Model name: model_name=EAM_Dynamo_DeluigiPasianotValencia_2021_FeNiCrCoCu__MO_657255834688_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.620000123977662
cohesive_energy=3.54027837806963
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.2894463229206397e-19, 2.31359112479502e-19, 2.8343786396767197e-19, 3.5391601192069794e-19, 4.1614775673852596e-19, 4.492855760595479e-19, 4.62119010897888e-19, 4.706906558897879e-19, 4.7931997924051195e-19, 4.87808311047444e-19, 4.96823758966962e-19, 5.062605793412219e-19, 5.15751873721038e-19, 5.24908313184348e-19, 5.33362999281966e-19, 5.408756055187919e-19, 5.47346796943518e-19, 5.527974018523859e-19, 5.57304324723828e-19, 5.60942867859642e-19, 5.63740268262606e-19, 5.65691719402818e-19, 5.668116408699839e-19, 5.67170528436e-19, 5.66814845223252e-19, 5.657894521774919e-19, 5.6417445813042e-19, 5.62025939264226e-19, 5.59201301858484e-19, 5.55131773208124e-19, 5.4890251045513195e-19, 5.396066816246639e-19, 5.26598609533218e-19, 5.0940404989713e-19, 4.87547156256102e-19, 4.604911994377439e-19, 4.2753122172309596e-19, 3.8725890985087196e-19, 3.3736712946811197e-19, 2.75827524956172e-19, 2.0641963099465799e-19, 1.359092792912886e-19, 5.43669801568488e-20, -6.71411344597308e-20, -2.03583778352478e-19, -2.8519064520526797e-19, -9.909991199579219e-20, 1.126437519536478e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013617061562425193
Energy: 0.09884645063377967
Energy: 0.45057516724749164
Energy: 0.013887453378122359
Energy: 0.09884645063377967
Energy: 0.4526132649898686
Energy: 0.013887453378122359
Energy: 0.452613264995359
Energy: 0.4505751672542329
Energy: 0.013887453378122359
Energy: 0.013617061562425193
Energy: 0.09884645063437038
Energy: 0.013887453377496875
Energy: 0.45261326499720067
Energy: 0.09884645063377967
Energy: 0.452613264995359

minimum gb energy = 0.013617061562425193 eV
minimum distance =  2.48047802005315 Angstroms
sigma value = 1


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

Energy: 0.8417213217901423
Energy: 0.8046029743601503
Energy: 0.8038787973569885
Energy: 0.7260469038059324
Energy: 0.7203499451194727
Energy: 0.7955149573855299
Energy: 0.7203330098604618
Energy: 0.7955149573847714
Energy: 0.8060808769770208
Energy: 0.8005401071732836
Energy: 0.8492358016601381
Energy: 0.8005401071725251
Energy: 0.7220164096156836
Energy: 0.721154757076233
Energy: 0.7208770014401965
Energy: 0.7211547570754744
Energy: 0.8501378964142868
Energy: 0.7200912192711865
Energy: 0.7208050059559632
Energy: 0.7200912192711865
Energy: 0.7660247174617446
Energy: 0.8305013462158793
Energy: 0.7200687728024548
Energy: 0.8305013462166378
Energy: 0.7459077467397517
Energy: 0.7780180317045046
Energy: 0.8415007476897378
Energy: 0.7780180317045046
Energy: 0.7665769751277912
Energy: 0.892982680111029
Energy: 0.8034791140037846
Energy: 0.8929826801117875
Energy: 0.8162787211654651
Energy: 0.8258678381663217
Energy: 0.8136685769244475
Energy: 0.8258678381670802
Energy: 0.8001701850627672
Energy: 0.8731185758181355
Energy: 0.8051468765500377
Energy: 0.8731185758181355
Energy: 0.8570323269422405
Energy: 0.8255178623753799
Energy: 0.8152271880693408
Energy: 0.8255178623761384
Energy: 0.7663618044183975
Energy: 0.8928188403692394
Energy: 0.8027289818284515
Energy: 0.8928188403707564
Energy: 0.7459823858142328
Energy: 0.7774160702227096
Energy: 0.7168606745027939
Energy: 0.7774160702219511
Energy: 0.7660024466259877
Energy: 0.8337783265380577
Energy: 0.7165820005758592
Energy: 0.8337783265380577
Energy: 0.7161699109938442
Energy: 0.7203859747850571
Energy: 0.721095310516564
Energy: 0.7203859747850571
Energy: 0.7203940314406351
Energy: 0.7199091988589772
Energy: 0.7197056974012557
Energy: 0.7199091988908375
Energy: 0.7986065329390836
Energy: 0.7261870627674067
Energy: 0.720632737849207
Energy: 0.7261870627636138
Energy: 0.7200985701745982
Energy: 0.8792370645143522
Energy: 0.7177050739982336
Energy: 0.8792370645128351
Energy: 0.7187054290140733
Energy: 0.7993835789386703
Energy: 0.7990521306445536
Energy: 0.7993835789386703
Energy: 0.7622904984232535
Energy: 0.7958876151777486
Energy: 0.7219504417710273
Energy: 0.7958876151769901
Energy: 0.72385753334351
Energy: 0.7204074948671378
Energy: 0.9204681486870754
Energy: 0.7204074948671378
Energy: 0.7198344108833321
Energy: 0.7207167427433745
Energy: 0.7660064747709767
Energy: 0.7207167427426159
Energy: 0.7625985869029799
Energy: 0.7796544354488992
Energy: 0.7452269373434511
Energy: 0.779654435447382
Energy: 0.8030770217026522
Energy: 0.8955923985721738
Energy: 0.7633906384835554
Energy: 0.8955923985736911
Energy: 0.7956002189534057
Energy: 0.8279639703747693
Energy: 0.8170239385447566
Energy: 0.8279639703747693
Energy: 0.8023691694658186
Energy: 0.875739757879179
Energy: 0.80065426967642
Energy: 0.8757397578799376
Energy: 0.8155621096085414
Energy: 0.8270507371113466
Energy: 0.8553392790314817
Energy: 0.8270507371113466
Energy: 0.8036780908837805
Energy: 0.8526508062538907
Energy: 0.7649818578505603
Energy: 0.8526508062538907
Energy: 0.718866217620616
Energy: 0.7772905407742178
Energy: 0.7429092968837628
Energy: 0.7772905407727007
Energy: 0.7164925438208826
Energy: 0.8323839350578128
Energy: 0.7662234698628855
Energy: 0.8323839350585714
Energy: 0.7188281941942253
Energy: 0.7195747429535514
Energy: 0.716239597608914
Energy: 0.7195747429535514
Energy: 0.7199008663022218
Energy: 0.7187568700735703
Energy: 0.7199624464241647
Energy: 0.7187568700743289
Energy: 0.7201144519771902
Energy: 0.7267974537767239
Energy: 0.7977700050912904
Energy: 0.7267974537759653

minimum gb energy = 0.7161699109938442 eV
minimum distance =  2.32988652910458 Angstroms
sigma value = 1


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

Energy: 0.8888091998039787
Energy: 0.8422545503240406
Energy: 0.8404579682442845
Energy: 0.7521204836090967
Energy: 0.7492709170120774
Energy: 0.8267856179580593
Energy: 0.749599528781686
Energy: 0.826785617959789
Energy: 0.8391946945467296
Energy: 0.8407292408415655
Energy: 0.8818402462178736
Energy: 0.8407292408476199
Energy: 0.7520135274900249
Energy: 0.7495220531693342
Energy: 0.7501918341104556
Energy: 0.7495220531650096
Energy: 0.7473733298119435
Energy: 0.7494818393088464
Energy: 0.7488146501798956
Energy: 0.7494818393079814
Energy: 0.7991224755187792
Energy: 0.7501889789768434
Energy: 0.7484636064474683
Energy: 0.7501889789759785
Energy: 0.7867194055333365
Energy: 0.8183608737382564
Energy: 0.8817580397232171
Energy: 0.8183608737313371
Energy: 0.8012775028426409
Energy: 0.9053044970206883
Energy: 0.8508304114573583
Energy: 0.9053044970189583
Energy: 0.8068527406884708
Energy: 0.8671415224810199
Energy: 0.8177036526431234
Energy: 0.8671415224723709
Energy: 0.850292892426265
Energy: 0.9054029119837081
Energy: 0.801613831348118
Energy: 0.9054029119897625
Energy: 0.7486399048372518
Energy: 0.8196898306542906
Energy: 0.7856713450174947
Energy: 0.8196898306568854
Energy: 0.7487646260829139
Energy: 0.8568922136427424
Energy: 0.7997294213127117
Energy: 0.8568922136401476
Energy: 0.751240066924188
Energy: 0.7489559811820988
Energy: 0.7490811289800616
Energy: 0.748955981180369
Energy: 0.7487461953680565
Energy: 0.8980612115288332
Energy: 0.7453704983785557
Energy: 0.8980612115271034
Energy: 0.7465250776669077
Energy: 0.7525600537165631
Energy: 0.8360261951883111
Energy: 0.7525600537088182
Energy: 0.7496459505482387
Energy: 0.8973025053141687
Energy: 0.7492427322213195
Energy: 0.8973025053167634
Energy: 0.8360151732696579
Energy: 0.8374726778285972
Energy: 0.7475985040179121
Energy: 0.8374726778190833
Energy: 0.7523522295549556
Energy: 0.8271542354486597
Energy: 0.7982974287504387
Energy: 0.8271542354564437
Energy: 0.7488366290687473
Energy: 0.7507175328052347
Energy: 0.7491444388939218
Energy: 0.7507175328078294
Energy: 0.7999373154526704
Energy: 0.7486276801964966
Energy: 0.7486150622543198
Energy: 0.7486276801887124
Energy: 0.7864223298563516
Energy: 0.8227096083426636
Energy: 0.8839211416820206
Energy: 0.8227096083478531
Energy: 0.7991527768603072
Energy: 0.7968166593525267
Energy: 0.8004390485661698
Energy: 0.7968166593490671
Energy: 0.8078098366913118
Energy: 0.8699724528467283
Energy: 0.8184599240673116
Energy: 0.869972452851053
Energy: 0.8523185288421355
Energy: 0.8643154375111585
Energy: 0.801000508447913
Energy: 0.8643154375128882
Energy: 0.7499341782966276
Energy: 0.8185421120798569
Energy: 0.786440022570138
Energy: 0.8185421120815868
Energy: 0.7488190298190579
Energy: 0.8516023342896002
Energy: 0.8013537275285849
Energy: 0.8516023342835457
Energy: 0.748481405793875
Energy: 0.7485525075470706
Energy: 0.9332990768656747
Energy: 0.7485525075488004
Energy: 0.7484821733262704
Energy: 0.7485556252396256
Energy: 0.7453477958771936
Energy: 0.748555625236166
Energy: 0.7452809640891158
Energy: 0.7568587722925575
Energy: 0.8356453072197177
Energy: 0.7568587723020715

minimum gb energy = 0.7452809640891158 eV
minimum distance =  2.32812431260431 Angstroms
sigma value = 25


