171468441
Energy: 0.8786931776394347
Energy: 0.8001911255069815
Energy: 0.8786931776394347
Energy: 0.8214018795386167
Energy: 0.9145814515427095
Energy: 0.8213317941162837
Energy: 0.9145814515427095
Energy: 0.8242108570071394
Energy: 0.8713800034733312
Energy: 0.8254773861762327
Energy: 0.8713800034733312
Energy: 0.8296388265308927
Energy: 0.89454580473955
Energy: 0.8869258260931985
Energy: 0.8945458047405582
Energy: 0.820401542572827
Energy: 0.8747567143153063
Energy: 0.8201919929056591
Energy: 0.874756714314298
Energy: 0.8013744258560581
Energy: 0.9148399843718021
Energy: 0.8205220427489438
Energy: 0.9148399843718021
Energy: 0.8200628866907675
Energy: 0.880409745107318
Energy: 0.7973200561343323
Energy: 0.880409745107318

minimum gb energy = 0.7659286697245863 eV
minimum distance =  2.29163259370185 Angstroms
sigma value = 9


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

Energy: 0.8850449013556463
Energy: 0.8858860870704747
Energy: 1.0514991543461885
Energy: 0.885886087069272
Energy: 0.8393181719272925
Energy: 0.9357921198972258
Energy: 0.8747364526840289
Energy: 0.9357921198996313
Energy: 0.7916880395400429
Energy: 0.8676329139206929
Energy: 0.8804396621520502
Energy: 0.86763291391949
Energy: 0.8693436049768244
Energy: 0.9423320502436474
Energy: 0.8010306226664359
Energy: 0.9423320502448502
Energy: 0.9509289105422453
Energy: 0.9354202504942263
Energy: 0.8795444430762596
Energy: 0.9354202504918206
Energy: 0.7917661406430677
Energy: 0.8712187606515366
Energy: 0.7955455796615586
Energy: 0.8712187606515366
Energy: 0.8680323915889356
Energy: 0.8010097264419842
Energy: 0.8009602398606755
Energy: 0.8010097264419842
Energy: 0.9102894883008544
Energy: 0.8719113805736451
Energy: 0.7953683904686673
Energy: 0.8719113805748477
Energy: 0.8679855411405413
Energy: 0.9355617717944419
Energy: 0.8781396118501533
Energy: 0.9355617717932391
Energy: 0.8713468164389087
Energy: 0.8683647635609637
Energy: 0.8010172083914597
Energy: 0.868364763559761
Energy: 0.8287477752081126
Energy: 0.9409065079639148
Energy: 0.8802512444553875
Energy: 0.9409065079651175
Energy: 0.8695954955344232
Energy: 0.905407284104411
Energy: 0.8021465916673229
Energy: 0.9054072841056138
Energy: 0.7916464616015835
Energy: 0.8862586012671896
Energy: 0.8122554542237209
Energy: 0.8862586012623785
Energy: 0.8255257388785198
Energy: 0.8713397343766756
Energy: 0.8749519610254198
Energy: 0.8713397343754729
Energy: 0.7916562698666835
Energy: 0.8860183119073199
Energy: 0.8123915335908135
Energy: 0.8860183119061172
Energy: 0.8695004773171785
Energy: 0.905417553943231
Energy: 0.8022261311891389
Energy: 0.9054175539456366
Energy: 0.8286416860466762
Energy: 0.9408762600937031
Energy: 0.8802302471161021
Energy: 0.9408762600912975
Energy: 0.8714988227412163
Energy: 0.868265832700026
Energy: 0.8017941530642759
Energy: 0.868265832700026
Energy: 0.867913437282308
Energy: 0.9355880580108323
Energy: 0.8781678343339528
Energy: 0.9355880580084269
Energy: 0.9104220353740565
Energy: 0.8718512158867201
Energy: 0.7953575064773883
Energy: 0.8718512158867201
Energy: 0.8680182343965505
Energy: 0.8010849058245043
Energy: 0.8009649196274763
Energy: 0.8010849058233016

minimum gb energy = 0.7916464616015835 eV
minimum distance =  2.38497028333956 Angstroms
sigma value = 25


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

Energy: 0.8222888314236134
Energy: 1.0137570687631492
Energy: 1.1391183650736938
Energy: 1.0137570687616617
Energy: 0.8149213686230115
Energy: 0.8168093656033983
Energy: 0.8127034627832147
Energy: 0.8168093656004571
Energy: 0.8127687519947268
Energy: 0.9446478319462019
Energy: 0.8124977212881775
Energy: 0.9446478319462019
Energy: 0.8244792087379098
Energy: 0.855886603881569
Energy: 0.9640312663794661
Energy: 0.8558866038800816
Energy: 0.9608889738928004
Energy: 0.8171915585754369
Energy: 0.81281621891013
Energy: 0.8171915585754369
Energy: 0.8161740943001532
Energy: 0.8228794636829851
Energy: 0.8151174393025233
Energy: 0.8228794636844725
Energy: 0.8135255496219549
Energy: 0.9408280894476715
Energy: 0.8125535128480544
Energy: 0.9408280894476715
Energy: 0.9618459704446573
Energy: 1.0151136419335205
Energy: 0.8245040308207355
Energy: 1.0151136419335205
Energy: 0.8124683621403026
Energy: 0.8344192342238993
Energy: 0.8167804645895609
Energy: 0.8344192342238993
Energy: 0.9774869858605512
Energy: 0.9445625033824939
Energy: 0.8159930141866009
Energy: 0.9445625033810064
Energy: 0.8371054256221053
Energy: 1.0116575317810492
Energy: 1.0975926942556868
Energy: 1.011657531782537
Energy: 0.8135778585954171
Energy: 0.8293197967280133
Energy: 0.9763169925351508
Energy: 0.8293197967265259
Energy: 0.9623651520032975
Energy: 0.8575223739054177
Energy: 0.8124376055658756
Energy: 0.8575223739054177
Energy: 0.8126570080101138
Energy: 0.8554102618846409
Energy: 0.8250790284476952
Energy: 0.8554102618831534
Energy: 0.812474699211975
Energy: 1.0122271470171842
Energy: 0.960307032543016
Energy: 1.0122271470171842
Energy: 0.8166462729580695
Energy: 0.8563915554503844
Energy: 0.8161393017986426
Energy: 0.8563915554503844
Energy: 0.8128011953535665
Energy: 0.8845429487940653
Energy: 0.9757458805206084
Energy: 0.8845429487940653

minimum gb energy = 0.8124376055658756 eV
minimum distance =  2.36484377902029 Angstroms
sigma value = 17


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

Energy: 0.9335890710774396
Energy: 0.9032981523665705
Energy: 1.1762301606733017
Energy: 0.903298152361516
Energy: 0.9685800574739093
Energy: 0.897442461123623
Energy: 0.8378283970889263
Energy: 0.897442461123623
Energy: 0.9629804682887014
Energy: 0.8397695968841381
Energy: 0.8377412437674797
Energy: 0.8397695968824532
Energy: 0.8390127584028526
Energy: 0.8416411045299852
Energy: 0.9142361585486112
Energy: 0.8416411045308279
Energy: 0.9745270372465438
Energy: 0.9010116713343118
Energy: 0.867070734440502
Energy: 0.9010116713359967
Energy: 0.8406503983331347
Energy: 0.8617689274723932
Energy: 0.9713452087752874
Energy: 0.8617689274723932
Energy: 0.8417600862131692
Energy: 0.894489181032753
Energy: 0.8378943744437631
Energy: 0.8944891810319107
Energy: 0.9663393737511397
Energy: 0.8415513002642443
Energy: 0.8466940587372506
Energy: 0.8415513002634019
Energy: 0.8432300817725474
Energy: 0.9300434783486601
Energy: 1.0032096941738042
Energy: 0.9300434783495024
Energy: 1.0672666749365463
Energy: 0.8685575535267072
Energy: 0.8437637675891911
Energy: 0.8685575535250223
Energy: 0.8411221607951572
Energy: 0.8417286480756648
Energy: 0.9638045491177253
Energy: 0.8417286480748224
Energy: 0.8456729803405348
Energy: 0.8954053690738085
Energy: 0.8449595494532532
Energy: 0.8954053690729662
Energy: 0.9687140495588404
Energy: 0.8419316891964708
Energy: 0.8400555048960835
Energy: 0.8419316891956283
Energy: 0.8435394105585092
Energy: 0.9324315881126769
Energy: 0.9660922819649991
Energy: 0.9324315881126769
Energy: 0.916013600601272
Energy: 0.8937833651573017
Energy: 0.8435052130033277
Energy: 0.893783365155617
Energy: 0.9659119960608087
Energy: 0.8413746366282779
Energy: 0.9662665170082216
Energy: 0.8413746366274356
Energy: 0.8380404723748583
Energy: 0.9241077301755927
Energy: 0.9719352338195806
Energy: 0.9241077301764352
Energy: 0.9541198196689198
Energy: 0.840304104004819
Energy: 0.8406010851049445
Energy: 0.840304104004819
Energy: 0.8382270192950642
Energy: 0.9425783252912305
Energy: 0.8971353209638571
Energy: 0.9425783252895457
Energy: 0.8381963887575803
Energy: 0.8406501786066845
Energy: 0.8391803361425354
Energy: 0.8406501786066845
Energy: 0.9041331297893664
Energy: 0.9334169996622029
Energy: 0.9619821147437061
Energy: 0.9334169996622029
Energy: 0.8380123463622481
Energy: 0.9888780913500503
Energy: 1.061863951488169
Energy: 0.9888780913508928
Energy: 1.0063174537172048
Energy: 0.9042793593371182
Energy: 0.8377623995872706
Energy: 0.9042793593379607
Energy: 0.8396823396736525
Energy: 0.8939651372239503
Energy: 0.9673438035412184
Energy: 0.8939651372231078
Energy: 0.8400642429762495
Energy: 0.8422561315062705
Energy: 0.9663619338127132
Energy: 0.8422561315037433
Energy: 1.0046365373557398
Energy: 0.8413433608187901
Energy: 0.8388062278469743
Energy: 0.8413433608171054
Energy: 0.8526797993304259
Energy: 0.9728679980606774
Energy: 1.078700978513664
Energy: 0.972867998059835
Energy: 0.971181532137641
Energy: 0.8612307955389921
Energy: 0.96224264086889
Energy: 0.8612307955389921
Energy: 1.007088755865062
Energy: 0.9166594218270033
Energy: 0.8415377173704708
Energy: 0.9166594218261608
Energy: 0.8466139576737357
Energy: 0.9315960554758853
Energy: 0.9547128985674992
Energy: 0.9315960554784125

