Model name: model_name=EAM_Dynamo_Ackland_1987_Au__MO_754413982908_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.078000083565712
cohesive_energy=3.789343324199171
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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, -9.10007488932588e-18, -1.280760775099992e-17, -2.07320054262966e-17]
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: 0.011485043757664987
Energy: 0.012196934697306856
Energy: 0.012428680260208708
Energy: 0.011637021822254075
Energy: 0.39073976536890315
Energy: 0.011935082466793175
Energy: 0.012196934697525913
Energy: 0.07205047063164621
Energy: 0.07201720397416823
Energy: 0.07197954274386727
Energy: 0.07197006806608217
Energy: 0.07210742130594436
Energy: 0.012428680261167082
Energy: 0.0720172039695954
Energy: 0.07204354447575455
Energy: 0.012148678559876667
Energy: 0.07207121776946827
Energy: 0.07195785389433842
Energy: 0.011637021822254075
Energy: 0.07197954275180808
Energy: 0.012148678559876667
Energy: 0.011660279220881059
Energy: 0.0720167905560454
Energy: 0.011938576015026169
Energy: 0.3907397653698615
Energy: 0.07197006806030454
Energy: 0.07207121777743647
Energy: 0.0720167905521845
Energy: 0.07204947329097579
Energy: 0.07205861468210681
Energy: 0.011935082466793175
Energy: 0.07210742130523244
Energy: 0.07195785389387292
Energy: 0.011938576014779727
Energy: 0.07205861467895786
Energy: 0.012151355976410209

minimum gb energy = 0.011485043757664987 eV
minimum distance =  2.87673752716426 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.0475641602470511
Energy: 0.7393148657572826
Energy: 0.7135828946257311
Energy: 0.7241398027855142
Energy: 0.7581419624246061
Energy: 0.7087046201819447
Energy: 1.0014939920179813
Energy: 0.7060836606519001
Energy: 0.6888512228979904
Energy: 0.6910729588368305
Energy: 0.7063278030051721
Energy: 0.6905998552155703
Energy: 0.9698595618002419
Energy: 0.6819845079236574
Energy: 0.6666539021608083
Energy: 0.6876193393088874
Energy: 0.7123565151252379
Energy: 0.679992110578471
Energy: 1.14239252756602
Energy: 0.7019732914204071
Energy: 0.6926406100400434
Energy: 0.6848535138873009
Energy: 0.7293962838501155
Energy: 0.693876642918243
Energy: 0.9723709490669528
Energy: 0.6987681619246345
Energy: 0.6886190693642239
Energy: 0.6924376844814083
Energy: 0.6878622017775559
Energy: 0.6887276204567202
Energy: 0.9275782062455997
Energy: 0.69750886826735
Energy: 0.6963561141125458
Energy: 0.6877882065159215
Energy: 0.6992500247743174
Energy: 0.6979768795380172
Energy: 0.927206090043475
Energy: 0.6972164691580417
Energy: 0.6978669633738112
Energy: 0.6813421217148001
Energy: 0.6838696034938613
Energy: 0.6975352728465785
Energy: 0.9005913890789776
Energy: 0.6886964658445768
Energy: 0.6885171463172557
Energy: 0.6852458483005365
Energy: 0.6855688560804901
Energy: 0.6969491643811684
Energy: 0.7380392809616719
Energy: 0.6883884976802082
Energy: 0.6801557295016719
Energy: 0.7263099352717631
Energy: 0.6891967094274305
Energy: 0.6833883383084602
Energy: 0.7404239469483682
Energy: 0.6918218825516689
Energy: 0.6908847118416718
Energy: 0.6881867680071331
Energy: 0.6921270949133355
Energy: 0.6914153797975878
Energy: 0.7879797535078551
Energy: 0.6979483639326779
Energy: 0.6969063777191713
Energy: 0.7144800993606373
Energy: 0.691954520642255
Energy: 0.6878096455128644
Energy: 0.7133891587970871
Energy: 0.6927988306436128
Energy: 0.696291317497724
Energy: 0.7118203035129697
Energy: 0.6859571002588024
Energy: 0.6811109166758935
Energy: 0.706713189222856
Energy: 0.6904674396631117
Energy: 0.6893802244394606
Energy: 0.7066528760787584
Energy: 0.6910779074214398
Energy: 0.6920278839948916
Energy: 0.8267384775692085
Energy: 0.7000435899391746
Energy: 0.6915233551651252
Energy: 0.7709279022021231
Energy: 0.6999415001878275
Energy: 0.7311356817599515
Energy: 0.7179161490614522
Energy: 0.6914282738298866
Energy: 0.6912820510204819
Energy: 0.6949330266925751
Energy: 0.691981057190131
Energy: 0.6873736612884804
Energy: 0.7243255801965739
Energy: 0.6956740244217792
Energy: 0.6701348510232085
Energy: 0.7191988732130594
Energy: 0.6887313255143178
Energy: 0.6731768930992451
Energy: 0.8446551931321177
Energy: 0.6941978667375511
Energy: 0.6945035109984405
Energy: 0.6878924041623682
Energy: 0.6795949815901698
Energy: 0.6958920966052967
Energy: 0.8275555877975413
Energy: 0.6903944260117452
Energy: 0.6886792586253826
Energy: 0.6887024435743976
Energy: 0.6883726822717277
Energy: 0.6885685902888664
Energy: 0.8305539715129937
Energy: 0.6900027788223064
Energy: 0.6883565301745024
Energy: 0.688658170116925
Energy: 0.689772783769026
Energy: 0.6881297023664417
Energy: 0.9114371167812769
Energy: 0.6901935003682067
Energy: 0.6884272300541301
Energy: 0.6880192056194883
Energy: 0.6887328626529616
Energy: 0.6877874565985875
Energy: 1.0472418826051983
Energy: 0.6755042747147154
Energy: 0.6864459942472761
Energy: 0.7012397983398628
Energy: 0.714570404469736
Energy: 0.7006900348037163
Energy: 0.9363720709742818
Energy: 0.68217098302113
Energy: 0.6778048738263663
Energy: 0.6861283431205465
Energy: 0.7211499322937365
Energy: 0.6702224314492422
Energy: 1.0015348515013935
Energy: 0.694629273783008
Energy: 0.6944768205717963
Energy: 0.6944778202871267
Energy: 0.6952265471611124
Energy: 0.6905512706685198

minimum gb energy = 0.6666539021608083 eV
minimum distance =  2.70304033490915 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.2412300923877757
Energy: 0.7805361298766171
Energy: 0.7377099547760653
Energy: 0.738243552807325
Energy: 0.7434341249798097
Energy: 0.7735095577011403
Energy: 0.7456948371249691
Energy: 0.7088919477811578
Energy: 0.6917846183288794
Energy: 0.7142612626248693
Energy: 0.7148003678449845
Energy: 0.6961677694755731
Energy: 0.7511229344285354
Energy: 0.714958700980715
Energy: 0.7071281794262575
Energy: 0.7464605337029859
Energy: 0.7117005815716235
Energy: 0.761099226998742
Energy: 0.9419577807152872
Energy: 0.7745405524312287
Energy: 0.723238018129437
Energy: 0.73177295644
Energy: 0.7722304437434555
Energy: 0.7445037116087371
Energy: 0.7636941724465021
Energy: 0.8137716320293424
Energy: 0.7132271923648099
Energy: 0.7149539809429308
Energy: 0.7085180114461747
Energy: 0.806009414297154
Energy: 0.9587309032372134
Energy: 0.7131755727234109
Energy: 0.797496482912354
Energy: 0.7657716870625823
Energy: 0.8126459731926421
Energy: 0.7989415922511225
Energy: 0.9588953553790874
Energy: 0.7477365675816681
Energy: 0.8003993218800867
Energy: 0.7589940164253678
Energy: 0.7495950183737203
Energy: 0.7571615903657404
Energy: 0.9391248000252049
Energy: 0.7481382622064932
Energy: 0.7506849356878039
Energy: 0.7229620610526268
Energy: 0.7481300978982637
Energy: 0.7505156922463038
Energy: 0.7892167355030446
Energy: 0.7474615291693872
Energy: 0.7991517363612815
Energy: 0.788921670442211
Energy: 0.7472047427226686
Energy: 0.7602275951819734
Energy: 0.7902852750955656
Energy: 0.7955407977683583
Energy: 0.7552191122460907
Energy: 0.758889856202329
Energy: 0.7575483306821702
Energy: 0.7521229311288705
Energy: 0.8089481513304199
Energy: 0.6887589174284395
Energy: 0.713319981874856
Energy: 0.7863808177276628
Energy: 0.6967585853897713
Energy: 0.6848558611105023
Energy: 0.753308820622507
Energy: 0.7248572265047154
Energy: 0.7341791217705371
Energy: 0.753339901954947
Energy: 0.7004578849546529
Energy: 0.7441145171793627
Energy: 0.7499997587668406
Energy: 0.7947379810766048
Energy: 0.7920221723667394
Energy: 0.744192429856264
Energy: 0.7580783315632621
Energy: 0.7560084366908592
Energy: 0.7759306920783373
Energy: 0.7308817188840496
Energy: 0.745733591888873
Energy: 0.7750654249476842
Energy: 0.7457737322898622
Energy: 0.7452553019310612
Energy: 0.763622056668104
Energy: 0.800503374591022
Energy: 0.8010356455726811
Energy: 0.7673281459736484
Energy: 0.7556481628395583
Energy: 0.7566456890433556
Energy: 0.8356517608920646
Energy: 0.7905586223521384
Energy: 0.8007978906448645
Energy: 0.8145758932459346
Energy: 0.8076328331324598
Energy: 0.7593754215035857
Energy: 0.7604154652316685
Energy: 0.8011266004617632
Energy: 0.8007936308323449
Energy: 0.805711824249101
Energy: 0.8129992674050015
Energy: 0.8014379128918409
Energy: 0.8323106661921527
Energy: 0.7993987583563182
Energy: 0.7988041085817333
Energy: 0.748087501494007
Energy: 0.7689748188131771
Energy: 0.7488000272679868
Energy: 0.7963621119116632
Energy: 0.7933519696565962
Energy: 0.8012201619957293
Energy: 0.7479243356853218
Energy: 0.7949993496978334
Energy: 0.791798474303873
Energy: 0.8124554801781491
Energy: 0.7896580818044956
Energy: 0.7887832520414406
Energy: 0.7956977432088017
Energy: 0.790330663821768
Energy: 0.795043197324928
Energy: 1.1717569856118
Energy: 0.7613801625044748
Energy: 0.6847260814539264
Energy: 0.701112696092659
Energy: 0.7695244868478303
Energy: 0.6955237252543669
Energy: 0.9474180458518722
Energy: 0.7772238135143703
Energy: 0.7814896645615401
Energy: 0.701075571087353
Energy: 0.7869106067602377
Energy: 0.7757035392510145
Energy: 0.8997805202618212
Energy: 0.7881572858644947
Energy: 0.7873776207977428
Energy: 0.7953244917781807
Energy: 0.7864200834069294
Energy: 0.7933898808666464
Energy: 1.0273155226311506
Energy: 0.8751459096796796
Energy: 0.8842847166792813
Energy: 0.7473799726384125
Energy: 0.8740486561307649
Energy: 0.7305536792235862
Energy: 0.7994921743811819
Energy: 0.8077373036582091
Energy: 0.8042991583577864
Energy: 0.7952354079720068
Energy: 0.8053408958757776
Energy: 0.7952018765873524
Energy: 0.7650292762917952
Energy: 0.8019623516745717
Energy: 0.7973491600002933
Energy: 0.7644925057015824
Energy: 0.811165106869789
Energy: 0.7978109268909616
Energy: 1.069417645807952
Energy: 0.7503928116497209
Energy: 0.753075621129783
Energy: 0.8080485222940735
Energy: 0.817172595862874
Energy: 0.7590212841841106
Energy: 0.9172971047008114
Energy: 0.7480083040889705
Energy: 0.7487276835231778
Energy: 0.7544088878763802
Energy: 0.7480672345632357
Energy: 0.803193606790734
Energy: 0.7781407196110489
Energy: 0.7478124026264032
Energy: 0.7487333920308037
Energy: 0.7627047823150805
Energy: 0.7481004794844525
Energy: 0.7936044430851749
Energy: 0.7843418189274995
Energy: 0.7551281687353238
Energy: 0.7534620119667469
Energy: 0.7558154039503301
Energy: 0.7956256869010878
Energy: 0.7570773184104463
Energy: 0.7571655542272291
Energy: 0.7010746123508135
Energy: 0.7012115104806556
Energy: 0.7456131896429028
Energy: 0.7269615442037367
Energy: 0.722961246607121
Energy: 0.7565230494197109
Energy: 0.6828141507350987
Energy: 0.6831305113780317
Energy: 0.7564653782157589
Energy: 0.7254109769249963
Energy: 0.7505910160223411
Energy: 0.7538196047359688
Energy: 0.7513070131731377
Energy: 0.7550324866793349
Energy: 0.7540559701985713
Energy: 0.7918617344535456
Energy: 0.7339149627993707
Energy: 0.7766971060391672
Energy: 0.7459942883678553
Energy: 0.7441936460494549
Energy: 0.7686743560043796
Energy: 0.7476952332316146
Energy: 0.7453640811674466
Energy: 0.8090767694986831
Energy: 0.7589418399692517
Energy: 0.7585822644323273
Energy: 0.7802346165449942
Energy: 0.7994394034128822
Energy: 0.8057179208959365
Energy: 0.8295875932991255
Energy: 0.7643983475542564
Energy: 0.7494004248846797
Energy: 0.7718667169813039
Energy: 0.7610967041174231
Energy: 0.761804216405748
Energy: 0.7910267121845597
Energy: 0.8172472566519047
Energy: 0.7210986573720798
Energy: 0.7259399235106847
Energy: 0.7208870489989686
Energy: 0.7349990179121068
Energy: 0.791788914621032
Energy: 0.764650359106966
Energy: 0.7117239034710822
Energy: 0.7477412459666826
Energy: 0.7107938832390474
Energy: 0.8080015139112385
Energy: 0.8322023894717615
Energy: 0.7136948051576171
Energy: 0.7136923563856786
Energy: 0.748149608610225
Energy: 0.7158063044983526
Energy: 0.7495830452508201
Energy: 0.7665235405477088
Energy: 0.720216870870053
Energy: 0.7170899558701835
Energy: 0.7133354718504411
Energy: 0.7208720353994552
Energy: 0.7213501956082452
Energy: 0.9432275838350882
Energy: 0.7114447686434197
Energy: 0.6896342787959294
Energy: 0.6981995331334396
Energy: 0.7060928788774262
Energy: 0.7356661846687391

minimum gb energy = 0.6828141507350987 eV
minimum distance =  2.6695176409333 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.0880150539829336
Energy: 0.8429024145945484
Energy: 0.8158781742037531
Energy: 0.6835782899070736
Energy: 0.7873883674155472
Energy: 0.6845150370219236
Energy: 0.9429384705170132
Energy: 0.7170364161303975
Energy: 0.7026891545413905
Energy: 0.7061780892034203
Energy: 0.7167812952960972
Energy: 0.712352981552336
Energy: 0.8964668871873896
Energy: 0.7146019880540607
Energy: 0.7102293167320848
Energy: 0.7260437421522904
Energy: 0.7145646681406024
Energy: 0.7124606418554904
Energy: 0.9849782986804162
Energy: 0.6989352102094782
Energy: 0.7010424342552721
Energy: 0.7045341629954781
Energy: 0.7234019940962849
Energy: 0.7041728794544649
Energy: 0.857375301239725
Energy: 0.7217580680686154
Energy: 0.7218959030122557
Energy: 0.7222443441183795
Energy: 0.722036240594578
Energy: 0.7254472132233132
Energy: 0.8018480074923093
Energy: 0.7210889435530795
Energy: 0.716981114091679
Energy: 0.721560480488254
Energy: 0.7237809911937173
Energy: 0.7157715957201292
Energy: 0.8020812122689309
Energy: 0.7228923498017674
Energy: 0.723183196907187
Energy: 0.7217293418330304
Energy: 0.7229264988344799
Energy: 0.7256378916338523
Energy: 0.8097687909418899
Energy: 0.6942731306777643
Energy: 0.6942342968146773
Energy: 0.7622823209085365
Energy: 0.6936367727747719
Energy: 0.6941431907845045
Energy: 0.7146137601465383
Energy: 0.6970609940748549
Energy: 0.6960658802779429
Energy: 0.7142185030386832
Energy: 0.7225140305980801
Energy: 0.7105492975020916
Energy: 0.7191948891841401
Energy: 0.7231683234523327
Energy: 0.7389030490205986
Energy: 0.7192424636911386
Energy: 0.7068291143559601
Energy: 0.6982532432364165
Energy: 0.7155349455869943
Energy: 0.6978594965073114
Energy: 0.6975282488255834
Energy: 0.7149042373086015
Energy: 0.6962737372273874
Energy: 0.6964580965780091
Energy: 0.7207582259010705
Energy: 0.7067600670641087
Energy: 0.724823713065104
Energy: 0.7081014090469255
Energy: 0.7204172554867129
Energy: 0.7198647071337643
Energy: 0.7179989427894578
Energy: 0.7107472810406638
Energy: 0.7081599477705643
Energy: 0.7201331376815506
Energy: 0.7109307180471895
Energy: 0.7081664214780299
Energy: 0.7203732484498564
Energy: 0.7083475055211201
Energy: 0.708280669624081
Energy: 0.7180914274732966
Energy: 0.7085402776847656
Energy: 0.7078744000230539
Energy: 0.934660998404599
Energy: 0.7105454542095201
Energy: 0.7111326792959595
Energy: 0.7104067930029324
Energy: 0.7109570411782835
Energy: 0.7108351388362358
Energy: 0.8637239000276549
Energy: 0.7118251911655873
Energy: 0.7077468503991352
Energy: 0.7107143161873651
Energy: 0.7176485407975011
Energy: 0.7103189236498973
Energy: 0.8582725883689647
Energy: 0.7114082167723164
Energy: 0.7133737305116491
Energy: 0.7230341811757919
Energy: 0.717781879199208
Energy: 0.7181514443731012
Energy: 1.068258043222281
Energy: 0.6926238566138871
Energy: 0.6958251892310467
Energy: 0.6925046396691767
Energy: 0.6988099648966019
Energy: 0.709023354217281

minimum gb energy = 0.6835782899070736 eV
minimum distance =  2.71096359680244 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.8961613641734933
Energy: 0.6391727450728656
Energy: 0.7722986505154692
Energy: 0.689506665034578
Energy: 0.6308325407001253
Energy: 0.7708470206791536
Energy: 0.6049108386280078
Energy: 0.6263575146876112
Energy: 0.6271616421503277
Energy: 0.6494775331424139
Energy: 0.6262695715186587
Energy: 0.6271094362388823
Energy: 0.733089145115258
Energy: 0.6265750178185922
Energy: 0.6268270499388736
Energy: 0.6156852817496598
Energy: 0.62674231634023
Energy: 0.6269736244889149
Energy: 0.7459789368823013
Energy: 0.6269684911770609
Energy: 0.6268675347884732
Energy: 0.6376535762054317
Energy: 0.6268293377274798
Energy: 0.6275004114745895
Energy: 0.7113649615454669
Energy: 0.626671274715753
Energy: 0.649516612711873
Energy: 0.614593683700914
Energy: 0.6264471924058909
Energy: 0.6483902221365325
Energy: 0.7734477406231426
Energy: 0.6049632670485975
Energy: 0.6479349758436651
Energy: 0.6498281234268988
Energy: 0.6048222156981816
Energy: 0.6475774193223306
Energy: 0.8111996580064521
Energy: 0.615350643294432
Energy: 0.6488156611066813
Energy: 0.6490222660826003
Energy: 0.6150195921821171
Energy: 0.6479182059273888
Energy: 0.7621485601449276
Energy: 0.6050575101006108
Energy: 0.6049698439909587
Energy: 0.7618792293664514
Energy: 0.6051574709752003
Energy: 0.605065682272311
Energy: 0.6266187809383252
Energy: 0.605629547562441
Energy: 0.6054735652651433
Energy: 0.6263591907291599
Energy: 0.6065347063363582
Energy: 0.6056897320271231
Energy: 0.6263770096898629
Energy: 0.6485290955148053
Energy: 0.6276409373004019
Energy: 0.6264326611457498
Energy: 0.6150880972393702
Energy: 0.6269130026249266
Energy: 0.6255885471605714
Energy: 0.6877471914446476
Energy: 0.6857457793959839
Energy: 0.6257295640741672
Energy: 0.6378589144623837
Energy: 0.6270179386197964
Energy: 0.7331488264409423
Energy: 0.6495708624869028
Energy: 0.6489452123330585
Energy: 0.6266829292072141
Energy: 0.6152369331737034
Energy: 0.6275861314492708
Energy: 0.6032797403737147
Energy: 0.6489212700295536
Energy: 0.6483543454547395
Energy: 0.6044833710874238
Energy: 0.649026987510908
Energy: 0.6488282197551737
Energy: 0.7329992252120512
Energy: 0.6507020880170874
Energy: 0.6493706320668322
Energy: 0.626517062558749
Energy: 0.6499546931052834
Energy: 0.6488816338096811
Energy: 0.6044506096950322
Energy: 0.6277259164770005
Energy: 0.6278105615869701
Energy: 0.6058887021786659
Energy: 0.6265050038022605
Energy: 0.605607730253652
Energy: 0.9039469858225014
Energy: 0.6279466778180451
Energy: 0.6051961885491313
Energy: 0.6051709889728549
Energy: 0.6279764580072927
Energy: 0.6049990258295258
Energy: 0.7119619937602711
Energy: 0.6265850108079828
Energy: 0.6268301512098426
Energy: 0.6148124140342913
Energy: 0.6259774177823669
Energy: 0.6278023870753794
Energy: 0.7865882889153806
Energy: 0.6271476140899335
Energy: 0.6271590536472204
Energy: 0.6377948350823961
Energy: 0.6276899809166328
Energy: 0.6271976821247764
Energy: 0.7883926031739256
Energy: 0.6274470433912864
Energy: 0.6268683273680794
Energy: 0.6378170570585427
Energy: 0.6275845628926627
Energy: 0.6268102663003429
Energy: 0.733314330502409
Energy: 0.6048637461398857
Energy: 0.64830888590106
Energy: 0.6265969095489309
Energy: 0.6046882837209744
Energy: 0.6480971092137857
Energy: 0.7684590910296263
Energy: 0.6275188791407593
Energy: 0.6492129833206995
Energy: 0.6489701217131792
Energy: 0.6263458356779004
Energy: 0.6503142786944485
Energy: 0.7535812479681229
Energy: 0.6153814363178456
Energy: 0.70691237337544
Energy: 0.6266515426120762
Energy: 0.6151960191968636
Energy: 0.6487259769314703
Energy: 0.7326360457748344
Energy: 0.6053559292011047
Energy: 0.6048659343193361
Energy: 0.7630937463568539
Energy: 0.6051610315216286
Energy: 0.6052421343634096
Energy: 0.6262122313395849
Energy: 0.6483640046050675
Energy: 0.6485602876298008
Energy: 0.6263344156420579
Energy: 0.6364162279574503
Energy: 0.6270062779726826
Energy: 0.6263963084908701
Energy: 0.6493636497687653
Energy: 0.6277808573915583
Energy: 0.6264633403876795
Energy: 0.6153097834728375
Energy: 0.6268392327898423
Energy: 0.6156155749033484
Energy: 0.637776145650572
Energy: 0.6377204685199069
Energy: 0.6154086293959644
Energy: 0.6376720022529092
Energy: 0.6266701054866827
Energy: 0.7549967998207827
Energy: 0.6490518221904386
Energy: 0.6487865714042789
Energy: 0.6264346253592181
Energy: 0.6149178717597767
Energy: 0.6489514326211238
Energy: 0.6046045212446152
Energy: 0.6484035794599984
Energy: 0.6475603748298324
Energy: 0.6046342872777651
Energy: 0.6492796631956933
Energy: 0.6476618183342477
Energy: 0.7125316679666496
Energy: 0.6483239852343021
Energy: 0.647785195359191
Energy: 0.6148975774266858
Energy: 0.6490382348889895
Energy: 0.6484797244650111
Energy: 0.9039715925139686
Energy: 0.6276722866284529
Energy: 0.6050485583753484
Energy: 0.6051420377584193
Energy: 0.626402564650819
Energy: 0.6052721414129435