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

Energy: 0.9166451528115708
Energy: 0.8814301780759581
Energy: 0.8818608074226104
Energy: 0.7788752529772909
Energy: 0.7784419894519683
Energy: 0.8573992818108372
Energy: 0.7784526829693516
Energy: 0.8573992818098318
Energy: 0.8790217413627432
Energy: 0.8794437062478843
Energy: 0.8766456403306027
Energy: 0.8794437062478843
Energy: 0.7846022904904469
Energy: 0.8591439685784721
Energy: 0.7799764282529706
Energy: 0.8591439685784721
Energy: 0.7762398820759031
Energy: 0.7806619954981807
Energy: 0.7798635624032665
Energy: 0.780661995499186
Energy: 0.8097317709438594
Energy: 0.7800216242916026
Energy: 0.7796741346248329
Energy: 0.7800216242855701
Energy: 0.8362469199085378
Energy: 0.8687180403259562
Energy: 0.8377402541093764
Energy: 0.8687180403269618
Energy: 0.8086025543639839
Energy: 0.9236935551139664
Energy: 0.7921287794600981
Energy: 0.9236935551149719
Energy: 0.8384472286267115
Energy: 0.8678934409373903
Energy: 0.8866760463427019
Energy: 0.8678934409373903
Energy: 0.8100675331277334
Energy: 0.8804588662778003
Energy: 0.7794111906360731
Energy: 0.8804588662778003
Energy: 0.7695761713366701
Energy: 0.7799733126483107
Energy: 0.7786440829381219
Energy: 0.7799733126483107
Energy: 0.7687757887020159
Energy: 0.7854662238484723
Energy: 0.7791267540982965
Energy: 0.7854662238494776
Energy: 0.8778199260150591
Energy: 0.7838513339233295
Energy: 0.7679025556654011
Energy: 0.7838513339233295
Energy: 0.7788314564735442
Energy: 0.784728186463502
Energy: 0.7859840869454884
Energy: 0.7847281864655127
Energy: 0.7750588770153938
Energy: 0.878014314153272
Energy: 0.8782018529799597
Energy: 0.8780143141542774
Energy: 0.8072837114050523
Energy: 0.8574776340069704
Energy: 0.7841331220257085
Energy: 0.8574776340079758
Energy: 0.7794830381349942
Energy: 0.780937735422716
Energy: 0.7763030286993858
Energy: 0.780937735422716
Energy: 0.7799072739548784
Energy: 0.7797313082068165
Energy: 0.810243035427986
Energy: 0.7797313082068165
Energy: 0.8395635904376758
Energy: 0.870496946979501
Energy: 0.8100314866901488
Energy: 0.8704969469784953
Energy: 0.7925201021921586
Energy: 0.8448915830632109
Energy: 0.8115966128919999
Energy: 0.8448915830622056
Energy: 0.8848259890537626
Energy: 0.8681076675037024
Energy: 0.8382470219587144
Energy: 0.8681076675026969
Energy: 0.7859408539417027
Energy: 0.8779404511769451
Energy: 0.809220436789554
Energy: 0.8779404511779506
Energy: 0.7798130603433757
Energy: 0.7797342885463955
Energy: 0.7689915404806933
Energy: 0.77973428854539
Energy: 0.7791280853579596
Energy: 0.7834757945004986
Energy: 0.7689008851644892
Energy: 0.7834757944994931
Energy: 0.767331735078126
Energy: 0.7968248572638095
Energy: 0.8756267765142061
Energy: 0.7968248572638095

minimum gb energy = 0.767331735078126 eV
minimum distance =  2.33283003709696 Angstroms
sigma value = 9


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

Energy: 0.9752607645041168
Energy: 0.9359271372342725
Energy: 0.9366984529043872
Energy: 0.8596742084947993
Energy: 0.8255770231250933
Energy: 0.8973344470404653
Energy: 0.8789395554472378
Energy: 0.8973344470392658
Energy: 0.9356851887804958
Energy: 0.9354990999545364
Energy: 0.9925751540137749
Energy: 0.9354990999545364
Energy: 0.8296973446510777
Energy: 0.8983362595878684
Energy: 0.8443979696815422
Energy: 0.8983362595914669
Energy: 0.9024097513429001
Energy: 0.8304326934789195
Energy: 0.8316526732711134
Energy: 0.83043269347772
Energy: 0.8586448042782949
Energy: 0.8420812310078687
Energy: 0.8429190216792936
Energy: 0.8420812310066692
Energy: 0.868397188713527
Energy: 0.9415926719038079
Energy: 0.8423754820305228
Energy: 0.9415926719050072
Energy: 0.8861611339834758
Energy: 0.9479344518284032
Energy: 0.9263941684378276
Energy: 0.9479344518284032
Energy: 0.879117319577804
Energy: 0.8852123746626929
Energy: 0.8530544034383013
Energy: 0.8852123746638924
Energy: 0.8276818344809967
Energy: 0.7850664221794573
Energy: 0.8145653336937575
Energy: 0.7850664221806568
Energy: 0.7834485734739756
Energy: 0.8053846796279245
Energy: 0.8041151813603872
Energy: 0.8053846796267251
Energy: 0.8272921618000252
Energy: 0.785251164893935
Energy: 0.8042055510691207
Energy: 0.7852511648927356
Energy: 0.986689526318643
Energy: 0.9859704197163632
Energy: 0.9915709108772204
Energy: 0.9859704197175627
Energy: 0.8536622582613448
Energy: 0.7833360971644046
Energy: 0.9449827128145702
Energy: 0.7833360971632052
Energy: 0.7980642882258793
Energy: 0.8516269517920021
Energy: 0.8411886796856434
Energy: 0.851626951794401
Energy: 0.8682543802078116
Energy: 0.8511587300386843
Energy: 0.8388717504732123
Energy: 0.8511587300374848
Energy: 0.8386236127705509
Energy: 0.9478707584928971
Energy: 0.8484274867220276
Energy: 0.947870758495296
Energy: 0.8396242387205014
Energy: 0.9357020703953257
Energy: 0.8435326459521801
Energy: 0.9357020703965252
Energy: 0.8249223898551737
Energy: 0.8272713818229726
Energy: 0.8146690545052758
Energy: 0.8272713818241719
Energy: 0.8471639482333022
Energy: 0.8313261911744669
Energy: 0.8148536799676036
Energy: 0.8313261911768659
Energy: 0.8487119896602474
Energy: 0.8344500517795358
Energy: 0.9288943677697076
Energy: 0.8344500517771369

minimum gb energy = 0.7833360971632052 eV
minimum distance =  2.31493833018141 Angstroms
sigma value = 25


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

Energy: 0.8895662539226372
Energy: 0.9677853214942855
Energy: 0.9466318652006261
Energy: 0.7916059887727709
Energy: 0.8057886889181524
Energy: 0.8556776240344528
Energy: 0.8057454718877867
Energy: 0.8556776240344528
Energy: 0.944494574219135
Energy: 0.9537724744023189
Energy: 0.9442792505896224
Energy: 0.9537724744023189
Energy: 0.790090282903896
Energy: 0.8574120842168458
Energy: 0.8057970456739004
Energy: 0.857412084218329
Energy: 0.8364251405940739
Energy: 0.8937862451334593
Energy: 0.8172015472712567
Energy: 0.893786245131976
Energy: 0.7888037659841329
Energy: 0.8044181543011985
Energy: 0.8017003001524589
Energy: 0.8044181543086151
Energy: 0.7875138761907675
Energy: 0.8940463993639323
Energy: 0.8072078577959986
Energy: 0.8940463993624489
Energy: 0.7870472640916486
Energy: 0.8597095747227781
Energy: 0.8069357005110206
Energy: 0.8597095747242613
Energy: 0.9483405661859442
Energy: 0.948734317702546
Energy: 1.1369278705417798
Energy: 0.9487343177010628
Energy: 0.805706470760529
Energy: 0.8600776999814882
Energy: 0.7885164904888375
Energy: 0.8600776999800048
Energy: 0.9442652177972446
Energy: 0.9517628369134807
Energy: 0.9474461466959229
Energy: 0.9517628369134807
Energy: 0.9552171897167179
Energy: 0.858164985176613
Energy: 0.7881751936812876
Energy: 0.858164985176613
Energy: 0.8031272571039516
Energy: 0.8902364969042043
Energy: 0.8392628945653227
Energy: 0.8902364969056875
Energy: 0.8064124676138118
Energy: 0.898980346853728
Energy: 0.7908650563823566
Energy: 0.898980346853728
Energy: 0.8079078551999468
Energy: 0.9039942365404452
Energy: 0.787206097293057
Energy: 0.9039942365404452
Energy: 0.8035324869120749
Energy: 0.9057827759680714
Energy: 0.7869853152950422
Energy: 0.9057827759695548
Energy: 0.9449589418982285
Energy: 0.8951162302969873
Energy: 0.9463327361437046
Energy: 0.8951162302969873

minimum gb energy = 0.7869853152950422 eV
minimum distance =  2.32430682619121 Angstroms
sigma value = 17