minimum gb energy = 0.8377412437674797 eV
minimum distance =  2.33763730313274 Angstroms
sigma value = 53


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

Energy: 0.7937128607651027
Energy: 0.7933785329674756
Energy: 1.220111418129459
Energy: 0.7933785329674756
Energy: 0.9676689838454816
Energy: 0.8698839161103241
Energy: 0.90093615536947
Energy: 0.8698839161083847
Energy: 0.7948214131342639
Energy: 0.7943013102391415
Energy: 0.8379315940573677
Energy: 0.7943013102410809
Energy: 0.7951362632256401
Energy: 0.794019563356881
Energy: 0.8379365145678074
Energy: 0.794019563356881
Energy: 0.9675353348142485
Energy: 0.8698454365917546
Energy: 0.9005211026956436
Energy: 0.869845436593694
Energy: 0.7937128607670421
Energy: 0.7933785329674756
Energy: 1.1395945977206312
Energy: 0.7933785329674756
Energy: 0.9676689838493604
Energy: 0.8698839161083847
Energy: 0.9720452158854944
Energy: 0.8698839161083847
Energy: 0.7948214131362031
Energy: 0.7943013102410809
Energy: 0.8989912029699684
Energy: 0.7943013102410809
Energy: 0.7951362632256401
Energy: 0.7940195633549416
Energy: 0.9008836501947317
Energy: 0.794019563356881
Energy: 0.967535334812309
Energy: 0.8698454365917546
Energy: 0.9846043321081936
Energy: 0.869845436593694
Energy: 0.7937128607651027
Energy: 0.7933785329674756
Energy: 1.0879325683093022
Energy: 0.7933785329674756
Energy: 0.967668983847421
Energy: 0.8698839161083847
Energy: 0.9720452158854944
Energy: 0.8698839161083847
Energy: 0.7948214131342639
Energy: 0.7943013102391415
Energy: 0.9849448414882892
Energy: 0.7943013102410809

minimum gb energy = 0.7933785329674756 eV
minimum distance =  2.33551474808566 Angstroms
sigma value = 9


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

Energy: 0.8854858761049489
Energy: 1.0659716951612552
Energy: 1.2471228563772088
Energy: 1.0659716951612552
Energy: 1.0093240679793078
Energy: 0.9215744921240954
Energy: 0.8798829869212614
Energy: 0.9215744921262488
Energy: 0.8737262305488767
Energy: 0.8817609874800543
Energy: 0.8805882615506523
Energy: 0.8817609874786185
Energy: 0.9847606133654985
Energy: 1.0671113059578539
Energy: 0.8794936619911009
Energy: 1.067111305958572
Energy: 0.9985698747524441
Energy: 0.9262776447191414
Energy: 0.8808452004541517
Energy: 0.9262776447198593
Energy: 0.8807774554032743
Energy: 0.8809805898938836
Energy: 0.9992397946737273
Energy: 0.8809805898931659
Energy: 1.1567099324347672
Energy: 0.9257862500055789
Energy: 0.8780524879708769
Energy: 0.9257862500041433
Energy: 0.8737312978048521
Energy: 0.9473297998449267
Energy: 0.9941553485584083
Energy: 0.9473297998456446
Energy: 0.875291589505216
Energy: 1.070507636075725
Energy: 0.8802999757911294
Energy: 1.070507636075725
Energy: 0.8749303361010524
Energy: 0.9226366115988426
Energy: 0.8771489997065743
Energy: 0.9226366115981248
Energy: 0.8742081353643381
Energy: 1.0671352622294321
Energy: 1.1542651696109143
Energy: 1.0671352622294321
Energy: 1.00177557084781
Energy: 1.014378172548933
Energy: 0.8771487256864523
Energy: 1.014378172548933
Energy: 0.8748007994082133
Energy: 0.9428630598187292
Energy: 1.0673423865881284
Energy: 0.9428630598180114
Energy: 0.9894162759300895
Energy: 1.0647575550934532
Energy: 0.885009443691609
Energy: 1.064757555094889
Energy: 0.8753957482197908
Energy: 0.9925857047637
Energy: 0.9856036484308698
Energy: 0.9925857047644178
Energy: 0.8766273357514089
Energy: 1.0694344127198718
Energy: 0.9927866354460787
Energy: 1.069434412719154
Energy: 0.9336815083362088
Energy: 0.9918733742224504
Energy: 0.875230511574437
Energy: 0.9918733742224504
Energy: 0.87565563374813
Energy: 0.9257047089615696
Energy: 0.9953235886348679
Energy: 0.9257047089615696
Energy: 1.0062622619007946
Energy: 0.9867072554192349
Energy: 0.8807143525466509
Energy: 0.9867072554199526
Energy: 0.8779376262171273
Energy: 0.9263845636305145
Energy: 0.9397556800876883
Energy: 0.9263845636305145
Energy: 0.9896408323727338
Energy: 1.0652232622398976
Energy: 0.9875817964052246
Energy: 1.0652232622398976
Energy: 0.9398840200067923
Energy: 0.8834546847018397
Energy: 0.8747795211570227
Energy: 0.8834546847054288
Energy: 0.880362609214932
Energy: 0.9883426360612362
Energy: 0.8751311913439717
Energy: 0.988342636061954
Energy: 1.1687606372759687
Energy: 0.9480977970880654
Energy: 0.8730652254990143
Energy: 0.9480977970873476
Energy: 0.8783774153375192
Energy: 1.0173118416104467
Energy: 1.0896330776354768
Energy: 1.0173118416111644
Energy: 0.9405403289249621
Energy: 0.8811419300899734
Energy: 0.8735784791840379
Energy: 0.8811419300899734
Energy: 0.9900198388698657
Energy: 0.9918170607317649
Energy: 0.9843470686664519
Energy: 0.9918170607310471
Energy: 0.8844525514935595
Energy: 1.068591813931554
Energy: 0.9850154985077189
Energy: 1.0685918139322719
Energy: 0.9365291885928779
Energy: 0.8810340527356973
Energy: 0.8732422860084058
Energy: 0.881034052737133
Energy: 0.879735864249538
Energy: 1.0177077815016262
Energy: 1.0818446513257607
Energy: 1.0177077814994728
Energy: 1.1374202803425117
Energy: 0.9486397245759952
Energy: 0.8726179563856931
Energy: 0.9486397245803021
Energy: 0.8797854742630163
Energy: 0.9250920568796177
Energy: 0.8741950157999976
Energy: 0.9250920568796177
Energy: 0.8788486429853616
Energy: 0.8808069477881981
Energy: 0.8742646248877269
Energy: 0.8808069477881981
Energy: 0.9934089742822368
Energy: 1.0671103037733658
Energy: 0.9851823817299351
Energy: 1.067110303772648
Energy: 0.879882305235957
Energy: 1.008573086436974
Energy: 1.1555398958979899
Energy: 1.0085730864376918

minimum gb energy = 0.8726179563856931 eV
minimum distance =  2.30051007312319 Angstroms
sigma value = 73


