Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004_CuAgAuNiPdPtAlPbFeMoTaWMgCoTiZr__MO_870117231765_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.920081233978273
cohesive_energy=5.770451211374867
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.64412161827812e-19, 2.75449411270548e-19, 3.64930976279448e-19, 4.42610908202304e-19, 5.132572847019e-19, 5.76338183135748e-19, 6.30350761821156e-19, 6.75786888984762e-19, 7.14102943186872e-19, 7.466880115691639e-19, 7.746203590063201e-19, 7.987363217012879e-19, 8.19686383367472e-19, 8.38007273177262e-19, 8.5412837446857e-19, 8.68386144334536e-19, 8.81008091857188e-19, 8.92114380284076e-19, 9.017210313815398e-19, 9.097655602608539e-19, 9.16147029794076e-19, 9.20759696323362e-19, 9.23536268430084e-19, 9.24455917818e-19, 9.23456159598384e-19, 9.202373867406779e-19, 9.14477561741448e-19, 9.05867464510332e-19, 8.933400454090859e-19, 8.7580582432659e-19, 8.524605085925759e-19, 8.223347813434739e-19, 7.842013752776399e-19, 7.3648054423395e-19, 6.770926629414719e-19, 6.03285191942994e-19, 5.113955554531919e-19, 3.9663004098313793e-19, 2.5275137489666997e-19, 7.15782024299304e-20, -1.5803998491906717e-19, -4.5201408286725e-19, -8.33550017781474e-19, -1.335665766170538e-18, -2.00236831364052e-18, -2.89244152089288e-18, -4.097550719688659e-18, -5.778554444081459e-18, -8.2317432189969e-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: 0.02141350611121242
Energy: 0.12899597162902132
Energy: 0.1288729441548584
Energy: 0.12863349057697082
Energy: 0.02320773995531128
Energy: 0.02304429455973209
Energy: 0.1282193165220236
Energy: 0.1292328306703403
Energy: 0.128562914292208
Energy: 0.022790062748275854
Energy: 0.12948919614305512
Energy: 0.12853441169197127
Energy: 0.12913054041501548
Energy: 0.1297042953747087
Energy: 0.12879668337727776
Energy: 0.12954407587787842
Energy: 0.1285329170750012
Energy: 0.12914586884856624
Energy: 0.12851113548365206
Energy: 0.12917814384301282
Energy: 0.12849729121306788
Energy: 0.022926431363016732
Energy: 0.021862518938401312
Energy: 0.1291935660627646
Energy: 0.12983019241715085
Energy: 0.1284253884869515
Energy: 0.022536572688969927
Energy: 0.02194012494697255
Energy: 0.12896011525321818
Energy: 0.12903530209755104
Energy: 0.12811802570844558
Energy: 0.022381077745512304
Energy: 0.02212567145417327
Energy: 0.12803796022246214
Energy: 0.12869994273631724
Energy: 0.12838535901239695
Energy: 0.02241569948424213
Energy: 0.02209686110606121
Energy: 0.1277824150101547
Energy: 0.12840263459398932
Energy: 0.12806518924728008
Energy: 0.1288509559152176
Energy: 0.12873989544873893
Energy: 0.022295885230904984
Energy: 0.022249583798746277
Energy: 0.12902217304602004
Energy: 0.12853899825079917
Energy: 0.1286130352721429
Energy: 0.02248070239729425
Energy: 0.12803623389241212
Energy: 0.1281026855946372
Energy: 0.1286928471516107
Energy: 0.12987190025111475
Energy: 0.02219015005150858
Energy: 0.023269678891033378
Energy: 0.12813993991862382
Energy: 0.12780783588411432
Energy: 0.12881271919316473
Energy: 0.022495189302477632
Energy: 0.023978784396235693
Energy: 0.024132407405684942
Energy: 0.12874845394800863
Energy: 0.12928668035221177
Energy: 0.12997737645939922
Energy: 0.12928741701501079
Energy: 0.02410562434310316
Energy: 0.12899072944672133
Energy: 0.12943116012044117
Energy: 0.13081019465230814
Energy: 0.12895972261392635

minimum gb energy = 0.02141350611121242 eV
minimum distance =  2.73726510007779 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 1.2911120962908442
Energy: 0.8806747263680739
Energy: 0.896252151826582
Energy: 0.8847576682072067
Energy: 0.9048932757144778
Energy: 0.8988022099812798
Energy: 0.8811440534871773
Energy: 0.8976876633751572
Energy: 0.898891514786988
Energy: 0.89546279159742