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

Energy: 1.3362683667320403
Energy: 1.0485470086506479
Energy: 1.0486255112150151
Energy: 0.9501603874203982
Energy: 0.8077273823223865
Energy: 0.8771415634220774
Energy: 0.8769000820169678
Energy: 0.877141563417037
Energy: 0.873792843311133
Energy: 0.8736474741793937
Energy: 1.0503503778331158
Energy: 0.8736474741793937
Energy: 0.878488879838456
Energy: 0.9180658066111466
Energy: 0.8757002924121359
Energy: 0.9180658066086262
Energy: 0.878999638484861
Energy: 0.9262191877694008
Energy: 0.7998865266916115
Energy: 0.9262191877408381
Energy: 0.8729118780219615
Energy: 0.9196132533846126
Energy: 0.880358273283625
Energy: 0.9196132533820923
Energy: 0.9594916660784162
Energy: 0.8744704665191407
Energy: 0.8800641159093308
Energy: 0.8744704665199807
Energy: 1.0352820737972632
Energy: 0.8990634140053471
Energy: 0.8079347419512314
Energy: 0.8990634140061872
Energy: 1.049539813672035
Energy: 1.0472986914140963
Energy: 1.056860439569302
Energy: 1.0472986914149363
Energy: 1.0351090384778776
Energy: 0.9196342866195707
Energy: 0.8763566330847927
Energy: 0.9196342866204107
Energy: 0.8770758132673172
Energy: 0.8082675814962307
Energy: 0.8034417347430529
Energy: 0.8082675814962307
Energy: 0.9477517089433645
Energy: 0.8102211635393459
Energy: 0.8098609015039326
Energy: 0.8102211635410262
Energy: 0.9547983903976663
Energy: 0.8098039569408035
Energy: 0.8110039921405633
Energy: 0.809803956923162
Energy: 0.9538017777983068
Energy: 0.9511317149521086
Energy: 0.8045992123787334
Energy: 0.9511317149546288
Energy: 1.0497369234997223
Energy: 0.9203243023777414
Energy: 1.0338451455843838
Energy: 0.9203243023752212
Energy: 1.0522807708666455
Energy: 0.9223503900000671
Energy: 1.135493097510541
Energy: 0.9223503900000671
Energy: 0.9499557094265462
Energy: 0.8991696141815456
Energy: 0.8751669275737655
Energy: 0.8991696141815456
Energy: 0.9490741879669952
Energy: 0.8992392254330215
Energy: 0.8741488905011828
Energy: 0.8992392254338616
Energy: 0.8746922496498295
Energy: 0.9221436541713468
Energy: 0.879261246338701
Energy: 0.9221436541730269
Energy: 0.8660822684150543
Energy: 0.8572457277083321
Energy: 0.8811083844664199
Energy: 0.8572457277175728
Energy: 0.8784295250805726
Energy: 0.89906482679718
Energy: 0.9390857248801487
Energy: 0.89906482679718
Energy: 0.8739021479476351
Energy: 0.874916664180132
Energy: 0.9564951456465303
Energy: 0.874916664179292
Energy: 0.9591684657966303
Energy: 0.9189595819765101
Energy: 0.9638599439001423
Energy: 0.91895958197483
Energy: 1.0490375715646187
Energy: 1.050638821588568
Energy: 1.046017369324277
Energy: 1.050638821590248
Energy: 0.808614412396155
Energy: 0.8991903618474694
Energy: 1.0403268456352488
Energy: 0.8991903618457892
Energy: 0.8223904560181331
Energy: 0.8092796824327588
Energy: 0.8764022686315923
Energy: 0.8092796824218379
Energy: 0.8019857579059994
Energy: 0.8074578164143495
Energy: 0.9460565370018287
Energy: 0.8074578164143495
Energy: 0.8200860190012366
Energy: 0.8088365591161146
Energy: 0.9542372249292113
Energy: 0.8088365591203149
Energy: 0.8077337154368753
Energy: 0.8990838587295982
Energy: 0.9620547500621222
Energy: 0.8990838587295982
Energy: 1.143637483024267
Energy: 1.0471723829695778
Energy: 1.0460140970524952
Energy: 1.0471723829678978

minimum gb energy = 0.7998865266916115 eV
minimum distance =  2.31980741173052 Angstroms
sigma value = 53


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

Energy: 1.2231321920993938
Energy: 0.9309688332069405
Energy: 0.9285903985404167
Energy: 0.7184856526141414
Energy: 0.9243549804495841
Energy: 0.7837764220319786
Energy: 0.9335686310803943
Energy: 0.7837764220319786
Energy: 0.9274776131683379
Energy: 0.9324007796613856
Energy: 0.9180641336179088
Energy: 0.9324007796594518
Energy: 0.9234351534750811
Energy: 0.7848188034895368
Energy: 0.9330944802594382
Energy: 0.7848188034876027
Energy: 0.9288886808144065
Energy: 0.8141647410775003
Energy: 0.7167327977763549
Energy: 0.8141647410755662
Energy: 0.9300195786469486
Energy: 0.7892247241785991
Energy: 0.7146966080448746
Energy: 0.7892247241824671
Energy: 1.1096665181092058
Energy: 0.9265951579077423
Energy: 0.927054133121444
Energy: 0.9265951579096764
Energy: 1.1188269177816346
Energy: 0.7856784209789919
Energy: 0.922235393705897
Energy: 0.7856784209789919
Energy: 0.9245858310136276
Energy: 0.9230647507168054
Energy: 0.9182053206949654
Energy: 0.9230647507168054
Energy: 0.9208977485067189
Energy: 0.7847053815291941
Energy: 0.9326123515573709
Energy: 0.7847053815291941
Energy: 0.9323832045259829
Energy: 0.7856330578326388
Energy: 0.7158492560464661
Energy: 0.7856330578326388
Energy: 0.9292992386752172
Energy: 0.7843244960362864
Energy: 0.7188002991661102
Energy: 0.7843244960382204
Energy: 1.1189303532878652
Energy: 0.7858970727199848
Energy: 0.9223300515392439
Energy: 0.7858970727180509

minimum gb energy = 0.7146966080448746 eV
minimum distance =  2.38903255651535 Angstroms
sigma value = 9


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

Energy: 1.2985369619289933
Energy: 1.0833499963150035
Energy: 1.087699542192534
Energy: 1.0201957700656465
Energy: 0.8313975650373904
Energy: 0.8127395694515234
Energy: 1.0734691648950674
Energy: 0.812739569449376
Energy: 0.822247216408044
Energy: 0.8107580898159189
Energy: 1.1275242043085294
Energy: 0.8107580898144872
Energy: 0.809858331378179
Energy: 0.8118460003649475
Energy: 1.0231388318906123
Energy: 0.8118460003678107
Energy: 0.8225159253126118
Energy: 0.8158164628898308
Energy: 1.1276131518445802
Energy: 0.8158164628898308
Energy: 0.8230101561069972
Energy: 0.8153383718172261
Energy: 1.127574312506237
Energy: 0.8153383718157947
Energy: 1.0650030451063721
Energy: 1.0615472733213251
Energy: 1.0685888165464221
Energy: 1.0615472733284832
Energy: 1.0587908698851383
Energy: 0.8129201260933633
Energy: 1.0617420402626725
Energy: 0.8129201260919316
Energy: 0.8943835350097747
Energy: 0.8989384234876427
Energy: 0.9299851997444
Energy: 0.8989384234890743
Energy: 0.8608751665799851
Energy: 0.8560455923894741
Energy: 1.0591621551018144
Energy: 0.8560455923873267
Energy: 0.9001833900094651
Energy: 0.8998386612955828
Energy: 0.9846544614789969
Energy: 0.8998386612977302
Energy: 0.9098769893770519
Energy: 0.8987386090941177
Energy: 1.1442711945730077
Energy: 0.8987386090948335
Energy: 1.070083259467358
Energy: 0.898650385220297
Energy: 0.9293179578786304
Energy: 0.898650385220297
Energy: 1.0601297798034444
Energy: 0.9390974511228799
Energy: 0.9297058056688422
Energy: 0.9390974511249622
Energy: 1.0161521586293936
Energy: 0.9042839503182075
Energy: 0.9260616575063313
Energy: 0.9042839503196392
Energy: 1.0231819633577457
Energy: 0.9704058173730734
Energy: 0.9324163406395393
Energy: 0.9704058173723575
Energy: 1.0266644417600763
Energy: 0.8109166502366051
Energy: 0.9398240330618248
Energy: 0.8109166502373208
Energy: 0.9957904130259198
Energy: 0.9852832353313107
Energy: 1.1811059416027625
Energy: 0.9852832353313107
Energy: 0.9849858400631335
Energy: 0.8101983697095524
Energy: 0.8601816036829603
Energy: 0.8101983697116998
Energy: 1.1484950479963445
Energy: 0.844603857106044
Energy: 0.86633606536405
Energy: 0.8446038571096232
Energy: 1.0766038601204724
Energy: 0.8476812260952692
Energy: 0.848599964406703
Energy: 0.8476812260924059
Energy: 1.143854777928045
Energy: 0.8451871100841543
Energy: 0.8738092858606638
Energy: 0.8451871100863018
Energy: 1.1433031706322536
Energy: 0.9207355733124971
Energy: 0.8604489271812957
Energy: 0.9207355732895913
Energy: 1.1030376690764518
Energy: 1.0608261823687573
Energy: 1.0648852781443563
Energy: 1.0608261823716205
Energy: 1.0640747944026268
Energy: 0.8460146679742049
Energy: 1.0586423924001018
Energy: 0.846014667973489
Energy: 0.928479732640518
Energy: 0.9176101688158353
Energy: 0.8922473978221411
Energy: 0.9176101688122564
Energy: 1.0626792995371035
Energy: 0.845242003420217
Energy: 0.867237722536012
Energy: 0.8452420034152064
Energy: 1.0206387745181542
Energy: 0.8646150064003529
Energy: 0.8934536215013965
Energy: 0.8646150064025003
Energy: 1.144568015861228
Energy: 0.8792874845698365
Energy: 0.8986099535971341
Energy: 0.8792874845719838
Energy: 0.8940945105337395
Energy: 0.8637015287101254
Energy: 1.0384344053056305
Energy: 0.8637015287144202
Energy: 0.9050870799797931
Energy: 0.9079134922341454
Energy: 1.1258054092975278
Energy: 0.9079134922348613
Energy: 0.8887972275773598
Energy: 0.865741565280973
Energy: 1.0487721442131357
Energy: 0.8657415652816889
Energy: 0.8899633631102181
Energy: 0.9405290886016099
Energy: 1.0211382064473071
Energy: 0.9405290886030414
Energy: 0.9182236101333777
Energy: 0.8149364552311066
Energy: 1.0112454419814134
Energy: 0.8149364552361174
Energy: 1.158293961243006
Energy: 1.0612008166652749
Energy: 1.0651780152540014
Energy: 1.0612008166645588

minimum gb energy = 0.809858331378179 eV
minimum distance =  2.31858742533299 Angstroms
sigma value = 73