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

Energy: 0.8862915251563264
Energy: 0.8854085012182092
Energy: 1.222308419888864
Energy: 0.8854085012182092
Energy: 0.8892355464261815
Energy: 0.9552628684847977
Energy: 0.8808260545637195
Energy: 0.9552628684847977
Energy: 0.8781061126778227
Energy: 0.877902550962077
Energy: 0.8797874369607395
Energy: 0.877902550962077
Energy: 0.8804448172327165
Energy: 0.9549046141192481
Energy: 0.8809876735536805
Energy: 0.9549046141192481
Energy: 0.8798896735509106
Energy: 0.9503047983831973
Energy: 0.883641140849888
Energy: 0.9503047983809195
Energy: 0.8777301065850143
Energy: 0.8775852444949023
Energy: 1.1389297581644056
Energy: 0.8775852444949023
Energy: 1.130144077503899
Energy: 1.071781667171435
Energy: 0.8789126314202357
Energy: 1.071781667171435
Energy: 0.8802069200498387
Energy: 0.8850906663099244
Energy: 1.1129253923886635
Energy: 0.8850906663087855
Energy: 1.1191242473066092
Energy: 0.8834409821649906
Energy: 0.8832401050219608
Energy: 0.8834409821649906
Energy: 0.8781962180885079
Energy: 0.9481925191003244
Energy: 0.8783751800393039
Energy: 0.9481925191003244
Energy: 0.8827295740981432
Energy: 0.8828305275938019
Energy: 1.120571662633134
Energy: 0.8828305275938019
Energy: 1.000078424537474
Energy: 0.9532067238033491
Energy: 0.8810950747322926
Energy: 0.9532067238033491
Energy: 0.8786436344975305
Energy: 0.952289383235175
Energy: 0.9965138887581964
Energy: 0.952289383235175
Energy: 1.1693867637743147
Energy: 0.9531190027948354
Energy: 0.8776270847942699
Energy: 0.9531190027948354
Energy: 0.8804529572333647
Energy: 0.8976726769944959
Energy: 1.0007346705321734
Energy: 0.8976726769944959
Energy: 1.1171118865445258
Energy: 0.8843596711429514
Energy: 0.8801658395827131
Energy: 0.8843596711418127
Energy: 0.8793379011468382
Energy: 0.879358522170204
Energy: 0.8783349668236294
Energy: 0.8793585221690653
Energy: 0.8816173537550374
Energy: 0.8820775478180453
Energy: 0.8777685238906223
Energy: 0.8820775478180453
Energy: 0.8886685607698135
Energy: 0.8853846229459228
Energy: 0.8792001097301613
Energy: 0.8853846229447839
Energy: 0.8809469049635449
Energy: 0.8974717229536742
Energy: 1.132018242708315
Energy: 0.8974717229536742
Energy: 1.2102272092904167
Energy: 0.8782010470473263
Energy: 0.8775517551514681
Energy: 0.8782010470473263
Energy: 0.8809437312899373
Energy: 0.9496672491700012
Energy: 0.997888865107087
Energy: 0.9496672491700012

minimum gb energy = 0.8775517551514681 eV
minimum distance =  2.29161544529394 Angstroms
sigma value = 7


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

Energy: 0.9650878570150085
Energy: 0.9167479087723186
Energy: 1.2622802140901672
Energy: 0.9167479087699026
Energy: 1.120053907832723
Energy: 0.9447779984476022
Energy: 0.8887253914649225
Energy: 0.9447779984451864
Energy: 0.8922974907753086
Energy: 0.9172499853270134
Energy: 0.9093145923078125
Energy: 0.9172499853326506
Energy: 0.92138300255358
Energy: 0.9601627594781655
Energy: 0.89801034967302
Energy: 0.9601627594829972
Energy: 0.8990173798429127
Energy: 0.9500391257095401
Energy: 0.9481779215047412
Energy: 0.9500391257055135
Energy: 0.8968843346076335
Energy: 0.9158191895823038
Energy: 1.0556565766325645
Energy: 0.9158191895823038
Energy: 1.009320255775569
Energy: 0.9767440517843818
Energy: 0.913276683358358
Energy: 0.9767440517827713
Energy: 0.8966616029660104
Energy: 0.9154485073027668
Energy: 1.1048701244006336
Energy: 0.9154485073075986
Energy: 1.0155073939868762
Energy: 1.0103250488275515
Energy: 0.9003681951359762
Energy: 1.0103250488243305
Energy: 0.8893639913270939
Energy: 0.9689059747179004
Energy: 1.0395303446445898
Energy: 0.9689059747227321
Energy: 0.9147435130601582
Energy: 0.9136331552245404
Energy: 0.9088167852126057
Energy: 0.9136331552253458
Energy: 0.9147930402911739
Energy: 1.003632829041928
Energy: 0.9152288879773692
Energy: 1.0036328290443073
Energy: 0.914335662765906
Energy: 0.9604615569640855
Energy: 0.9152688084021952
Energy: 0.960461556960059
Energy: 0.9290142474404675
Energy: 0.9183511885226008
Energy: 0.9111931463427589
Energy: 0.918351188517769
Energy: 0.8874888462537073
Energy: 1.1127340893296118
Energy: 1.0319907479375543
Energy: 1.1127340893296118
Energy: 1.1082140952851112
Energy: 0.9135549933977504
Energy: 0.9030497819279312
Energy: 0.9135549933896976
Energy: 0.8944975384395858
Energy: 0.9595569676694958
Energy: 0.9724134061715968
Energy: 0.9595569676694958
Energy: 0.908487149089568
Energy: 0.9377412141217498
Energy: 0.9154407137225354
Energy: 0.9377412141185286
Energy: 0.8947055926268889
Energy: 0.9139355059773231
Energy: 0.9139997820761803
Energy: 0.9139355059781284
Energy: 0.8957906664854298
Energy: 0.9616866253489768
Energy: 0.958076884673556
Energy: 0.9616866253457556
Energy: 0.9226339199949312
Energy: 0.9149389604599603
Energy: 0.9004282005002385
Energy: 0.9149389604575444
Energy: 0.8897325907829395
Energy: 0.9168353963621323
Energy: 1.0029308571518278
Energy: 0.9168353963589111
Energy: 1.0676965979727424
Energy: 0.9645183937010944
Energy: 0.9087399559957801
Energy: 0.964518393697068
Energy: 0.9625521231540143
Energy: 0.9632384611910234
Energy: 1.0967042425808524
Energy: 0.9632384611886076
Energy: 0.958765872354571
Energy: 0.9507898180377663
Energy: 0.9132067167438673
Energy: 0.9507898180345452
Energy: 0.9142657665719018
Energy: 0.915215613668291
Energy: 0.9083329190411858
Energy: 0.915215613671512
Energy: 0.8924543730394705
Energy: 0.9144516803184665
Energy: 0.9997778455111994
Energy: 0.9144516803184665
Energy: 0.9629022404765627
Energy: 0.9483095084347556
Energy: 0.8980164037403258
Energy: 0.9483095084363662
Energy: 0.89910823668559
Energy: 0.9171220487629062
Energy: 1.017375440451783
Energy: 0.917122048759685
Energy: 1.1476581716620695
Energy: 0.9067188486446279
Energy: 0.8887327791936847
Energy: 0.9067188486406015
Energy: 0.8991192977299488
Energy: 0.9177412142033664
Energy: 0.9898960030560638
Energy: 0.9177412141969605

minimum gb energy = 0.8874888462537073 eV
minimum distance =  2.27562474345379 Angstroms
sigma value = 29


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

Energy: 0.8802377463209251
Energy: 0.9028027236381727
Energy: 1.2874894211181265
Energy: 0.9028027236376119
Energy: 0.8677968139553736
Energy: 0.8662636705817038
Energy: 0.8828090952539436
Energy: 0.8662636705819845
Energy: 0.9079765798104922
Energy: 0.9345410289864942
Energy: 1.007980148832154
Energy: 0.9345410289859643
Energy: 0.8819294248949413
Energy: 0.8667389748630006
Energy: 0.8702780480314892
Energy: 0.8667389748627202
Energy: 0.8810545722104206
Energy: 0.92434825737798
Energy: 0.901671312082235
Energy: 0.9243482573782605
Energy: 0.9024741539219862
Energy: 0.9293785221483103
Energy: 0.9024673417322344
Energy: 0.9293785221480609
Energy: 0.9017606843713194
Energy: 0.924342143018352
Energy: 0.8810964277033717
Energy: 0.9243421430189132
Energy: 0.8702648540488088
Energy: 0.8665705783521837
Energy: 0.8820025434066849
Energy: 0.8665705783519032
Energy: 1.0079527691593448
Energy: 0.9345199724646694
Energy: 0.9079865790428353
Energy: 0.9345199724649501

minimum gb energy = 0.8662636705817038 eV
minimum distance =  2.32915463810527 Angstroms
sigma value = 5