minimum gb energy = 0.6032797403737147 eV
minimum distance =  2.75110498546045 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.7602153650347304
Energy: 0.7488357623674675
Energy: 0.8148252453776436
Energy: 0.6402564405173602
Energy: 0.7148906197712411
Energy: 0.8134136820202891
Energy: 0.6914253177523981
Energy: 0.6751367263302697
Energy: 0.6402251622776522
Energy: 0.6393372742658243
Energy: 0.6931882694676347
Energy: 0.6392510377841603
Energy: 0.6995763296797732
Energy: 0.6906639837862351
Energy: 0.6720013469871278
Energy: 0.674189937870967
Energy: 0.691310907403241
Energy: 0.6400513027595545
Energy: 0.8965976447715208
Energy: 0.6868346337775739
Energy: 0.6813407174514778
Energy: 0.6587124230795239
Energy: 0.7249298231396913
Energy: 0.6455856702017765
Energy: 0.8036055638513733
Energy: 0.6094301062391546
Energy: 0.6400818452315705
Energy: 0.6707315926032682
Energy: 0.6102970893259511
Energy: 0.6387867349759152
Energy: 0.6917598639905124
Energy: 0.6102192578824615
Energy: 0.6100792246588441
Energy: 0.6918195582185283
Energy: 0.6153880194932692
Energy: 0.6098216398251654
Energy: 0.6740786664009973
Energy: 0.660227736717461
Energy: 0.6391520417236581
Energy: 0.674216084500883
Energy: 0.6397800559843053
Energy: 0.6394113131030073
Energy: 0.7252017507295602
Energy: 0.6504466323975184
Energy: 0.6275575133209333
Energy: 0.7253214165910378
Energy: 0.6443896844246473
Energy: 0.6808977197941823
Energy: 0.7765038943006533
Energy: 0.6591786505871703
Energy: 0.6564535351247844
Energy: 0.6787156282262796
Energy: 0.6624335733508919
Energy: 0.6567535174757599
Energy: 0.6165409598246675
Energy: 0.6436493125986728
Energy: 0.6409164262763447
Energy: 0.6494021530588437
Energy: 0.644786263855594
Energy: 0.6456998838408086
Energy: 0.7001712377307849
Energy: 0.6479303530634783
Energy: 0.6442189371065702
Energy: 0.6769702835707829
Energy: 0.6461466246510732
Energy: 0.645772516896262
Energy: 0.6914253175378146
Energy: 0.6840371987486653
Energy: 0.6404485363745654
Energy: 0.6411906934919998
Energy: 0.6779955663692337
Energy: 0.641213908072716

minimum gb energy = 0.6094301062391546 eV
minimum distance =  2.73345494793849 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.0918360522848733
Energy: 0.7360489343225429
Energy: 0.8940382002273946
Energy: 0.7149996670080827
Energy: 0.8614047816961764
Energy: 0.651764046915441
Energy: 0.5553409804188204
Energy: 0.5986052927758406
Energy: 0.5663415004068175
Energy: 0.5718440829165345
Energy: 0.6143654468309894
Energy: 0.5654169303804769
Energy: 0.7704980780826481
Energy: 0.5946396783077363
Energy: 0.5686000240485698
Energy: 0.6054262556163874
Energy: 0.5962229161523651
Energy: 0.5702843348753248
Energy: 0.7666229840312915
Energy: 0.5786287488412023
Energy: 0.5683893791966091
Energy: 0.5757766965713025
Energy: 0.5963960218266089
Energy: 0.588808650882394
Energy: 0.5978381309286257
Energy: 0.5955810953916157
Energy: 0.5756087411309357
Energy: 0.6555723490211292
Energy: 0.5953852202272553
Energy: 0.5804811650295137
Energy: 0.635628707312407
Energy: 0.5796299782683371
Energy: 0.588390264647125
Energy: 0.6357571390000234
Energy: 0.5785685350046482
Energy: 0.6109631632766076
Energy: 0.6667874192127412
Energy: 0.5610687568799093
Energy: 0.561181818465908
Energy: 0.661086055691784
Energy: 0.5958761844165994
Energy: 0.5896977180628854
Energy: 0.6812008072222148
Energy: 0.5902030033473556
Energy: 0.5908194835690119
Energy: 0.6082162811440212
Energy: 0.5881121323187798
Energy: 0.6359317934388323
Energy: 0.6443628319410469
Energy: 0.5925725780699809
Energy: 0.5910403396395463
Energy: 0.6532805187361085
Energy: 0.6046706415340222
Energy: 0.5929375032254138
Energy: 0.8936946746383065
Energy: 0.6410595416062345
Energy: 0.626887539097334
Energy: 0.5677536751246502
Energy: 0.6424589409138464
Energy: 0.5831320604554511
Energy: 0.7282810158347246
Energy: 0.6485355881132419
Energy: 0.632324968645122
Energy: 0.6106595569814721
Energy: 0.6505058729448924
Energy: 0.590212501180549
Energy: 0.6440503098610915
Energy: 0.6556696458517838
Energy: 0.5890813216318839
Energy: 0.5732670166126667
Energy: 0.6610737160635964
Energy: 0.5621237841906639
Energy: 0.9757327777457234
Energy: 0.6375106868593505
Energy: 0.6729875212027648
Energy: 0.6099162295408416
Energy: 0.6381758017213832
Energy: 0.6740008145874742
Energy: 0.6026758806458472
Energy: 0.5911071775580647
Energy: 0.5616896876533759
Energy: 0.573844089151455
Energy: 0.6361911264474036
Energy: 0.5612126089018884
Energy: 0.5969299086932602
Energy: 0.5758170718640472
Energy: 0.5779173216086546
Energy: 0.5885036960084281
Energy: 0.574309922210376
Energy: 0.5940895103670338
Energy: 0.5873981552525595
Energy: 0.5660297692548499
Energy: 0.5681771246642621
Energy: 0.5967320952226675
Energy: 0.6108029599329582
Energy: 0.5644458687325874
Energy: 0.6139717883926683
Energy: 0.5775700690368963
Energy: 0.5673972604984183
Energy: 0.6090289586956222
Energy: 0.5773337679049766
Energy: 0.568969956791658
Energy: 0.5983345504100722
Energy: 0.592998369740985
Energy: 0.5793454123765528
Energy: 0.6080976259598775
Energy: 0.5874007088415308
Energy: 0.6059111841865877
Energy: 0.5972230443332807
Energy: 0.5682924141329136
Energy: 0.5679526526329739
Energy: 0.5895530325720844
Energy: 0.584209270119188
Energy: 0.5611798133161021
Energy: 0.5952835374160409
Energy: 0.5761096939456547
Energy: 0.5674009203093865
Energy: 0.5681428360513725
Energy: 0.5676168591907221
Energy: 0.5681611135611564
Energy: 0.5986251760809578
Energy: 0.563272672618576
Energy: 0.5668821175556702
Energy: 0.5829149073225571
Energy: 0.5862350775800024
Energy: 0.5754998058085852
Energy: 0.6376529692445025
Energy: 0.5795600740209416
Energy: 0.6097720325083004
Energy: 0.593421857355792
Energy: 0.6144662920677875
Energy: 0.5946546141942072
Energy: 0.6686739186935446
Energy: 0.6048903010769214
Energy: 0.581446053009549
Energy: 0.5935314889163844
Energy: 0.6084201753962822
Energy: 0.5593761153468108
Energy: 0.5972630472379963
Energy: 0.5944955473841143
Energy: 0.5637153014766606
Energy: 0.6178487289691874
Energy: 0.5983721527759914
Energy: 0.5664187273334098
Energy: 0.7478208631645836
Energy: 0.5891388766450455
Energy: 0.5990323256867527
Energy: 0.6662948737753398
Energy: 0.5884479249179775
Energy: 0.6003571594044268
Energy: 0.5970825955296429
Energy: 0.5733946018511384
Energy: 0.5609405066955426
Energy: 0.6600961160179903
Energy: 0.5735347084902759
Energy: 0.5670966311377603
Energy: 0.6218556087774594
Energy: 0.6442191429541644
Energy: 0.6152130239665619
Energy: 0.6221279425424034
Energy: 0.6085922526724933
Energy: 0.5893699995204482
Energy: 0.6652662769344444
Energy: 0.560640869357409
Energy: 0.5618650361283775
Energy: 0.6603238580175803
Energy: 0.5737900565585777
Energy: 0.5623605365980274
Energy: 0.6423123554612368
Energy: 0.5890442391006854
Energy: 0.5897488614866486
Energy: 0.643755504277958
Energy: 0.5888770603700674
Energy: 0.6154027968424096
Energy: 0.5903662312934933
Energy: 0.5796260606493702
Energy: 0.6077522602990123
Energy: 0.6064985234575336
Energy: 0.5732871207418632
Energy: 0.6338335733569537
Energy: 0.5546871474931352
Energy: 0.6355140221431447
Energy: 0.5929355071415726
Energy: 0.6095190373840466
Energy: 0.6422147982908388
Energy: 0.5906713409590155
Energy: 0.89512866097276
Energy: 0.6045784154817491
Energy: 0.5960323727030221
Energy: 0.5690719031474746
Energy: 0.6370263786051741
Energy: 0.5816773065573162
Energy: 0.6025950244170312
Energy: 0.6471378743874886
Energy: 0.5898787731281984
Energy: 0.6234531105750878
Energy: 0.6408862920828154
Energy: 0.5611539388735914
Energy: 0.7724447403402519
Energy: 0.6451982643731741
Energy: 0.5901311915726581
Energy: 0.5855973844708242
Energy: 0.6445274665076294
Energy: 0.6130559435875909
Energy: 0.5973189862734862
Energy: 0.6634201866460898
Energy: 0.5616196716618277
Energy: 0.6050510646833259
Energy: 0.6560610442849043
Energy: 0.5622851510976813
Energy: 0.5973035451093978
Energy: 0.5805723889750232
Energy: 0.588483672828525
Energy: 0.6093205137254178
Energy: 0.5797877501756473
Energy: 0.5771125237469975
Energy: 0.5948665836907469
Energy: 0.5841265465873915
Energy: 0.577489423956797
Energy: 0.587510890217693
Energy: 0.5838951687009878
Energy: 0.5693448909314263
Energy: 0.6093778703709118
Energy: 0.5645371734687953
Energy: 0.5649444408380083
Energy: 0.609119316651505
Energy: 0.5636631747197255
Energy: 0.5907291923775505
Energy: 0.7205978792283364
Energy: 0.6754087440595027
Energy: 0.6468182975015407
Energy: 0.7205459751905824
Energy: 0.6286595135033507
Energy: 0.6617248410933011
Energy: 0.6001971429792046
Energy: 0.5641185445250332
Energy: 0.5611783987171671
Energy: 0.6081667536122489
Energy: 0.5627559457674326
Energy: 0.5679731109567586
Energy: 0.592897285577686
Energy: 0.5735597248131926
Energy: 0.5735834855012624
Energy: 0.5662260683000103
Energy: 0.5750119075555766
Energy: 0.5703258607801298
Energy: 0.5972810932070549
Energy: 0.5663126157799698
Energy: 0.5713428045224658
Energy: 0.5749256967890198
Energy: 0.5693346841016607
Energy: 0.5614252420618976
Energy: 0.6686596177206764
Energy: 0.5713397442288417
Energy: 0.5693021330225889
Energy: 0.5935239868554422
Energy: 0.6086214896498646
Energy: 0.5390813032888556

minimum gb energy = 0.5390813032888556 eV
minimum distance =  2.73581242401568 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.2844202647556099
Energy: 0.2923655428255319
Energy: 0.2942209510263419
Energy: 0.28691321464605274
Energy: 0.32094715313028455
Energy: 0.32501187304670737
Energy: 0.2860928445636924
Energy: 0.30594726239916414
Energy: 0.30984794686535205
Energy: 0.3207041107261241
Energy: 0.3211213121609846
Energy: 0.3252128746091326
Energy: 0.35085343413267
Energy: 0.32895315329736885
Energy: 0.30739790770049036
Energy: 0.32162374016789397
Energy: 0.32098030789189713
Energy: 0.3099249477952283
Energy: 0.3508174129145538
Energy: 0.3233984111917052
Energy: 0.30674804670851474
Energy: 0.32233707792264227
Energy: 0.3518141127566062
Energy: 0.34535010325910737
Energy: 0.3465225439330071
Energy: 0.28701137063029514
Energy: 0.3070781423009173
Energy: 0.3493663286079562
Energy: 0.28616279721542254
Energy: 0.30980712356262213
Energy: 0.320365181035709
Energy: 0.2865959559881575
Energy: 0.2875896397801522
Energy: 0.30325479784261944
Energy: 0.28566097003526286
Energy: 0.305557094953479
Energy: 0.31524610257420566
Energy: 0.30530581533458456
Energy: 0.30985635452847693
Energy: 0.3161668040538363
Energy: 0.30508701510002
Energy: 0.31278456641679114
Energy: 0.3203798437750409
Energy: 0.3053576366870848
Energy: 0.3373662565272164
Energy: 0.3204194281814674
Energy: 0.3038745750017579
Energy: 0.3074716644045432
Energy: 0.3467919893934574
Energy: 0.32666140840437
Energy: 0.3119230792896353
Energy: 0.34939467126693613
Energy: 0.3215331616119016
Energy: 0.30771370633200346
Energy: 0.28582320803669786
Energy: 0.3368168706176615
Energy: 0.31443954718582307
Energy: 0.2856736424383691
Energy: 0.3214106240684206
Energy: 0.30589066891786026
Energy: 0.2857988307700609
Energy: 0.3046706151451449
Energy: 0.30787336775488616
Energy: 0.2858620008344981
Energy: 0.30489074106645764
Energy: 0.3065801421168882
Energy: 0.3506025733737987
Energy: 0.32395877359429986
Energy: 0.33709824802299027
Energy: 0.32127832575421755
Energy: 0.32095103564857397
Energy: 0.31322547184219574
Energy: 0.35098622203902025
Energy: 0.3513859730686387
Energy: 0.3654013161219589
Energy: 0.3382851073202627
Energy: 0.3510810272984564
Energy: 0.3213347298615273
Energy: 0.34768397611716895
Energy: 0.3235381408735859
Energy: 0.33840707158128686
Energy: 0.32275737309283803
Energy: 0.32104025982025836
Energy: 0.31058455479124286
Energy: 0.3507808646596105
Energy: 0.28611521818853786
Energy: 0.28707139207120136
Energy: 0.3209099463877272
Energy: 0.287026931751039
Energy: 0.3056141048526424
Energy: 0.32006187550020254
Energy: 0.30759019493025214
Energy: 0.3106995981624838
Energy: 0.3206420686291247
Energy: 0.2857524032985564
Energy: 0.3105829864590644
Energy: 0.3208043009487342
Energy: 0.3348449622653962
Energy: 0.31188385015388537
Energy: 0.32087063380862163
Energy: 0.32258660255407123
Energy: 0.30885500591935805
Energy: 0.3506272607788233
Energy: 0.3048193128511446
Energy: 0.3372710582176255
Energy: 0.3508831547493367
Energy: 0.3035843373494239
Energy: 0.30737951290063026
Energy: 0.2858053338380319
Energy: 0.30586466842893384
Energy: 0.3082260097472695
Energy: 0.28611747364700796
Energy: 0.324031542292832
Energy: 0.31059502670102074

minimum gb energy = 0.2844202647556099 eV
minimum distance =  2.79023522612137 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.8666020612685104
Energy: 0.6617304502632274
Energy: 0.8396605547300968
Energy: 0.7620888528024712
Energy: 0.5685382985669992
Energy: 0.5583508662030321
Energy: 0.47981964531739263
Energy: 0.49653716444875423
Energy: 0.49096975030492623
Energy: 0.4709855118551784
Energy: 0.47279571628971784
Energy: 0.4998750496026691
Energy: 0.4734936856495102
Energy: 0.4835927723370215
Energy: 0.4800872054506567
Energy: 0.4792851341258228
Energy: 0.4814972370714669
Energy: 0.5026127081891333
Energy: 0.47331099126350795
Energy: 0.5012380774631686
Energy: 0.4897400299878521
Energy: 0.47917163053137707
Energy: 0.47781260123354174
Energy: 0.5009875649847441
Energy: 0.4719370211837883
Energy: 0.5255918808659991
Energy: 0.5220509201753522
Energy: 0.47941952432242196
Energy: 0.6286926163321509
Energy: 0.5035627980315354
Energy: 0.5059388524862856
Energy: 0.6560215575118785
Energy: 0.6488702062016232
Energy: 0.4799424686520706
Energy: 0.6685205525096289
Energy: 0.5116409080870914
Energy: 0.5056346852845404
Energy: 0.48873663550949253
Energy: 0.4903692678923129
Energy: 0.47258053743217304
Energy: 0.4734762577779171
Energy: 0.48195707530046084
Energy: 0.48191833568823905
Energy: 0.5443626966255297
Energy: 0.5445276474332078
Energy: 0.49508914669834375
Energy: 0.5442805531617015
Energy: 0.5671971338314001
Energy: 0.5054807879886792
Energy: 0.4933340458188933
Energy: 0.5100226084644643
Energy: 0.49055732631025956
Energy: 0.46912147876890475
Energy: 0.5176255379815095
Energy: 0.8013326548401817
Energy: 0.5152307635316438
Energy: 0.5408633887270994
Energy: 0.6981746739397312
Energy: 0.5146347561853992
Energy: 0.5306122870890164
Energy: 0.8580839918718554
Energy: 0.5105976852350159
Energy: 0.538278531103913
Energy: 0.5131147435501241
Energy: 0.5170683423682231
Energy: 0.5364349907679958
Energy: 0.5702889914182347
Energy: 0.4818406762053289
Energy: 0.5109622868625235
Energy: 0.5386897923745594
Energy: 0.46228577419031236
Energy: 0.5128255164438253
Energy: 0.6656910307641637
Energy: 0.6114240930973498
Energy: 0.5578803349184355
Energy: 0.6674397333561441
Energy: 0.6462047043814706
Energy: 0.5102521705744829
Energy: 0.565432233270501
Energy: 0.541022521483067
Energy: 0.5382670562899904
Energy: 0.5132916128936637
Energy: 0.5428294486288295
Energy: 0.5399862276896621
Energy: 0.8271227711404943
Energy: 0.7160935232327844
Energy: 0.7142393255013474
Energy: 0.8281438842790165
Energy: 0.7157703457893732
Energy: 0.635872444684585
Energy: 0.8358066623458849
Energy: 0.5472189129033828
Energy: 0.5404357754800455
Energy: 0.48957386871156
Energy: 0.5278965326472962
Energy: 0.5381251870928976
Energy: 0.658801252138129
Energy: 0.6474045682363038
Energy: 0.7452176115490524
Energy: 0.6500381266197838
Energy: 0.7378743946034865
Energy: 0.7451917438323198
Energy: 0.8470578196989401
Energy: 0.5340820634549669
Energy: 0.5403382063150385
Energy: 0.4865876953754141
Energy: 0.5065823200804546
Energy: 0.5415369997614968
Energy: 0.6891566822107389
Energy: 0.5129410518447288
Energy: 0.5239966730836145
Energy: 0.4934336033185357
Energy: 0.47355496738352904
Energy: 0.5310521127490366
Energy: 0.5703997001532881
Energy: 0.6796511545544109
Energy: 0.6810928785831176
Energy: 0.5746619877724748
Energy: 0.6854722337992541
Energy: 0.681098245794071
Energy: 0.6874506318532887
Energy: 0.5313324517933173
Energy: 0.5302010738170155
Energy: 0.4865747512330095
Energy: 0.5419226660392149
Energy: 0.5177835417004418
Energy: 0.5791768616485852
Energy: 0.7383915911505493
Energy: 0.7367033419433813
Energy: 0.618426678123845
Energy: 0.7575308007121971
Energy: 0.5660704908659536
Energy: 0.46873459925974215
Energy: 0.5230560751778941
Energy: 0.5206883991582143
Energy: 0.4691214487104417
Energy: 0.5095408851836966
Energy: 0.5134333365817833
Energy: 0.5430090711705233
Energy: 0.5921592733153042
Energy: 0.5427483745383491
Energy: 0.5439130619089675
Energy: 0.5730472049833056
Energy: 0.5426821201766553
Energy: 0.5350348877479489
Energy: 0.4807967165520221
Energy: 0.5019482142800967
Energy: 0.5354729322634099
Energy: 0.47874138660498705
Energy: 0.49962342283696465
Energy: 0.8823949696835157
Energy: 0.4841681752774995
Energy: 0.5183524887118707
Energy: 0.6417741606747109
Energy: 0.48009014663202654
Energy: 0.5284946139304412