Energy: 0.8224971840060483
Energy: 0.8993928904828173
Energy: 0.8998725978835589
Energy: 0.9147074490462456
Energy: 0.7880461895865543
Energy: 0.7828032809261579
Energy: 0.9362975197554033
Energy: 0.8959148624483251
Energy: 0.9313791181395358
Energy: 0.9041869145199491
Energy: 0.8343933925148665
Energy: 0.9734251995675748
Energy: 0.7979997024547025
Energy: 0.806123892704203
Energy: 0.7746083531368501
Energy: 0.7792291696408462
Energy: 0.9332934007432759
Energy: 0.8017018156397263
Energy: 0.7894184587267766
Energy: 0.7884266975066068
Energy: 0.8150019858104464
Energy: 0.9211313713636126
Energy: 0.8982661636603241
Energy: 0.7953258698317924
Energy: 0.8192296618258692
Energy: 0.7788612329265221
Energy: 0.8928072340855734
Energy: 0.9343960472503577
Energy: 0.8594776463220603
Energy: 0.7882598672593034
Energy: 0.9658154955910129
Energy: 0.922870164091916
Energy: 0.9610193368399005
Energy: 0.8244791865929069
Energy: 0.7806151587032956
Energy: 0.973943479318485
Energy: 0.886617861662974
Energy: 0.9626303367619817
Energy: 0.8426058693037514
Energy: 0.8556460005834547
Energy: 0.9395691703792161
Energy: 0.896102417719748
Energy: 0.9732686186567119
Energy: 0.8258417786104959
Energy: 0.9846017090143311
Energy: 0.9392735192038026
Energy: 0.9569063324863699
Energy: 1.0006077199848138
Energy: 0.8223384955276387
Energy: 0.9810631484247923
Energy: 0.9583019609141095
Energy: 0.9018462704145402
Energy: 0.9764522383322298
Energy: 0.7135133922702028
Energy: 0.972952989829463
Energy: 0.9607730755891184
Energy: 0.9049243972954927
Energy: 0.7767863334955075
Energy: 0.8316744063873599
Energy: 0.9754386001268583
Energy: 1.023121636175338
Energy: 0.9343696040065208
Energy: 0.9195010901181304
Energy: 0.9516593237131171
Energy: 0.901547710188462
Energy: 0.933315678753681
Energy: 0.9316549476072924
Energy: 0.9238009204805215
Energy: 0.9615425330535655
Energy: 0.9378929695166097
Energy: 0.9554806442560729
Energy: 0.8757633454475912
Energy: 0.7828068396796586
Energy: 0.9872055641016688
Energy: 0.9395180045511241
Energy: 0.9623651982031765
Energy: 0.7153573441380543
Energy: 0.7829602215338409
Energy: 1.018723521263471
Energy: 0.9451462230656901
Energy: 0.937639085891171
Energy: 0.8376229670231102
Energy: 0.7749164644761938
Energy: 0.8798984990544595
Energy: 0.7967138067599367
Energy: 0.8731896157543748
Energy: 0.8497556116360997
Energy: 0.8347097625684954
Energy: 0.8705137651717536
Energy: 0.796213311566708
Energy: 0.9373906824050394
Energy: 0.8200192747777589
Energy: 0.8442465693903135
Energy: 0.84713048317814
Energy: 0.8065875446491134
Energy: 0.848214723752361
Energy: 0.8435476894356683
Energy: 0.8274398455006423
Energy: 0.8532947315066051
Energy: 0.7943491301007161
Energy: 0.8973174468377171
Energy: 0.7130487284290067
Energy: 0.9350557097176284
Energy: 0.9617231907690211
Energy: 0.9415747670517521
Energy: 0.9395934832340891
Energy: 0.771854918842502
Energy: 0.9713555926088944
Energy: 0.9270757961682174
Energy: 0.9790313779834156
Energy: 0.8621082822840922
Energy: 0.7763806883137246
Energy: 0.8769651755288255
Energy: 0.8993409895802711
Energy: 0.9372828033836754
Energy: 0.9828164590385886
Energy: 0.7157210854914265
Energy: 0.9177561701344821
Energy: 0.8972063634158676
Energy: 0.9451113832459568
Energy: 0.7105313498950908
Energy: 0.7129651082645699
Energy: 0.9618889882533653
Energy: 0.9293530463634898
Energy: 0.9918096018434225
Energy: 0.8909328514903817
Energy: 0.7163307883725658
Energy: 0.9542165459385505
Energy: 0.9147706073561227
Energy: 0.9127949511314443
Energy: 1.1053258433837974
Energy: 0.9713177442783271
Energy: 0.9262765221598185
Energy: 0.9265371546911048
Energy: 0.9176558423990043
Energy: 1.055923003388571
Energy: 0.9623213728023268
Energy: 0.9365399850000498
Energy: 0.9267186468284049
Energy: 0.9123297321026088