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

Energy: 0.8366965478467132
Energy: 0.8699834868718679
Energy: 1.0777211208052928
Energy: 0.8699834868733891
Energy: 0.9773247299967057
Energy: 0.8816644312372424
Energy: 0.8216107864242802
Energy: 0.8816644312380031
Energy: 0.8275772909204723
Energy: 0.8712031767355053
Energy: 0.9984542207532607
Energy: 0.871203176736266
Energy: 0.8291774494367928
Energy: 0.8989396627438223
Energy: 0.8236431904460668
Energy: 0.8989396627445829
Energy: 0.8300025535527482
Energy: 0.8991876995850742
Energy: 0.9877819788114375
Energy: 0.8991876995865956
Energy: 0.88040406408532
Energy: 0.8715803338083165
Energy: 0.8210385731724104
Energy: 0.8715803338083165
Energy: 0.8274979961922875
Energy: 0.899486996950069
Energy: 0.8346015748186302
Energy: 0.899486996950069
Energy: 0.8241983866118626
Energy: 0.8729802875430309
Energy: 0.8301718436065175
Energy: 0.8729802875430309
Energy: 0.8300993631143695
Energy: 0.899710447175168
Energy: 0.836126428910956
Energy: 0.8997104471736467
Energy: 0.8270256889779503
Energy: 0.899809547739841
Energy: 0.8300721063493665
Energy: 0.8998095477406017
Energy: 0.8295265914432539
Energy: 0.873430279963853
Energy: 0.8292422272256608
Energy: 0.8734302799653746
Energy: 0.8290782165116175
Energy: 0.9191251216187175
Energy: 0.9174994489631735
Energy: 0.9191251216171961
Energy: 0.8800943188230077
Energy: 0.8708564043015847
Energy: 0.8726481583727778
Energy: 0.8708564043000633
Energy: 0.8306531091157359
Energy: 0.8722276325255005
Energy: 0.8508714611483877
Energy: 0.8722276325239792
Energy: 0.8493877526619976
Energy: 0.9001629484535387
Energy: 0.8302359151681626
Energy: 0.9001629484542993
Energy: 0.8253885995409735
Energy: 0.8700719069151701
Energy: 0.8624002710531953
Energy: 0.8700719069144094
Energy: 0.963745474521516
Energy: 0.9211676883251371
Energy: 0.821421825166549
Energy: 0.9211676883258979
Energy: 0.8309575718940224
Energy: 0.8716300010788686
Energy: 0.92818010073395
Energy: 0.8716300010819114
Energy: 0.8228424976459978
Energy: 0.9009172667815676
Energy: 0.8218786826348472
Energy: 0.9009172667823282
Energy: 0.8277611533654123
Energy: 0.897995340992432
Energy: 0.8563728982104815
Energy: 0.8979953409931928
Energy: 0.828838847056441
Energy: 0.8986742234189581
Energy: 0.8248767946554374
Energy: 0.8986742234197187
Energy: 0.8307513843167842
Energy: 0.8999928152148167
Energy: 0.833878495058125
Energy: 0.8999928152140559
Energy: 0.8213025909502033
Energy: 0.8725791031849023
Energy: 0.8282299558414237
Energy: 0.8725791031841414
Energy: 0.8863445761438659
Energy: 0.8602198325347257
Energy: 0.8279088898835255
Energy: 0.860219832533965
Energy: 0.8791324862030978
Energy: 0.8535303064466017
Energy: 0.8227174841498941
Energy: 0.8535303064481231
Energy: 0.8564147988807639
Energy: 0.8982033016755779
Energy: 0.8303087652333462
Energy: 0.8982033016748173
Energy: 0.8213800912960741
Energy: 0.8958653818852836
Energy: 0.8471765002534632
Energy: 0.8958653818852836
Energy: 0.8982637806419411
Energy: 0.8905861611643394
Energy: 0.8253836182688185
Energy: 0.8905861611658608
Energy: 0.8296047408708747
Energy: 0.8831892066829383
Energy: 0.966968294160582
Energy: 0.8831892066829383
Energy: 0.9433113097824752
Energy: 0.8706526662231792
Energy: 0.8310349265317813
Energy: 0.8706526662231792
Energy: 0.8209949659283275
Energy: 0.8464146745568881
Energy: 0.9423642905414965
Energy: 0.8464146745576486
Energy: 0.9651659135817083
Energy: 0.8889459886436999
Energy: 0.8280253843208436
Energy: 0.8889459886436999
Energy: 0.8237613945747914
Energy: 0.8964244178709586
Energy: 0.8296784836342199
Energy: 0.896424417839044

minimum gb energy = 0.8209949659283275 eV
minimum distance =  2.28732907662873 Angstroms
sigma value = 1


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

Energy: 0.8264729029977405
Energy: 0.8262782089749005
Energy: 1.2476086333791727
Energy: 0.8262782089717452
Energy: 0.809044837540997
Energy: 0.8393523159513374
Energy: 0.7738369893103467
Energy: 0.8393523159492339
Energy: 0.777529881908005
Energy: 0.8265289363513023
Energy: 0.9496474330615986
Energy: 0.8265289363513023
Energy: 0.8043146923223021
Energy: 0.8716253010133225
Energy: 0.773967786189984
Energy: 0.8716253010143743
Energy: 0.7769492437717972
Energy: 0.8983764133242356
Energy: 0.9861396219054426
Energy: 0.8983764133252874
Energy: 0.7767449805809118
Energy: 0.8297382804838735
Energy: 0.7740166051429881
Energy: 0.82973828048177
Energy: 0.7767762455240329
Energy: 0.8980414928722047
Energy: 0.8431184436381209
Energy: 0.8980414928722047
Energy: 0.7767170431300652
Energy: 0.8293011939152312
Energy: 0.8358369956353163
Energy: 0.829301193916283
Energy: 0.82629226601755
Energy: 0.8099260544737349
Energy: 0.8310828277570618
Energy: 0.8099260544716314
Energy: 0.8262986525684546
Energy: 0.8098076444722803
Energy: 0.8527883944936352
Energy: 0.8098076444701767
Energy: 0.7767007605135332
Energy: 0.8293282917363819
Energy: 0.802209180322757
Energy: 0.8293282917353302
Energy: 0.7769471193728112
Energy: 0.8978226969928905
Energy: 0.8432810348512023
Energy: 0.8978226969970977
Energy: 0.7764844365566727
Energy: 0.8297506555494318
Energy: 0.7739795134213836
Energy: 0.8297506555504836
Energy: 0.7770776279656715
Energy: 0.8983548691621873
Energy: 0.996544445129817
Energy: 0.8983548691611355
Energy: 0.8042917850676066
Energy: 0.8717009314645547
Energy: 0.7739672306196924
Energy: 0.8717009314645547
Energy: 0.7775205161757237
Energy: 0.8265568458412412
Energy: 0.8636074069275785
Energy: 0.8265568458422932
Energy: 0.8090334110471706
Energy: 0.839264521813051
Energy: 0.773709678207666
Energy: 0.8392645218141028
Energy: 0.8264729029977405
Energy: 0.8262782089749005
Energy: 0.8596284619115965
Energy: 0.8262782089727969
Energy: 0.809044837540997
Energy: 0.8393523159513374
Energy: 0.7738369893103467
Energy: 0.8393523159492339
Energy: 0.777529881908005
Energy: 0.8265289363502504
Energy: 1.1448231343770923
Energy: 0.8265289363513023
Energy: 0.8043146923212503
Energy: 0.8716253010133225
Energy: 0.773967786189984
Energy: 0.8716253010143743
Energy: 0.7769492437717972
Energy: 0.8983764133242356
Energy: 0.9710032240012239
Energy: 0.8983764133252874
Energy: 0.7767449805809118
Energy: 0.8297382804828217
Energy: 0.7740166051429881
Energy: 0.82973828048177
Energy: 0.7767762455240329
Energy: 0.8980414928722047
Energy: 0.802112615521616
Energy: 0.8980414928722047

minimum gb energy = 0.773709678207666 eV
minimum distance =  2.29970211614492 Angstroms
sigma value = 17