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

Energy: 1.2948681737769812
Energy: 1.010966212592356
Energy: 1.0312257056595242
Energy: 0.9024862684661116
Energy: 0.8316830531059712
Energy: 0.8331379301943127
Energy: 0.9837495165533426
Energy: 0.8331379301977196
Energy: 0.8507188250243983
Energy: 0.8322323812366397
Energy: 1.0355271101145251
Energy: 0.8322323812343683
Energy: 0.8312823463116303
Energy: 0.8362402172968701
Energy: 1.0489651292368136
Energy: 0.8362402172991414
Energy: 0.8451503539369024
Energy: 0.8355166231268538
Energy: 1.0781725599730951
Energy: 0.8355166231291252
Energy: 0.8487917717920324
Energy: 0.8376701611012914
Energy: 1.0439531015802188
Energy: 0.8376701611012914
Energy: 0.9039509234957095
Energy: 1.0716907300955623
Energy: 1.0493090281965793
Energy: 1.0716907300944267
Energy: 0.9686929016782431
Energy: 0.8351677642590015
Energy: 1.0338590119268922
Energy: 0.8351677642567302
Energy: 0.9103456587179853
Energy: 0.8155935211622688
Energy: 1.0353041640563545
Energy: 0.8155935211588874
Energy: 0.888325715321542
Energy: 0.8718578059084409
Energy: 1.0292056489911434
Energy: 0.8718578059050337
Energy: 0.9128742597214068
Energy: 0.9371433777307375
Energy: 1.0360573859381068
Energy: 0.9371433777307375
Energy: 0.874872335675788
Energy: 0.8150205646088287
Energy: 1.1147216173634422
Energy: 0.8150205646088287
Energy: 1.034975889669929
Energy: 0.9392529265418963
Energy: 0.8828006469434585
Energy: 0.9392529265430319
Energy: 1.0366727462497551
Energy: 0.9280774636546254
Energy: 0.9077681870195242
Energy: 0.9280774636546254
Energy: 1.0522324592993004
Energy: 0.9540648829221533
Energy: 0.8795832564954442
Energy: 0.9540648829210178
Energy: 1.0434727945564921
Energy: 0.8818166958367266
Energy: 0.8870019438833763
Energy: 0.8818166958401336
Energy: 1.1089000828218512
Energy: 0.9094052492907059
Energy: 0.887033512017985
Energy: 0.9094052492907059
Energy: 1.0232227805577037
Energy: 0.9904002470823016
Energy: 0.9037419003040981
Energy: 0.9904002470823016
Energy: 0.9836314984897169
Energy: 0.9078694619251815
Energy: 0.9695875481480193
Energy: 0.9078694619217744
Energy: 1.0019098545545067
Energy: 0.9122267461825052
Energy: 0.9734686136736752
Energy: 0.9122267461802338
Energy: 0.9855800055499994
Energy: 0.9093692085937455
Energy: 0.8867746824027486
Energy: 0.9093692085937455
Energy: 1.0735199329345428
Energy: 0.9091997903224411
Energy: 0.9903087483526071
Energy: 0.9091997903224411

minimum gb energy = 0.8150205646088287 eV
minimum distance =  2.30872567000069 Angstroms
sigma value = 7


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

Energy: 1.5464246397359385
Energy: 1.0097091892374386
Energy: 1.030578670123658
Energy: 0.8534711810895808
Energy: 0.8608233877748893
Energy: 0.8454820761655997
Energy: 1.0885126723812717
Energy: 0.8454820761623875
Energy: 0.8538522322807136
Energy: 0.8426681773556692
Energy: 0.963281242426885
Energy: 0.8426681773564723
Energy: 0.840301364305154
Energy: 0.9073079140530068
Energy: 1.0901164393643787
Energy: 0.9073079140554159
Energy: 0.8713553835635428
Energy: 0.8452333463711422
Energy: 1.0663637556078192
Energy: 0.8452333463695362
Energy: 0.8572780051149519
Energy: 0.9613205338561013
Energy: 1.0657724702386557
Energy: 0.9613205338593135
Energy: 0.9854951614670074
Energy: 0.9986108549245715
Energy: 0.8474743453667374
Energy: 0.9986108549125621
Energy: 1.0902417924449428
Energy: 0.9577233550189501
Energy: 0.8693291506010234
Energy: 0.9577233550229655
Energy: 1.0888875846793211
Energy: 0.8448750735151417
Energy: 0.8415898471899328
Energy: 0.8448750735143387
Energy: 1.0752636822742927
Energy: 0.9010555208130142
Energy: 0.8435519461522297
Energy: 0.9010555208748127
Energy: 1.088996364166722
Energy: 0.9229267443117927
Energy: 0.9706307073905055
Energy: 0.9229267443142017
Energy: 0.9901038994593436
Energy: 0.9728519048230607
Energy: 0.9813855044385263
Energy: 0.9728519048254699
Energy: 0.9639372016778477
Energy: 0.8431031452913373
Energy: 0.9695359745323804
Energy: 0.8431031453122168
Energy: 0.9622844209053771
Energy: 0.9091853994517549
Energy: 0.8513613505898047
Energy: 0.9091853994533609
Energy: 0.9705622887392314
Energy: 0.8442181004347784
Energy: 0.8516116570908538
Energy: 0.8442181004315661
Energy: 0.8601931590947379
Energy: 0.9642974702909464
Energy: 0.9897843186455134
Energy: 0.9642974702901435
Energy: 1.1018051176138604
Energy: 0.8459157854959339
Energy: 1.0875036583831401
Energy: 0.8459157854919188
Energy: 0.842036956643215
Energy: 0.8423028746304462
Energy: 0.9650042157614492
Energy: 0.8423028746264309
Energy: 0.8415331911542525
Energy: 0.8436291784390595
Energy: 1.0886540511477332
Energy: 0.8436291784414686
Energy: 0.8688623840529139
Energy: 0.957371235812821
Energy: 1.1011947216031395
Energy: 0.957371235813624
Energy: 0.8476181898581645
Energy: 0.9430954924460593
Energy: 1.0689202263083089
Energy: 0.9430954924476656
Energy: 0.9804306237083324
Energy: 0.846798436894768
Energy: 0.856134652585616
Energy: 0.8467984364131564
Energy: 0.971268441103741
Energy: 0.8457518719903
Energy: 0.8714191252894536
Energy: 0.8457518719927092
Energy: 1.0891515173982098
Energy: 0.9054337194180694
Energy: 0.839691657905227
Energy: 0.9054337194076297
Energy: 1.0718423133946644
Energy: 0.8426493099474575
Energy: 0.8540619926066294
Energy: 0.8426493099514727
Energy: 1.0685213582043487
Energy: 0.8445036694644625
Energy: 0.861112521117736
Energy: 0.8445036694468319
Energy: 1.0163350372569901
Energy: 1.0178589361574435
Energy: 1.3159718929432058
Energy: 1.0178589361566404
Energy: 0.9652186935405105
Energy: 0.8446024059322027
Energy: 0.9856564721273046
Energy: 0.8446024059948042
Energy: 0.9639409845774869
Energy: 0.9155483761598021
Energy: 0.9649214430701958
Energy: 0.9155483761606054
Energy: 0.9831414679623718
Energy: 0.9789980866096876
Energy: 0.8511332149915055
Energy: 0.9789980866064754
Energy: 1.1023209793357105
Energy: 0.9664991816083668
Energy: 0.9832085521456027
Energy: 0.966499181611579

minimum gb energy = 0.839691657905227 eV
minimum distance =  2.29462431208284 Angstroms
sigma value = 29


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

Energy: 0.8288389476926649
Energy: 0.9857976568215193
Energy: 0.9414922039843537
Energy: 0.8763832635485387
Energy: 0.8543961792071512
Energy: 0.8937605252494787
Energy: 0.8536914961686526
Energy: 0.8937605252513745
Energy: 0.8384777240889147
Energy: 0.8713278334184797
Energy: 0.8229916507962795
Energy: 0.8713278334151853
Energy: 0.8243632659524294
Energy: 0.878993476212459
Energy: 0.837134527481652
Energy: 0.8789934762141064
Energy: 0.8366178443712575
Energy: 0.8785625084613405
Energy: 0.8176270523255735
Energy: 0.8785625084657228
Energy: 0.8474659646061885
Energy: 0.8798467039793061
Energy: 0.8171145429671741
Energy: 0.8798467039877912
Energy: 0.8166259953867948
Energy: 0.8748605095985763
Energy: 0.8368880183543251
Energy: 0.8748605095961209
Energy: 0.8538876078256535
Energy: 0.8787738782689867
Energy: 0.8222960460206393
Energy: 0.8787738782804865
Energy: 0.819244450474322
Energy: 0.8854970379185214
Energy: 0.8349526148999376
Energy: 0.885497037925328

minimum gb energy = 0.8166259953867948 eV
minimum distance =  2.39410810950761 Angstroms
sigma value = 5