Energy: 0.7101961214196928
Energy: 0.977424163247482
Energy: 0.935013371356411
Energy: 0.9583941878794993
Energy: 0.7126205156265143
Energy: 0.7761996809494487
Energy: 1.0261085620427794
Energy: 0.9308592638765115
Energy: 0.9671829420057217
Energy: 0.7119828099419929
Energy: 0.7118182615343034
Energy: 0.9282164906487019
Energy: 0.794406341765874
Energy: 0.7631574725699717
Energy: 0.8278449971404566
Energy: 0.8382081463667987
Energy: 0.9895931205981096
Energy: 0.7986118021329273
Energy: 0.7681222468110926
Energy: 0.7101111759476054
Energy: 0.7625414530735165
Energy: 0.8077974151594419
Energy: 0.796466010755881
Energy: 0.8591986123274074
Energy: 0.8220855681511756
Energy: 0.8075035301028228
Energy: 0.8032980419528465
Energy: 0.9323411250287678
Energy: 0.7622773042352119
Energy: 0.82137595711945
Energy: 0.8571139349983472
Energy: 0.965450459439809
Energy: 0.9735379540572126
Energy: 0.826869200620127
Energy: 0.8718843822777659
Energy: 1.0231120729116217
Energy: 0.9712970147485803
Energy: 0.9831586679961307
Energy: 0.8251637309776723
Energy: 0.712163478476013
Energy: 0.9384617697750034
Energy: 0.9016734938595948
Energy: 0.9712080346121466
Energy: 0.8239393540490036
Energy: 0.9831296944787814
Energy: 0.9383083773189455
Energy: 0.9335962024877623
Energy: 0.9957233688785131
Energy: 0.9316109699251154
Energy: 0.9857232429572024
Energy: 0.9630060514460738
Energy: 0.9332397937182416
Energy: 0.881315925521608
Energy: 0.8285207801915788
Energy: 0.8243220059199591
Energy: 0.9314300788591207
Energy: 0.9593123077913566
Energy: 0.7128090424665606
Energy: 0.7744199142567529
Energy: 0.981230076019412
Energy: 1.0188027845335963
Energy: 0.9312972529969401
Energy: 0.9607099649732285
Energy: 0.9793858782323034
Energy: 0.9330914750490709
Energy: 0.9387337542348942
Energy: 0.9066473036407597
Energy: 0.865729120374617
Energy: 0.9525915408014547
Energy: 0.9347844535211113
Energy: 0.961228206089529
Energy: 0.9647685023301985
Energy: 0.7846970392666583
Energy: 0.9887241338565286
Energy: 0.9770124035551387
Energy: 0.964450973772284
Energy: 0.8555956239842846
Energy: 0.8256625739847133
Energy: 1.0065038890052125
Energy: 0.934522450219841
Energy: 0.8410665976050333
Energy: 0.8034523595008962
Energy: 0.8319227415853065
Energy: 0.8723005108672733
Energy: 0.7953629834702043
Energy: 0.8701934864690586
Energy: 0.8522091799240059
Energy: 0.775729786271132
Energy: 0.8596977789443676
Energy: 0.7951099026054607
Energy: 0.8388378378642934
Energy: 0.8498079660810515
Energy: 0.8325690326022732
Energy: 0.8414167648555475
Energy: 0.7983447941877749
Energy: 0.8559629791455022
Energy: 0.8256698647224384
Energy: 0.8435946293357787
Energy: 0.8437873894927971
Energy: 0.7942947311862177
Energy: 0.9576690755051164
Energy: 0.8363795253060782
Energy: 0.8275294254292717
Energy: 0.9359176250961417
Energy: 0.8896714100996743
Energy: 1.0434039225958542
Energy: 0.7839729390880273
Energy: 0.8303841192102466
Energy: 0.9588533069469123
Energy: 0.8965599418900921
Energy: 1.0152032918656282
Energy: 0.9130158516134763
Energy: 0.9195323084656501
Energy: 0.9332289502449757
Energy: 0.937789746898949
Energy: 0.9145135185265119
Energy: 0.8500028041128973
Energy: 0.898843380060936
Energy: 0.9329234457200636
Energy: 0.9381546360087207
Energy: 0.9043217796237708
Energy: 0.8518076189350754
Energy: 0.9242223081325929
Energy: 0.896666072863185
Energy: 0.9731060689373341
Energy: 0.7807372933223489
Energy: 0.7975604012574521
Energy: 0.9280362504623858
Energy: 0.9036378790458032
Energy: 1.0111479652883244
Energy: 0.9932143441821001
Energy: 0.9162961471145962
Energy: 0.8993700458476764
Energy: 0.8859885245155381
Energy: 0.894061538494604
Energy: 1.0722650676717849
Energy: 0.9115608995723375
Energy: 0.8965964766088947
Energy: 0.898484900745356
Energy: 0.9714486706806756