minimum gb energy = 0.46228577419031236 eV
minimum distance =  2.73333425606314 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.8480341982381393
Energy: 0.9891222644118409
Energy: 0.9890288972608123
Energy: 0.7337218305246506
Energy: 0.662524973454375
Energy: 0.7338341156203733
Energy: 0.5326010117108504
Energy: 0.545392010427317
Energy: 0.530289297859183
Energy: 0.522708423855787
Energy: 0.5203827810216508
Energy: 0.5395887080454856
Energy: 0.5218389336430052
Energy: 0.5308123797107952
Energy: 0.5341697763665576
Energy: 0.5302245602202479
Energy: 0.5302193087063696
Energy: 0.5322588522171446
Energy: 0.5217300057433829
Energy: 0.5348603100314949
Energy: 0.5380746483998055
Energy: 0.5312994728092603
Energy: 0.5311822385310971
Energy: 0.5286379951522064
Energy: 0.5181846856616978
Energy: 0.5268927836147823
Energy: 0.5267480562143768
Energy: 0.5312014246484272
Energy: 0.6924474962214568
Energy: 0.5435929054419727
Energy: 0.572672825457033
Energy: 0.6232528590627174
Energy: 0.6166970835538366
Energy: 0.5288955237073701
Energy: 0.6149174093685228
Energy: 0.6172408289788589
Energy: 0.5759120392476751
Energy: 0.5314899359426725
Energy: 0.5302965980732991
Energy: 0.521005045256701
Energy: 0.5301686811826822
Energy: 0.5297865970112798
Energy: 0.5346834632335103
Energy: 0.637368219523873
Energy: 0.6379888992298187
Energy: 0.5495201892049487
Energy: 0.6374723638437256
Energy: 0.5042799977291534
Energy: 0.574260613626611
Energy: 0.5300059198321218
Energy: 0.5336573513914153
Energy: 0.5472812989624627
Energy: 0.5339050131686826
Energy: 0.5370002277027478
Energy: 0.6718615321489175
Energy: 0.6359206803285291
Energy: 0.6385026383887491
Energy: 0.6141604550866246
Energy: 0.635945975529441
Energy: 0.53675184706105
Energy: 0.6721222937584427
Energy: 0.5400279550478494
Energy: 0.538988329255252
Energy: 0.6142493562945789
Energy: 0.5315847928614326
Energy: 0.5343813591403145
Energy: 0.8418019103326878
Energy: 0.502246645436017
Energy: 0.5037077877020427
Energy: 0.6390455861103688
Energy: 0.49944185746269487
Energy: 0.539160600370255
Energy: 0.635823370510422
Energy: 0.5039101744810504
Energy: 0.6462027880245248
Energy: 0.647132088533325
Energy: 0.7341806452022998
Energy: 0.6459956987922758
Energy: 0.5150971360627045
Energy: 0.5370138208785089
Energy: 0.5375151012951771
Energy: 0.5179677830610153
Energy: 0.5322982039838172
Energy: 0.5339573412975859
Energy: 0.6286903172609956
Energy: 0.6245188320328812
Energy: 0.6624479029926544
Energy: 0.6290822234978446
Energy: 0.6177304948658265
Energy: 0.6312327585200146
Energy: 0.5199981221147932
Energy: 0.5338341968692193
Energy: 0.5297956407489459
Energy: 0.5334390940801549
Energy: 0.5215144523959618
Energy: 0.5302320869217322
Energy: 0.8095859160794321
Energy: 0.5167417213188576
Energy: 0.4983454305408609
Energy: 0.7245102157506067
Energy: 0.517266721280063
Energy: 0.7301761272990239
Energy: 0.529006653082673
Energy: 0.5347807386876412
Energy: 0.5421577901240007
Energy: 0.5054608800134416
Energy: 0.5190014251335102
Energy: 0.506787799669456
Energy: 0.5213097441291583
Energy: 0.5327628757186148
Energy: 0.530983943476785
Energy: 0.5306470273375806
Energy: 0.5320007212161909
Energy: 0.5293958324345758
Energy: 0.5216702708963394
Energy: 0.5314177499825248
Energy: 0.5280056437456468
Energy: 0.5318576657135863
Energy: 0.5317686050885592
Energy: 0.5310377143935292
Energy: 0.5205096202386661
Energy: 0.529848981296187
Energy: 0.5446318921160079
Energy: 0.5199056386782557
Energy: 0.5315531958022557
Energy: 0.5315558039799952
Energy: 0.9337853419427316
Energy: 0.6161290096028095
Energy: 0.6129576249772304
Energy: 0.8712749627183488
Energy: 0.6130847897359716
Energy: 0.6131567316641382
Energy: 0.5746097598337483
Energy: 0.5294676034042648
Energy: 0.5303057693538363
Energy: 0.5325327795246614
Energy: 0.5326073241758058
Energy: 0.5305667514106657
Energy: 0.5339316235736098
Energy: 0.6220273066658564
Energy: 0.6256457086738296
Energy: 0.5502349263317546
Energy: 0.6226461262799209
Energy: 0.5047577963105988
Energy: 0.5756104069544271
Energy: 0.5302692201164778
Energy: 0.5294662330467204
Energy: 0.5403216850933696
Energy: 0.5331342017060103
Energy: 0.5372993529949587
Energy: 0.7332079737658365
Energy: 0.5339480688474385
Energy: 0.5382974839416889
Energy: 0.6142299439489749
Energy: 0.5279029229211045
Energy: 0.5352095094241788
Energy: 0.6714654343548558
Energy: 0.6371307460466179
Energy: 0.535228708641368
Energy: 0.6140878250881523
Energy: 0.648541235181365
Energy: 0.5413395248632048
Energy: 0.7336796285984928
Energy: 0.503779339258783
Energy: 0.5346044405593928
Energy: 0.5288577661165154
Energy: 0.5110608036258663
Energy: 0.5382222879601436
Energy: 0.6281680765858397
Energy: 0.7392165882462404
Energy: 0.7390616268522702
Energy: 0.6348195786985845
Energy: 0.7328312224594433
Energy: 0.7390339336679151
Energy: 0.5155938433358338
Energy: 0.5372767007763123
Energy: 0.5368715366238315
Energy: 0.5181001006750968
Energy: 0.5312975900211421
Energy: 0.5339906107182976
Energy: 0.6362580576648994
Energy: 0.6262129629052602
Energy: 0.629995923058022
Energy: 0.6360095019189131
Energy: 0.6500370555269044
Energy: 0.6281353601459814
Energy: 0.5201687365320062
Energy: 0.5355709793994209
Energy: 0.5336181909470382
Energy: 0.5297755571183466
Energy: 0.5301626771889081
Energy: 0.5295507556320969
Energy: 0.8713607132168738
Energy: 0.5206524589634783
Energy: 0.5055686575449809
Energy: 0.7246491901144243
Energy: 0.5218451961807388
Energy: 0.5049739174510532

minimum gb energy = 0.4983454305408609 eV
minimum distance =  2.75897195252056 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.7050807448845642
Energy: 0.8919026120417426
Energy: 0.8917086274389797
Energy: 0.5520799592928446
Energy: 0.5834314011261038
Energy: 0.8921181845834384
Energy: 0.5930327980844856
Energy: 0.564451278797757
Energy: 0.5785458741419754
Energy: 0.5468387083638416
Energy: 0.573369625044006
Energy: 0.5863147644140074
Energy: 0.5740904226254224
Energy: 0.5705933802306992
Energy: 0.5680650430645957
Energy: 0.5751293088543096
Energy: 0.5741997651997535
Energy: 0.565709629367048
Energy: 0.5739486299056614
Energy: 0.5764271387795805
Energy: 0.5696270914785113
Energy: 0.5757313717191508
Energy: 0.5784539875190552
Energy: 0.5676411587330752
Energy: 0.5727461751681859
Energy: 0.5449464229660953
Energy: 0.5598106128513668
Energy: 0.572517871967045
Energy: 0.5476434925577311
Energy: 0.5685595179863674
Energy: 0.7408229651146454
Energy: 0.5471744571090027
Energy: 0.5501133659528683
Energy: 0.572440300755209
Energy: 0.5485711955261329
Energy: 0.550788686403203
Energy: 0.5969070143085471
Energy: 0.5515266993928601
Energy: 0.5518920670427774
Energy: 0.5727405683365991
Energy: 0.5527848938393541
Energy: 0.5660397546096754
Energy: 0.595703388395011
Energy: 0.7525329244431509
Energy: 0.5480602733736937
Energy: 0.5502844935820148
Energy: 0.7685705799319771
Energy: 0.5480418401451197
Energy: 0.5962167233894599
Energy: 0.5479407348557305
Energy: 0.5551383920101234
Energy: 0.5800212671800864
Energy: 0.5474788336637428
Energy: 0.558064521375746
Energy: 0.8082728395491786
Energy: 0.5490728782248561
Energy: 0.5493962217449667
Energy: 0.5591361030197085
Energy: 0.5482681612029477
Energy: 0.5540814770093877
Energy: 0.5968583043570681
Energy: 0.5765672441941038
Energy: 0.5739017496094149
Energy: 0.5810135314660247
Energy: 0.5808306061732801
Energy: 0.5661574554417795
Energy: 0.7336366321106397
Energy: 0.5468467201223969
Energy: 0.5491245817880526
Energy: 0.5717799029900396
Energy: 0.5500922181409348
Energy: 0.5668258757425076
Energy: 0.5736542752474084
Energy: 0.5490148825281658
Energy: 0.5520217627488346
Energy: 0.5732737025074516
Energy: 0.5513671078797474
Energy: 0.5526801249891755
Energy: 0.572683957152824
Energy: 0.5725137056335701
Energy: 0.5701149859458393
Energy: 0.5736014039697173
Energy: 0.5830292749506619
Energy: 0.5654341939537367
Energy: 0.5694931964714065
Energy: 0.5680077286220231
Energy: 0.5673994243717096
Energy: 0.5909451769622238
Energy: 0.5698951212623337
Energy: 0.5637928144528576
Energy: 0.5706503616085302
Energy: 0.5782790558207832
Energy: 0.5658547056612759
Energy: 0.5805816652424407
Energy: 0.5738604365242936
Energy: 0.5661499064353284
Energy: 0.7883708522302498
Energy: 0.5738142301275477
Energy: 0.5463563528021785
Energy: 0.5487046382831032
Energy: 0.5736118261929545
Energy: 0.5432872628602472
Energy: 0.5933302299075508
Energy: 0.5986179142759981
Energy: 0.5535544285190732
Energy: 0.5535471070172336
Energy: 0.572128735933063
Energy: 0.5594905292022406
Energy: 0.5742974645403418
Energy: 0.5500301283426277
Energy: 0.5481960076962534
Energy: 0.5745001916651703
Energy: 0.552419017966095
Energy: 0.5690600782847137
Energy: 0.5499575947275224
Energy: 0.5500018223561604
Energy: 0.5473762782928798
Energy: 0.5498200102815674
Energy: 0.552346469526786
Energy: 0.5530567970293611
Energy: 0.5470754984282354
Energy: 0.57534130557925
Energy: 0.5576490380997597
Energy: 0.5478610133813675
Energy: 0.5794402742679275
Energy: 0.5563403368264981
Energy: 0.7207497935683881
Energy: 0.5532281285341691
Energy: 0.7262296962204596
Energy: 0.7205933502641916
Energy: 0.5593104556023558
Energy: 0.5541028227897922
Energy: 0.5718593271963052
Energy: 0.5680711237461138
Energy: 0.5659455805710255
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Energy: 0.5739530960849021
Energy: 0.5519872249934149
Energy: 0.5994055385114684
Energy: 0.5732221169274963
Energy: 0.7213909775157797
Energy: 0.5578753790256381
Energy: 0.7422167568811668
Energy: 0.888399819560318
Energy: 0.5941787868715523
Energy: 0.5772085247492326
Energy: 0.5790648391370551
Energy: 0.5432095541080683
Energy: 0.573940077071402
Energy: 0.590561058092323
Energy: 0.5740702657464778
Energy: 0.5716564233457699
Energy: 0.5682211546482023
Energy: 0.575584226746124
Energy: 0.5748955363982408
Energy: 0.5656237680480016
Energy: 0.5741267609743719
Energy: 0.567364978452565
Energy: 0.5661947238095371
Energy: 0.5755141702850812
Energy: 0.5756132067345103
Energy: 0.5682438910636386
Energy: 0.5727654132272566
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Energy: 0.5675456783228604
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Energy: 0.5529759281528042
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Energy: 0.5481106217158049
Energy: 0.568651404331203
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Energy: 0.5467509187797287
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Energy: 0.6046682465693458
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Energy: 0.558720372673552
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Energy: 0.5656841472883685
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Energy: 0.5776713054578165
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Energy: 0.5799983159374429
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Energy: 0.5656073275414637
Energy: 0.7882672789661328
Energy: 0.5776172923390083
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Energy: 0.5935274596003419
Energy: 0.5536126256700468
Energy: 0.5476358727607198
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Energy: 0.5729150434755089
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Energy: 0.5482116310902198
Energy: 0.5810811291274461
Energy: 0.5521656988865103
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Energy: 0.5492981882715093
Energy: 0.5500253286646452
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Energy: 0.5489425688408497
Energy: 0.5523812275643513
Energy: 0.5466843640660195
Energy: 0.5461904717262559
Energy: 0.558707505072458
Energy: 0.5582888813126397
Energy: 0.5464591724912023
Energy: 0.5573006656561437
Energy: 0.5565302192645015
Energy: 0.7258856856181243
Energy: 0.5532380680295881
Energy: 0.726298289822293
Energy: 0.7259291616094833
Energy: 0.5593746723113073
Energy: 0.7272918378782688
Energy: 0.5714254055220096
Energy: 0.5830320981996212
Energy: 0.5659605554918081
Energy: 0.5488631366312279
Energy: 0.5776203560992909
Energy: 0.5534335323004389
Energy: 1.017093784216867
Energy: 0.5747309350947987
Energy: 0.5479035928997122
Energy: 0.5479279030082204
Energy: 0.7433203341965507
Energy: 0.5503639124172944

minimum gb energy = 0.5432095541080683 eV
minimum distance =  2.73580968914998 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.8115643965289306
Energy: 0.5788174945445649
Energy: 0.578692489339951
Energy: 0.5794372801182849
Energy: 0.6417141787471106
Energy: 0.5789991416667831
Energy: 0.7304134645468838
Energy: 0.6158341487509258
Energy: 0.6143800344562207
Energy: 0.7030313479342116
Energy: 0.6301745190140603
Energy: 0.6103064835484043
Energy: 0.6571965337582956
Energy: 0.5787999612694429
Energy: 0.6202708218462396
Energy: 0.6356740576955441
Energy: 0.5784594805374775
Energy: 0.6221599425234476
Energy: 0.6312122358390531
Energy: 0.616666516240628
Energy: 0.6316505916769108
Energy: 0.6194863695009087
Energy: 0.6342757868127374
Energy: 0.6339389382476932
Energy: 0.6482134916826243
Energy: 0.6190767483456601
Energy: 0.6344581884396325
Energy: 0.6469994119175255
Energy: 0.6193067899247818
Energy: 0.636661328866708
Energy: 0.6409216486056414
Energy: 0.6040432719117992
Energy: 0.6275294414595683
Energy: 0.6409136729677345
Energy: 0.6025968215692654
Energy: 0.6321659920054759
Energy: 0.7305993496585178
Energy: 0.6181073498129728
Energy: 0.616606175847994
Energy: 0.64458126688436
Energy: 0.6252201418413387
Energy: 0.6136882105422142