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

Energy: 1.2194689716173703
Energy: 0.9623470704553838
Energy: 0.9631306032324454
Energy: 0.8194395387589944
Energy: 0.8486667216848132
Energy: 0.9322977849040425
Energy: 0.9987934778524402
Energy: 0.9322977849032839
Energy: 0.9958940856920276
Energy: 0.9321563229919732
Energy: 1.0092732638082538
Energy: 0.9321563229896974
Energy: 0.8676063109270823
Energy: 0.8423443934674263
Energy: 1.0069310999657612
Energy: 0.8423443934651504
Energy: 0.8635431869018309
Energy: 0.8423998649195447
Energy: 1.0038057394892461
Energy: 0.8423998649203033
Energy: 0.8505122306983864
Energy: 0.8428847671023668
Energy: 1.0151961371451368
Energy: 0.8428847671023668
Energy: 0.8418451908824
Energy: 0.8428509490432644
Energy: 1.0059486816297873
Energy: 0.8428509490417472
Energy: 0.8468217108479135
Energy: 0.8443396472600598
Energy: 1.1197439137719851
Energy: 0.8443396472593012
Energy: 0.952269966570686
Energy: 0.9641625148774249
Energy: 1.117128999800202
Energy: 0.9641625148766664
Energy: 1.0421525417296056
Energy: 0.8159372785580581
Energy: 0.8198981566882789
Energy: 0.8159372785580581
Energy: 0.9517929811349112
Energy: 0.8140303698809703
Energy: 0.8155358910665242
Energy: 0.8140303698802117
Energy: 1.1168772767953363
Energy: 0.8193403413027759
Energy: 0.8191709405537487
Energy: 0.8193403413020173
Energy: 1.115267964652498
Energy: 0.8142374470691643
Energy: 0.8165791919848137
Energy: 0.8142374470691643
Energy: 0.8425421685697722
Energy: 0.9034759761692439
Energy: 0.9962532697335298
Energy: 0.9034759761692439
Energy: 0.8417347713656634
Energy: 0.9062450289976514
Energy: 1.0061329780437627
Energy: 0.90624502899841
Energy: 0.8444563293521591
Energy: 0.8422372992082138
Energy: 0.8501106171970831
Energy: 0.8422372992082138
Energy: 0.8584893395952671
Energy: 0.8436817159674489
Energy: 0.8670223862182279
Energy: 0.8436817159659318
Energy: 1.0045293725980924
Energy: 0.8437333263879275
Energy: 0.8174442354296916
Energy: 0.8437333263879275
Energy: 1.0033334483231602
Energy: 0.9325146737716347
Energy: 0.9966443764967376
Energy: 0.9325146737723933
Energy: 1.005301788819269
Energy: 1.0037692375323295
Energy: 0.867478919773169
Energy: 1.0037692375316052
Energy: 0.9937540698535294
Energy: 0.8453210811902235
Energy: 0.8619982721326824
Energy: 0.8453210811902235
Energy: 1.0171264757246827
Energy: 0.8426491793428061
Energy: 0.8540984633628268
Energy: 0.8426491793443233
Energy: 0.9801203848627146
Energy: 0.8426854799629142
Energy: 0.841322972484961
Energy: 0.8426854799644314
Energy: 1.1266237567336723
Energy: 0.8436863630861277
Energy: 0.8459277401015298
Energy: 0.8436863630861277
Energy: 1.122276461959441
Energy: 0.9643477240622289
Energy: 0.9065428340422036
Energy: 0.9643477240629875
Energy: 0.8228063317204257
Energy: 0.8173468648953285
Energy: 1.0424146817210156
Energy: 0.8173468648976042
Energy: 0.8183043962528611
Energy: 0.8156070451508217
Energy: 0.859435625892434
Energy: 0.8156070451493044
Energy: 0.8184582920908425
Energy: 0.8172793011975437
Energy: 0.8908532936149893
Energy: 0.817279301196785
Energy: 0.8283264465317925
Energy: 0.8205963099931824
Energy: 1.1140867803838326
Energy: 0.8205963100007684
Energy: 1.0064963213945852
Energy: 0.9084721429322732
Energy: 0.8433032456479992
Energy: 0.9084721429330317
Energy: 1.0069452629519502
Energy: 0.9060618688387604
Energy: 0.8427182665112287
Energy: 0.9060618688395191
Energy: 0.8502709306882451
Energy: 0.8415435152205388
Energy: 0.8425107587564651
Energy: 0.8415435152197803
Energy: 0.8799540585608875
Energy: 0.8437861782928631
Energy: 0.8520406941227217
Energy: 0.8437861782936216

minimum gb energy = 0.8140303698802117 eV
minimum distance =  2.29558265852931 Angstroms
sigma value = 1


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

Energy: 1.3177652676186573
Energy: 0.9304501507276165
Energy: 0.9306759639354824
Energy: 0.78015825416117
Energy: 0.8106213242073443
Energy: 0.8102132572704527
Energy: 0.8230633110117983
Energy: 0.8102132572861616
Energy: 0.8226281481535471
Energy: 0.8081645386611415
Energy: 0.8251355445113857
Energy: 0.8081645386611415
Energy: 0.8324900390721736
Energy: 0.8113668739308495
Energy: 0.8102085484113246
Energy: 0.8113668739350448
Energy: 0.8056516777237583
Energy: 0.8040783463444281
Energy: 0.8206230251697726
Energy: 0.8040783463444281
Energy: 0.8039187269403808
Energy: 0.8045891112336192
Energy: 0.8046395444285546
Energy: 0.8045891112346681
Energy: 0.8015753718540349
Energy: 0.8043507052262747
Energy: 0.8080279913003544
Energy: 0.8043507052304701
Energy: 0.8077526833134416
Energy: 0.8074264821057516
Energy: 0.7827185419993763
Energy: 0.8074264821047028
Energy: 0.8085099286425722
Energy: 0.9593965894106862
Energy: 0.7775405003163129
Energy: 0.9593965894106862
Energy: 0.8171065949498523
Energy: 0.8082283787115891
Energy: 0.8077207957873845
Energy: 0.8082283787115891
Energy: 0.8081990132743364
Energy: 0.8836662734974273
Energy: 0.8019392934084992
Energy: 0.883666273499525
Energy: 0.7751830400997688
Energy: 0.8088947581477811
Energy: 0.8031198278565385
Energy: 0.808894758149879
Energy: 0.7744279512381794
Energy: 0.8041684703788272
Energy: 0.8160894176717224
Energy: 0.8041684703788272
Energy: 0.8067874262633921
Energy: 0.8105307679692123
Energy: 0.8223123718849098
Energy: 0.8105307679671148
Energy: 0.835109661062482
Energy: 0.9041701623255801
Energy: 0.8221322466868474
Energy: 0.9041701623245313
Energy: 0.8374795898963843
Energy: 0.8110988832575314
Energy: 0.8074008018826829
Energy: 0.8110988832617269
Energy: 0.8060802190342752
Energy: 0.8103033206720167
Energy: 0.801918605140584
Energy: 0.8103033206699191
Energy: 0.8112392088680804
Energy: 0.8070194081514055
Energy: 0.8049314371463656
Energy: 0.8070194081514055
Energy: 0.8047685318079123
Energy: 0.8065101705798806
Energy: 0.7766277904319109
Energy: 0.8065101705819783
Energy: 0.8079098148178745
Energy: 0.809962994428076
Energy: 0.7806947386406274
Energy: 0.8099629944291248
Energy: 0.8167082715659048
Energy: 0.8854657090193044
Energy: 0.8090992315020492
Energy: 0.8854657090255975
Energy: 0.8171714816008807
Energy: 0.806363293228954
Energy: 0.8061244329732938
Energy: 0.8063632932331494
Energy: 0.8073415094587862
Energy: 0.8037145152370269
Energy: 0.8022019174726418
Energy: 0.8037145152359779
Energy: 0.7743617650079646
Energy: 0.804242723041314
Energy: 0.8042880336752795
Energy: 0.8042427230402651

minimum gb energy = 0.7743617650079646 eV
minimum distance =  2.30758829578407 Angstroms
sigma value = 17


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

Energy: 1.421875800177413
Energy: 0.9319850971312809
Energy: 0.9343448800272455
Energy: 0.7831295853919321
Energy: 0.809090023741954
Energy: 0.8051987536911662
Energy: 0.9455293323327002
Energy: 0.8051987536924629
Energy: 1.076098731258348
Energy: 0.8474018283274437
Energy: 0.9561473260683303
Energy: 0.8474018283287402
Energy: 1.084736717446844
Energy: 0.9184941572733744
Energy: 0.8239843500256484
Energy: 0.9184941572746708
Energy: 0.7863622313426025
Energy: 0.782029818553853
Energy: 0.9307974279551071
Energy: 0.782029818553853
Energy: 0.7819784706346307
Energy: 0.7811727353067027
Energy: 0.809402393975828
Energy: 0.7811727353086475
Energy: 0.7813110237391317
Energy: 0.781464297541886
Energy: 0.825189364871994
Energy: 0.7814642975451274
Energy: 0.7884842009375014
Energy: 0.7847143110024247
Energy: 0.7882530755774969
Energy: 0.7847143110011282
Energy: 0.916314189539193
Energy: 0.8909476605179403
Energy: 0.8252295825625561
Energy: 0.890947660517292
Energy: 0.966394279276862
Energy: 0.8068468153458659
Energy: 0.837070778439165
Energy: 0.8068468153426245
Energy: 0.8061389032894096
Energy: 0.8506321315293033
Energy: 0.8192115032128127
Energy: 0.8506321315305999
Energy: 0.8026867909262354
Energy: 0.8128633028480822
Energy: 0.9319608438072529
Energy: 0.8128633028467857
Energy: 0.8057605076839859
Energy: 0.8016388189610792
Energy: 0.8026913529502697
Energy: 0.8016388189610792
Energy: 0.8037606149358246
Energy: 0.8015709248317816
Energy: 0.8026158849327866
Energy: 0.8015709248298367
Energy: 1.0814891496725194
Energy: 0.8041721994009838
Energy: 0.8083001165021055
Energy: 0.8041721994022804
Energy: 0.7810455166532096
Energy: 0.8873699693154395
Energy: 0.8065091946377607
Energy: 0.8873699693167361
Energy: 0.809678558256207
Energy: 0.8075137197969244
Energy: 0.9397616923487843
Energy: 0.8075137197943315
Energy: 0.8034413861378479
Energy: 0.8033747530720396
Energy: 0.8093214623766858
Energy: 0.8033747530713913
Energy: 0.8151614920627368
Energy: 0.8076320441324109
Energy: 0.8218050366928175
Energy: 0.8076320441330591
Energy: 0.8033577464712655
Energy: 0.8048153779513574
Energy: 0.7875335222787486
Energy: 0.8048153778489882
Energy: 0.954179355566321
Energy: 0.8044423822213272
Energy: 0.803064471491523
Energy: 0.8044423822206789
Energy: 0.9543407607681779
Energy: 0.9137185100088528
Energy: 1.0770426223956606
Energy: 0.9137185100101494
Energy: 0.823568045210619
Energy: 0.886499925438019
Energy: 1.0834790718471614
Energy: 0.886499925435426
Energy: 0.9330758308070692
Energy: 0.7829976688873883
Energy: 0.784737290934228
Energy: 0.7829976688854435
Energy: 0.8084563789299745
Energy: 0.7857887337081
Energy: 0.7816437463119023
Energy: 0.7857887337100448
Energy: 0.8260879140222422
Energy: 0.7819219081523527
Energy: 0.7834733060575884
Energy: 0.7819219081542976
Energy: 0.791225211408489
Energy: 0.7846702530773747
Energy: 0.791705926155664
Energy: 0.7846702530676505
Energy: 0.8237486274457145
Energy: 0.8877570672393567
Energy: 0.9189461038448666
Energy: 0.8877570672380602
Energy: 0.936651450403359
Energy: 0.805922849166237
Energy: 0.9530410069843901
Energy: 0.805922849166237
Energy: 0.8200145796610028
Energy: 0.8542121011824116
Energy: 0.8048290160532847
Energy: 0.8542121011837083
Energy: 0.9549410280438104
Energy: 0.8017060602781355
Energy: 0.8036576464747004
Energy: 0.8017060602761906
Energy: 0.8022728401608175
Energy: 0.801667127149293
Energy: 0.8044846413144843
Energy: 0.8016671271466999
Energy: 0.8012344267593717
Energy: 0.8016137749478169
Energy: 0.8046188520440921
Energy: 0.8016137749465203
Energy: 0.8113893462731729
Energy: 0.80564579733996
Energy: 1.0826595397321463
Energy: 0.8056457973380151
Energy: 0.8086490217340613
Energy: 0.9663798202852665
Energy: 0.7935503792485215
Energy: 0.9663798202859147
Energy: 1.2682003570067617
Energy: 0.810022531902218
Energy: 0.8170289662451615
Energy: 0.8100225319028662
Energy: 0.8084037700294174
Energy: 0.8019529292846892
Energy: 0.8013442751587722
Energy: 0.8019529292846892
Energy: 0.8227803770119635
Energy: 0.8099091546292783
Energy: 0.814687016618988
Energy: 0.8099091546280406

minimum gb energy = 0.7810455166532096 eV
minimum distance =  2.29835242374245 Angstroms
sigma value = 89