minimum gb energy = 0.7101111759476054 eV
minimum distance =  2.43330543570784 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.878839494456636
Energy: 0.8369103831118424
Energy: 0.8522711434190464
Energy: 0.9481853821943822
Energy: 0.9232058464124474
Energy: 0.9272281230368825
Energy: 0.9410541015816312
Energy: 0.859623485619635
Energy: 0.9615465529596291
Energy: 0.8181918839705187
Energy: 0.8693087772692037
Energy: 0.84648025580582
Energy: 0.8519205043914475
Energy: 0.8734858777847979
Energy: 0.8754507672334845
Energy: 0.904618038714298
Energy: 0.8633303906741949
Energy: 0.8571197381019596
Energy: 0.8646682975141077
Energy: 0.8265701080232409
Energy: 0.8928395353710203
Energy: 1.001598297102625
Energy: 0.9014601764944319
Energy: 0.887410524274546
Energy: 0.8948243315268362
Energy: 0.8587955971300881
Energy: 1.0019122826501166
Energy: 0.901958871048406
Energy: 0.9022094077161544
Energy: 0.8440094139359059
Energy: 0.9083113694290027
Energy: 0.8648930026274376
Energy: 0.8511157586960684
Energy: 0.8693947337715473
Energy: 0.8648163378415987
Energy: 0.8797505770908762
Energy: 0.8616107047749253
Energy: 0.8613472350780459
Energy: 0.8950314099426502
Energy: 0.9038247365078853
Energy: 0.9581202484713752
Energy: 0.8281038656963694
Energy: 0.9817609117881843
Energy: 0.9919286325227991
Energy: 0.8519275504116056
Energy: 0.8913914524551887
Energy: 0.8432973022554321
Energy: 0.9886836615232646
Energy: 0.9608642175838344
Energy: 0.8681031213051313
Energy: 0.94562750210675
Energy: 0.9331451896519128
Energy: 0.8689691644447598
Energy: 0.8838446362338032
Energy: 0.9568416687000577
Energy: 0.9269995142708017
Energy: 0.83908158616969
Energy: 0.8642685982746677
Energy: 0.8830113005037172
Energy: 0.9506553727617516
Energy: 0.863007704049873
Energy: 0.859163180784044
Energy: 0.8757926158649773
Energy: 0.8626644832199737
Energy: 0.8510174869146865
Energy: 0.8613504617611766
Energy: 0.851797821686165
Energy: 0.8523290942682705
Energy: 0.8447061087667528
Energy: 0.8900417199514928
Energy: 0.8400327871511133
Energy: 0.9412815352042616
Energy: 0.9969710575293856
Energy: 0.9018924683775109
Energy: 0.8679070652703651
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Energy: 0.9154276352074614
Energy: 0.9972795399720136
Energy: 0.9013973642456321
Energy: 0.8912083006167345
Energy: 0.8359302710639791
Energy: 0.9506563025771891
Energy: 0.8579123078735323
Energy: 0.8782379283744718
Energy: 0.8669575614554171
Energy: 0.8744247362661698
Energy: 0.8716480062152192
Energy: 0.8154053985348929
Energy: 0.8644569010766674
Energy: 0.8923993023408883
Energy: 0.9301366732546459
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Energy: 0.8474737463233941
Energy: 0.9740683969080616
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Energy: 0.9476339153380896
Energy: 0.9170103687083737
Energy: 0.8356380396454194
Energy: 0.9736304720348848
Energy: 0.9968112340822284
Energy: 0.9750394321280983
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Energy: 0.9258965337235919
Energy: 0.8504226776752167
Energy: 0.8771234937118034
Energy: 0.9483506467788779
Energy: 0.8382529632112593
Energy: 0.9267858631466374
Energy: 0.8404665370377781
Energy: 0.9765876194248417
Energy: 0.8836157276734263
Energy: 0.8314182508756807
Energy: 0.9024891692211519
Energy: 0.8503753008994261
Energy: 0.8852137234525389
Energy: 0.8590543104284843
Energy: 0.8239468458595512
Energy: 0.853261788156087
Energy: 0.8469758588223839
Energy: 0.9683429259467028
Energy: 0.9183901012628759
Energy: 0.8884217537647967
Energy: 0.9452943158618673
Energy: 0.9013806892644555
Energy: 0.9392369025413876
Energy: 0.8673814512262306
Energy: 0.8887123727786715
Energy: 0.9377162205242636
Energy: 0.9012194431337699
Energy: 0.9259371818248774
Energy: 0.8753372505809511
Energy: 0.8681442928931989