minimum gb energy = 0.5784594805374775 eV
minimum distance =  2.75012479126816 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.8532937464084914
Energy: 0.8566878963318698
Energy: 0.7584797101540236
Energy: 0.7858447170039412
Energy: 0.8631986177905755
Energy: 0.7697828209917011
Energy: 0.69808708301061
Energy: 0.6864516347230288
Energy: 0.6923094420071753
Energy: 0.709884764520978
Energy: 0.7045887357982997
Energy: 0.6889056253929666
Energy: 0.7341648371954745
Energy: 0.7101639471834248
Energy: 0.716564550626453
Energy: 0.7325653658813325
Energy: 0.7081456588769004
Energy: 0.7243361149933715
Energy: 0.6889577779709964
Energy: 0.6946091502885073
Energy: 0.6912650170326958
Energy: 0.689432342060749
Energy: 0.7028391959092251
Energy: 0.6827075168281356
Energy: 0.6844464573809198
Energy: 0.6999073836109457
Energy: 0.6990981268529879
Energy: 0.6854349645402822
Energy: 0.6985190333425165
Energy: 0.7013276692062338
Energy: 0.7218647776826342
Energy: 0.7053416194928586
Energy: 0.709176644284606
Energy: 0.7064112323334762
Energy: 0.7051623825617036
Energy: 0.7039067335195167
Energy: 0.6724218604224801
Energy: 0.6935732829560042
Energy: 0.6957228490114671
Energy: 0.7216649617761017
Energy: 0.7128548057542403
Energy: 0.7042278309492495
Energy: 0.9449268258838845
Energy: 0.7821750652493494
Energy: 0.7896502827925203
Energy: 0.7405395319264936
Energy: 0.892058700524673
Energy: 0.7448535360792363
Energy: 0.7399570555634248
Energy: 0.6938963809326377
Energy: 0.6951453530598843
Energy: 0.7475416897357656
Energy: 0.7120902558847659
Energy: 0.7087791889770525
Energy: 0.8419171234469247
Energy: 0.7217689967128599
Energy: 0.7214594517957705
Energy: 0.77943568858878
Energy: 0.6919790135890932
Energy: 0.7055329588370112
Energy: 0.7475497746391258
Energy: 0.6937595653782618
Energy: 0.7060008536087178
Energy: 0.7433241704928271
Energy: 0.7086628965674487
Energy: 0.6980898329367174
Energy: 0.7364264954073694
Energy: 0.7045737449006139
Energy: 0.6944297123697328
Energy: 0.7019969484925525
Energy: 0.7031886932914623
Energy: 0.6962334196886435
Energy: 0.6882334877813793
Energy: 0.6970539097345192
Energy: 0.6979915988845127
Energy: 0.6954990298512462
Energy: 0.6972347446029957
Energy: 0.7003139017597281
Energy: 0.7206211290961644
Energy: 0.6721163159147613
Energy: 0.6823654539596463
Energy: 0.7073196583323499
Energy: 0.6864961589714208
Energy: 0.6823305313265458
Energy: 0.8587831594518883
Energy: 0.7428487986529319
Energy: 0.7520376143552576
Energy: 0.7071430844224469
Energy: 0.7439485853429114
Energy: 0.7295442196618356
Energy: 0.8037864451124697
Energy: 0.6770736468565165
Energy: 0.6850090136862074
Energy: 0.7522416677006577
Energy: 0.7010224591239427
Energy: 0.6795213553520321
Energy: 0.8536013654933571
Energy: 0.7364116563312375
Energy: 0.7660679021806838
Energy: 0.8546345135566262
Energy: 0.6866125562018176
Energy: 0.7930896624065155
Energy: 0.7255125071944364
Energy: 0.7027674960427156
Energy: 0.6936014718371135
Energy: 0.7040261551128015
Energy: 0.7376685007837754
Energy: 0.6946996806238922
Energy: 0.7055524578798538
Energy: 0.7342367107645035
Energy: 0.6856924828109932
Energy: 0.6870337078779087
Energy: 0.7212716853002876
Energy: 0.6802100623656958
Energy: 0.7490064160483104
Energy: 0.6973397995081762
Energy: 0.6819891958303644
Energy: 0.6885887914506983
Energy: 0.6965214338948609
Energy: 0.6890422871525727
Energy: 0.716586259380433
Energy: 0.6925001855286546
Energy: 0.6949140784870066
Energy: 0.6937714126615251
Energy: 0.6842822397113819
Energy: 0.6939744352480499
Energy: 0.7511284238713997
Energy: 0.7042632281456616
Energy: 0.6977659071030937
Energy: 0.6964876950065017
Energy: 0.7122836768134536
Energy: 0.6976848172374579
Energy: 0.7085080927268304
Energy: 0.6908386479290086
Energy: 0.6901341461044208
Energy: 0.7097619262079182
Energy: 0.7015935186910986
Energy: 0.6942241575791129
Energy: 0.6915877441967421
Energy: 0.7341849903633372
Energy: 0.7349255222327942
Energy: 0.7068160620399536
Energy: 0.6763517782292255
Energy: 0.7171562869372655
Energy: 0.7062991929680159
Energy: 0.6919000140009026
Energy: 0.7079259362463881
Energy: 0.7108468618867646
Energy: 0.7031816788055825
Energy: 0.7068759403594702
Energy: 0.7793410041009032
Energy: 0.6739749711945108
Energy: 0.6848369216699204
Energy: 0.6761686309513831
Energy: 0.6805747465391419
Energy: 0.702608557562906
Energy: 0.6620453264173279
Energy: 0.679923282599546
Energy: 0.6814989614830816
Energy: 0.6868691265606005
Energy: 0.6753233550510691
Energy: 0.7084494108839854
Energy: 0.7078391531262269
Energy: 0.703346711528524
Energy: 0.7031529047632524
Energy: 0.7080818434913957
Energy: 0.7054231216969281
Energy: 0.7069678823915679
Energy: 0.7210642602844657
Energy: 0.7163258219180206
Energy: 0.7240625664190941
Energy: 0.7136645926330728
Energy: 0.7092280819209335
Energy: 0.7174491479131946
Energy: 0.685949144324726
Energy: 0.7003140769442406
Energy: 0.6860177137461758
Energy: 0.6891824215025247
Energy: 0.6847366423972174
Energy: 0.6841087098159655
Energy: 0.7367189867742586
Energy: 0.7162364039380815
Energy: 0.715033779096837
Energy: 0.713826233447603
Energy: 0.7259545546792103
Energy: 0.7161808402206795
Energy: 0.7036506042309685
Energy: 0.7114265683221717
Energy: 0.7048801342619999
Energy: 0.6995083677894186
Energy: 0.6972890587133626
Energy: 0.7034595354689731
Energy: 0.7913593530272337
Energy: 0.7307054146582111
Energy: 0.6932255770171832
Energy: 0.698414390348268
Energy: 0.721030131404791
Energy: 0.6999548258416013
Energy: 0.6777317692484955
Energy: 0.6924189683821226
Energy: 0.6938406594592833
Energy: 0.6835572697905455
Energy: 0.7009357473674718
Energy: 0.6941147614848764
Energy: 0.7257744563004834
Energy: 0.7026863933803572
Energy: 0.7041381575626394
Energy: 0.7131657423224824
Energy: 0.706695634854321
Energy: 0.7030238816349486
Energy: 0.7235747795230176
Energy: 0.6997312162410877
Energy: 0.7361698952055825
Energy: 0.7553429012230002
Energy: 0.6919007503251914
Energy: 0.704934508726547
Energy: 0.7486326380748526
Energy: 0.6905377191430248
Energy: 0.6916443457812713
Energy: 0.7504230537207061
Energy: 0.6930636942128308
Energy: 0.6930174577477375
Energy: 0.8033868238409112
Energy: 0.7052629292665735
Energy: 0.7085748053497599
Energy: 0.6966616857661869
Energy: 0.7050614588435717
Energy: 0.7111343569684739
Energy: 0.7212059393510268
Energy: 0.6754243718877285
Energy: 0.6701545469379054
Energy: 0.7062563321380804
Energy: 0.6728605797506445
Energy: 0.692614165968905
Energy: 0.7048130537916378
Energy: 0.7100054018401498
Energy: 0.7124439091899618
Energy: 0.7143067729940354
Energy: 0.708756505126908
Energy: 0.6887860709391616
Energy: 0.7411680663704028
Energy: 0.6981962237790806
Energy: 0.6841074449707938
Energy: 0.7029735494978279
Energy: 0.742043686503301
Energy: 0.6868278744881342
Energy: 0.7525667976760965
Energy: 0.7006538326813707
Energy: 0.6927285227550727
Energy: 0.7398822399585601
Energy: 0.6830841445917221
Energy: 0.6874464398869393
Energy: 0.8399416160076383
Energy: 0.6989758434867214
Energy: 0.7145498862885061
Energy: 0.8292076370766924
Energy: 0.6985276901737211
Energy: 0.6902029537172945
Energy: 0.8106018938990314
Energy: 0.6856098107311646
Energy: 0.6872235097867102
Energy: 0.8033879027288854
Energy: 0.7071772845484459
Energy: 0.6878167078945063
Energy: 0.7893012087566691
Energy: 0.7371846471488626
Energy: 0.7659866096222404
Energy: 0.7342716440075543
Energy: 0.7364482293873144
Energy: 0.7658565644133182
Energy: 0.7023253020442349
Energy: 0.6872706995732212
Energy: 0.6897138293413875
Energy: 0.6901449142559238
Energy: 0.7072197510754412
Energy: 0.6839462027212729
Energy: 0.7511502818235075
Energy: 0.6888660312792303
Energy: 0.6890635059625226
Energy: 0.693173743973528
Energy: 0.690696087892472
Energy: 0.689835489684534
Energy: 0.7066721980772206
Energy: 0.6896830631736306
Energy: 0.6902987752044257
Energy: 0.6959191111668606
Energy: 0.686792485923734
Energy: 0.6884883131246973
Energy: 0.7077124634940022
Energy: 0.6829102618982312
Energy: 0.6889215611914723
Energy: 0.7084180438234094
Energy: 0.6763985733916591
Energy: 0.6985865546747174
Energy: 0.7374012000257149
Energy: 0.680268102571227
Energy: 0.701012589599135
Energy: 0.7352290495143241
Energy: 0.683526368138794
Energy: 0.6987464437802785
Energy: 0.6897220678296125
Energy: 0.6860797642181535
Energy: 0.6918033357659933
Energy: 0.7408815657787969
Energy: 0.7390446844090822
Energy: 0.684064348353317

minimum gb energy = 0.6620453264173279 eV
minimum distance =  2.72201893521827 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.1241318309930322
Energy: 0.8020915179587602
Energy: 0.8027444057641727
Energy: 0.8071655158754273
Energy: 0.7862976714648421
Energy: 0.8045213093838307
Energy: 0.656569032640021
Energy: 0.6759524559699995
Energy: 0.6756159013363859
Energy: 0.6946404587277741
Energy: 0.6770628266993076
Energy: 0.6780242918874941
Energy: 0.76211977515027
Energy: 0.6692114114868176
Energy: 0.6681609723150205
Energy: 0.7368680047711264
Energy: 0.6693698407402747
Energy: 0.6877382119385818
Energy: 0.6917012601927426
Energy: 0.6678463926732786
Energy: 0.689389386962117
Energy: 0.691777988548871
Energy: 0.6680280208422746
Energy: 0.6893647802455387
Energy: 0.6998627741716464
Energy: 0.6800237153277476
Energy: 0.6790193576633613
Energy: 0.6916927100525597
Energy: 0.6876027231423792
Energy: 0.6783571183674099
Energy: 0.7512984910255411
Energy: 0.6828210706261467
Energy: 0.6830145290686233
Energy: 0.730443888137897
Energy: 0.6843850473047687
Energy: 0.6879725932088536
Energy: 0.7090619526629228
Energy: 0.6694845823901554
Energy: 0.6705584939018396
Energy: 0.7002549894139786
Energy: 0.6727541907361357
Energy: 0.6801799892405874
Energy: 0.7066228115618532
Energy: 0.7611302903243047
Energy: 0.7640750119666384
Energy: 0.6813649632714032
Energy: 0.83030710665936
Energy: 0.7233147019295715
Energy: 0.8367025771953802
Energy: 0.6880448093377429
Energy: 0.6780622173563096
Energy: 0.7032615047571904
Energy: 0.6900691449024388
Energy: 0.7101351886264518
Energy: 0.7517231953676636
Energy: 0.660802567162824
Energy: 0.6607037327480584
Energy: 0.7458194001162317
Energy: 0.6608883300742635
Energy: 0.706893285472361
Energy: 0.6960048147580088
Energy: 0.6468829373791526
Energy: 0.632681435521512
Energy: 0.6899029078716691
Energy: 0.6519457931347766
Energy: 0.6629268048308029
Energy: 0.6737390427635529
Energy: 0.6780915150716121
Energy: 0.6820466185024112
Energy: 0.6769764388371472
Energy: 0.6781193384584172
Energy: 0.6832496825967795
Energy: 0.7359906891439756
Energy: 0.691117637118039
Energy: 0.6827934737122728
Energy: 0.6693486106089301
Energy: 0.6907107065096891
Energy: 0.6690801107376275
Energy: 0.6878598431064957
Energy: 0.6800274039370118
Energy: 0.6848033087106344
Energy: 0.7023560289618124
Energy: 0.697594699270027
Energy: 0.692578857410641
Energy: 0.688657876807016
Energy: 0.7579375753663038
Energy: 0.7606548709333767
Energy: 0.6871511547111421
Energy: 0.7559687560656623
Energy: 0.688755660299604
Energy: 0.6876866735784676
Energy: 0.7004855741240144
Energy: 0.7081493979161416
Energy: 0.6883102062968335
Energy: 0.6987727533052972
Energy: 0.708703649358706
Energy: 0.760142490220019
Energy: 0.7235815670339666
Energy: 0.7240383530078349
Energy: 0.7603214092357129
Energy: 0.7220278838341551
Energy: 0.724275222133047
Energy: 0.6609690876113083
Energy: 0.6884689010816667
Energy: 0.7005655813668665
Energy: 0.7077358883032757
Energy: 0.6927082151164636
Energy: 0.7033058548420152
Energy: 0.6312662291223704
Energy: 0.6946772171513952
Energy: 0.6605855281561951
Energy: 0.6349255840402999
Energy: 0.7249489229416499
Energy: 0.6595945517763958
Energy: 0.6312781276926175
Energy: 0.6946953291737961
Energy: 0.6602498349451119
Energy: 0.6558138783419788
Energy: 0.7050419608157318
Energy: 0.6475940943927425
Energy: 0.661052962957379
Energy: 0.685922244304164
Energy: 0.700073887695954
Energy: 0.702621406225436
Energy: 0.6792584087188945
Energy: 0.7009124076537986
Energy: 0.7127773662752759
Energy: 0.6682211764730243
Energy: 0.666857219423605
Energy: 0.6901197858999824
Energy: 0.6698318208941441
Energy: 0.6690008569071719
Energy: 0.6983150118864045
Energy: 0.6913962590848761
Energy: 0.6920230429678702
Energy: 0.6994957092093892
Energy: 0.693593312507007
Energy: 0.6810950155498983
Energy: 0.6999955162105601
Energy: 0.7059666006454545
Energy: 0.6999984589048076
Energy: 0.7042960915843286
Energy: 0.6956597166794171
Energy: 0.7032021900853881
Energy: 0.7328294929398177
Energy: 0.6907648252321815
Energy: 0.6934998400728722
Energy: 0.6889301583536335
Energy: 0.697527063100584
Energy: 0.6925813799391717
Energy: 0.8485340217136697
Energy: 0.6803372023468967
Energy: 0.6822821154684436
Energy: 0.668979850519599
Energy: 0.6885805742734826
Energy: 0.6815993319659013
Energy: 0.6823748475335375
Energy: 0.6833484419626839
Energy: 0.6864460379814542
Energy: 0.6700583915345426
Energy: 0.6782311938038289
Energy: 0.6823717214404904
Energy: 0.7061670216664413
Energy: 0.646883052663682
Energy: 0.662813775894851
Energy: 0.6715770028655932
Energy: 0.633545538310508
Energy: 0.6654758748551752
Energy: 0.7493303812723479
Energy: 0.6608522097961146
Energy: 0.7092419517642198
Energy: 0.685466258654791
Energy: 0.6609015252196668
Energy: 0.7515137808179846
Energy: 0.7222633493638264
Energy: 0.6765433722073455
Energy: 0.6785036979902542
Energy: 0.7018485395814857
Energy: 0.6883324032809068
Energy: 0.6707705192996606
Energy: 0.7368336121090648
Energy: 0.682047400413724
Energy: 0.6889985954807799
Energy: 0.6700424644808602
Energy: 0.6988098003422482
Energy: 0.6685728567751217
Energy: 0.7001643531900713
Energy: 0.666013384843731
Energy: 0.6747736530974338
Energy: 0.6928723431957124
Energy: 0.6659930396594314
Energy: 0.673857716904965
Energy: 0.7053227770494107
Energy: 0.6854904018031416
Energy: 0.6854406421222602
Energy: 0.6942475486356086
Energy: 0.6875457344854973
Energy: 0.6876420586983316
Energy: 0.6888116268418281
Energy: 0.6951123735219701
Energy: 0.6767342890524517
Energy: 0.6816415699267832
Energy: 0.6949480978952027
Energy: 0.6779970409649407
Energy: 0.6946399486959552
Energy: 0.6924655032898476
Energy: 0.6822600828003335
Energy: 0.69455291152692
Energy: 0.665696237276149
Energy: 0.6902888615688513
Energy: 0.8013427079557846
Energy: 0.7261039252707658
Energy: 0.7259449287143643
Energy: 0.8009405678396663
Energy: 0.6834128972484739
Energy: 0.7296928839729407
Energy: 0.7344323511772803
Energy: 0.6892755916851285
Energy: 0.6745257320023867
Energy: 0.6950460793092919
Energy: 0.6915127468874279
Energy: 0.6799797667122418
Energy: 0.8219948211750707
Energy: 0.7684624713983093
Energy: 0.7527653280055789
Energy: 0.690200828938934
Energy: 0.7728744957329976
Energy: 0.7511645371686801

minimum gb energy = 0.6312662291223704 eV
minimum distance =  2.72642582499438 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.8492076713625251
Energy: 0.7852720732582044
Energy: 0.7817482839487886
Energy: 0.7377504841725534
Energy: 0.8353880741619738
Energy: 0.8052981779053016
Energy: 0.7956425370481748
Energy: 0.6925691665205472
Energy: 0.6903740408556688
Energy: 0.7214233636628834
Energy: 0.6880907354993883
Energy: 0.7036806295651067
Energy: 0.684306547449337
Energy: 0.6638119658173243
Energy: 0.6663710891538676
Energy: 0.7970706377043055
Energy: 0.6702653229029938
Energy: 0.7102377455777784
Energy: 0.6817058984124919
Energy: 0.6659608579750393
Energy: 0.6760527274347344
Energy: 0.6822496336998431
Energy: 0.6739166546938887
Energy: 0.6808891395309804
Energy: 0.676379349578324
Energy: 0.6757449553221849
Energy: 0.6735026138673452
Energy: 0.6764010744109341
Energy: 0.6783346533147234
Energy: 0.6744646215217235
Energy: 0.7353151945676442
Energy: 0.6783305951167906
Energy: 0.6792975704074128
Energy: 0.6829271155648049
Energy: 0.6785380743931123
Energy: 0.6808758689303592
Energy: 0.6828260157459998
Energy: 0.6891434584242085
Energy: 0.6799724246973752
Energy: 0.6852453466535212
Energy: 0.689080457310534
Energy: 0.6794070732908021
Energy: 0.7407824611831862
Energy: 0.6832663673425863
Energy: 0.6832692672875322
Energy: 0.6967897311780294
Energy: 0.6832517389007994
Energy: 0.7112383355038685
Energy: 0.6974421809251266
Energy: 0.6898871165943442
Energy: 0.6802357183708219
Energy: 0.6911476850594205
Energy: 0.6908851945481002
Energy: 0.6806022772873568
Energy: 0.8020451632836846
Energy: 0.6769867915157516
Energy: 0.7076465739828978
Energy: 0.6903771796116196
Energy: 0.6774888582444359
Energy: 0.7295028161347911
Energy: 0.6561066419172104
Energy: 0.7084928978491035
Energy: 0.6860256406649168
Energy: 0.6911470085417476
Energy: 0.6806421872275923
Energy: 0.6905272348861703
Energy: 0.7270634272136184
Energy: 0.6932919625088756
Energy: 0.6840243454842341
Energy: 0.657383763177083
Energy: 0.7237416924204915
Energy: 0.6841423751648276
Energy: 0.7237887859908061
Energy: 0.7118252430302889
Energy: 0.6927098575514421
Energy: 0.6635216763021301
Energy: 0.7116747050486368
Energy: 0.6934572733080435
Energy: 0.6555908048385152
Energy: 0.6769254055304997
Energy: 0.6666548917837297
Energy: 0.6935988597197315
Energy: 0.6881337579208746
Energy: 0.6664728334968997
Energy: 0.6603975364352536
Energy: 0.7001280994958573
Energy: 0.6948178384977167
Energy: 0.6942106106121936
Energy: 0.6780964138629475
Energy: 0.6962186823615077
Energy: 0.6619057761333521
Energy: 0.6666966951659828
Energy: 0.6594894350728567
Energy: 0.6622438149504452
Energy: 0.70136343015667
Energy: 0.6568095684230342
Energy: 0.6628636798931962
Energy: 0.6624501014565917
Energy: 0.6642624898591969
Energy: 0.6670558343280367
Energy: 0.7006092045350664
Energy: 0.6620408987742008
Energy: 0.6629163228633034
Energy: 0.659698532665834
Energy: 0.6601322704857999
Energy: 0.715722310508386
Energy: 0.6900177093200197
Energy: 0.6906042597551123
Energy: 0.7570624660015222
Energy: 0.7212312728840281
Energy: 0.6903899005226243
Energy: 0.7067703352671162
Energy: 0.7199947556691485
Energy: 0.7087724662148058
Energy: 0.7757085865954748
Energy: 0.7209600361167054
Energy: 0.6911141032307979
Energy: 0.6931066016712956
Energy: 0.7204914396889164
Energy: 0.6787116735426074
Energy: 0.7337330161810572
Energy: 0.6602920391314405
Energy: 0.7302279307308097
Energy: 0.6907609854963981
Energy: 0.7136060500054702
Energy: 0.6907152377056031
Energy: 0.7520913993513032
Energy: 0.6921354557485304
Energy: 0.7045622088598845
Energy: 0.7526029996194049
Energy: 0.7461771788032255
Energy: 0.764212625580086
Energy: 0.7344805392181494
Energy: 0.6591468497702656
Energy: 0.6599608970055458
Energy: 0.6898610380500437
Energy: 0.7206939294096321
Energy: 0.6594625586157155
Energy: 0.7485435960139877
Energy: 0.7222760125938492
Energy: 0.7250966436260998
Energy: 0.7067303925291446
Energy: 0.6656213034562128
Energy: 0.6903007828080667
Energy: 0.7246195274875272
Energy: 0.6602675428327651
Energy: 0.6641197270730014
Energy: 0.6857163858852539
Energy: 0.660352360835451
Energy: 0.6644720600306591
Energy: 0.7262757544571294
Energy: 0.6653530441420044
Energy: 0.6670723456693438
Energy: 0.701954219273795
Energy: 0.6554718593911538
Energy: 0.6709186319907721
Energy: 0.7255806570315242
Energy: 0.6891017941705322
Energy: 0.6984019981666229
Energy: 0.6784181995411726
Energy: 0.69077291237726
Energy: 0.7018403853514865
Energy: 0.7112134981689783
Energy: 0.661616436916886
Energy: 0.6797321882096503
Energy: 0.6831380711904694
Energy: 0.6720282571056112
Energy: 0.682262357594387
Energy: 0.8409412550751182
Energy: 0.7072525869095155
Energy: 0.7189773419347474
Energy: 0.8408478104123568
Energy: 0.69298876785453
Energy: 0.7244062769252593
Energy: 0.7635852476144163
Energy: 0.6861816881969597
Energy: 0.6675303018240543
Energy: 0.6810885926342931
Energy: 0.6888181490202866
Energy: 0.6799975641100102
Energy: 0.7301961449755525
Energy: 0.7363596236592092
Energy: 0.7488926799409755
Energy: 0.6937564478369802
Energy: 0.7283521995471437
Energy: 0.6649579315998508