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

Energy: 1.515634104094629
Energy: 0.8837004653073998
Energy: 0.8749427056446074
Energy: 0.7620164253724192
Energy: 0.740804281468009
Energy: 0.7428120939664837
Energy: 0.7518227124549534
Energy: 0.74281209396818
Energy: 0.7329748950382523
Energy: 0.7419528598011691
Energy: 0.7555913285533858
Energy: 0.7419528598062578
Energy: 0.7332610242062669
Energy: 0.8167188985081837
Energy: 0.7396023994172659
Energy: 0.8167188985081837
Energy: 0.7375055003554092
Energy: 0.7428756912230112
Energy: 0.7497358178345006
Energy: 0.7428756912247073
Energy: 0.7372251295552518
Energy: 0.7439960541697801
Energy: 0.7485867708047612
Energy: 0.743996054161299
Energy: 0.7363994357661691
Energy: 0.7365134821110862
Energy: 0.7393831418203075
Energy: 0.7365134821026051
Energy: 0.7393102655639108
Energy: 0.7413269743569801
Energy: 0.7307588123481658
Energy: 0.7413269743586762
Energy: 0.7403336566702846
Energy: 0.7450616679707484
Energy: 0.7412070233228146
Energy: 0.7450616679707484
Energy: 0.7586683071174137
Energy: 0.7415735899416771
Energy: 0.7552893153615011
Energy: 0.7415735899433734
Energy: 0.7394859188423736
Energy: 0.8206623400741145
Energy: 0.7304700924201272
Energy: 0.8206623400758107
Energy: 0.7479877101471791
Energy: 0.7420881994539059
Energy: 0.7387447078718495
Energy: 0.7420881994539059
Energy: 0.7497426330623512
Energy: 0.7393473965564623
Energy: 0.7408171362114405
Energy: 0.7393473965564623
Energy: 0.7392605861247238
Energy: 0.73627031007008
Energy: 0.7352637946377317
Energy: 0.7362703100717762
Energy: 0.7319227436149868
Energy: 0.7385741527941968
Energy: 0.7399969341574208
Energy: 0.7385741527908044

minimum gb energy = 0.7304700924201272 eV
minimum distance =  2.32857481907702 Angstroms
sigma value = 13


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

Energy: 1.3447878576629269
Energy: 0.712125783175649
Energy: 0.8524620652032927
Energy: 0.7032548367553197
Energy: 0.8228236911227574
Energy: 0.7089199656285159
Energy: 0.8453672203711546
Energy: 0.7089199656349144
Energy: 0.7251863279890869
Energy: 0.8310287149855548
Energy: 0.8591967235983725
Energy: 0.8310287149905313
Energy: 1.0154287210577286
Energy: 0.8089064793779418
Energy: 0.8245700445431243
Energy: 0.8089064793850513
Energy: 0.8293596612464035
Energy: 0.8279708344901703
Energy: 0.8320503120765883
Energy: 0.8279708344915921
Energy: 0.8425584808279243
Energy: 0.8328784526957151
Energy: 0.8376052371854315
Energy: 0.8328784526907386
Energy: 0.8422560225141082
Energy: 0.7067263850773621
Energy: 0.8235830971502394
Energy: 0.7067263850866045
Energy: 0.7131393287955105
Energy: 0.7065272244641917
Energy: 0.825548890714903
Energy: 0.706527224458504
Energy: 0.7063822800615072
Energy: 0.7070867940606095
Energy: 0.8284077414765294
Energy: 0.7070867940527892
Energy: 0.7079399604714841
Energy: 0.7067668313935861
Energy: 0.8336340862429158
Energy: 0.7067668313886095
Energy: 0.70846829750641
Energy: 0.7060547210363848
Energy: 1.3451732638288336
Energy: 0.7060547210378068
Energy: 0.8382411608862469
Energy: 0.7085820164518365
Energy: 0.8271287747278198
Energy: 0.7085820164511256
Energy: 0.8598132280608485
Energy: 0.8237151286870739
Energy: 0.8347367778214516
Energy: 0.8237151286835191
Energy: 0.8256091497892211
Energy: 0.749510089947048
Energy: 1.015963516147458
Energy: 0.7495100899442042
Energy: 0.8254830117419352
Energy: 0.709906658701217
Energy: 0.715582735988817
Energy: 0.7099066587076156
Energy: 0.8290950202131819
Energy: 0.7077220420566377
Energy: 0.712339488040151
Energy: 0.7077220420559267
Energy: 0.9227085203860199
Energy: 0.7067781314883305
Energy: 0.7088362072065557
Energy: 0.706778131493307
Energy: 0.7149079657860158
Energy: 0.7061582476370105
Energy: 0.7123357784663196
Energy: 0.7061582476355887
Energy: 0.9297754827858347
Energy: 0.7056929889571526
Energy: 0.8231492131054411
Energy: 0.7056929889578636
Energy: 0.834533173448962
Energy: 0.8304805523147775
Energy: 0.8650620931625017
Energy: 0.8304805523161993
Energy: 1.0171065939258725
Energy: 0.7061176270134965
Energy: 0.8227753675000081
Energy: 0.7061176270085197
Energy: 0.8358104165371602
Energy: 0.9182999649740279
Energy: 0.8376453961438548
Energy: 0.9182999649718951
Energy: 0.8296560658439421
Energy: 0.7081741663989654
Energy: 0.8243816869046198
Energy: 0.7081741663982543
Energy: 0.7126555858291912
Energy: 0.7059392965851589
Energy: 0.8257247901186694
Energy: 0.705939296582315
Energy: 0.7125214894489901
Energy: 0.7063362558159579
Energy: 0.8259606393315055
Energy: 0.7063362558102704
Energy: 0.7069929902324057
Energy: 0.7057230731138648
Energy: 0.8275484687367575
Energy: 0.7057230731152868
Energy: 0.7056235131446835
Energy: 0.7053492132885235
Energy: 0.828601539270961
Energy: 0.7053492132807031
Energy: 0.7071587599485349
Energy: 0.7062466233425616
Energy: 0.7124813270874912
Energy: 0.7062466233411397
Energy: 0.8331341246568333
Energy: 0.7073027111497007
Energy: 0.9516400014363257
Energy: 0.707302711146146
Energy: 0.8642457279553248
Energy: 0.8232780820633906
Energy: 0.8296932185232258
Energy: 0.8232780820648126
Energy: 0.8267728078736751
Energy: 0.7482315763813672
Energy: 1.0180202534419958
Energy: 0.7482315763870547
Energy: 0.8234823565616868
Energy: 0.7091580176291336
Energy: 0.8295951429470011
Energy: 0.7091580176270006
Energy: 0.8262078998513942
Energy: 0.709298805755298
Energy: 0.7127713377180869
Energy: 0.7092988057481884
Energy: 0.9235015782417533
Energy: 0.7055877757601491
Energy: 0.7060749365537191
Energy: 0.7055877757693915
Energy: 0.929408110801853
Energy: 0.706566514286408
Energy: 0.7086099883131142
Energy: 0.7065665142835643

minimum gb energy = 0.7032548367553197 eV
minimum distance =  2.31376937203249 Angstroms
sigma value = 37


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

Energy: 1.309796966212115
Energy: 0.6680048974972215
Energy: 0.815529768362661
Energy: 0.6538713063856688
Energy: 0.8549544615100308
Energy: 0.6682759832389625
Energy: 0.6763537594252723
Energy: 0.6682759832389625
Energy: 0.7499289859092844
Energy: 0.6680369392879868
Energy: 0.669476981204438
Energy: 0.66803693928921
Energy: 0.749969913720732
Energy: 0.6739441783968766
Energy: 0.6769116801656737
Energy: 0.6739441783968766
Energy: 0.8573030281393411
Energy: 0.8043449425283488
Energy: 0.7502784012715472
Energy: 0.8043449425283488
Energy: 0.7658831101779355
Energy: 0.8043889129471947
Energy: 0.6469904653542996
Energy: 0.8043889129471947
Energy: 0.7650485102926908
Energy: 0.6495015385208642
Energy: 0.6444069353003941
Energy: 0.6495015385196411
Energy: 0.7613811773662248
Energy: 0.6485606773420426
Energy: 0.7558521352646232
Energy: 0.6485606773395963
Energy: 0.7658403440470494
Energy: 0.6445949197342423
Energy: 0.7610399324662951
Energy: 0.6445949197330192
Energy: 0.7648961915099292
Energy: 0.6451306444646445
Energy: 0.6471906518519602
Energy: 0.6451306444658677
Energy: 0.7748486150231735
Energy: 0.7745836461145745
Energy: 1.1706977646812042
Energy: 0.7745836461133514
Energy: 0.7648084703991366
Energy: 0.6446229400515191
Energy: 0.6473643105511163
Energy: 0.6446229400515191
Energy: 0.766669063329095
Energy: 0.6459377701607212
Energy: 0.7499141904276978
Energy: 0.6459377701570518
Energy: 0.7628711005562289
Energy: 0.6449962316132961
Energy: 0.7494368193680908
Energy: 0.6449962316132961
Energy: 0.7502784012776631
Energy: 0.7304500270158877
Energy: 0.6510409115962091
Energy: 0.7304500270171108
Energy: 0.8564015818597734
Energy: 0.6676161847143636
Energy: 0.7658885172929785
Energy: 0.6676161847155867
Energy: 0.8572133014451605
Energy: 0.6675845931109123
Energy: 0.7650919174202052
Energy: 0.6675845931121355
Energy: 0.755852135256061
Energy: 0.6756910176537766
Energy: 0.6756664275693497
Energy: 0.6756910176537766
Energy: 0.7610399324675182
Energy: 0.6663056397504508
Energy: 0.6680632145919387
Energy: 0.6663056397480045
Energy: 0.822927291659447
Energy: 0.6670794564770184
Energy: 0.6686292780627855
Energy: 0.6670794564757953

minimum gb energy = 0.6444069353003941 eV
minimum distance =  2.31323453502025 Angstroms
sigma value = 25