Energy: 0.8877594975921601
Energy: 0.8534326321779032
Energy: 0.8741474511328386
Energy: 0.8260151213217628
Energy: 0.8496193553062611
Energy: 0.8692925143027734
Energy: 0.8460695500246
Energy: 0.8635485512647175
Energy: 0.9530119390579627
Energy: 0.9417149857251201
Energy: 0.946420562075779
Energy: 0.8433948796583285
Energy: 0.9703294236541753
Energy: 0.9500239029165821
Energy: 0.8399836286016227
Energy: 0.9336850472543996
Energy: 0.8451219798260146
Energy: 0.9508932486752049
Energy: 1.0170755629017851
Energy: 0.8613047083597287
Energy: 0.8420487193807132
Energy: 0.9325031989773289
Energy: 0.8446607367422865
Energy: 0.9528955584861023
Energy: 0.8489586831299195
Energy: 0.826245045245449
Energy: 0.9232624531600109
Energy: 0.8387313350492134
Energy: 0.9957295343126061
Energy: 0.9066787422948168
Energy: 0.8607080760064343
Energy: 0.985105847443786
Energy: 0.9730097409774938
Energy: 0.8903767833538706
Energy: 0.856268836340706
Energy: 0.8372599967381452
Energy: 0.8542844601403209
Energy: 0.8141708619030569
Energy: 0.9435925226562923
Energy: 0.8746567841671707
Energy: 0.8832117194671713
Energy: 0.9273879793158111
Energy: 0.8334596412364385
Energy: 0.974128040987479
Energy: 0.8749918888389352
Energy: 0.8838323519439772
Energy: 0.9450366767504089
Energy: 0.8617321589232124
Energy: 0.9278461468567113
Energy: 0.8509588430322853
Energy: 0.894549185673674
Energy: 0.9524578194138815
Energy: 0.8758377270264867
Energy: 0.9844525272867723
Energy: 0.8372731557556018
Energy: 0.854463210037645
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minimum gb energy = 0.8141708619030569 eV
minimum distance =  2.43704768937877 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.8441181602288033
Energy: 0.843768408555568
Energy: 0.8734354415840717
Energy: 0.9485821022652375
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Energy: 0.8448468457793848
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Energy: 0.9130795608523282
Energy: 0.9125977377696136
Energy: 0.9322351906946599
Energy: 0.8387385061670571
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Energy: 1.0233674171813845
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Energy: 0.9437502408067528
Energy: 0.942299128133235
Energy: 0.9194134723175024
Energy: 0.8857259909459803
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Energy: 0.9412340524084937
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Energy: 0.96019870610248
Energy: 0.8856713811857744
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Energy: 0.882381556007942
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Energy: 0.8858912458978982
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Energy: 0.8680713785048095
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Energy: 0.9011448490270739
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Energy: 0.9389968990012751
Energy: 0.924354226044313
Energy: 0.9207944013413095
Energy: 0.9056123242070894
Energy: 0.8834617969874481
Energy: 0.8958037797760453
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Energy: 0.8856190799580425
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Energy: 0.853720283056085
Energy: 0.926689121733976
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Energy: 0.8903381735507456
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Energy: 0.8863208774959915
Energy: 0.9091701409405403
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Energy: 0.8991360505049247
Energy: 0.9187945149145439
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Energy: 0.9534982005838085
Energy: 0.8626164415651122
Energy: 0.952279012946001
Energy: 0.9083452811082275
Energy: 0.9164460089221497
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Energy: 0.8529454903638461
Energy: 0.8723813716676615