minimum gb energy = 0.6554718593911538 eV
minimum distance =  2.75356223375502 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.7814257394949855
Energy: 0.6996682152654214
Energy: 0.6995107314800886
Energy: 0.6860400079618125
Energy: 0.7150627316494281
Energy: 0.6998711325098136
Energy: 0.6053567695335876
Energy: 0.7094126852918612
Energy: 0.7040553132566734
Energy: 0.6758370116845569
Energy: 0.7094862666880696
Energy: 0.6443848753133089
Energy: 0.6983512858611202
Energy: 0.6754893696044041
Energy: 0.6749336889134978
Energy: 0.6888441020093599
Energy: 0.684984744242965
Energy: 0.6780108568919168
Energy: 0.6529307981402862
Energy: 0.675248173035665
Energy: 0.671927085123955
Energy: 0.6535267866456952
Energy: 0.6756036989428783
Energy: 0.6539824324041741
Energy: 0.66098629194707
Energy: 0.6501233877185315
Energy: 0.6507186400545957
Energy: 0.6608197589907995
Energy: 0.6747902914506663
Energy: 0.6744321179287702
Energy: 0.670114118159745
Energy: 0.6756342926470879
Energy: 0.6750971477298894
Energy: 0.6845765258078905
Energy: 0.6549741056573983
Energy: 0.6833465498880257
Energy: 0.6815186332675435
Energy: 0.6695312184633126
Energy: 0.6694330840372309
Energy: 0.6541152653986119
Energy: 0.6735622091860947
Energy: 0.6534830654436763
Energy: 0.6838303338659935
Energy: 0.685767444670999
Energy: 0.6865163778794621
Energy: 0.6773774183925024
Energy: 0.7723034137328108
Energy: 0.689967669014685
Energy: 0.6739794298230487
Energy: 0.704446632496829
Energy: 0.67147013810447
Energy: 0.6636166728337631
Energy: 0.7101861344073456
Energy: 0.6445017898704664
Energy: 0.7905388147832535
Energy: 0.6794935387581885
Energy: 0.6979926284734232
Energy: 0.6895606484201756
Energy: 0.6917657340448924
Energy: 0.6987066250171894
Energy: 0.659006807957248
Energy: 0.7106629766982251
Energy: 0.6564518196070183
Energy: 0.6856701270582524
Energy: 0.6679206196140772
Energy: 0.6853205008057001
Energy: 0.6013073737442528
Energy: 0.6860485681019494
Energy: 0.6874634670848873
Energy: 0.6034034284694173
Energy: 0.6864623651700426
Energy: 0.7144903689666813
Energy: 0.6032163610491107
Energy: 0.6894337647019545
Energy: 0.6964170748825873
Energy: 0.6285972948143369
Energy: 0.6881036347217582
Energy: 0.6961942358157124
Energy: 0.6581150370295847
Energy: 0.6510872908464097
Energy: 0.6734732135534688
Energy: 0.7033742892736645
Energy: 0.6624008788689891
Energy: 0.6721007421070412
Energy: 0.6557227997419769
Energy: 0.6665121180163073
Energy: 0.6648195643134668
Energy: 0.6845088882434929
Energy: 0.667299190232526
Energy: 0.664989638888167
Energy: 0.6705780879000638
Energy: 0.6388662514460474
Energy: 0.6440816001925562
Energy: 0.6719231180890541
Energy: 0.6564086565425908
Energy: 0.6636996712107048
Energy: 0.6552090985783262
Energy: 0.6745784430971515
Energy: 0.6756851780097344
Energy: 0.6762821150286698
Energy: 0.6755883063038436
Energy: 0.6747993216328603
Energy: 0.6633967322663284
Energy: 0.6536421054578777
Energy: 0.6578381751315302
Energy: 0.6755337723489185
Energy: 0.6609783933251986
Energy: 0.689584591945451
Energy: 0.6623062336188646
Energy: 0.6543433507818794
Energy: 0.6533099712081415
Energy: 0.6500280454991829
Energy: 0.6534313807662462
Energy: 0.6913347631478517
Energy: 0.6627764453363824
Energy: 0.6878878088747971
Energy: 0.6917757471133961
Energy: 0.6557588211394744
Energy: 0.6874798289813653
Energy: 0.6926594919728053
Energy: 0.6750987312285506
Energy: 0.6941221341689691
Energy: 0.6754844841653875
Energy: 0.7032639669118679
Energy: 0.676385179734899
Energy: 0.6545459318837917
Energy: 0.7967900287373989
Energy: 0.6865564544776579
Energy: 0.6802039900109218
Energy: 0.6964163673836511
Energy: 0.6820254995332248
Energy: 0.7051295219509603
Energy: 0.6582769286234457
Energy: 0.6764294131693883
Energy: 0.6941390912300723
Energy: 0.7050648815077162
Energy: 0.6744587213273414
Energy: 0.671392502904673
Energy: 0.6033057448892865
Energy: 0.6887547804728716
Energy: 0.6957598553472868
Energy: 0.62938964654247
Energy: 0.6883161914794492
Energy: 0.6964443205816939

minimum gb energy = 0.6013073737442528 eV
minimum distance =  2.66946168948484 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.9587587717463558
Energy: 0.7663720544215293
Energy: 0.7661178108487863
Energy: 0.6267577688197417
Energy: 0.729647504174916
Energy: 0.627348522333636
Energy: 0.6035727023052238
Energy: 0.6697140171724302
Energy: 0.6693271002416084
Energy: 0.669891137285146
Energy: 0.6702374210701457
Energy: 0.6164771355358685
Energy: 0.7660573885437728
Energy: 0.6049176814700733
Energy: 0.6067580012917752
Energy: 0.670221088261617
Energy: 0.6053558499734838
Energy: 0.6062356813847898
Energy: 0.6696686563359215
Energy: 0.6066367150578001
Energy: 0.6067794230328112
Energy: 0.6695634120448193
Energy: 0.6072209089683963
Energy: 0.613443009953088
Energy: 0.5968429488450954
Energy: 0.6261710325697453
Energy: 0.6099595738830624
Energy: 0.5965947461143194
Energy: 0.6246264312531182
Energy: 0.6097152715582954
Energy: 0.603027062652675
Energy: 0.6129607894859104
Energy: 0.6133105581204363
Energy: 0.6356926397430146
Energy: 0.5906533130033135
Energy: 0.6098280205515735
Energy: 0.5953605084207912
Energy: 0.5898913868124466
Energy: 0.5897600452786133
Energy: 0.6642811176195657
Energy: 0.592138150188802
Energy: 0.6023505773942336
Energy: 0.591463251644924
Energy: 0.6196626134146782
Energy: 0.6191261725811852
Energy: 0.6186391736784418
Energy: 0.6205608936963812
Energy: 0.6183632706545467
Energy: 0.5902249359609065
Energy: 0.6109719180481944
Energy: 0.6092586465915909
Energy: 0.5913977558858143
Energy: 0.60971597013384
Energy: 0.5901515731293713
Energy: 0.5907357056825916
Energy: 0.6153252967399038
Energy: 0.6148392693803103
Energy: 0.5909344179864435
Energy: 0.6098462922446141
Energy: 0.6095098923214103
Energy: 0.6746632809990474
Energy: 0.6097074516081838
Energy: 0.6100429153341244
Energy: 0.6279018711842894
Energy: 0.5967943373027751
Energy: 0.6093470316612174
Energy: 0.6276168216099558
Energy: 0.6696530033490513
Energy: 0.6697115115614363
Energy: 0.651433757162571
Energy: 0.6692923020302649
Energy: 0.6702655895647012
Energy: 0.5925587071120042
Energy: 0.6700224985246122
Energy: 0.670264958733273
Energy: 0.6095951704697777
Energy: 0.6706619484010445
Energy: 0.6695922914218062
Energy: 0.7348979978054286
Energy: 0.6695394370251766
Energy: 0.6695646419793578
Energy: 0.7165171834235041
Energy: 0.6695167562260959
Energy: 0.6161271731520089
Energy: 0.7375866846851803
Energy: 0.6649106205009513
Energy: 0.6648031526406621
Energy: 0.6765954689430644
Energy: 0.6651963131724818
Energy: 0.665817998777674
Energy: 0.7619865182508525
Energy: 0.6699623325829561
Energy: 0.627866075519928
Energy: 0.6838247134307996
Energy: 0.6812188064225132
Energy: 0.669955462623972
Energy: 0.5781545611145341
Energy: 0.6773509748786357
Energy: 0.7295977722287109
Energy: 0.6021234950680475
Energy: 0.6776576105260325
Energy: 0.7305386015422836

minimum gb energy = 0.5781545611145341 eV
minimum distance =  2.70137416177613 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.998131105370721
Energy: 0.7235393160056518
Energy: 0.6089147987869645
Energy: 0.6110040015906261
Energy: 0.6458144292915077
Energy: 0.6091410649728883
Energy: 0.7076925087246206
Energy: 0.6441386347170943
Energy: 0.5792861479070806
Energy: 0.6501414086981074
Energy: 0.649046880116228
Energy: 0.5718358274594685
Energy: 0.7522187177669857
Energy: 0.5582860392541471
Energy: 0.5915576612041982
Energy: 0.6521477249588129
Energy: 0.5589854493203615
Energy: 0.5869657097788593
Energy: 0.6475415799785067
Energy: 0.6026577520051476
Energy: 0.5899401602118973
Energy: 0.648437880974215
Energy: 0.5832225727218538
Energy: 0.5862314318636125
Energy: 0.6272168778115612
Energy: 0.5755670316041623
Energy: 0.5766916767537277
Energy: 0.5775897238936569
Energy: 0.5782355725796686
Energy: 0.5715588396269504
Energy: 0.5862762710783329
Energy: 0.5776557410703772
Energy: 0.5641514187438903
Energy: 0.5584219026924435
Energy: 0.5629473676356758
Energy: 0.5607742424863036
Energy: 0.6616973155836046
Energy: 0.5644446936192684
Energy: 0.5641654949455347
Energy: 0.5587169042243096
Energy: 0.5642051256039584
Energy: 0.5613664753264848
Energy: 0.6589071305821219
Energy: 0.5503031644927948
Energy: 0.5578816284691785
Energy: 0.5534998152768866
Energy: 0.5497483178065882
Energy: 0.5577316999990947
Energy: 0.5347822444798275
Energy: 0.5549323147569906
Energy: 0.5501871993720767
Energy: 0.5353141485664463
Energy: 0.6009122878988924
Energy: 0.5338564580023741
Energy: 0.5389402259136705
Energy: 0.5662192492594432
Energy: 0.5530416657912101
Energy: 0.5342718278551641
Energy: 0.5522016780291384
Energy: 0.5483228663277803
Energy: 0.5911103339660324
Energy: 0.5345442128067148
Energy: 0.5529389688474093
Energy: 0.5516633046617151
Energy: 0.5353713099981234
Energy: 0.5526096216382868
Energy: 0.6400945760243142
Energy: 0.5337974787791245
Energy: 0.534008271489729
Energy: 0.6017296865983441
Energy: 0.5358199925019865
Energy: 0.5503526567987704
Energy: 0.636187265042641
Energy: 0.5561326237971884
Energy: 0.5560034581459956
Energy: 0.5522326973005909
Energy: 0.5558953372750925
Energy: 0.5560774063385082
Energy: 0.5640307596348875
Energy: 0.5580272037015576
Energy: 0.5581237107096594
Energy: 0.5650262141514
Energy: 0.5583959241618577
Energy: 0.5643564255113713
Energy: 0.5634865006517092
Energy: 0.5747361232514718
Energy: 0.5557459330854643
Energy: 0.5630923730038377
Energy: 0.562967571955041
Energy: 0.5805844836252089
Energy: 0.6898932837453108
Energy: 0.5791818093715737
Energy: 0.5813160637441213
Energy: 0.5828594606353992
Energy: 0.5778325529727424
Energy: 0.5803936233658624
Energy: 0.6706212452229712
Energy: 0.6438850860063623
Energy: 0.6464493008993693
Energy: 0.5780307309755778
Energy: 0.6435853426115571
Energy: 0.5789562805623246
Energy: 0.6246714111203127
Energy: 0.6454656548326099
Energy: 0.6475987285635324
Energy: 0.6099592870207122
Energy: 0.6453432134998288
Energy: 0.5790473062210887
Energy: 0.7082891857024841
Energy: 0.6479253969150357
Energy: 0.6088216879822665
Energy: 0.6479089024037255
Energy: 0.5767308007500633
Energy: 0.5800465657647189
Energy: 0.7387510861463337
Energy: 0.5794973709858754
Energy: 0.5841530469264589
Energy: 0.7806629599478628
Energy: 0.5804223577249386
Energy: 0.6511108832831703
Energy: 0.7304772211710885
Energy: 0.6473517321151526
Energy: 0.648442786723951
Energy: 0.6479661179978543
Energy: 0.6467517470809095
Energy: 0.6478880534985867
Energy: 0.7081901678964687
Energy: 0.6506059806565472
Energy: 0.6999178552276839
Energy: 0.5902680365255947
Energy: 0.651652815343993
Energy: 0.5882848458131569
Energy: 0.7131295615134449
Energy: 0.6482268503220461
Energy: 0.5766939798820023
Energy: 0.6698171559447444
Energy: 0.648062622122001
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Energy: 0.7271895613497388
Energy: 0.5854607431234814
Energy: 0.6400841761497622
Energy: 0.6460986664372957
Energy: 0.5618907542847794
Energy: 0.6477523358603628
Energy: 0.6437669052241707
Energy: 0.5609685165129026
Energy: 0.5866891100654702
Energy: 0.6439720787176052
Energy: 0.5588242154416234
Energy: 0.5872405441668646
Energy: 0.6314569209072813
Energy: 0.5779189672043162
Energy: 0.5785191271306996
Energy: 0.5763798731479424
Energy: 0.5794991894916182
Energy: 0.5812721892974229
Energy: 0.6419069835560739
Energy: 0.5823656923501953
Energy: 0.5785417216351616
Energy: 0.5578704412554216
Energy: 0.5827302035964609
Energy: 0.5592357242161256
Energy: 0.6441668945297245
Energy: 0.5714449622752787
Energy: 0.5639654397655757
Energy: 0.6449006184689404
Energy: 0.564137189994085
Energy: 0.5663633016955909
Energy: 0.6573439936829825
Energy: 0.5731273631162205
Energy: 0.5590924032818807
Energy: 0.5549129117866272
Energy: 0.5674785691844509
Energy: 0.5582054240837523
Energy: 0.5311755632337994
Energy: 0.5500877285166526
Energy: 0.5521229466462224
Energy: 0.5321658102675338
Energy: 0.549922776707485
Energy: 0.5560737342865146
Energy: 0.5369199640654524
Energy: 0.5513080015907776
Energy: 0.5506856817901359
Energy: 0.5380273702985743
Energy: 0.5522210255092749
Energy: 0.5471972451101175
Energy: 0.5908388975666539
Energy: 0.5524458128355004
Energy: 0.5522056479939113
Energy: 0.5677266253520801
Energy: 0.5529103522171078
Energy: 0.5519858413672667
Energy: 0.6368340410146002
Energy: 0.5377815299329376
Energy: 0.5339365643417375
Energy: 0.6379484461479085
Energy: 0.5327364775520735
Energy: 0.5338926532207074
Energy: 0.5696032491304749
Energy: 0.5574574003558783
Energy: 0.5574459270307932
Energy: 0.5625318097448355
Energy: 0.5522694040478968
Energy: 0.557792311405827
Energy: 0.5688899766197052
Energy: 0.5568042347936302
Energy: 0.5563584840711785
Energy: 0.5637929305765713
Energy: 0.5827183253028005
Energy: 0.557269315672757
Energy: 0.5693815928465202
Energy: 0.5539852498448811
Energy: 0.5752063087093666
Energy: 0.5635848588136175
Energy: 0.5538352067217946
Energy: 0.566285771568794
Energy: 0.694911889980576
Energy: 0.578534495649966
Energy: 0.5784766701385149
Energy: 0.5833017992161814
Energy: 0.575765715473761
Energy: 0.5780006087402567
Energy: 0.6997354529315102
Energy: 0.6438246327125685
Energy: 0.5777240002704036
Energy: 0.5799308831414774
Energy: 0.6455138463285053
Energy: 0.5797037753370256
Energy: 0.621501993561313
Energy: 0.6412899006732039
Energy: 0.5788578363243527
Energy: 0.5743993285231691
Energy: 0.6487778462437691
Energy: 0.5763793088125536
Energy: 0.6883571958497623
Energy: 0.651488453226539
Energy: 0.6447504852793848
Energy: 0.5793728921261069
Energy: 0.6488904196562884
Energy: 0.6063777144243525
Energy: 0.7067067270028162
Energy: 0.5782831172782532
Energy: 0.6451826628098095
Energy: 0.6515077589784007
Energy: 0.5773649909631621
Energy: 0.6426806329446455
Energy: 0.726908003622078
Energy: 0.6032321663149407
Energy: 0.5786341002843696
Energy: 0.6490238576258069
Energy: 0.5763953772274647
Energy: 0.646960638874538
Energy: 0.7129533613168451
Energy: 0.6484003234317243
Energy: 0.6457313876012158
Energy: 0.6699773459270489
Energy: 0.6480635775107856
Energy: 0.6325011579794797

minimum gb energy = 0.5311755632337994 eV
minimum distance =  2.68723015902116 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.6347890101436497
Energy: 0.679653711569344
Energy: 0.585648424080436
Energy: 0.5464344309657616
Energy: 0.7370260245143494
Energy: 0.5718133286343986
Energy: 0.6700174497348321
Energy: 0.6208633924880397
Energy: 0.5411495217803621
Energy: 0.61953848225405
Energy: 0.6180635403925137
Energy: 0.5516469046561017
Energy: 0.7051546880746661
Energy: 0.5251704151285994
Energy: 0.5337255646463016
Energy: 0.6217610822471528
Energy: 0.5241777392892344
Energy: 0.5579902990866428
Energy: 0.6164278813257139
Energy: 0.5328527060633713
Energy: 0.5583966605472871
Energy: 0.6172701232121068
Energy: 0.5256075735484818
Energy: 0.5648153925961384
Energy: 0.5719126016987115
Energy: 0.5476870093495347
Energy: 0.549718082454925
Energy: 0.5924735074881422
Energy: 0.5470357692551405
Energy: 0.5500419097410435
Energy: 0.5891362087527597
Energy: 0.5418640342943125
Energy: 0.5226707115970425
Energy: 0.5049945845227295
Energy: 0.5396963468440992
Energy: 0.5197814145234897
Energy: 0.6282609419672601
Energy: 0.5448698830850827
Energy: 0.539465139339967
Energy: 0.5220718816553448
Energy: 0.5417347845925998
Energy: 0.528905847117371
Energy: 0.6230534675938373
Energy: 0.49974806272298145
Energy: 0.5117726441208028
Energy: 0.5358934210096433
Energy: 0.5006544361693792
Energy: 0.5220306966800213
Energy: 0.5039045297133006
Energy: 0.5170930185803573
Energy: 0.5032669213378639
Energy: 0.5037051238307751
Energy: 0.5943350901957458
Energy: 0.5046058897195391
Energy: 0.5015427252383294
Energy: 0.5220538002854832
Energy: 0.5220781440151558
Energy: 0.5040771973336066
Energy: 0.5314362379489539
Energy: 0.5146806993693186
Energy: 0.5829168726716795
Energy: 0.4853085067646791
Energy: 0.5079393278579676
Energy: 0.49503599606036147
Energy: 0.48507062069209406
Energy: 0.5088178331956533
Energy: 0.5883301497715905
Energy: 0.4928573822903299
Energy: 0.4961227365099503
Energy: 0.5478070772755336
Energy: 0.49053455748383235
Energy: 0.5011302488548852
Energy: 0.5917108361568117
Energy: 0.5150847998102983
Energy: 0.5138685756069343
Energy: 0.5042501332605775
Energy: 0.5284742229617571
Energy: 0.5033858876875553
Energy: 0.48686689723070703
Energy: 0.5000072678946074
Energy: 0.4872137404487087
Energy: 0.4882964232687825
Energy: 0.5470327126508474
Energy: 0.4957905213461231
Energy: 0.49323996577541135
Energy: 0.4999641450220481
Energy: 0.49947014789258104
Energy: 0.48494422844869617
Energy: 0.5148670282404875
Energy: 0.5133726062866063
Energy: 0.6041368089441613
Energy: 0.5033272547601292
Energy: 0.5113270237953114
Energy: 0.535646687222756
Energy: 0.5092856298351497
Energy: 0.5114324634021968
Energy: 0.5927268225789535
Energy: 0.5109026811315217
Energy: 0.5029463988213438
Energy: 0.49949487237022555
Energy: 0.5086847601642303
Energy: 0.5175053330420757
Energy: 0.6077283437163636
Energy: 0.5180645239404221
Energy: 0.5185869574307335
Energy: 0.6063146704801043
Energy: 0.519679229186421
Energy: 0.5202771613638427
Energy: 0.5396831957139943
Energy: 0.5207636251398853
Energy: 0.5396624412474661
Energy: 0.5412676173358345
Energy: 0.5217128990205355
Energy: 0.5406167902357605
Energy: 0.6675661034192489
Energy: 0.5247462569510378
Energy: 0.5280744649614064
Energy: 0.5547131395744126
Energy: 0.5150364543002514
Energy: 0.5385155176934562
Energy: 0.656089752360424
Energy: 0.5488618445638636
Energy: 0.5518821194542314
Energy: 0.5482069023652
Energy: 0.6191809032790467
Energy: 0.5499314865382587
Energy: 0.5785725957847649
Energy: 0.6135344045587826
Energy: 0.5408848768643656
Energy: 0.5158506116559316
Energy: 0.6216515645254159
Energy: 0.5390274145537053
Energy: 0.601049397112899
Energy: 0.6222038190205831
Energy: 0.6179102732189354
Energy: 0.5485527085269446
Energy: 0.6176625591793529
Energy: 0.6092754273506277
Energy: 0.6679145393138917
Energy: 0.550735423116547
Energy: 0.5407052020563089
Energy: 0.6180485508831003
Energy: 0.5502517055986339
Energy: 0.5505521282122258
Energy: 0.7166585710890113
Energy: 0.541464771765552
Energy: 0.5383490560743343
Energy: 0.6206044727194358
Energy: 0.5381907837303795
Energy: 0.5496067270521792
Energy: 0.6904873052740348
Energy: 0.6235829554579128
Energy: 0.6208358265884455
Energy: 0.6197082314448878
Energy: 0.6204325392035612
Energy: 0.5496964416462113
Energy: 0.5640734123358115
Energy: 0.6117677594279511
Energy: 0.5644582675269322
Energy: 0.5287402653749418
Energy: 0.6199542955309397
Energy: 0.5594130199366144