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

Energy: 1.3959559474136263
Energy: 0.5841785921817284
Energy: 0.7414333535727132
Energy: 0.5891802775827367
Energy: 0.9274978280772882
Energy: 0.5832655812194416
Energy: 0.773081090281153
Energy: 0.5832655812184865
Energy: 0.9168040048362461
Energy: 0.5851282086456244
Energy: 0.7717587416138454
Energy: 0.5851282086465797
Energy: 0.9734725055879008
Energy: 0.5880582761220009
Energy: 0.7564570734473317
Energy: 0.5880582760971674
Energy: 0.9271293514675373
Energy: 0.649238470859608
Energy: 0.9250322251920955
Energy: 0.6492384708605631
Energy: 0.9176483256021076
Energy: 0.6478001991562136
Energy: 0.9258191667247497
Energy: 0.6478001991562136
Energy: 0.9580715066306955
Energy: 0.6507295695852059
Energy: 0.9262377427474296
Energy: 0.6507295695842508
Energy: 0.7565639240937535
Energy: 0.5906981341255315
Energy: 0.9264367012812778
Energy: 0.5906981341255315
Energy: 0.7711698738683849
Energy: 0.5842100749795599
Energy: 0.9338945533684129
Energy: 0.5842100749795599
Energy: 0.7522462989654498
Energy: 0.5833147769166781
Energy: 0.9287145649539584
Energy: 0.5833147769166781
Energy: 0.58565097146879
Energy: 0.5850836582152653
Energy: 1.1841225535663265
Energy: 0.5850836582104896
Energy: 0.5834329153315431
Energy: 0.5830262408241816
Energy: 0.9305249449605795
Energy: 0.5830262408241816
Energy: 0.5831064926872314
Energy: 0.5832384391307109
Energy: 0.9170514658673201
Energy: 0.5832384391297559
Energy: 0.5905068326959828
Energy: 0.588500230909127
Energy: 0.915577070344969
Energy: 0.588500230909127
Energy: 0.7734686867001328
Energy: 0.582481813449968
Energy: 0.9296420835174494
Energy: 0.582481813449968
Energy: 0.7522904262084444
Energy: 0.5832335452913354
Energy: 0.9163628128732689
Energy: 0.5832335452903803
Energy: 0.7564234222206336
Energy: 0.5840149826021174
Energy: 0.9164263611809307
Energy: 0.5840149826030726
Energy: 0.7785530993844328
Energy: 0.649828888762712
Energy: 0.925580926759674
Energy: 0.649828888762712
Energy: 0.9339225766034571
Energy: 0.6478674651214295
Energy: 0.9574407564910354
Energy: 0.6478674651223847
Energy: 0.9290783756454962
Energy: 0.6490746436849801
Energy: 0.9552708004239141
Energy: 0.6490746436859351
Energy: 1.186155892193472
Energy: 0.5837046553466118
Energy: 0.7540354711197135
Energy: 0.5837046553466118
Energy: 0.9307298210308615
Energy: 0.5845202570950351
Energy: 0.5827194827066255
Energy: 0.5845202570950351
Energy: 0.9294578864037337
Energy: 0.583520081360321
Energy: 0.7499820263000129
Energy: 0.583520081359366
Energy: 0.9358866807640452
Energy: 0.58290665964053
Energy: 0.5868229020504456
Energy: 0.5829066596414851
Energy: 0.9263590213176369
Energy: 0.5824539717953341
Energy: 0.5833890581420916
Energy: 0.5824539717962893
Energy: 0.9148410867888501
Energy: 0.5833098364147999
Energy: 0.5853982737451804
Energy: 0.5833098364147999

minimum gb energy = 0.5824539717953341 eV
minimum distance =  2.32229411744351 Angstroms
sigma value = 41


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

Energy: 1.53179679070489
Energy: 0.6952683391504433
Energy: 0.6973470910903933
Energy: 0.5397797186843957
Energy: 1.0631278260688644
Energy: 0.5316802269666241
Energy: 0.6770394595292504
Energy: 0.5316802269681903
Energy: 1.0741765801106327
Energy: 0.5309724803177925
Energy: 0.689115234757393
Energy: 0.5309724803177925
Energy: 1.0550037871253954
Energy: 0.5312041394986023
Energy: 0.6807774101873776
Energy: 0.5312041394993854
Energy: 1.0601092186019772
Energy: 0.6820222929360059
Energy: 0.9583258354393458
Energy: 0.6820222929352228
Energy: 1.0634478281122763
Energy: 0.6807430012539584
Energy: 0.9421898747612336
Energy: 0.6807430012555244
Energy: 1.0689206286818753
Energy: 0.6814250710193697
Energy: 0.9536356631379577
Energy: 0.6814250710201528
Energy: 0.9489231770729503
Energy: 0.5315105923483341
Energy: 1.0132941777293598
Energy: 0.5315105923639596
Energy: 0.8451926274649643
Energy: 0.6808508754506533
Energy: 1.0658502601102302
Energy: 0.6808508754514363
Energy: 0.8436575994058972
Energy: 0.5302065491233681
Energy: 1.063672324158919
Energy: 0.5302065490732882
Energy: 0.682622008988421
Energy: 0.5317777640598713
Energy: 1.3581384559592125
Energy: 0.5317777640606542
Energy: 0.6793086898248312
Energy: 0.5305431621584065
Energy: 1.0635900983809314
Energy: 0.5305431621599725
Energy: 0.6764143745299465
Energy: 0.5310907265963107
Energy: 1.065492876888147
Energy: 0.5310907265963107
Energy: 0.5350838752339298
Energy: 0.5311649132821892
Energy: 0.9424210932962195
Energy: 0.5311649132814061
Energy: 0.5311252633199444
Energy: 0.5318341096533379
Energy: 1.0619347467694582
Energy: 0.5318341096533379
Energy: 0.5325149364549738
Energy: 0.5308905814154741
Energy: 0.8211806776869458
Energy: 0.5308905814139079
Energy: 0.53996144380128
Energy: 0.5317869269580076
Energy: 0.8196329181336924
Energy: 0.5317869269556584
Energy: 0.6895726485370328
Energy: 0.5312984404529404
Energy: 1.0611122417606413
Energy: 0.5312984404529404
Energy: 0.6785285044822612
Energy: 0.5313588019892713
Energy: 1.0652531331407875
Energy: 0.5313588019892713
Energy: 0.8371875025702381
Energy: 0.5315104976086859
Energy: 1.0643409272312607
Energy: 0.5315104976000722
Energy: 1.0157634969134008
Energy: 0.5879895960020164
Energy: 1.0602892596965923
Energy: 0.5879895960027997
Energy: 0.9404710796756381
Energy: 0.531671052975949
Energy: 1.0679217759638286
Energy: 0.5316710529861286
Energy: 1.066043877540446
Energy: 0.585504964637761
Energy: 1.0598563439035316
Energy: 0.585504964637761
Energy: 0.962334877141651
Energy: 0.5336753001942551
Energy: 0.9412353091640698
Energy: 0.5336753001926889
Energy: 1.059593385758956
Energy: 0.5870332761995651
Energy: 0.8476912238344658
Energy: 0.5870332761995651
Energy: 1.072978152467856
Energy: 0.5309596272159642
Energy: 0.8372246099338423
Energy: 0.5309596272183134
Energy: 1.0796201787905317
Energy: 0.5315851999489811
Energy: 0.6780827822030437
Energy: 0.5315851999505471
Energy: 1.0605655724483982
Energy: 0.532440806135755
Energy: 0.6906938565403377
Energy: 0.532440806135755
Energy: 0.9458619707092856
Energy: 0.531521336301287
Energy: 0.5408579052118427
Energy: 0.531521336302853
Energy: 1.0647510722632372
Energy: 0.5310480900346748
Energy: 0.5327731492974319
Energy: 0.5310480900354579
Energy: 1.0605512307740688
Energy: 0.5319578900648764
Energy: 0.5313806982514573
Energy: 0.5319578900648764
Energy: 0.8372765130006451
Energy: 0.5312430537037169
Energy: 0.5351031611181498
Energy: 0.5312430537029338

minimum gb energy = 0.5302065490732882 eV
minimum distance =  2.32086496970723 Angstroms
sigma value = 15