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Energy: 0.9500745794854031
Energy: 0.8932735479284771
Energy: 0.8581347252580929
Energy: 0.8758789066531568
Energy: 0.9314688988465177
Energy: 0.903842637859693
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Energy: 0.8691270387151264
Energy: 0.8700191584522566
Energy: 0.9044812744142701
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Energy: 0.8632696763883999
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Energy: 0.8529222155810768
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Energy: 0.8201234946930859
Energy: 0.9275456844441023
Energy: 0.8794699637056226
Energy: 0.930794418114814
Energy: 0.8571371928820724
Energy: 0.8394930912629887
Energy: 0.9360911606900721
Energy: 0.8798192819333183
Energy: 0.9459488081586452
Energy: 0.943824429764199
Energy: 0.855122997267734
Energy: 0.9368363119559313
Energy: 0.9077885737151911
Energy: 0.8545969518222278
Energy: 0.917355519337422
Energy: 0.9158900691961301
Energy: 0.9465969881617269
Energy: 0.8681153758566782
Energy: 0.9373555920162754
Energy: 0.9179594870780338
Energy: 0.9158479142932079
Energy: 0.9465300050594647
Energy: 0.9746581352816435
Energy: 0.853142718882097
Energy: 0.8388540993468527
Energy: 0.9419230813939273
Energy: 0.8550479070862406
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Energy: 0.8533885834703933
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Energy: 0.9555298179448494
Energy: 0.8547813432845273
Energy: 0.8814529541919781
Energy: 0.8440619104023446
Energy: 0.8372354338820343
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Energy: 0.9631492836922214
Energy: 0.8925543010314058
Energy: 0.8440868838279811
Energy: 0.8439349878116336
Energy: 0.854158762033174
Energy: 0.9250896694328736
Energy: 0.9494222445059967
Energy: 0.8366378021070816
Energy: 0.8554751546322589
Energy: 0.8579633119045437
Energy: 0.8666947115119834
Energy: 0.9390299123177466
Energy: 0.8322084950549793
Energy: 0.8544992957885499
Energy: 0.8831354010356238
Energy: 0.9001288962365404
Energy: 0.967678312688695
Energy: 0.9307986192449946
Energy: 0.9251000367139994
Energy: 0.9028218551675057
Energy: 0.8575936408583724
Energy: 0.9869131018949402
Energy: 0.916422466782324
Energy: 0.9339748169654817
Energy: 0.900898371598854
Energy: 0.9107880977183737
Energy: 0.945371621440293
Energy: 0.9494338246022781
Energy: 0.9287924174616933
Energy: 0.9165046678413701
Energy: 0.9259652368783073
Energy: 0.8722147126559322
Energy: 0.9459879084926117
Energy: 0.9318483700130854
Energy: 0.8772070420745322
Energy: 0.9205711876697507
Energy: 0.9079876965360435
Energy: 0.9380374567806053
Energy: 0.8890378459488645
Energy: 0.8660693312803418
Energy: 0.9260139658288833
Energy: 0.8413960112677739
Energy: 0.8868245481741205
Energy: 0.8881391479222315
Energy: 0.874540874300866
Energy: 0.8735637046312053
Energy: 0.961129373089147
Energy: 0.9058884506333139
Energy: 0.8907629657159752
Energy: 0.8763367149809002
Energy: 0.9332453527839181
Energy: 0.9329838102217592
Energy: 0.9032167819863716
Energy: 0.885145247891093
Energy: 0.8760716019594949
Energy: 0.9337234843427324
Energy: 0.9594087007925738
Energy: 0.925560370484184
Energy: 0.9013420284042338
Energy: 0.8849205720366136
Energy: 0.939609216595966
Energy: 0.8876361556225885
Energy: 0.8890531423420538
Energy: 0.8894071908016116
Energy: 0.8853011596584295
Energy: 0.9531398720220352
Energy: 0.8859560148679784
Energy: 0.8966353504685586
Energy: 0.9094574933241856
Energy: 0.904233611020359
Energy: 0.8963011086179884
Energy: 0.8910174564962502
Energy: 0.8924400472641988
Energy: 0.9089178920275254
Energy: 0.9066204276088318
Energy: 0.8644575653383398
Energy: 0.9011341667103016
Energy: 0.9119952788541225
Energy: 0.8891425313709663
Energy: 0.8913152658605038
Energy: 0.8601444844105824