minimum gb energy = 0.48494422844869617 eV
minimum distance =  2.6995785375853 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.5563534047763371
Energy: 0.5570383308239191
Energy: 0.49653155504940244
Energy: 0.4594272600954706
Energy: 0.6343575083463289
Energy: 0.47944358297251694
Energy: 0.5734989835592271
Energy: 0.5351244846725082
Energy: 0.4923200751377096
Energy: 0.5321579523974372
Energy: 0.531913239937865
Energy: 0.4702048142369717
Energy: 0.5984319343773962
Energy: 0.4302497741394143
Energy: 0.4435231074335496
Energy: 0.5349551902554206
Energy: 0.43056305978717885
Energy: 0.44364660127864514
Energy: 0.5257783625119044
Energy: 0.44520888896918787
Energy: 0.4535630772639692
Energy: 0.4702519664129819
Energy: 0.434642338954513
Energy: 0.4944361364756623
Energy: 0.5134777563356008
Energy: 0.46815071174274936
Energy: 0.46990787353578106
Energy: 0.4766849079128158
Energy: 0.4690476718913589
Energy: 0.4701904725476927
Energy: 0.5052722194868213
Energy: 0.4764759581269954
Energy: 0.43782483702137526
Energy: 0.41723193089129507
Energy: 0.4750660209409594
Energy: 0.42609487130959117
Energy: 0.5404084987973582
Energy: 0.47505440265892823
Energy: 0.4750482910219456
Energy: 0.45359316600057126
Energy: 0.47520833948548163
Energy: 0.46169442494429513
Energy: 0.5386681812268681
Energy: 0.41417714810900497
Energy: 0.41863403726099985
Energy: 0.4280793150650523
Energy: 0.4140206091681971
Energy: 0.41853033423142566
Energy: 0.4424466398674498
Energy: 0.4181752082993839
Energy: 0.44393715949683293
Energy: 0.4434440694489162
Energy: 0.5144931844478031
Energy: 0.4424610956190776
Energy: 0.4282713792647983
Energy: 0.41661243399484865
Energy: 0.4226629221676488
Energy: 0.44352638500012537
Energy: 0.4168377260759976
Energy: 0.4223758313635688
Energy: 0.5002219979656919
Energy: 0.4208816304921691
Energy: 0.41313471227634974
Energy: 0.4105456783457958
Energy: 0.42102193916716824
Energy: 0.4080767499367696
Energy: 0.5112939889000521
Energy: 0.42092674881779746
Energy: 0.4230001933728718
Energy: 0.4206332038225489
Energy: 0.4213252449423894
Energy: 0.4210805144158781
Energy: 0.5126616561000837
Energy: 0.41045527809699833
Energy: 0.40620636245529906
Energy: 0.42928910745999527
Energy: 0.40398121737848597
Energy: 0.4195659879413488
Energy: 0.4088381734142053
Energy: 0.40776262405442465
Energy: 0.4109966200074314
Energy: 0.4101823266697531
Energy: 0.5039591876419597
Energy: 0.41112231749394035
Energy: 0.4091532066810666
Energy: 0.40818935094449865
Energy: 0.4077764327852526
Energy: 0.4090058305534455
Energy: 0.40836750448546505
Energy: 0.40739061951756933
Energy: 0.499654796278297
Energy: 0.4042653909382333
Energy: 0.40460602496205134
Energy: 0.40407338531217424
Energy: 0.4038367212984532
Energy: 0.40403404307783086
Energy: 0.501294434155601
Energy: 0.4055188271547922
Energy: 0.4054882908563284
Energy: 0.40604840867790803
Energy: 0.40441087472206594
Energy: 0.4102435449572391
Energy: 0.5031903352372966
Energy: 0.4183921284041449
Energy: 0.4101400780588328
Energy: 0.45948660923538925
Energy: 0.41764532487064654
Energy: 0.4101307966132951
Energy: 0.4042477296926501
Energy: 0.45912465728163077
Energy: 0.40573385095777675
Energy: 0.4048825648460503
Energy: 0.5024314070786915
Energy: 0.4053379468279722
Energy: 0.504146351060143
Energy: 0.42750774974938816
Energy: 0.4109943572023469
Energy: 0.41047342018519367
Energy: 0.42797420698605704
Energy: 0.41410028839708674
Energy: 0.5055788238997261
Energy: 0.4100391868602927
Energy: 0.4109206344814432
Energy: 0.41189750458769375
Energy: 0.41018673189259236
Energy: 0.41431731319677007
Energy: 0.5043283348222781
Energy: 0.40938895171470796
Energy: 0.40993593268221534
Energy: 0.40642194094501727
Energy: 0.4092206791926876
Energy: 0.4060776431564474
Energy: 0.42096074354687957
Energy: 0.41029971865253306
Energy: 0.41009314893947396
Energy: 0.4216688176639671
Energy: 0.41096704389062716
Energy: 0.41062878759977073
Energy: 0.42064831907197076
Energy: 0.41836943920874126
Energy: 0.422921363825606
Energy: 0.42171532738119355
Energy: 0.5106239627027803
Energy: 0.42189619935750056
Energy: 0.5245456108164253
Energy: 0.41191575651881873
Energy: 0.41308490093541095
Energy: 0.42809238603200944
Energy: 0.41064026377393414
Energy: 0.4125988952572745
Energy: 0.5237985548068235
Energy: 0.44164737229608614
Energy: 0.4424442635359244
Energy: 0.4311966111244645
Energy: 0.4415688330751599
Energy: 0.43097534416946087
Energy: 0.5029229087501156
Energy: 0.441592312373531
Energy: 0.4277541866090147
Energy: 0.41445190847325164
Energy: 0.4415538438238376
Energy: 0.4169159398957865
Energy: 0.47499937084897953
Energy: 0.43142398875058413
Energy: 0.4267872571830813
Energy: 0.47548173815873707
Energy: 0.4310893954868963
Energy: 0.42687057711343773
Energy: 0.476086340614002
Energy: 0.43031897490897986
Energy: 0.47949385392266275
Energy: 0.4769748677385618
Energy: 0.5054302011995137
Energy: 0.4746939725316583
Energy: 0.5740467349618202
Energy: 0.4235646274063773
Energy: 0.43052743977258917
Energy: 0.4463232986036196
Energy: 0.4233115847552345
Energy: 0.42960919524334584
Energy: 0.5607679415763773
Energy: 0.5318721478582846
Energy: 0.46869176519162653
Energy: 0.4836743924025637
Energy: 0.5322741845392178
Energy: 0.47081552857977327
Energy: 0.5336295002130252
Energy: 0.5310478210429445
Energy: 0.4530883325722324
Energy: 0.4259054077752308
Energy: 0.531237219620258
Energy: 0.4394849847187445
Energy: 0.5190741766569352
Energy: 0.5289178180111878
Energy: 0.500356205491623
Energy: 0.4707409021841282
Energy: 0.5332415653914089
Energy: 0.5005023997321139
Energy: 0.5631906052678668
Energy: 0.45641910786383916
Energy: 0.4610855513607386
Energy: 0.4709590541235806
Energy: 0.5015024327237001
Energy: 0.5041307258386236
Energy: 0.5985470245528376
Energy: 0.4440810039564613
Energy: 0.47191254569507074
Energy: 0.5318995926400175
Energy: 0.4460532931119728
Energy: 0.47203411658697497
Energy: 0.5734989831750834
Energy: 0.5303634458693668
Energy: 0.5005148767651743
Energy: 0.5306388370260633
Energy: 0.532837084295917
Energy: 0.5003516767379124

minimum gb energy = 0.4038367212984532 eV
minimum distance =  2.69093288591065 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.16963105432953451
Energy: 0.1871301433215677
Energy: 0.029540828187460726
Energy: 0.030401200961940537
Energy: 1.5509396449857482
Energy: 0.16989589315750805
Energy: 0.1878379955453626
Energy: 0.29120360293806075
Energy: 0.29352553477595417
Energy: 0.34126256671072175
Energy: 0.29601393034710805
Energy: 0.29126579071795144
Energy: 0.3132680303358651
Energy: 0.029343081429971815
Energy: 0.0294205778190008
Energy: 0.3425403084185477
Energy: 0.029324847453217933
Energy: 0.02945084232066357
Energy: 0.31407000002832614
Energy: 0.029437554998551652
Energy: 0.029638471712911663
Energy: 0.3139326881457388
Energy: 0.029385924738919253
Energy: 0.05080047396875869
Energy: 0.05042475913217845
Energy: 0.33425429935951767
Energy: 0.312142050860257
Energy: 0.05108221533273168
Energy: 0.33436037256349704
Energy: 0.3345198677459656
Energy: 0.02971136134695936
Energy: 0.3091171085005039
Energy: 0.02952095882094651
Energy: 0.030594719732233214
Energy: 0.30947648420328977
Energy: 0.02932787201094328
Energy: 0.3391399096700198
Energy: 0.3094133960710322
Energy: 0.29109183555186635
Energy: 0.33853019253783123
Energy: 0.3092549095490815
Energy: 0.3092537505500626
Energy: 0.3373581420733992
Energy: 0.029335637457692694
Energy: 0.02944153283697876
Energy: 0.3384873911604588
Energy: 0.029214882155430826
Energy: 0.02948962324805405
Energy: 0.29292904172920486
Energy: 0.02949231149939461
Energy: 0.05090618992976519
Energy: 0.3169640849084797
Energy: 0.029436890852995275
Energy: 0.05159653681193593
Energy: 0.1699184204147964
Energy: 0.3174689434770376
Energy: 0.3169930045113136
Energy: 0.029368321435044364
Energy: 0.31695055315703685
Energy: 0.31184609908301414

minimum gb energy = 0.029214882155430826 eV
minimum distance =  2.82665390890124 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.5001469403745313
Energy: 0.6035603795509925
Energy: 0.5338238052698198
Energy: 0.4830444132675821
Energy: 0.49744860276789904
Energy: 0.4925075780508001
Energy: 0.5250756613349418
Energy: 0.5133631922204859
Energy: 0.4940784387254855
Energy: 0.5059413991935905
Energy: 0.571976362975742
Energy: 0.4921139029401822
Energy: 0.5539652411496775
Energy: 0.4840484448959457
Energy: 0.4843964241406884
Energy: 0.536981037997992
Energy: 0.48345746367252307
Energy: 0.4884700275852219
Energy: 0.5231845316277592
Energy: 0.4829940545925295
Energy: 0.4869479030279732
Energy: 0.5230528790906044
Energy: 0.4471512367312124
Energy: 0.49509627624304337
Energy: 0.46857992380166413
Energy: 0.4926008760698004
Energy: 0.49386198013675664
Energy: 0.4680735235019003
Energy: 0.49785825544191303
Energy: 0.49206204222813255
Energy: 0.4677338907242331
Energy: 0.501464329789752
Energy: 0.49140676834946173
Energy: 0.4582274035904148
Energy: 0.5347770842483185
Energy: 0.4584624442631848
Energy: 0.497138633008306
Energy: 0.4560121602502869
Energy: 0.476297848471019
Energy: 0.4976139803046461
Energy: 0.4558507368505516
Energy: 0.4952838788801705
Energy: 0.5231918141772203
Energy: 0.4642462028662197
Energy: 0.46409632646375476
Energy: 0.5227918165376446
Energy: 0.4404572357881855
Energy: 0.47095398334396343
Energy: 0.495111971422295
Energy: 0.4637279347697346
Energy: 0.4953383771977614
Energy: 0.49685899119353866
Energy: 0.44116739396856397
Energy: 0.49805267952337057
Energy: 0.4747498386793528
Energy: 0.4890831234542673
Energy: 0.48881940532457396
Energy: 0.47472756598004356
Energy: 0.49107577262065877
Energy: 0.46032268930536224
Energy: 0.4967498568335398
Energy: 0.47005670667562127
Energy: 0.47020898840359915
Energy: 0.44447037461544026
Energy: 0.4673102287890483
Energy: 0.44469042462278735
Energy: 0.4525343890967964
Energy: 0.4739700573754699
Energy: 0.4699421425572333
Energy: 0.45268246822174096
Energy: 0.4733410594452778
Energy: 0.4270341691624953
Energy: 0.45243330125459974
Energy: 0.4341227310645553
Energy: 0.45060936161242027
Energy: 0.452570911248994
Energy: 0.433823148252954
Energy: 0.44094496083636725
Energy: 0.45296423263102514
Energy: 0.44437453816336425
Energy: 0.45043310855956475
Energy: 0.4506839972419512
Energy: 0.443895294844088
Energy: 0.45457235117904893
Energy: 0.4514079500932886
Energy: 0.4320183847738704
Energy: 0.43281139915370936
Energy: 0.4506332509757487
Energy: 0.43419275058776585
Energy: 0.4343621505726402
Energy: 0.45191221624493555
Energy: 0.43836502085706747
Energy: 0.43920848778866345
Energy: 0.43711296722047016
Energy: 0.44576896163238594
Energy: 0.43934909047009346
Energy: 0.4206990985633731
Energy: 0.44173267010999584
Energy: 0.44059642270001453
Energy: 0.4210139347119964
Energy: 0.44068874537210573
Energy: 0.41598121028517976
Energy: 0.41667236444053934
Energy: 0.4347293328013482
Energy: 0.43442306262972297
Energy: 0.41647075547693807
Energy: 0.4350111764515303
Energy: 0.43878158376355003
Energy: 0.4427662167756481
Energy: 0.4626099670211259
Energy: 0.4341869916261842
Energy: 0.43784141910914287
Energy: 0.46207022001696657
Energy: 0.43452073638682526
Energy: 0.4450368354043063
Energy: 0.4148050015728101
Energy: 0.4210852878304622
Energy: 0.44563246628857356
Energy: 0.4217771059986185
Energy: 0.42057006983186696
Energy: 0.44489962383149506
Energy: 0.4385512456490589
Energy: 0.4399762089789243
Energy: 0.4454633424164744
Energy: 0.4381868164114304
Energy: 0.4402917108048863
Energy: 0.4318151734492275
Energy: 0.4387073116077306
Energy: 0.4319937405121678
Energy: 0.43300566292826176
Energy: 0.43803606504644843
Energy: 0.4308946056965429
Energy: 0.43198647311210087
Energy: 0.45376212736832083
Energy: 0.4505776589437425
Energy: 0.4124945746272076
Energy: 0.45038478144828836
Energy: 0.4500144289093946
Energy: 0.48467034176219814
Energy: 0.45236484174096975
Energy: 0.45110048579132933
Energy: 0.4407583221905092
Energy: 0.4541571979842189
Energy: 0.44012101175960094
Energy: 0.46893022590003763
Energy: 0.4549220721876283
Energy: 0.43187743119850097
Energy: 0.4696111821921489
Energy: 0.452724333739222
Energy: 0.42676845600990815
Energy: 0.4704876673522589
Energy: 0.4551302533613144
Energy: 0.45484820686186445
Energy: 0.47066342260131616
Energy: 0.43387022034298506
Energy: 0.46962996287505726
Energy: 0.48931048356631424
Energy: 0.45442508011217536
Energy: 0.4546561942081305
Energy: 0.49036517257449075
Energy: 0.47357063224311846
Energy: 0.47180858071469955
Energy: 0.4657081703309926
Energy: 0.47570209194721325
Energy: 0.4747311742122005
Energy: 0.46575135577230886
Energy: 0.47569666304328323
Energy: 0.4580993702781583
Energy: 0.5378987989277326
Energy: 0.5147312843824242
Energy: 0.4958738802817358
Energy: 0.44985779381156565
Energy: 0.5137416755276211
Energy: 0.4497055942998305
Energy: 0.47086555565264576
Energy: 0.49274968913153794
Energy: 0.49321339883049337
Energy: 0.4723335525827714
Energy: 0.5167314110713751
Energy: 0.49527338066177484
Energy: 0.5124615575335685
Energy: 0.47160920100671305
Energy: 0.4716384314307474
Energy: 0.5123456030421423
Energy: 0.44583877667889577
Energy: 0.4714748965023573
Energy: 0.5522597654356314
Energy: 0.4718800535850303
Energy: 0.506515962457475
Energy: 0.4979484984180119
Energy: 0.4630187478733979
Energy: 0.49152633610979823
Energy: 0.4888669902144023
Energy: 0.5145904194904696
Energy: 0.5128735742329369
Energy: 0.48764311180073616
Energy: 0.5128284819640251
Energy: 0.47206673313484254

minimum gb energy = 0.4124945746272076 eV
minimum distance =  2.6497522397995 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.5983393625845469
Energy: 0.59141094715554
Energy: 0.5970262160793497
Energy: 0.5598867754258864
Energy: 0.5841268305708578
Energy: 0.597127415138015
Energy: 0.6100900078403434
Energy: 0.6095031847543713
Energy: 0.6123937123446318
Energy: 0.6135283102975215
Energy: 0.6076577852548739
Energy: 0.6085337344974615
Energy: 0.6306669722577598
Energy: 0.5705550674892665
Energy: 0.5819702682122114
Energy: 0.6179148598287582
Energy: 0.563021596188577
Energy: 0.5815656133927813
Energy: 0.6095554346127212
Energy: 0.6042207850137603
Energy: 0.6095138231949565
Energy: 0.5752401202296811
Energy: 0.5563108014308379
Energy: 0.6177874178950573
Energy: 0.5746064320501647
Energy: 0.6140484469553789
Energy: 0.6129168550773773
Energy: 0.5659658836576588
Energy: 0.6141778309712592
Energy: 0.6083079161876644
Energy: 0.5973953196860061
Energy: 0.5832117643816642
Energy: 0.5638389574551175
Energy: 0.5645730150520173
Energy: 0.6108626621641364
Energy: 0.5640028206754607
Energy: 0.5857898212417035
Energy: 0.5662057339620409
Energy: 0.5690100506077584
Energy: 0.5841988256222739
Energy: 0.5635595736222374
Energy: 0.5665159307830903
Energy: 0.5830469079198424
Energy: 0.5529303500458954
Energy: 0.5501358003818322
Energy: 0.583392694840889
Energy: 0.5417045580354236
Energy: 0.5624518366311256
Energy: 0.5610132217151588
Energy: 0.5726853387227125
Energy: 0.5724371057174912
Energy: 0.5663446950236758
Energy: 0.5483347997061195
Energy: 0.5691913330110684
Energy: 0.5625099281768939
Energy: 0.5518938543125683
Energy: 0.5555553418347133
Energy: 0.5639881050256085
Energy: 0.5512387962351173
Energy: 0.5456949118073896
Energy: 0.5613596638856051
Energy: 0.549784865555737
Energy: 0.5515722790318581
Energy: 0.5461994877316689
Energy: 0.5446895112259006
Energy: 0.5522918667799946
Energy: 0.5231965893958217
Energy: 0.5479360987570507
Energy: 0.5487218606471663
Energy: 0.5237829240919509
Energy: 0.5477969459700202
Energy: 0.5138064654722481
Energy: 0.5228170348839246
Energy: 0.5439351829923964
Energy: 0.5428421048704645
Energy: 0.5230809320022023
Energy: 0.5406195066054158
Energy: 0.5211483038535526
Energy: 0.5398013383218841
Energy: 0.5437734431240226
Energy: 0.5420546623565516
Energy: 0.5405083562728521
Energy: 0.5530707869579222
Energy: 0.5420488079101242
Energy: 0.5394716902837119
Energy: 0.5243320541949301
Energy: 0.5283021354413794
Energy: 0.5405258499950121
Energy: 0.5231252566320955
Energy: 0.5193141065060923
Energy: 0.5434646662257542
Energy: 0.5447540462105792
Energy: 0.5484242785792529
Energy: 0.5494971312233174
Energy: 0.5406218740446662
Energy: 0.5477670565496368
Energy: 0.5490311496293129
Energy: 0.5396866689026945
Energy: 0.5374205859573893
Energy: 0.5497419777979816
Energy: 0.5382517168313561
Energy: 0.5356230504116556
Energy: 0.5459557711435958
Energy: 0.5667056679734056
Energy: 0.5689182530669434
Energy: 0.5477733632920507
Energy: 0.5664710688501703
Energy: 0.5252924482756585
Energy: 0.5397652035352144
Energy: 0.5622955324193905
Energy: 0.5501206068214171
Energy: 0.5501520573728098
Energy: 0.5607914985168407
Energy: 0.5499145517658243
Energy: 0.5609166827716762
Energy: 0.5801792862182471
Energy: 0.5803678788864899
Energy: 0.5614750444595868
Energy: 0.5763292553751644
Energy: 0.5708718962462436
Energy: 0.575393052899138
Energy: 0.5792760622695509
Energy: 0.5789193608824266
Energy: 0.5767476065108045
Energy: 0.5726577309835637
Energy: 0.5853664062204968
Energy: 0.6304782251058373
Energy: 0.5489421397598712
Energy: 0.5792846543359342
Energy: 0.6132187664744819
Energy: 0.5483579115505635
Energy: 0.579047459785267
Energy: 0.6106772877226555
Energy: 0.5643769726625483
Energy: 0.5682428118349437
Energy: 0.6109895178687647
Energy: 0.5623473798775346
Energy: 0.5619567528125394