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

Energy: 0.8156506871650783
Energy: 0.8159891424835207
Energy: 1.0318391182739173
Energy: 0.8159891424835207
Energy: 0.9200331271519117
Energy: 0.7999795044743857
Energy: 0.7772942657959988
Energy: 0.7999795044743857
Energy: 0.7815409652270906
Energy: 0.8107122290640346
Energy: 1.01348821986299
Energy: 0.8107122290614345
Energy: 0.8278096448136234
Energy: 0.7769839871497934
Energy: 0.7755604986259232
Energy: 0.7769839871478431
Energy: 0.7819736624916469
Energy: 0.8642572279196605
Energy: 0.8058197615056486
Energy: 0.8642572279203107
Energy: 0.7824244700238544
Energy: 0.7815795345633102
Energy: 0.7821473170068679
Energy: 0.7815795345633102
Energy: 0.7842901509817007
Energy: 0.8559524322468376
Energy: 0.8241652030722928
Energy: 0.8559524322448875
Energy: 0.777261722725718
Energy: 0.8418164638837198
Energy: 0.7764023743408293
Energy: 0.8418164638817696
Energy: 0.8230372528211068
Energy: 0.8317521493547215
Energy: 0.8146601685979943
Energy: 0.8317521493534212
Energy: 0.8222326065731568
Energy: 0.8312037422071237
Energy: 0.7842170584848658
Energy: 0.8312037422103741
Energy: 0.7813551635402985
Energy: 0.8217374274214326
Energy: 0.7757001209405328
Energy: 0.8217374274181822
Energy: 0.7845601808733279
Energy: 0.8421336628444854
Energy: 0.7838557484595445
Energy: 0.8421336628451355
Energy: 0.7813742830681344
Energy: 0.8259987519971661
Energy: 0.7760182513126873
Energy: 0.8259987519971661
Energy: 0.7863178419896485
Energy: 0.8628481051532071
Energy: 0.8331690724191032
Energy: 0.8628481051558073
Energy: 0.7759616817777079
Energy: 0.7854720347268629
Energy: 0.8219753149928511
Energy: 0.7854720347281631
Energy: 0.7818886821373014
Energy: 0.8110766673026597
Energy: 0.9231933223432243
Energy: 0.8110766673033099
Energy: 0.7940422965937423
Energy: 0.786669872787071
Energy: 0.7758573857088917
Energy: 0.786669872787071
Energy: 0.7763032469666187
Energy: 0.8158014317642488
Energy: 0.7977068793116603
Energy: 0.8158014317642488
Energy: 0.9062711004955718
Energy: 0.8451823565377115
Energy: 0.7839169541567403
Energy: 0.8451823565364114
Energy: 0.78265151948043
Energy: 0.8110135494690481
Energy: 0.8395266038648164
Energy: 0.8110135494677481
Energy: 0.7803350954582841
Energy: 0.7959716478655524
Energy: 0.7758973544758297
Energy: 0.7959716478655524
Energy: 0.7765591074813675
Energy: 0.817430369774161
Energy: 0.9175637779852641
Energy: 0.8174303697748111
Energy: 0.8120043866693415
Energy: 0.7817428898308344
Energy: 0.7834163878252116
Energy: 0.7817428898314845
Energy: 0.7818033180246583
Energy: 0.8574302622947417
Energy: 0.9208336131581495
Energy: 0.8574302622966921
Energy: 0.8190599581777867
Energy: 0.8165445553188344
Energy: 0.7757530542536952
Energy: 0.8165445553181845
Energy: 0.7756509278161126
Energy: 0.8649137007086947
Energy: 0.7942699051959081
Energy: 0.8649137007086947
Energy: 0.905539745764295
Energy: 0.8281720413688739
Energy: 0.7828700084647575
Energy: 0.8281720413688739
Energy: 0.8256725168291011
Energy: 0.9316177277858898
Energy: 0.775449299606231
Energy: 0.93161772778719
Energy: 0.8299091067829354
Energy: 0.862569179268008
Energy: 0.7827970967510669
Energy: 0.8625691792719083
Energy: 0.7756323768185431
Energy: 0.8256069156926987
Energy: 0.8124645341198693
Energy: 0.8256069156913985
Energy: 0.7898452781379973
Energy: 0.8627604038433104
Energy: 0.7894531607803357
Energy: 0.8627604038439606
Energy: 0.7756774470496576
Energy: 0.822540402284344
Energy: 0.7788491623037538
Energy: 0.822540402283694
Energy: 0.7826849585072824
Energy: 0.8315045470810964
Energy: 0.9271540359846777
Energy: 0.8315045470843468
Energy: 0.8130473916045288
Energy: 0.9407082821076769
Energy: 0.7852030698968822
Energy: 0.9407082821070268
Energy: 0.7840383561262971
Energy: 0.8178793411178902
Energy: 0.8105508666179991
Energy: 0.8178793411178902
Energy: 0.8133797975171946
Energy: 0.8570870307788936
Energy: 0.7826765319861648
Energy: 0.8570870307788936
Energy: 0.7831314198487942
Energy: 0.7828697544894002
Energy: 0.7838016954665538
Energy: 0.7828697544868
Energy: 0.7817338238689294
Energy: 0.8652003986496173
Energy: 0.7768503017671557
Energy: 0.8652003986496173

minimum gb energy = 0.775449299606231 eV
minimum distance =  2.29390718275347 Angstroms
sigma value = 89


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

Energy: 0.7170940972733679
Energy: 0.7173127471885143
Energy: 1.0419499392507305
Energy: 0.7173127471885143
Energy: 0.7188154289330783
Energy: 0.7305529927724286
Energy: 0.7267320044478119
Energy: 0.7305529927724286
Energy: 0.7250316375849014
Energy: 0.8293628091354688
Energy: 1.0999987104538886
Energy: 0.8293628091354688
Energy: 0.7313830909173626
Energy: 0.7305351200053644
Energy: 0.7270181432122033
Energy: 0.7305351200053644
Energy: 0.7176514095883989
Energy: 0.7936707565855755
Energy: 0.7342863785260104
Energy: 0.7936707565855755
Energy: 0.7189675490575641
Energy: 0.7182291570691058
Energy: 0.7212328173852761
Energy: 0.7182291570708068
Energy: 0.7252928174552474
Energy: 0.8306375205138561
Energy: 0.7282124839886374
Energy: 0.8306375205138561
Energy: 0.7476064039889585
Energy: 0.9188290564556516
Energy: 0.7268672826365228
Energy: 0.9188290564539506
Energy: 0.7177271771012278
Energy: 0.7929646238616721
Energy: 0.7259902025731864
Energy: 0.7929646238616721
Energy: 0.7317863036952916
Energy: 0.7179665758013357
Energy: 0.719960268726629
Energy: 0.7179665758013357
Energy: 0.7171931574000873
Energy: 0.7314468817260144
Energy: 0.7281084823968308
Energy: 0.7314468817243133
Energy: 0.7173031522961337
Energy: 0.8280556364802222
Energy: 0.7268412208375673
Energy: 0.8280556364802222
Energy: 0.7178876899922154
Energy: 0.7195888128812898
Energy: 0.7457722471509679
Energy: 0.7195888128812898
Energy: 0.719959771947005
Energy: 0.7906311022425561
Energy: 0.7201486127890179
Energy: 0.7906311022442569
Energy: 0.7265734958285238
Energy: 0.7195605360266784
Energy: 0.7178297714894001
Energy: 0.7195605360249774

minimum gb energy = 0.7170940972733679 eV
minimum distance =  2.31396046366304 Angstroms
sigma value = 13