Energy: 0.9029571956485442
Energy: 0.8872161815351414
Energy: 0.8866644612719781
Energy: 0.8892668582637102
Energy: 0.8539211315772772
Energy: 0.9450686716536317
Energy: 0.8557737589865412
Energy: 0.9257074307379345
Energy: 0.9257366146183101
Energy: 0.8794027116781118
Energy: 0.9448381979134557
Energy: 0.8646604617595062
Energy: 0.884839475911794
Energy: 0.9515763678308272
Energy: 0.9008050314690386
Energy: 0.9419656080178473
Energy: 0.9343135077359807
Energy: 0.9246229306148983
Energy: 0.9182836703755471
Energy: 0.9192897611098504
Energy: 0.9423844513662811
Energy: 0.9310944433985697
Energy: 0.93059371422516
Energy: 0.9192234772014575
Energy: 0.9243415054561192
Energy: 0.8857687393592104
Energy: 0.8850814781037185
Energy: 0.837036047009851
Energy: 0.8382258067368866
Energy: 0.9236028720010951
Energy: 0.870156111611229
Energy: 0.9353004380346557
Energy: 0.8458483177124723
Energy: 0.8410627813556546
Energy: 0.9348940558125074
Energy: 0.8708869833734494
Energy: 0.8560064510013257
Energy: 0.860123054325029
Energy: 0.8574927720582145
Energy: 0.867534564554672
Energy: 0.8666317362183974
Energy: 0.8520715669667914
Energy: 0.8533110462733707
Energy: 0.8540790600670816
Energy: 0.9102308673948623

minimum gb energy = 0.8195510733177982 eV
minimum distance =  2.43932120730473 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 1.1893903965547092
Energy: 0.8289756182749867
Energy: 0.8290490561372129
Energy: 0.8677221048624356
Energy: 0.7953423520126983
Energy: 1.0897321021365203
Energy: 0.8348121665864318
Energy: 0.8334316347480146
Energy: 0.8822802066526017
Energy: 0.8412818534153057
Energy: 0.8149615389015589
Energy: 0.9027504026894634
Energy: 0.8655624719824387
Energy: 0.8735356688124863
Energy: 0.869913591450462
Energy: 0.816928865876009
Energy: 0.821518139441907
Energy: 0.8782721414772491
Energy: 0.8772085402726414
Energy: 0.9228071351876215
Energy: 0.8471923603551935
Energy: 0.9201556719535869
Energy: 0.8810329834300393
Energy: 0.8641457615208582
Energy: 0.8640157044872524
Energy: 0.8382516647213452
Energy: 0.8848547671945161
Energy: 0.8681283107410926
Energy: 0.8778307569811872
Energy: 0.8706615546462063
Energy: 0.9592967492553685
Energy: 0.8677897648203466
Energy: 0.886390120949104
Energy: 0.8314143829471858
Energy: 0.8316789592788589
Energy: 0.9559991294683681
Energy: 0.8758035372953259
Energy: 0.8546620227988512
Energy: 0.846946894038396
Energy: 0.8650307075230763
Energy: 0.9212281701781229
Energy: 0.8775903789584395
Energy: 0.8800978208197816
Energy: 0.8154078485511829
Energy: 0.8155685010796581
Energy: 0.8781536413565773
Energy: 0.8489291405721128
Energy: 0.853128754402731
Energy: 0.8169113476717027
Energy: 0.8125912778197452
Energy: 0.8704988000903653
Energy: 0.8580726357666543
Energy: 0.8223042945300816
Energy: 0.8379200508382068
Energy: 0.8839150932333982
Energy: 0.8586481430457356
Energy: 0.8577782607453365
Energy: 0.8835766878445805
Energy: 0.8375436387904026
Energy: 0.8157804315982943
Energy: 0.8186352983484328
Energy: 0.9229383517357439
Energy: 0.9209456648484323
Energy: 0.8856929933114834
Energy: 0.8244892669835129
Energy: 0.8782019255677675
Energy: 0.8769458499658016
Energy: 0.9253793220665131
Energy: 0.8817633742634653
Energy: 0.8251010045307245
Energy: 0.879124997844103
Energy: 0.9231665626170261
Energy: 0.9170128767513059
Energy: 0.9172247184067771
Energy: 0.8256603932074621
Energy: 0.8057492901968111
Energy: 0.9167229089876336
Energy: 0.9173243231609928
Energy: 0.9177967179391207
Energy: 0.7970382924669029
Energy: 0.8054767196264024
Energy: 0.8239619256262556
Energy: 0.8837183524856319
Energy: 0.9196364573792465
Energy: 0.9139466819636577
Energy: 0.8055269037928869
Energy: 0.8230352897720312
Energy: 0.8824711153285223
Energy: 0.9200355605689697
Energy: 0.8744644606079697