minimum gb energy = 0.5138064654722481 eV
minimum distance =  2.65365185982688 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.9630707836968179
Energy: 0.7286467181957863
Energy: 0.7292202657104714
Energy: 0.6411986202082479
Energy: 0.6923375815980869
Energy: 0.6389020016940724
Energy: 0.6399537158616269
Energy: 0.6543591549337878
Energy: 0.6595861330913257
Energy: 0.6552049943089118
Energy: 0.655163783047958
Energy: 0.6569874639791677
Energy: 0.7209523114644911
Energy: 0.647799359272718
Energy: 0.6470945199952725
Energy: 0.6860637574109727
Energy: 0.648063605238714
Energy: 0.6470876899965873
Energy: 0.7006591245442425
Energy: 0.6481011156867627
Energy: 0.6477383400189815
Energy: 0.6452859736436103
Energy: 0.6045412120113416
Energy: 0.6469948733136548
Energy: 0.6237370924784968
Energy: 0.6542112295370833
Energy: 0.6565259170743614
Energy: 0.6153221410334455
Energy: 0.6548561930804857
Energy: 0.6542861617399996
Energy: 0.6904692271147871
Energy: 0.6542121822323209
Energy: 0.6539344683482678
Energy: 0.6040431155241194
Energy: 0.6539865920836475
Energy: 0.6078296530558986
Energy: 0.623497890368352
Energy: 0.6562843262137337
Energy: 0.6220115757382172
Energy: 0.6156734741782239
Energy: 0.6537863027426815
Energy: 0.6150494463594244
Energy: 0.643759521615408
Energy: 0.6070334597389667
Energy: 0.6070477586895803
Energy: 0.6403068511516629
Energy: 0.607432231252311
Energy: 0.6118171779794852
Energy: 0.6075831727172564
Energy: 0.6115916648090693
Energy: 0.61203029650791
Energy: 0.6135274087562627
Energy: 0.583881321186327
Energy: 0.6125276084994876
Energy: 0.6053438090018001
Energy: 0.590280491657965
Energy: 0.5853692118707374
Energy: 0.6063161004612114
Energy: 0.5855979269938232
Energy: 0.5874524571638204
Energy: 0.6053928640988578
Energy: 0.6307675421522386
Energy: 0.6064808159799515
Energy: 0.5899336772993035
Energy: 0.5898323266900735
Energy: 0.6071654676735597
Energy: 0.5842703344608338
Energy: 0.589173756268536
Energy: 0.5883920047350433
Energy: 0.5842697842252322
Energy: 0.601250906065718
Energy: 0.5858062009553385
Energy: 0.5885094914387642
Energy: 0.6128280071459344
Energy: 0.6131397578004701
Energy: 0.5878181071178741
Energy: 0.6140640749153158
Energy: 0.5855269325867726
Energy: 0.6211772098444374
Energy: 0.6115097940977327
Energy: 0.6172158858958626
Energy: 0.575206938657829
Energy: 0.6056960482386716
Energy: 0.5964219443697026
Energy: 0.6212396312624127
Energy: 0.6154117637137164
Energy: 0.6115742883023323
Energy: 0.6222829032288983
Energy: 0.6431281530471259
Energy: 0.6117141228911626
Energy: 0.6156045488470044
Energy: 0.6213298379779142
Energy: 0.6209370460952527
Energy: 0.6163234154046999
Energy: 0.6031983991080464
Energy: 0.6113972327775102
Energy: 0.721624081539764
Energy: 0.6217464684933215
Energy: 0.6213219882019686
Energy: 0.6853901866648315
Energy: 0.6220948767310176
Energy: 0.6209213190931476
Energy: 0.6965135077930232
Energy: 0.6560443657438422
Energy: 0.657313390976011
Energy: 0.6566551502435246
Energy: 0.6572812342244465
Energy: 0.6334375943728773
Energy: 0.6802081150952903
Energy: 0.6558892252998281
Energy: 0.674082049300447
Energy: 0.6204698447753911
Energy: 0.685276257312119
Energy: 0.6197246476635211
Energy: 0.6402785979973671
Energy: 0.6544527820699552
Energy: 0.6560694512071501
Energy: 0.6420224381487343
Energy: 0.6553158865310716
Energy: 0.6542468489065669
Energy: 0.7200858578750728
Energy: 0.6478830236663791
Energy: 0.6478954398679381
Energy: 0.6961409441642418
Energy: 0.6251421187716525
Energy: 0.6467878814610302
Energy: 0.6959759784489732
Energy: 0.6478080884128041
Energy: 0.6467922466931234
Energy: 0.6925248005127917
Energy: 0.6481938749525387
Energy: 0.6466377300005128
Energy: 0.6238621681022221
Energy: 0.6543657880748824
Energy: 0.6571034731506672
Energy: 0.6153956463535848
Energy: 0.6551349304788661
Energy: 0.6568278676640633
Energy: 0.6564137929705577
Energy: 0.6537067184188762
Energy: 0.6540178364391701
Energy: 0.604596986012815
Energy: 0.6608089121657975
Energy: 0.6082078916883624
Energy: 0.6236782600693144
Energy: 0.6581467208296724
Energy: 0.6565021199588235
Energy: 0.6157490691626162
Energy: 0.656841944333255
Energy: 0.6162504089289563
Energy: 0.6419090713693227
Energy: 0.6065902527632513
Energy: 0.6169199539548734
Energy: 0.6427487985283483
Energy: 0.6067592991592462
Energy: 0.6119184731493619
Energy: 0.6065744001037554
Energy: 0.6131110736077735
Energy: 0.611365235479955
Energy: 0.6137679784595262
Energy: 0.6151733134619038
Energy: 0.6141708798458259
Energy: 0.6060679631387398
Energy: 0.5922148723024343
Energy: 0.5852285864943906
Energy: 0.6140064540061605
Energy: 0.5871486270111292
Energy: 0.5878607602486685
Energy: 0.6064902806405216
Energy: 0.593251631249406
Energy: 0.60529735573031
Energy: 0.5867384355687866
Energy: 0.5917085174156048
Energy: 0.5888166242411406
Energy: 0.5843363799906338
Energy: 0.5893940392791217
Energy: 0.588459824650517
Energy: 0.5842893764997239
Energy: 0.604993287122835
Energy: 0.5843374849670423
Energy: 0.5912069969000356
Energy: 0.6116134896653803
Energy: 0.6016491637230056
Energy: 0.5883534692021453
Energy: 0.612626689364504
Energy: 0.5851142090805942
Energy: 0.6211726589314015
Energy: 0.6115733950133784
Energy: 0.6106949333938967
Energy: 0.5758325209796155
Energy: 0.6122809960342329
Energy: 0.6117516907918786
Energy: 0.6217150015437917
Energy: 0.6117127599450195
Energy: 0.6116448644201022
Energy: 0.6235805125777797
Energy: 0.6422272316557346
Energy: 0.6196517097699161
Energy: 0.6161722146320641
Energy: 0.6269597331795207
Energy: 0.611373309113455
Energy: 0.6162180150589558
Energy: 0.602835891803833
Energy: 0.6113032055409281
Energy: 0.7195220457114512
Energy: 0.6218110142252524
Energy: 0.6214501097853051
Energy: 0.6846391460276927
Energy: 0.5651853813182203
Energy: 0.6210875157187085
Energy: 0.6953751392977199
Energy: 0.6575026108692461
Energy: 0.6113281941195517
Energy: 0.6568597427177618
Energy: 0.6593940075684666
Energy: 0.6569703185945769
Energy: 0.6805898726223396
Energy: 0.6539800991890652
Energy: 0.6735247970471981
Energy: 0.6205091881856106
Energy: 0.6836882697984813
Energy: 0.6193615083840716

minimum gb energy = 0.5651853813182203 eV
minimum distance =  2.67596710984646 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.8834951497293969
Energy: 0.7739466103813479
Energy: 0.7770935909087119
Energy: 0.6858135409848771
Energy: 0.7119227188169784
Energy: 0.7706242982209683
Energy: 0.7107902097835123
Energy: 0.7151891778787922
Energy: 0.6970672810991276
Energy: 0.7154179014264791
Energy: 0.7139547076596753
Energy: 0.6989644870843698
Energy: 0.7811633813318164
Energy: 0.6955204302191474
Energy: 0.695667688456093
Energy: 0.7131074739280122
Energy: 0.6893738074589977
Energy: 0.693754563139178
Energy: 0.7138111529737767
Energy: 0.6968022989975797
Energy: 0.6955152143406037
Energy: 0.7154583461688115
Energy: 0.6907465125282268
Energy: 0.67770325573979
Energy: 0.6837453501111168
Energy: 0.7142464649200189
Energy: 0.6964365353830384
Energy: 0.6845777418189339
Energy: 0.712378091192061
Energy: 0.6991741876085704
Energy: 0.7078607104992851
Energy: 0.7033205926982556
Energy: 0.6983935626562796
Energy: 0.6949046446486823
Energy: 0.7032186420601726
Energy: 0.6786977338581045
Energy: 0.6846919592852728
Energy: 0.7162474202141177
Energy: 0.7175808919365643
Energy: 0.6844305888630535
Energy: 0.7165802347554981
Energy: 0.6661441220662561
Energy: 0.6870077977421734
Energy: 0.6715696880601402
Energy: 0.6700645675686115
Energy: 0.6876366627199884
Energy: 0.6662012260541222
Energy: 0.6693535418286176
Energy: 0.7047338146503874
Energy: 0.6800778450260118
Energy: 0.6787569308809751
Energy: 0.6765731190321106
Energy: 0.6802600655626743
Energy: 0.677977375136466
Energy: 0.7053373791950954
Energy: 0.6882945847618257
Energy: 0.6683797201542452
Energy: 0.6654719571162232
Energy: 0.6828935402810876
Energy: 0.669029523877967
Energy: 0.709526141686978
Energy: 0.664723051726743
Energy: 0.7006511604274459
Energy: 0.6983530674291127
Energy: 0.6824924418238782
Energy: 0.702310090106892
Energy: 0.7726994186930731
Energy: 0.6790038502640219
Energy: 0.6777823338301924
Energy: 0.7132963061583026
Energy: 0.6463094650547623
Energy: 0.6777198491036922
Energy: 0.7786998687751406
Energy: 0.6996695013453104
Energy: 0.6891568352325957
Energy: 0.7168258078109274
Energy: 0.6981587193115818
Energy: 0.6986876298165043
Energy: 0.8041070529898259
Energy: 0.7125939546302961
Energy: 0.7028588218959485
Energy: 0.6775572532843408
Energy: 0.7121761829004412
Energy: 0.703198564450617

minimum gb energy = 0.6463094650547623 eV
minimum distance =  2.67567347319031 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.807455606095095
Energy: 0.8554288442240017
Energy: 0.8729176939688865
Energy: 0.7616284520559617
Energy: 0.9623049890423695
Energy: 0.8933971122913378
Energy: 0.7951675419185843
Energy: 0.7405796216807428
Energy: 0.742453656409788
Energy: 0.73209518809793
Energy: 0.74207066352253
Energy: 0.7278523961051462
Energy: 0.8523756079803296
Energy: 0.7289805024097186
Energy: 0.7230708740375036
Energy: 0.7270848921259168
Energy: 0.7300933078841586
Energy: 0.7284853566243891
Energy: 0.727373328703548
Energy: 0.72870001674462
Energy: 0.7365290310353921
Energy: 0.7273797300645218
Energy: 0.7291241458391471
Energy: 0.7291652134468064
Energy: 0.7290261347506557
Energy: 0.7430088319169066
Energy: 0.7401115081260956
Energy: 0.7392510986539358
Energy: 0.7428108000983317
Energy: 0.7284797936894508
Energy: 0.7236043403167252
Energy: 0.7653768060253315
Energy: 0.7451349073854636
Energy: 0.7298285301472414
Energy: 0.783283594668727
Energy: 0.7237790173252613
Energy: 0.7805002431582198
Energy: 0.733880123392675
Energy: 0.7862988923640503
Energy: 0.7853476628648027
Energy: 0.7220734991880133
Energy: 0.7275192902108474
Energy: 0.7583225102819007
Energy: 0.7377308464444847
Energy: 0.7241201112074092
Energy: 0.7420198298652493
Energy: 0.7309387357892397
Energy: 0.7414787865533824
Energy: 0.7757490704299469
Energy: 0.7289026772005391
Energy: 0.7293899996844476
Energy: 0.7262778976685406
Energy: 0.7274826332836697
Energy: 0.721439077565611
Energy: 0.7754842996871054
Energy: 0.728905919538337
Energy: 0.7297273891985137
Energy: 0.7963209169321751
Energy: 0.7281856170507686
Energy: 0.7213997007097475
Energy: 0.7585264726735885
Energy: 0.7380901624981469
Energy: 0.7236336664025625
Energy: 0.7419331536006855
Energy: 0.7300302747333377
Energy: 0.7405274804663395
Energy: 0.8145293288068599
Energy: 0.7478856517140252
Energy: 0.7753715466996607
Energy: 0.8194670777517293
Energy: 0.7202110513529758
Energy: 0.7752510718406598
Energy: 0.7454353080605091
Energy: 0.7244834574681959
Energy: 0.7350397483803447
Energy: 0.7437732674495632
Energy: 0.727296617496002
Energy: 0.729380309015919
Energy: 0.7300615209523381
Energy: 0.7291127260127611
Energy: 0.7282629369381164
Energy: 0.7471107986437471
Energy: 0.7286070357853504
Energy: 0.7286443723071314
Energy: 0.7552858721240144
Energy: 0.7393061900634967
Energy: 0.7231734555608056
Energy: 0.7555908447541269
Energy: 0.7288273821245245
Energy: 0.7286209196369251
Energy: 0.7463255857768413
Energy: 0.7234590834666927
Energy: 0.7302899446552736
Energy: 0.7477555522302959
Energy: 0.7333781251312687
Energy: 0.7467702363133842
Energy: 0.760662690487213
Energy: 0.7287949655866032
Energy: 0.7236167005351913
Energy: 0.7610577772934108
Energy: 0.7279556549980709
Energy: 0.7255148055982423
Energy: 0.720119696538251
Energy: 0.7563635483351103
Energy: 0.7398522813079762
Energy: 0.7328318847469502
Energy: 0.7853205519183266
Energy: 0.8116926251714401
Energy: 0.7300670967760068
Energy: 0.7251680612711227
Energy: 0.7326004078479365
Energy: 0.7304444227580189
Energy: 0.7323286059205654
Energy: 0.7252047736905555
Energy: 0.7308853171342229
Energy: 0.7288354184719634
Energy: 0.7189007324566284
Energy: 0.7308286679429661
Energy: 0.7309682824489094
Energy: 0.7325277217035411
Energy: 0.785663983198977
Energy: 0.7288010984122785
Energy: 0.7316024221748892
Energy: 0.7310295860587669
Energy: 0.7297424747197534
Energy: 0.7314257191444609
Energy: 0.7824277302781993
Energy: 0.724517286982242
Energy: 0.7362211291649184
Energy: 0.7741794888462711
Energy: 0.7328239110054329
Energy: 0.7310713751183666
Energy: 0.782447917680333
Energy: 0.7316157623737846
Energy: 0.7459851651167907
Energy: 0.7284769125835924
Energy: 0.7283458664671371
Energy: 0.726036769542654
Energy: 0.7838462943377806
Energy: 0.7322858270933565
Energy: 0.7320455666686707
Energy: 0.7318527470470086
Energy: 0.732071700757564
Energy: 0.7279119352074572
Energy: 0.8152311226452047
Energy: 0.7303625983190779
Energy: 0.7262535553356714
Energy: 0.8153484568835659
Energy: 0.7260895727959863
Energy: 0.7330936132286927
Energy: 0.737189527231853
Energy: 0.7411922061067991
Energy: 0.7318355887911512
Energy: 0.7359135280787024
Energy: 0.7614119675258122
Energy: 0.723550267948113
Energy: 0.7283518517592563
Energy: 0.7465932957068634
Energy: 0.7471889272432798
Energy: 0.7359365235984275
Energy: 0.7489520272776217
Energy: 0.7320639143682913
Energy: 0.7369509675970403
Energy: 0.7401257971906166
Energy: 0.7301313004650091
Energy: 0.7326558608275087
Energy: 0.7544225096549962
Energy: 0.7230756405289154
Energy: 0.8618107560474468
Energy: 0.7283316395257422
Energy: 0.7274759422809426
Energy: 0.7592373442421602
Energy: 0.7298779967706437
Energy: 0.7291446123162453
Energy: 0.8466408595808713
Energy: 0.7427859065497829
Energy: 0.7606759354350936
Energy: 0.7272721112897554
Energy: 0.7470627475609785
Energy: 0.7231196935023319
Energy: 0.9063553994946955
Energy: 0.7823570874291031
Energy: 0.7707331560275603
Energy: 0.7343224414429144
Energy: 0.7815338774476175
Energy: 0.7697740727973826

minimum gb energy = 0.7189007324566284 eV
minimum distance =  2.69508320190855 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.1001066344851653
Energy: 0.6826425899049492
Energy: 0.6861086117050441
Energy: 0.9177494714920793
Energy: 0.6884840280736202
Energy: 0.9168277612655412
Energy: 0.706741457938671
Energy: 0.6882104509188495
Energy: 0.689038527255607
Energy: 0.6840993703358618
Energy: 0.6867805048982587
Energy: 0.6636055129012898
Energy: 0.8178242807747305
Energy: 0.6599123202425824
Energy: 0.6600863287655468
Energy: 0.8192636161204334
Energy: 0.6601945298897732
Energy: 0.6887845622023882
Energy: 0.68406766452167
Energy: 0.6891245774388786
Energy: 0.7310675594521207
Energy: 0.6865815347668076
Energy: 0.8071855335972349
Energy: 0.6888275209719781
Energy: 0.7062366025864213
Energy: 0.6882850098079832
Energy: 0.688326741458133
Energy: 0.6887186721443738
Energy: 0.6888674583077024
Energy: 0.6887826987254421
Energy: 0.6872620870086062
Energy: 0.7071856105406961
Energy: 0.6634240146328249
Energy: 0.6961044127709184
Energy: 0.7046828850842878
Energy: 0.6626276635561265
Energy: 0.7047727900130304
Energy: 0.6482807901825788
Energy: 0.6484234109444388
Energy: 0.7040247203454493
Energy: 0.6574692782159839
Energy: 0.6629204147730741
Energy: 0.8030070555123943
Energy: 0.6882288311031028
Energy: 0.6903805051336701
Energy: 0.6883315804394208
Energy: 0.7057393813151249
Energy: 0.6628314187709626
Energy: 0.7060624870314666
Energy: 0.6882807044697139
Energy: 0.6483552882909678
Energy: 0.6491582461933046
Energy: 0.6879109196263522
Energy: 0.6487463514921721
Energy: 0.706058555719569
Energy: 0.6883877377924192
Energy: 0.6482980406726764
Energy: 0.64880853089979
Energy: 0.6900488672263011
Energy: 0.6486702780408344
Energy: 0.8037984584656754
Energy: 0.6896254797810564
Energy: 0.6837234789159995
Energy: 0.6885246697820969
Energy: 0.6860302428596985
Energy: 0.6895623047267263
Energy: 0.6848284443535096
Energy: 0.6599292441572918
Energy: 0.6596629684246195
Energy: 0.6857609375345308
Energy: 0.6603635850218043
Energy: 0.6885056320619122
Energy: 0.6841394395095484
Energy: 0.6885432917557113
Energy: 0.6637894898017214
Energy: 0.6852718046072858
Energy: 0.6864419467678542
Energy: 0.6615223084824289
Energy: 0.6861710208678377
Energy: 0.8227829703762749
Energy: 0.6897360806071985
Energy: 0.6963715108298191
Energy: 0.8245910283517488
Energy: 0.6899648088727784
Energy: 0.7047346779312614
Energy: 0.6475609681718238
Energy: 0.6883051961045944
Energy: 0.7050765927658373
Energy: 0.6489022097211802
Energy: 0.661877410429241
Energy: 0.8175539590170116
Energy: 0.647408993236883
Energy: 0.6476226939125805
Energy: 0.8193863901311766
Energy: 0.6492805706357424
Energy: 0.689473588461612
Energy: 0.7067571920818352
Energy: 0.6881388373845198
Energy: 0.6888205808141399
Energy: 0.7072002031318596
Energy: 0.6868868430039522
Energy: 0.6977501767369582