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

Energy: 0.7039788995827327
Energy: 0.6812081566403375
Energy: 1.1524240247475306
Energy: 0.6812081566403375
Energy: 0.8324716354141617
Energy: 0.6926286871313494
Energy: 0.6843662939241627
Energy: 0.6926286871313494
Energy: 0.6820291514915073
Energy: 0.6816245642949105
Energy: 0.8344119773013874
Energy: 0.6816245642927715
Energy: 0.69253193420277
Energy: 0.6929174299890895
Energy: 0.6807335562178928
Energy: 0.6929174299883766
Energy: 0.6827480120102272
Energy: 0.7385290487243829
Energy: 0.6940687574213125
Energy: 0.7385290487265217
Energy: 0.6935958869376638
Energy: 0.6937885619390065
Energy: 0.6943019138367802
Energy: 0.6937885619411451
Energy: 0.6825628225687129
Energy: 0.7346009474888296
Energy: 0.827496157222685
Energy: 0.7346009474895425
Energy: 0.6864155358777824
Energy: 0.6924009611139312
Energy: 0.6943104676856882
Energy: 0.6924009611538557
Energy: 0.6827092682556892
Energy: 0.7345859016420275
Energy: 0.889669573778688
Energy: 0.7345859016398887
Energy: 0.8571254246917713
Energy: 0.7468502462455829
Energy: 0.6811647525135853
Energy: 0.7468502462455829
Energy: 0.6827898004543528
Energy: 0.7478054435975252
Energy: 0.6940953445104666
Energy: 0.7478054435911087
Energy: 0.7010675411415735
Energy: 0.7468579014464033
Energy: 0.6792629012892546
Energy: 0.7468579014414126
Energy: 0.7121228509429466
Energy: 0.6923269197187967
Energy: 0.6912622961618544
Energy: 0.6923269197216485
Energy: 0.9546204684190126
Energy: 0.7471208100765907
Energy: 0.6795227347909804
Energy: 0.7471208100773037
Energy: 0.6828380513040148
Energy: 0.6815773461052679
Energy: 0.6877809191017075
Energy: 0.6815773461066937
Energy: 0.6982545556787525
Energy: 0.7475650387664938
Energy: 0.6832738749707494
Energy: 0.7475650387729101
Energy: 0.6894821806549399
Energy: 0.7347170909552708
Energy: 0.6831865143315142
Energy: 0.7347170909581225
Energy: 0.6982645241056055
Energy: 0.7326569219175151
Energy: 0.7030348259545447
Energy: 0.7326569219196539
Energy: 0.7015512253532403
Energy: 0.6940384942794839
Energy: 0.7028818550828791
Energy: 0.6940384942830486
Energy: 0.7014077600524381
Energy: 0.6938885810678163
Energy: 0.702873412881761
Energy: 0.6938885810642517
Energy: 0.6982802315677086
Energy: 0.7326997482444472
Energy: 0.7027368961388252
Energy: 0.732699748245873
Energy: 0.6892495855822929
Energy: 0.7348410674145408
Energy: 0.683282111212923
Energy: 0.7348410674188184
Energy: 0.6981814252493892
Energy: 0.7473597668643178
Energy: 0.6833420146248402
Energy: 0.7473597668693084
Energy: 0.6827968975260162
Energy: 0.6813743552171099
Energy: 0.6944488138271514
Energy: 0.6813743552206745
Energy: 0.9547217998761166
Energy: 0.7471457227347206
Energy: 0.6791784845357937
Energy: 0.747145722741137
Energy: 0.7121016340072472
Energy: 0.6926142550122782
Energy: 0.6941440539126322
Energy: 0.6926142550087134
Energy: 0.7010711544821113
Energy: 0.7466868777909905
Energy: 0.6793671672824737
Energy: 0.7466868777902775
Energy: 0.6828485754306569
Energy: 0.7477413969192742
Energy: 0.6941751539380356
Energy: 0.7477413969185612
Energy: 0.857441600028948
Energy: 0.7467367873725298
Energy: 0.6808772723107253
Energy: 0.7467367873718169
Energy: 0.6824939812051322
Energy: 0.7347962536272341
Energy: 0.9528774805629227
Energy: 0.7347962536258081
Energy: 0.6815205284949429
Energy: 0.6923394021747914
Energy: 0.6943169313155978
Energy: 0.6923394021783561
Energy: 0.6828647503807707
Energy: 0.7345536355303186
Energy: 0.8275580287481168
Energy: 0.734553635526754
Energy: 0.6930886691827368
Energy: 0.6935348380612283
Energy: 0.6942878952775584
Energy: 0.6935348380697189
Energy: 0.682894384974968
Energy: 0.7384210008343361
Energy: 0.6945422060749256
Energy: 0.7384210008336233
Energy: 0.6924323455340619
Energy: 0.6928046028547118
Energy: 0.6807672156072371
Energy: 0.6928046028554248

minimum gb energy = 0.6791784845357937 eV
minimum distance =  2.33239932489571 Angstroms
sigma value = 37


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

Energy: 0.6348883652909251
Energy: 0.6349125632800913
Energy: 1.1431606320769019
Energy: 0.6349125632800913
Energy: 0.6344040321436302
Energy: 0.7134406504004727
Energy: 0.624417985889107
Energy: 0.7134406504016993
Energy: 0.6188449433068911
Energy: 0.6529402685601151
Energy: 0.6288423122762805
Energy: 0.6529402685601151
Energy: 0.619947614594384
Energy: 0.7133104382764945
Energy: 0.6246829418596196
Energy: 0.7133104382764945
Energy: 0.6235946481714607
Energy: 0.6349006726019185
Energy: 0.6400931674008342
Energy: 0.6349006726019185
Energy: 0.627034327614437
Energy: 0.7137713642570449
Energy: 0.6209240792948627
Energy: 0.7137713642582715
Energy: 0.619768908538831
Energy: 0.7383875622735165
Energy: 0.6346530477714074
Energy: 0.7383875622722899
Energy: 0.6196438372781286
Energy: 0.6356704587225371
Energy: 0.6373502002140864
Energy: 0.6356704587225371
Energy: 0.6235821553471383
Energy: 0.6366327061136416
Energy: 0.7602608981627549
Energy: 0.6366327061136416
Energy: 0.9463992483435394
Energy: 0.6363082533921457
Energy: 0.620948593082472
Energy: 0.6363082533921457
Energy: 0.6248921310097448
Energy: 0.6581134950637086
Energy: 0.6216271836079066
Energy: 0.6581134950637086
Energy: 0.9143268069699744
Energy: 0.6351184209932379
Energy: 0.624574203020596
Energy: 0.6351184209932379
Energy: 0.6239131894563553
Energy: 0.7130171111507639
Energy: 0.6439298217396521
Energy: 0.7130171111495651
Energy: 0.8697117049521569
Energy: 0.737285987654076
Energy: 0.6202239212620827
Energy: 0.737285987654076
Energy: 0.6397044394209848
Energy: 0.6565197736892441
Energy: 0.6213514879763902
Energy: 0.6565197736892441
Energy: 0.6409444001826473
Energy: 0.6352866468717632
Energy: 0.6247526047166924
Energy: 0.6352866468717632
Energy: 0.6235835224489412
Energy: 0.7139556114337651
Energy: 0.6272536725694338
Energy: 0.7139556114337651
Energy: 0.6202467858839447
Energy: 0.6571225410116074
Energy: 0.6202853322485987
Energy: 0.6571225410116074
Energy: 0.6259135190534867
Energy: 0.6364145237913169
Energy: 0.6192441946766417
Energy: 0.6364145237925435
Energy: 0.6195076441851023
Energy: 0.6355473255867424
Energy: 0.6191607194380557
Energy: 0.6355473255855159

minimum gb energy = 0.6188449433068911 eV
minimum distance =  2.3324491971924 Angstroms
sigma value = 25


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

Energy: 0.5821281849414185
Energy: 0.5609948942303405
Energy: 1.070182160942304
Energy: 0.5609948942312983
Energy: 0.7592575102163728
Energy: 0.5690342412781613
Energy: 0.5639398502829782
Energy: 0.5690342412800768
Energy: 0.5587269441053264
Energy: 0.5589215172188085
Energy: 0.5600055018952163
Energy: 0.5589215172188085
Energy: 0.5679798039589405
Energy: 0.5696130441699642
Energy: 0.5641478251021027
Energy: 0.5696130441690063
Energy: 0.5631400236767142
Energy: 0.5693419679179279
Energy: 0.5744846417866156
Energy: 0.5693419679179279
Energy: 0.5541525272978165
Energy: 0.5696924006276857
Energy: 0.5641362053933565
Energy: 0.5696924006267278
Energy: 0.5639106333012518
Energy: 0.5589821594163956
Energy: 0.5684677544606108
Energy: 0.5589821594163956
Energy: 0.5593135048020436
Energy: 0.5823341514121299
Energy: 0.5599036621781807
Energy: 0.5823341514121299
Energy: 0.5630000379057946
Energy: 0.5693512654110747
Energy: 0.8581623736468743
Energy: 0.5693512654101168
Energy: 0.5541219321519752
Energy: 0.5612948130093565
Energy: 0.5838197370979528
Energy: 0.5612948130103145
Energy: 0.5637986328216485
Energy: 0.5592156992386363
Energy: 0.9431634006166011
Energy: 0.5592156992376786
Energy: 0.8202400887746332
Energy: 0.7615393124383222
Energy: 0.5599434047101313
Energy: 0.7615393124383222
Energy: 0.5631371989477465
Energy: 0.5695815436104799
Energy: 0.854648307107399
Energy: 0.5695815436114376
Energy: 0.8055018791389228
Energy: 0.7375438336123452
Energy: 0.5641033154846826
Energy: 0.7375438336142608
Energy: 0.5637525797337686
Energy: 0.5590362678649736
Energy: 0.5541397016224212
Energy: 0.5590362678649736
Energy: 0.5702491313615804
Energy: 0.6485014666999765
Energy: 0.5599904780097326
Energy: 0.6485014666990188
Energy: 0.5631292677702313
Energy: 0.5822435193764578
Energy: 0.5667714465397332
Energy: 0.5822435193764578
Energy: 0.757489014139657
Energy: 0.5691128848304513
Energy: 0.5641005180715595
Energy: 0.5691128848294935
Energy: 0.5867512093230942
Energy: 0.5594023179151347
Energy: 0.5544826710148624
Energy: 0.5594023179141769
Energy: 0.9407730085442334
Energy: 0.647088863913855
Energy: 0.5664874987204634
Energy: 0.6470888639148128
Energy: 0.5631606973211448
Energy: 0.5819560975213287
Energy: 0.5597410309503202
Energy: 0.5819560975213287
Energy: 0.5627000842150893
Energy: 0.5695081903105359
Energy: 0.5642342225641025
Energy: 0.5695081903105359
Energy: 0.5640690728349926
Energy: 0.5597505479645098
Energy: 0.8023215904746415
Energy: 0.5597505479673833
Energy: 0.5583843107823017
Energy: 0.6466606828828888
Energy: 0.5662651704248548
Energy: 0.6466606828828888
Energy: 0.5618464747150494
Energy: 0.6475525648560265
Energy: 0.786695328173247
Energy: 0.6475525648550687
Energy: 0.5541475084874936
Energy: 0.582292939184116
Energy: 0.5643146264411585
Energy: 0.582292939184116

minimum gb energy = 0.5541219321519752 eV
minimum distance =  2.33622743143586 Angstroms
sigma value = 41