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

Energy: 1.3219985355067907
Energy: 0.6606915339867068
Energy: 0.6611224045086953
Energy: 0.4986175021538195
Energy: 1.1619934258596232
Energy: 0.4909257814293042
Energy: 0.6183362691203049
Energy: 0.4909257814286408
Energy: 1.1688642914762475
Energy: 0.4914021043599692
Energy: 0.6174863575944011
Energy: 0.49140210435930587
Energy: 1.173386342302584
Energy: 0.4904340671064545
Energy: 0.6280883153570581
Energy: 0.4904340671064545
Energy: 1.1606610812380034
Energy: 0.4945315041085339
Energy: 0.8531722534509507
Energy: 0.4945315041005736
Energy: 1.1650335377988752
Energy: 0.4915311593746316
Energy: 0.8500771346827839
Energy: 0.49153115936667136
Energy: 0.9628505199344133
Energy: 0.49111352972447475
Energy: 0.8682267567468456
Energy: 0.4911135297271282
Energy: 1.0618514798018892
Energy: 0.5381915511552059
Energy: 0.8950209878359479
Energy: 0.538191551149899
Energy: 0.9610963413561947
Energy: 0.7552136079310106
Energy: 1.0584980550607626
Energy: 0.7552136079303472
Energy: 0.9588845233384814
Energy: 0.5434846344807672
Energy: 1.0708626211485432
Energy: 0.5434846344814305
Energy: 0.8576088112651792
Energy: 0.4912096202738673
Energy: 1.1792306066948783
Energy: 0.4912096202705505
Energy: 0.7557507090737438
Energy: 0.4934005694866636
Energy: 1.16137623188885
Energy: 0.4934005694840102
Energy: 0.850715517786072
Energy: 0.48957431414416785
Energy: 1.0755231746334923
Energy: 0.4895743141415145
Energy: 0.6257512300723882
Energy: 0.49050167450738313
Energy: 1.0684418188997267
Energy: 0.49050167450804655
Energy: 0.6276532251973541
Energy: 0.49278850336059526
Energy: 1.1605808804314304
Energy: 0.49278850335993196
Energy: 0.6193004604748831
Energy: 0.4905060242127672
Energy: 1.057335583267013
Energy: 0.4905060242114405
Energy: 0.4943238520009343
Energy: 0.4897686758232834
Energy: 1.058203040336974
Energy: 0.48976867582062983
Energy: 0.4920220848800977
Energy: 0.4912013649693767
Energy: 1.1595891088183277
Energy: 0.4912013649713668
Energy: 0.4927310433424224
Energy: 0.4904006886115889
Energy: 1.168607641254291
Energy: 0.4904006886129157
Energy: 0.6200998280627221
Energy: 0.49065596375282994
Energy: 0.9546784170344464
Energy: 0.49065596375216664
Energy: 0.6231277541704338
Energy: 0.49259391165774086
Energy: 1.1593225532611275
Energy: 0.4925939116550874
Energy: 0.6236600983286922
Energy: 0.4905426652936695
Energy: 1.1706679930800448
Energy: 0.49054266529565954
Energy: 0.8496402168030198
Energy: 0.4901846275942836
Energy: 1.161041882846868
Energy: 0.4901846275942836
Energy: 0.860839698750699
Energy: 0.4928796750965366
Energy: 1.1611027937044112
Energy: 0.4928796750945465
Energy: 0.8553768295913352
Energy: 0.49079899796110316
Energy: 1.0344354598230334
Energy: 0.49079899794590615
Energy: 1.0621299559614918
Energy: 0.5375292059820191
Energy: 0.9629558196749765
Energy: 0.5375292059820191
Energy: 0.8530117999724881
Energy: 0.5370220735853657
Energy: 1.0592966698700348
Energy: 0.5370220735953161
Energy: 1.0592224353212805
Energy: 0.5425337325905737
Energy: 1.03545197209276
Energy: 0.5425337325866538
Energy: 1.0634722641643248
Energy: 0.4914146082660449
Energy: 0.8709739399829212
Energy: 0.49141460826471817
Energy: 1.0634398261557783
Energy: 0.4922555055669864
Energy: 0.8511933546310873
Energy: 0.492255505566323
Energy: 1.1591982204075142
Energy: 0.4953175123093007
Energy: 0.7554304093348851
Energy: 0.4953175123093007
Energy: 1.0661004708551949
Energy: 0.4907332403741347
Energy: 0.6299121451934027
Energy: 0.49073324037811483
Energy: 1.164315842767158
Energy: 0.49112271809888913
Energy: 0.6183116688020512
Energy: 0.49112271809888913
Energy: 1.1623989679528193
Energy: 0.491044049448149
Energy: 0.6172494883449651
Energy: 0.49104404944748553
Energy: 1.4703656281378603
Energy: 0.4970813719712573
Energy: 0.4949800280900334
Energy: 0.497081371972584
Energy: 1.1634305564187444
Energy: 0.49130487751250973
Energy: 0.49194233521880765
Energy: 0.49130487751051966
Energy: 0.9579108601906707
Energy: 0.49089591198154586
Energy: 0.4911880860635301
Energy: 0.4908959119795558

minimum gb energy = 0.4895743141415145 eV
minimum distance =  2.33428275446438 Angstroms
sigma value = 85


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

Energy: 1.4097093065444664
Energy: 0.44442478433454335
Energy: 0.617954318139991
Energy: 0.44050540405046984
Energy: 1.2187751630394168
Energy: 0.4410183160932758
Energy: 0.555474220771549
Energy: 0.4410183160932758
Energy: 1.1312363248147177
Energy: 0.4415687070111514
Energy: 0.5555687824607258
Energy: 0.44156870701230205
Energy: 1.0365668028366308
Energy: 0.4430167495692617
Energy: 0.5580662399402512
Energy: 0.443016749569837
Energy: 1.2168051275984173
Energy: 0.44343097435325696
Energy: 0.7643013067212097
Energy: 0.4434309743538323
Energy: 1.0420429003256695
Energy: 0.4420596435981251
Energy: 0.7619218396309091
Energy: 0.4420596435975498
Energy: 1.0377661255267128
Energy: 0.4419999815579823
Energy: 0.763484679186469
Energy: 0.4419999815579823
Energy: 1.0454071773097957
Energy: 0.6015269657906163
Energy: 0.7908163472261204
Energy: 0.6015269657911915
Energy: 1.0381332582682186
Energy: 0.44288962421851424
Energy: 0.9470781170097948
Energy: 0.4428896242018296
Energy: 1.0383628324781908
Energy: 0.5980908863015879
Energy: 0.9479766617124671
Energy: 0.5980908863015879
Energy: 0.9519640843180162
Energy: 0.444192389919472
Energy: 1.0359120733438243
Energy: 0.4441923899188967
Energy: 0.8612573388506539
Energy: 0.522892105752489
Energy: 1.1270314992440331
Energy: 0.5228921057513385
Energy: 0.948522374686199
Energy: 0.44328077975862806
Energy: 1.1298099152514989
Energy: 0.44328077975862806
Energy: 0.7681838452691815
Energy: 0.44356080294791983
Energy: 0.9458953787004135
Energy: 0.44356080294734446
Energy: 0.6708958842444059
Energy: 0.4450466466154683
Energy: 1.2166386683680517
Energy: 0.44504664661949567
Energy: 0.7634247726230142
Energy: 0.44249964823143434
Energy: 1.0449940133638589
Energy: 0.4424996482308591
Energy: 0.5563677564228494
Energy: 0.4423274237149366
Energy: 1.0411747735148962
Energy: 0.44232742371608724
Energy: 0.558272758349317
Energy: 0.44183266932665355
Energy: 1.2161669212586446
Energy: 0.44183266932665355
Energy: 0.5564531730780269
Energy: 0.44327137652603876
Energy: 1.041847011808394
Energy: 0.44327137652431275
Energy: 0.4422853709953562
Energy: 0.44249309584455654
Energy: 1.0407038540864746
Energy: 0.4424930958434059
Energy: 0.44210130238807177
Energy: 0.4433696263766935
Energy: 1.2165687319070193
Energy: 0.4433696263761182
Energy: 0.44307001446419536
Energy: 0.4428855248492452
Energy: 1.0405268156595835
Energy: 0.4428855248503959
Energy: 0.5568666170284096
Energy: 0.44234074248237837
Energy: 1.045826305245136
Energy: 0.44234074248295363
Energy: 0.5585816829389784
Energy: 0.4417824585861747
Energy: 1.2177995200426914
Energy: 0.44178245858559934
Energy: 0.5586030919298952
Energy: 0.44335606273116984
Energy: 1.1553132329009543
Energy: 0.44335606273174516
Energy: 0.7617160149757355
Energy: 0.44131434392264196
Energy: 1.0467654237909216
Energy: 0.44131434392149127
Energy: 0.763595088032379
Energy: 0.44508450167445296
Energy: 1.2172065040889162
Energy: 0.44508450167560365
Energy: 0.7625745232951326
Energy: 0.44210039902715703
Energy: 1.1577835392558486
Energy: 0.44210039902773235
Energy: 0.946999547653473
Energy: 0.443037882753374
Energy: 1.0452217530872072
Energy: 0.443037882749922
Energy: 0.9502263309084994
Energy: 0.5940260673351804
Energy: 1.0413616295789163
Energy: 0.5940260673357558
Energy: 0.9476571796698693
Energy: 0.44328562963947404
Energy: 0.852636874237105
Energy: 0.44328562963947404
Energy: 0.9467263341681373
Energy: 0.4426421493247741
Energy: 0.9524379230071646
Energy: 0.4426421493270754
Energy: 1.1311753024923952
Energy: 0.5944788697812935
Energy: 0.8565987865880604
Energy: 0.5944788697801429
Energy: 1.1312217369755624
Energy: 0.44322037715571505
Energy: 0.8578611200760264
Energy: 0.44322037720229074
Energy: 1.032966116598933
Energy: 0.4433489102161059
Energy: 0.7628893330063069
Energy: 0.4433489102161059
Energy: 1.2179675616003929
Energy: 0.44454105900361207
Energy: 0.7658347557021834
Energy: 0.44454105900246144
Energy: 1.0439269451095565
Energy: 0.4414181263636933
Energy: 0.7616629159561827
Energy: 0.4414181263642686
Energy: 1.2818225471093865
Energy: 0.4428768960882062
Energy: 0.5578254983705694
Energy: 0.4428768960882062
Energy: 1.2169480746087968
Energy: 0.44364923777106874
Energy: 0.558547652958351
Energy: 0.44364923777164406
Energy: 1.0405274233781376
Energy: 0.4423551576405884
Energy: 0.5582723425075745
Energy: 0.4423551576405884
Energy: 1.0409234847660942
Energy: 0.4431421313248308
Energy: 0.44321395339425557
Energy: 0.4431421313236801
Energy: 1.216711365423014
Energy: 0.44210692912411664
Energy: 0.4418381890066224
Energy: 0.4421069291235413
Energy: 1.0361003936068327
Energy: 0.4426551922566449
Energy: 0.4424388260775415
Energy: 0.44265519225606964

minimum gb energy = 0.44050540405046984 eV
minimum distance =  2.31661438103228 Angstroms
sigma value = 113


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

Energy: 0.01540594653053499
Energy: 0.306750167443846
Energy: 0.9903239234608809
Energy: 0.01623940707970882
Energy: 0.7923210667864667
Energy: 0.10593101904906686
Energy: 0.7915302104666445
Energy: 0.10593101904906686
Energy: 0.016129529604264555
Energy: 0.10435327301842368
Energy: 0.7894653290804065
Energy: 0.10435327301972594
Energy: 0.017183778439414828
Energy: 0.10641840881844673
Energy: 0.7968720406336621
Energy: 0.106418408818889
Energy: 0.7964460197289566
Energy: 0.10685279648824564
Energy: 0.794420323982683
Energy: 0.10685279648910566
Energy: 0.01600271069301726
Energy: 0.10452477873299162
Energy: 0.789802849465904
Energy: 0.10452477873213162

minimum gb energy = 0.01540594653053499 eV
minimum distance =  2.524543524603 Angstroms
sigma value = 1