minimum gb energy = 0.647408993236883 eV
minimum distance =  2.69771111690438 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.8700388471244321
Energy: 0.8959909141053739
Energy: 0.8595821615146605
Energy: 0.8289514408645139
Energy: 0.8219620815202409
Energy: 0.8596752681456402
Energy: 0.8288791876451798
Energy: 0.7734144252301062
Energy: 0.8145027007195534
Energy: 0.7510369554325345
Energy: 0.7832641505044271
Energy: 0.7763381545617054
Energy: 0.7879054418421358
Energy: 0.7552699184103102
Energy: 0.7708136541168786
Energy: 0.7884582170918759
Energy: 0.754451651746167
Energy: 0.8389283650214238
Energy: 0.7834815669116739
Energy: 0.7744400881141689
Energy: 0.7541304250380818
Energy: 0.7928940966784981
Energy: 0.7754501378152382
Energy: 0.7737046321518621
Energy: 0.755552124140561
Energy: 0.7827329442244083
Energy: 0.7875198737398846
Energy: 0.752765209480565
Energy: 0.7952612823140701
Energy: 0.7901810479753282
Energy: 0.7416844599437015
Energy: 0.7554454645853871
Energy: 0.7536817376098708
Energy: 0.7424158342322857
Energy: 0.755408568074884
Energy: 0.776880547386924
Energy: 0.7744778233886284
Energy: 0.7630543734256885
Energy: 0.7410550232699189
Energy: 0.7752803482286927
Energy: 0.8198990380167127
Energy: 0.826261027979851
Energy: 0.793200091777257
Energy: 0.7978844115652736
Energy: 0.7887952424802348
Energy: 0.7842576443917323
Energy: 0.7926709219520183
Energy: 0.7538748995806137
Energy: 0.8650399448310346
Energy: 0.7913704242449631
Energy: 0.7604763792755074
Energy: 0.7713547377112195
Energy: 0.7858842183065298
Energy: 0.7488100384933833
Energy: 0.7979675645049487
Energy: 0.7585670441072906
Energy: 0.7609753614080264
Energy: 0.7572776983621655
Energy: 0.7577654079619772
Energy: 0.7615890999604069
Energy: 0.7939702963467784
Energy: 0.7909512958436625
Energy: 0.7898570246640914
Energy: 0.7841476117209568
Energy: 0.7799646334494172
Energy: 0.7876227125174473
Energy: 0.7925422843505672
Energy: 0.7557061161931418
Energy: 0.7937374453316671
Energy: 0.7850508960085596
Energy: 0.7508238117625687
Energy: 0.7919209339618287
Energy: 0.8934372547168775
Energy: 0.766428260208306
Energy: 0.7567448997861803
Energy: 0.7379766494249428
Energy: 0.7640587083039174
Energy: 0.7499861706602999
Energy: 0.8396078293134721
Energy: 0.789876735984354
Energy: 0.7907494639171804
Energy: 0.7458263616523485
Energy: 0.7547506479881828
Energy: 0.7556376927330151
Energy: 0.7868806259724785
Energy: 0.798652681448691
Energy: 0.7668742042679885
Energy: 0.7873531350785407
Energy: 0.7561436395490717
Energy: 0.7810510883543946
Energy: 0.784636717928413
Energy: 0.7437448034887943
Energy: 0.7605560719710711
Energy: 0.7853921679472682
Energy: 0.7426873045673698
Energy: 0.7811949763885577
Energy: 0.7678322646961713
Energy: 0.7752768911323552
Energy: 0.7759770907215461
Energy: 0.7859710309497963
Energy: 0.7776098635976593
Energy: 0.7904082484061794
Energy: 0.8326097749653854
Energy: 0.7917052968503062
Energy: 0.7774560617000917
Energy: 0.7603978064743276
Energy: 0.7884202746429622
Energy: 0.763534781645541
Energy: 0.7786284428158561
Energy: 0.7571816309367063
Energy: 0.7748556785468501
Energy: 0.777774668329265
Energy: 0.76070983662281
Energy: 0.7757384055040496
Energy: 0.7899681880432601
Energy: 0.7737368538122643
Energy: 0.7747320781114219
Energy: 0.7908276743756687
Energy: 0.7561505153664223
Energy: 0.7534763370466684
Energy: 0.8180967527380122
Energy: 0.7932074672780978
Energy: 0.787137420479916
Energy: 0.7689646017303823
Energy: 0.779585703326105
Energy: 0.7683680935428413

minimum gb energy = 0.7379766494249428 eV
minimum distance =  2.67515752032897 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.8670298310020431
Energy: 0.8154503157000069
Energy: 0.7993750312569124
Energy: 0.8656558083767847
Energy: 1.0635122775035155
Energy: 0.8005171722201242
Energy: 0.775096805707631
Energy: 0.8266847085134341
Energy: 0.8106799057536035
Energy: 0.8116793668788422
Energy: 0.8266817798717014
Energy: 0.8052723765161429
Energy: 0.7726805339925834
Energy: 0.7854349297183795
Energy: 0.807507253591203
Energy: 0.7559445690810035
Energy: 0.7453785434983814
Energy: 0.756146676653178
Energy: 0.8176492009373051
Energy: 0.801245856988563
Energy: 0.7998873393203842
Energy: 0.8085180031054662
Energy: 0.7730590171667134
Energy: 0.8012281049651807
Energy: 0.7455870612050576
Energy: 0.7981543017042165
Energy: 0.8601567165228402
Energy: 0.7463856201849524
Energy: 0.8090692867464768
Energy: 0.8367428466015338
Energy: 0.768728979092075
Energy: 0.8047334868172233
Energy: 0.8000266356137772
Energy: 0.75193099817149
Energy: 0.8229155042325002
Energy: 0.8002237997313291
Energy: 0.8028372647239531
Energy: 0.7125593711770689
Energy: 0.7610801623398282
Energy: 0.804178889621196
Energy: 0.7124710243275258
Energy: 0.7366685128672281
Energy: 0.8036613012054333
Energy: 0.742335328765495
Energy: 0.7769095241557307
Energy: 0.7885745708804867
Energy: 0.7137288529088642
Energy: 0.7996079980551836
Energy: 0.820855527893462
Energy: 0.7692904061835357
Energy: 0.7693983100973363
Energy: 0.7838224908175052
Energy: 0.779648282298975
Energy: 0.7845719333849636
Energy: 0.8347966559603335
Energy: 0.7662124513560836
Energy: 0.7834480120878026
Energy: 0.7653923852470212
Energy: 0.7678649499330538
Energy: 0.7836713672795215
Energy: 0.8036267633200166
Energy: 0.8104744687800712
Energy: 0.8144047534668402
Energy: 0.7969176431397129
Energy: 0.7543953078920846
Energy: 0.8139288257786373
Energy: 0.8186309749490385
Energy: 0.7750210950862197
Energy: 0.7774281464010951
Energy: 0.8215244755309593
Energy: 0.7703849740266224
Energy: 0.7887174832863184
Energy: 0.7135527093260569
Energy: 0.7983188402226862
Energy: 0.7350325091080402
Energy: 0.7118283309920591
Energy: 0.8033443784843206
Energy: 0.7649989057205909
Energy: 0.7122738536223332
Energy: 0.7857448434016288
Energy: 0.7714977022929507
Energy: 0.71336409096594
Energy: 0.7972652226378054
Energy: 0.7429655110082543
Energy: 0.7905306397656199
Energy: 0.7764829075289104
Energy: 0.8006533431841899
Energy: 0.776228856295794
Energy: 0.7628984842598704
Energy: 0.7895368352337837
Energy: 0.8014055328732806
Energy: 0.7829417271144549
Energy: 0.7762076230859224
Energy: 0.7910293970023848
Energy: 0.7871393325802317
Energy: 0.7683363192854867
Energy: 0.7457396206562141
Energy: 0.8092071155190974
Energy: 0.7925448748030645
Energy: 0.7467767070394425
Energy: 0.8118721086265276
Energy: 0.7922459087014496
Energy: 0.7902813433920365
Energy: 0.8095813387303372
Energy: 0.7819317591084602
Energy: 0.7605701096438736
Energy: 0.8094813233504592
Energy: 0.789319451134282
Energy: 0.8036125950936804
Energy: 0.7151828574693948
Energy: 0.7440161838508964
Energy: 0.804229340794476
Energy: 0.7132986630422397
Energy: 0.7452277605213615
Energy: 0.8039544821233326
Energy: 0.7153565786610985
Energy: 0.7142402094900285
Energy: 0.803814843167684
Energy: 0.7136512683679296
Energy: 0.7408254257449849
Energy: 0.919693102607345
Energy: 0.7761112426828943
Energy: 0.798955373009448
Energy: 0.7610269981642154
Energy: 0.8009089873671189
Energy: 0.7996029073674618
Energy: 0.7547868706183665
Energy: 0.8306410766438055
Energy: 0.8312355637018519
Energy: 0.7560196802528301
Energy: 0.8317053943924291
Energy: 0.827258626251763
Energy: 0.8041214169873911
Energy: 0.7732300270593054
Energy: 0.8166389312303868
Energy: 0.8108031741751207
Energy: 0.7709227530424588
Energy: 0.8150098010443533
Energy: 0.8053600466533426
Energy: 0.7975551540010224
Energy: 0.7864665916826166
Energy: 0.7891399794861993
Energy: 0.7627294316121612
Energy: 0.8050847649952667
Energy: 0.7887877825667511
Energy: 0.8265610873420786
Energy: 0.8277375436451999
Energy: 0.7894351914122508
Energy: 0.8263281159727284
Energy: 0.7819606977300214

minimum gb energy = 0.7118283309920591 eV
minimum distance =  2.67877932440171 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.1319622693370908
Energy: 0.8626938025901658
Energy: 1.0766550850820062
Energy: 0.970090786685238
Energy: 0.8041228499830515
Energy: 1.0820320693545538
Energy: 0.7838749109265525
Energy: 0.7656515358296612
Energy: 0.7763009555897246
Energy: 0.7915091750836031
Energy: 0.756434594684152
Energy: 0.7805714582057156
Energy: 0.804474584009327
Energy: 0.7608297490264492
Energy: 0.7876489469655223
Energy: 0.7969894048975139
Energy: 0.7611032002136828
Energy: 0.8369223782222327
Energy: 0.7915687992661276
Energy: 0.7854221607860977
Energy: 0.7842382786390594
Energy: 0.8001574259381907
Energy: 0.7599617019547829
Energy: 0.7837367400071408
Energy: 0.7683724578132568
Energy: 0.8486514924107907
Energy: 0.839634602889376
Energy: 0.7694292473131481
Energy: 0.8436821755544486
Energy: 0.8387392566265846
Energy: 0.7760851731437547
Energy: 0.7849458483225662
Energy: 0.7842039387655503
Energy: 0.7756575950037866
Energy: 0.7871201003992273
Energy: 0.7766146071213895
Energy: 0.8137842909052845
Energy: 0.7613774826000139
Energy: 0.7800994510814896
Energy: 0.7823709803225098
Energy: 0.7659168360130578
Energy: 0.7536777325259302
Energy: 0.8072155265421472
Energy: 0.7777494205375253
Energy: 0.7817789173073288
Energy: 0.8079372625203167
Energy: 0.7779567975493535
Energy: 0.7880552026641799
Energy: 0.7560919104138666
Energy: 0.7847931248024785
Energy: 0.7735857350893524
Energy: 0.7580790395525995
Energy: 0.7943005201794583
Energy: 0.7678108727251404
Energy: 0.7610442845654539
Energy: 0.7973815920202494
Energy: 0.7856499121486384
Energy: 0.7634447738454848
Energy: 0.7846987109319297
Energy: 0.7805374763604646
Energy: 0.9495945541610669
Energy: 0.7741394063872334
Energy: 0.8889467353529907
Energy: 0.9457843415381944
Energy: 0.743276321191714
Energy: 0.7638327104054444
Energy: 0.7869237588547928
Energy: 0.7468917285532718
Energy: 0.7688249578567716
Energy: 0.7884176675902614
Energy: 0.7417859019956753
Energy: 0.7757286255643355
Energy: 0.7854244956583117
Energy: 0.7918236141636543
Energy: 0.7885421400817442
Energy: 0.7673268822623368
Energy: 0.7872203964745982
Energy: 0.7663871851264729
Energy: 0.822049546640085
Energy: 0.7718203549059655
Energy: 0.7765934668960878
Energy: 0.7467468412017746
Energy: 0.7662216523083105
Energy: 0.7759118804450671
Energy: 0.7867739451987479
Energy: 0.7495004220126239
Energy: 0.7573763014667768
Energy: 0.7868122686299829
Energy: 0.7494796858589657
Energy: 0.7647404945675058
Energy: 0.7864773236488586
Energy: 0.7527927612225324
Energy: 0.7645326977742353
Energy: 0.7834988978069252
Energy: 0.7379134402133033
Energy: 0.7689467471441737
Energy: 0.7570024908825065
Energy: 0.7722900987782741
Energy: 0.7906485601026372
Energy: 0.7414700846564785
Energy: 0.7740244515027708
Energy: 0.7710717130633263
Energy: 0.8124333097528152
Energy: 0.7729367096870025
Energy: 0.77215881397121
Energy: 0.7422500138391718
Energy: 0.8010397876712533
Energy: 0.7851631107526712
Energy: 0.805103272048699
Energy: 0.7582053658573937
Energy: 0.7604469695951288
Energy: 0.8001033190009508
Energy: 0.7677548889587961
Energy: 0.7644207920954809
Energy: 0.7903463570792262
Energy: 0.764336543030528
Energy: 0.7807324674956978
Energy: 0.7910457851300042
Energy: 0.7479820182566614
Energy: 0.7826872242544403
Energy: 0.7534928140157784
Energy: 0.7728572606940721
Energy: 0.7688468332782502
Energy: 0.7532878790699725
Energy: 0.7860315630626138
Energy: 0.7644996195892942
Energy: 0.7459229440783796
Energy: 0.7827955447783561
Energy: 0.7799410213684186
Energy: 0.7465757254692543
Energy: 0.7603168191196179
Energy: 0.7610233923787993
Energy: 0.7832453810844047
Energy: 0.7713181468215781
Energy: 0.7635637330138624
Energy: 0.7840127625842925
Energy: 0.7798212805836822
Energy: 0.758688031062417
Energy: 0.8154810218869762
Energy: 0.760397200202638
Energy: 0.7719245858996383
Energy: 0.815980778311413
Energy: 0.7411401475307967
Energy: 0.7740929868047788
Energy: 0.7931207442269681
Energy: 0.7731001433317102
Energy: 0.7766053512400614
Energy: 0.7473544873167853
Energy: 0.7949041350661401
Energy: 0.7719801570644076
Energy: 0.7617652210264414
Energy: 0.785663544265582
Energy: 0.7851687632314516
Energy: 0.7567157259731002
Energy: 0.7854547707866785
Energy: 0.7668028210363916
Energy: 0.7939650284039215
Energy: 0.7658358204540886
Energy: 0.7659264299126978
Energy: 0.7872791175114479
Energy: 0.7644393737712454
Energy: 0.7794207327735484
Energy: 0.7978804501349632
Energy: 0.7611997575633227
Energy: 0.7695747341614283
Energy: 0.7932690854573421
Energy: 0.7595609274056278
Energy: 0.7668416888748303
Energy: 0.8069451847725674
Energy: 0.7983323963536849
Energy: 0.7984546574732495
Energy: 0.7331582031512668
Energy: 0.7980621119211236
Energy: 0.759019459382513

minimum gb energy = 0.7331582031512668 eV
minimum distance =  2.67127466993765 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.0696317641611004
Energy: 1.128971559378645
Energy: 1.1296960850066255
Energy: 0.9356598933183607
Energy: 0.7480920939111275
Energy: 0.9372692984507087
Energy: 0.760570182527344
Energy: 0.7386225774033308
Energy: 0.7370374062326471
Energy: 0.7377440477383176
Energy: 0.7423684708790391
Energy: 0.7464739598468781
Energy: 0.8856642879647029
Energy: 0.758679638470416
Energy: 0.75445691850272
Energy: 0.8605882847348785
Energy: 0.7400367944494203
Energy: 0.7614933645787852
Energy: 0.7714904665091747
Energy: 0.7471130556456643
Energy: 0.7452832504293355
Energy: 0.7458523299330588
Energy: 0.7478539814997784
Energy: 0.7447554087126064
Energy: 0.7783583147300308
Energy: 0.8669262992922587
Energy: 0.859590461815882
Energy: 0.7501335967481482
Energy: 0.8580231964210012
Energy: 0.7654890549863818
Energy: 0.7507140514312077
Energy: 0.7365080076271554
Energy: 0.7423616791983696
Energy: 0.7583909846005594
Energy: 0.734944959749788
Energy: 0.7469820437874999
Energy: 0.7781538436839446
Energy: 0.755296461991466
Energy: 0.7537798340336495
Energy: 0.7633232897885252
Energy: 0.7550199402244704
Energy: 0.8633222132483547
Energy: 0.7518448130569401
Energy: 0.7481214801969025
Energy: 0.7443859490018513
Energy: 0.7612663383513888
Energy: 0.7413832051636577
Energy: 0.7668212568387652
Energy: 0.7342692010689249
Energy: 0.7587908967653602
Energy: 0.7492074119729398
Energy: 0.7353439947697517
Energy: 0.7728965772178632
Energy: 0.7400755315299598
Energy: 0.7383330725208216
Energy: 0.7531615610770662
Energy: 0.7464024936127741
Energy: 0.7577967455580754
Energy: 0.7425646894531863
Energy: 0.7459055605788615
Energy: 0.8592818312207037
Energy: 0.74994943579122
Energy: 0.7507839273813586
Energy: 0.860330660279159
Energy: 0.7504725674603459
Energy: 0.9442307250877573
Energy: 0.7784904151414619
Energy: 0.7405548783676947
Energy: 0.7436508828468869
Energy: 0.7629077984949109
Energy: 0.7382059100391685
Energy: 0.7430659682057529
Energy: 0.7497961750873113
Energy: 0.755384617680079
Energy: 0.7427290704530602
Energy: 0.7344754463917693
Energy: 0.7662095931890366
Energy: 0.7433312534909824
Energy: 0.7456004345630982
Energy: 0.7545241596023362
Energy: 0.7536153803201513
Energy: 0.73314776666615
Energy: 0.7404856591143905
Energy: 0.7540736911282577
Energy: 0.7882293261941299
Energy: 0.7537815433607603
Energy: 0.7436714109916714
Energy: 0.7889840774214919
Energy: 0.7519104772922258
Energy: 0.7468121004293067
Energy: 0.7874362053987235
Energy: 0.7343527392242681
Energy: 0.7372664521740384
Energy: 0.7547105097659262
Energy: 0.7347110627989862
Energy: 0.7448877019600574
Energy: 0.7424411755048361
Energy: 0.7600579534713062
Energy: 0.7422552566077121
Energy: 0.7217332501137008
Energy: 0.7965216301252175
Energy: 0.9369828870414516
Energy: 0.7597002207260615
Energy: 0.7613913307784481
Energy: 0.752944340986004
Energy: 0.7429787168518928
Energy: 0.7572582101835017
Energy: 0.7477716943233476
Energy: 0.7882060654485222
Energy: 0.7400143231474725
Energy: 0.7367196312455209
Energy: 0.7708042759805683
Energy: 0.7366233922500552
Energy: 0.7351553701166553
Energy: 0.7623535292996726
Energy: 0.7378273806463862
Energy: 0.7468453363846828
Energy: 0.756296723202804
Energy: 0.7368551734768841
Energy: 0.7515397484983446
Energy: 0.7520782780308788
Energy: 0.7491751974981516
Energy: 0.8603520409933727
Energy: 0.7502291886122389
Energy: 0.747503547164772
Energy: 0.7315282183363774
Energy: 0.7502974828350442
Energy: 0.7341893760874837
Energy: 0.7387627111563552
Energy: 0.7489160877211328
Energy: 0.7563609433747979
Energy: 0.7372765585559403
Energy: 0.763754135842593
Energy: 0.7333341868253257
Energy: 0.7380050115967641
Energy: 0.7580561930991265
Energy: 0.7515262557574867
Energy: 0.7331117200403674
Energy: 0.7680452184858797
Energy: 0.7349461264183595
Energy: 0.7452041199354937
Energy: 0.7621107751013539
Energy: 0.7388592541434711
Energy: 0.7571538425053349
Energy: 0.7376370107310123
Energy: 0.7464336913925983
Energy: 0.7367483285998155
Energy: 0.7385725404993283
Energy: 0.7655507383185963
Energy: 0.7366289376713141
Energy: 0.7371028443822191
Energy: 0.7508808603579424
Energy: 0.7445930859892139
Energy: 0.7382087676257072
Energy: 0.7655084601840274
Energy: 0.7366569723340765
Energy: 0.7737369546821213
Energy: 0.7227364698015017
Energy: 0.7250106051566793
Energy: 0.7463767774487968
Energy: 0.7207965788476289
Energy: 0.729862224322318
Energy: 0.7871726819099197
Energy: 0.7379607794909365
Energy: 0.7362552633789563
Energy: 0.762510392463642
Energy: 0.7227717363070469
Energy: 0.7401340056668367
Energy: 0.7476593811954101
Energy: 0.7515770855173588
Energy: 0.7398199070990457
Energy: 0.7351358320476924
Energy: 0.7732091040587245
Energy: 0.7386431857367262
Energy: 0.7457833051540409
Energy: 0.7575558329221658
Energy: 0.747686899158199
Energy: 0.7323661330798881
Energy: 0.7587469939430321
Energy: 0.7479420663104861
Energy: 0.7866446467464339
Energy: 0.7404308872754112
Energy: 0.7377390480754802
Energy: 0.762622570685947
Energy: 0.7399217916254377
Energy: 0.7400490979614708
Energy: 0.7880015005694472
Energy: 0.7391287155109835
Energy: 0.735698153260331
Energy: 0.7654550827006685
Energy: 0.7365806593898199
Energy: 0.7338002023973472
Energy: 0.7448173816002436
Energy: 0.7900466959111835
Energy: 0.7415238966993664
Energy: 0.7182932657180071
Energy: 0.7916685585107812
Energy: 0.7250704814376345

minimum gb energy = 0.7182932657180071 eV
minimum distance =  2.68204729136684 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.012993843716583929
Energy: 0.013948017267421724
Energy: 0.013571951320719498
Energy: 0.01421541112695911
Energy: 0.5845887612437349
Energy: 0.013459819679206293
Energy: 0.01430895575003835
Energy: 0.07920811517919056
Energy: 0.0787100802372425
Energy: 0.07809485718758198
Energy: 0.07832688119876055
Energy: 0.07818930962103787
Energy: 0.7711455788909631
Energy: 0.5857875422211309
Energy: 0.5847157977651689
Energy: 0.5841259094273246
Energy: 0.5849737812319766
Energy: 0.5844475646637042
Energy: 0.014308955750386869
Energy: 0.07920811517783521
Energy: 0.0787100802372425
Energy: 0.07809485718860817
Energy: 0.0783268812001159
Energy: 0.07818930962171554

minimum gb energy = 0.012993843716583929 eV
minimum distance =  2.85041245706496 Angstroms
sigma value = 1