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

Energy: 0.8451000641352269
Energy: 0.5191223168367445
Energy: 0.5318763390509447
Energy: 0.519122316835174
Energy: 0.8414460986503449
Energy: 0.5110806766951025
Energy: 0.5085942843053988
Energy: 0.511080676696673
Energy: 0.5178665723787474
Energy: 0.5069537419983491
Energy: 0.5160207780420856
Energy: 0.5069537419991343
Energy: 0.6792784697567457
Energy: 0.5113926997904769
Energy: 0.5087077597222764
Energy: 0.5113926997904769
Energy: 0.5054474067474951
Energy: 0.5290097305101099
Energy: 0.5209826676487715
Energy: 0.5290097305108953
Energy: 0.5181568391145868
Energy: 0.5116580770130702
Energy: 0.508694705607843
Energy: 0.5116580770146407
Energy: 0.5079832199491539
Energy: 0.5112803056001985
Energy: 0.5181922117918907
Energy: 0.5112803056009837
Energy: 0.5046592823373327
Energy: 0.5184874467019458
Energy: 0.5060436403457327
Energy: 0.5184874467011606
Energy: 0.5107320364908657
Energy: 0.5201377333401861
Energy: 0.7620746677561802
Energy: 0.5201377333378303
Energy: 0.5207246489157985
Energy: 0.5072455061247282
Energy: 0.5185612283090221
Energy: 0.5072455061247282
Energy: 0.5079074264405852
Energy: 0.5114696789036232
Energy: 0.8412201553301243
Energy: 0.5114696789012674
Energy: 0.5046280677203085
Energy: 0.5193514154342823
Energy: 0.8457699739806199
Energy: 0.5193514154350676
Energy: 0.5106671417248989
Energy: 0.5226220693335126
Energy: 0.9124911192346008
Energy: 0.5226220693335126
Energy: 0.6861768409787308
Energy: 0.5299611293747379
Energy: 0.5185618158121176
Energy: 0.5299611293731674
Energy: 0.5080951103732776
Energy: 0.5110812894144013
Energy: 0.8362275212395188
Energy: 0.5110812894144013
Energy: 0.7187280896411544
Energy: 0.5201304447290169
Energy: 0.5060730959627446
Energy: 0.5201304447282317
Energy: 0.510415975924366
Energy: 0.6837225133706982
Energy: 0.7610012015084882
Energy: 0.6837225133699131
Energy: 0.5195859322893178
Energy: 0.5239660763461249
Energy: 0.5085476752016316
Energy: 0.5239660763445545
Energy: 0.5080262907720703
Energy: 0.5187320171349532
Energy: 0.5149028148614707
Energy: 0.5187320171357384
Energy: 0.7032904181413978
Energy: 0.5196017002285755
Energy: 0.5153964687960233
Energy: 0.5196017002309313
Energy: 0.5204561203707501
Energy: 0.6838011339761991
Energy: 0.5084069123353475
Energy: 0.683801133975414
Energy: 0.9743064052938188
Energy: 0.5281644022423558
Energy: 0.5086347118757732
Energy: 0.5281644022478168
Energy: 0.8467776348671495
Energy: 0.5185070091103358
Energy: 0.5149694188889098
Energy: 0.5185070091064096
Energy: 0.8427558074599011
Energy: 0.5184784183967148
Energy: 0.5135856437830616
Energy: 0.518478418400641
Energy: 0.520639136021299
Energy: 0.5712209800944357
Energy: 0.5247542870557167
Energy: 0.5712209800928651
Energy: 0.8350917531567853
Energy: 0.8280199221433098
Energy: 0.5087866159914514
Energy: 0.8280199221440951
Energy: 0.5079983545795087
Energy: 0.518372002744145
Energy: 0.7158926321220989
Energy: 0.5183720027449303
Energy: 0.5152057641297422
Energy: 0.5186636238075464
Energy: 0.5134977730557236
Energy: 0.5186636238051907
Energy: 0.5104781902904345
Energy: 0.5757457611206128
Energy: 0.7052147262911831
Energy: 0.5757457611206128
Energy: 0.5142455362505542
Energy: 0.5419444125827526
Energy: 0.5110983738557024
Energy: 0.5419444125835379
Energy: 0.5079178346534334
Energy: 0.5183465378995618
Energy: 0.6995456687454735
Energy: 0.5183465378987766
Energy: 0.5093865044439759
Energy: 0.681856332245217
Energy: 0.5235330309941899
Energy: 0.6818563322467875

minimum gb energy = 0.5046280677203085 eV
minimum distance =  2.33260148605322 Angstroms
sigma value = 15


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

Energy: 0.7576133575096079
Energy: 0.4758790690975556
Energy: 0.7368907554624649
Energy: 0.4758790690982208
Energy: 0.8804819401556784
Energy: 0.47361379779005963
Energy: 0.4743639943731033
Energy: 0.4736137977887292
Energy: 0.48574114233706267
Energy: 0.4732587674964281
Energy: 0.4754776834289455
Energy: 0.4732587674977585
Energy: 0.7591129653806632
Energy: 0.47444797789134047
Energy: 0.47430510690773414
Energy: 0.4744479778906753
Energy: 0.4724436041605736
Energy: 0.5256912294478552
Energy: 0.48211974104061683
Energy: 0.5256912294458594
Energy: 0.6187170617486523
Energy: 0.47316841391336384
Energy: 0.47433507064562985
Energy: 0.47316841391402903
Energy: 0.4740516873331402
Energy: 0.4799883321765056
Energy: 0.4801371821111526
Energy: 0.4799883321804969
Energy: 0.4792151370720917
Energy: 0.47948634073419116
Energy: 0.47457171930432535
Energy: 0.4794863407335259
Energy: 0.4758550266996906
Energy: 0.48066415815931485
Energy: 0.6904405266961446
Energy: 0.480664158156654
Energy: 0.4799952107353178
Energy: 0.4737845754661812
Energy: 0.47279702812573965
Energy: 0.47378457546285513
Energy: 0.47403105769915765
Energy: 0.4740878313561567
Energy: 0.7598844523699949
Energy: 0.47408783135482624
Energy: 0.48424528376626036
Energy: 0.4735135493809566
Energy: 0.48631356089572836
Energy: 0.4735135493789609
Energy: 0.4756504924007606
Energy: 0.4815867260457518
Energy: 0.9406482889287653
Energy: 0.4815867260444214
Energy: 0.48359523798043236
Energy: 0.4769644843048317
Energy: 0.75810822708218
Energy: 0.476964484302836
Energy: 0.4739525159155313
Energy: 0.4740066467737022
Energy: 0.9979147087852657
Energy: 0.47400664678168464
Energy: 0.6119704514501211
Energy: 0.47342280288459504
Energy: 0.48617588336342754
Energy: 0.4734228028825994
Energy: 0.47550656166551286
Energy: 0.4828011675700983
Energy: 0.938838003869748
Energy: 0.4828011676273062
Energy: 0.6385917524293214
Energy: 0.5277548370233349
Energy: 0.4727511584046823
Energy: 0.5277548370253305
Energy: 0.4738806229536136
Energy: 0.4733285572008519
Energy: 0.7567265332768675
Energy: 0.4733285572008519
Energy: 0.6445265908956873
Energy: 0.4739156564023739
Energy: 0.4743241172986464
Energy: 0.4739156564083607
Energy: 0.4755997189497944
Energy: 0.4864225607597658
Energy: 0.6901772245928637
Energy: 0.48642256076442236
Energy: 0.6410787489943334
Energy: 0.4791978230778835
Energy: 0.4776464897018219
Energy: 0.47919782308320524
Energy: 0.47417611876064497
Energy: 0.47355396854467874
Energy: 0.47862261709656606
Energy: 0.47355396854268306
Energy: 0.7597201801523291
Energy: 0.4748788213381252
Energy: 0.47446687675831023
Energy: 0.47487882133879045
Energy: 0.48764874821125237
Energy: 0.4867111584077902
Energy: 0.4785876586021385
Energy: 0.48671115840379897
Energy: 0.8806786880744499
Energy: 0.48047904731080454
Energy: 0.4775065645313676
Energy: 0.48047904731346536
Energy: 0.7590869051324252
Energy: 0.47436824312201403
Energy: 0.4787860175003338
Energy: 0.4743682431213489
Energy: 0.9956852296758621
Energy: 0.4748206531355982
Energy: 0.47440694243600867
Energy: 0.4748206531362634
Energy: 0.4872972039649524
Energy: 0.5331087384772023
Energy: 0.4864887018673515
Energy: 0.5331087384745415
Energy: 0.7589507147858298
Energy: 0.48266190352838045
Energy: 0.47769085324171423
Energy: 0.482661903530376
Energy: 0.4741766902922921
Energy: 0.5205262552861419
Energy: 0.6493554274509492
Energy: 0.5205262552888027
Energy: 0.7546299448563487
Energy: 0.4730856437776392
Energy: 0.47450469954346736
Energy: 0.4730856437783044
Energy: 0.4755874200806896
Energy: 0.4892123925943017
Energy: 0.6429942618246639
Energy: 0.4892123925949669
Energy: 0.47959427894058265
Energy: 0.48641910682974143
Energy: 0.47771727043039225
Energy: 0.48641910683107187
Energy: 0.4685767924849357
Energy: 0.62733589354312
Energy: 0.6387991099216579
Energy: 0.6273358935424548
Energy: 0.4757262876853179
Energy: 0.4735598664697238
Energy: 0.47620476194661715
Energy: 0.4735598664697238
Energy: 0.4758167046789239
Energy: 0.5330427429836336
Energy: 0.9061562034446327
Energy: 0.5330427429829685

minimum gb energy = 0.4685767924849357 eV
minimum distance =  2.3362702414519 Angstroms
sigma value = 85


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

Energy: 0.6889791611418792
Energy: 0.4456520557730374
Energy: 0.9506986211736058
Energy: 0.44565205577419126
Energy: 0.8923029696141399
Energy: 0.44372432880359003
Energy: 0.4268205541244973
Energy: 0.443724328804167
Energy: 0.6711456980602518
Energy: 0.44293585078681
Energy: 0.42334810498215825
Energy: 0.44293585078623304
Energy: 0.7876733481471374
Energy: 0.44385139645334487
Energy: 0.4267808819705205
Energy: 0.4438513964539218
Energy: 0.4417565104085338
Energy: 0.42606786938165636
Energy: 0.4374119267832883
Energy: 0.42606786938223334
Energy: 0.6826629468027589
Energy: 0.4435225794331289
Energy: 0.42673814951560857
Energy: 0.4435225794342827
Energy: 0.4247767838086322
Energy: 0.45363711487284136
Energy: 0.4402614568757305
Energy: 0.45363711487226444
Energy: 0.5611237175844394
Energy: 0.44289873940268193
Energy: 0.42675555030212503
Energy: 0.44289873940498964
Energy: 0.42630852178541934
Energy: 0.43372571350188593
Energy: 0.683025419718288
Energy: 0.43372571350188593
Energy: 0.5393587311980874
Energy: 0.45339279388542314
Energy: 0.42510418068304173
Energy: 0.45339279388426934
Energy: 0.42786500908354924
Energy: 0.4433586808891887
Energy: 0.6825668589269936
Energy: 0.4433586808891887
Energy: 0.41782294700567746
Energy: 0.4426211292188506
Energy: 0.44214904624813384
Energy: 0.4426211292176968
Energy: 0.426404006831592
Energy: 0.43310194251393186
Energy: 0.8888107684220704
Energy: 0.4331019425145088
Energy: 0.42303265051833344
Energy: 0.4429665935790733
Energy: 0.671562619393394
Energy: 0.4429665935802272
Energy: 0.42783517735838433
Energy: 0.4434292867974544
Energy: 0.8930412494769713
Energy: 0.4434292867997621
Energy: 0.4183163587922687
Energy: 0.4458450853573376
Energy: 0.6894894762512481
Energy: 0.4458450853561837
Energy: 0.42645368499378544
Energy: 0.43304442735459314
Energy: 0.9945715173905983
Energy: 0.433044427355747
Energy: 0.538498007463734
Energy: 0.4429029797887956
Energy: 0.6715927834941806
Energy: 0.4429029797876417
Energy: 0.42783710200626934
Energy: 0.4433556399104946
Energy: 0.8779090984908795
Energy: 0.4433556399104946
Energy: 0.5663061805057241
Energy: 0.4461623242947114
Energy: 0.4421588439155214
Energy: 0.4461623242970192
Energy: 0.42639617579213157
Energy: 0.4330348260723317
Energy: 0.8800764171274306
Energy: 0.43303482607175475
Energy: 0.5635852083517904
Energy: 0.44299608040253297
Energy: 0.42514283763003075
Energy: 0.4429960804031099
Energy: 0.4278068761510646
Energy: 0.44262934464651166
Energy: 0.6615835913815016
Energy: 0.4426293446459347
Energy: 0.5600434192674115
Energy: 0.45491353015436514
Energy: 0.42680142601927407
Energy: 0.4549135301537882
Energy: 0.4265908338561179
Energy: 0.44245699687071577
Energy: 0.6680450559442669
Energy: 0.4424569968701388
Energy: 0.6832723311972383
Energy: 0.44313556782812796
Energy: 0.42923503519754547
Energy: 0.4431355678263971
Energy: 0.4435122549640083
Energy: 0.4422272491598415
Energy: 0.4175826541818872
Energy: 0.44222724916041845
Energy: 0.8023336880172329
Energy: 0.455145907307948
Energy: 0.42679426647418894
Energy: 0.45514590730852494
Energy: 0.6727493352622924
Energy: 0.44330078498629
Energy: 0.4292446605678078
Energy: 0.4433007849430459
Energy: 0.9902301463821791
Energy: 0.4431959974464754
Energy: 0.429249490896976
Energy: 0.4431959974464754
Energy: 0.6906592150992851
Energy: 0.4423532375362738
Energy: 0.41798153932973947
Energy: 0.44235323753511996
Energy: 0.8842162635242378
Energy: 0.453211678699488
Energy: 0.4267923021253193
Energy: 0.45321167870006496
Energy: 0.6728529352333511
Energy: 0.4433540745427325
Energy: 0.4296400302009034
Energy: 0.44335407454157866
Energy: 0.8777103816588427
Energy: 0.44313070933497933
Energy: 0.42912156527104883
Energy: 0.44313070933497933
Energy: 0.4435647797854393
Energy: 0.44242125602745097
Energy: 0.5645007190212896
Energy: 0.4424212560280279
Energy: 0.6650409362943466
Energy: 0.4534449040619925
Energy: 0.42685699008992634
Energy: 0.45344490406314636
Energy: 0.42646610281063685
Energy: 0.4434635747072039
Energy: 0.5634415485336249
Energy: 0.44346357470431913
Energy: 0.6615440703772695
Energy: 0.4428094871164574
Energy: 0.4291019206059
Energy: 0.44280948711703433
Energy: 0.42797164992431325
Energy: 0.44241252386109275
Energy: 0.5600628632932861
Energy: 0.4424125238593619
Energy: 0.4163225769217896
Energy: 0.4666349164929441
Energy: 0.42837320980849997
Energy: 0.46663491649179023
Energy: 0.4295466984125965
Energy: 0.4435490621398781
Energy: 0.8020352834238111
Energy: 0.44354906214045503
Energy: 0.41661051663494864
Energy: 0.4421404190872798
Energy: 0.44568741911082593
Energy: 0.44214041908670293
Energy: 0.42792890075604195
Energy: 0.44349362367543677
Energy: 0.8011507601227823
Energy: 0.44349362367543677

minimum gb energy = 0.4163225769217896 eV
minimum distance =  2.34506866148565 Angstroms
sigma value = 113


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

Energy: 0.01560535980051511
Energy: 0.01693376906051811
Energy: 0.8567735362918734
Energy: 0.01693376906007459
Energy: 0.5818368254331211
Energy: 0.21548078435542942
Energy: 0.215564156837226
Energy: 0.21548078435587295
Energy: 0.01560535980009623
Energy: 0.01693376906093699
Energy: 0.8567735362810318
Energy: 0.01693376906007459
Energy: 0.5818368254327023
Energy: 0.21548078435542942
Energy: 0.21556415683158345
Energy: 0.21548078435587295
Energy: 0.01560535980009623
Energy: 0.01693376906093699
Energy: 0.8567735362853682
Energy: 0.01693376906007459
Energy: 0.5818368254331211
Energy: 0.21548078435542942
Energy: 0.21556415683897545
Energy: 0.21548078435587295

minimum gb energy = 0.01560535980009623 eV
minimum distance =  2.54575007130159 Angstroms
sigma value = 1