Energy: 0.8647647204780661
Energy: 0.8550569824382259
Energy: 0.9214081537640636
Energy: 0.9283611001257708
Energy: 0.9110136866077921
Energy: 0.9295267100493152
Energy: 0.8257806721693368
Energy: 0.9261281628477663
Energy: 0.9238259390832994
Energy: 0.9225110709804757
Energy: 0.9105759099571625
Energy: 0.9415637206878102
Energy: 0.8555254385649227
Energy: 0.882330881959109
Energy: 0.8651563589066839
Energy: 0.9276740025390134
Energy: 0.9034843282590868
Energy: 0.8548889026121522
Energy: 0.8989668610977692
Energy: 0.8654867192197351
Energy: 0.9271165904284315
Energy: 0.8698005673456878
Energy: 0.8570655336585093
Energy: 0.8287068463359081
Energy: 0.8485025875499298
Energy: 0.9335922850801809
Energy: 0.8667268982437518
Energy: 0.8555790336650999
Energy: 0.8929154054518101
Energy: 0.8314965835982079
Energy: 0.8919035887231066
Energy: 0.8755692637843443
Energy: 0.8196861389408167
Energy: 0.8219960049017834
Energy: 0.8285178964383526
Energy: 0.8929107245925189
Energy: 0.8921957176176499
Energy: 0.8917494032444077
Energy: 0.884623157138175
Energy: 0.8325841617890789
Energy: 0.9253282703135205
Energy: 0.8212349707283255
Energy: 0.9153191037045587
Energy: 0.8345994536299527
Energy: 0.8157968585328368
Energy: 0.873202915730203
Energy: 0.8345985534370739
Energy: 0.8598242543158064
Energy: 0.8338479075507387
Energy: 0.8133705106720625
Energy: 0.8338738007582608
Energy: 0.9213329489847046
Energy: 0.8663585232562906
Energy: 0.8333320673394108
Energy: 0.8595988886547105
Energy: 0.7909355873988166
Energy: 0.878564861425933
Energy: 0.8793318789115542
Energy: 0.8326151936942269
Energy: 0.8905420193230508

minimum gb energy = 0.7909355873988166 eV
minimum distance =  2.46978464935194 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.7723383736462213
Energy: 0.7918829421891519
Energy: 0.7628639600421375
Energy: 0.7403177993374387
Energy: 0.7480938836478707
Energy: 0.7312054804720111
Energy: 0.7778749221132131
Energy: 0.7685197896235555
Energy: 0.7599482761089148
Energy: 0.8044414251020063
Energy: 0.8225790884375147
Energy: 0.7974989838818228
Energy: 0.7396039066816913
Energy: 0.7573018867868505
Energy: 0.7542333989723637
Energy: 0.8098058729550627
Energy: 0.7629838036180407
Energy: 0.7718656912350845
Energy: 0.7666247794633891
Energy: 0.8199037114468237
Energy: 0.7573661524053954
Energy: 0.7989662033584551
Energy: 0.8114644111986664
Energy: 0.7875870243752799
Energy: 0.7795679573956387
Energy: 0.7700740379570838
Energy: 0.7602159981738159
Energy: 0.8219817667169879
Energy: 0.8023240790065244
Energy: 0.7782081073274123
Energy: 0.8133984492438131
Energy: 0.7428000398126441
Energy: 0.8037156139473276
Energy: 0.7934079852695048
Energy: 0.840342865154064
Energy: 0.8065074491096288
Energy: 0.8037080912990732
Energy: 0.7704363712071277
Energy: 0.8002054420192272
Energy: 0.7959056600572177
Energy: 0.8202123200243183
Energy: 0.7759895369123401
Energy: 0.8081473004544247
Energy: 0.7998282712789956
Energy: 0.7948440825469093
Energy: 0.8102074785325266
Energy: 0.8255252306961286
Energy: 0.8073357484769214
Energy: 0.8071485940346734
Energy: 0.7893516503246514
Energy: 0.8103414316956719
Energy: 0.8555345813324243
Energy: 0.8036892994951884
Energy: 0.7700958347380688
Energy: 0.8203286899288678
Energy: 0.8357703130157802
Energy: 0.7348260583303043
Energy: 0.7955952364814508
Energy: 0.7721335226894597
Energy: 0.8141477986185731
Energy: 0.8083320652242146
Energy: 0.8196369627137697
Energy: 0.8137995020544507
Energy: 0.7673935153833675
Energy: 0.801282519350162
Energy: 0.8070933167371366
Energy: 0.7804982618770437
Energy: 0.7956239727002854
Energy: 0.8413216512674709
Energy: 0.8089027528751713
Energy: 0.8089963112431366
Energy: 0.7900190438294634
Energy: 0.7883526539725956
Energy: 0.7667087104125312
Energy: 0.8006990733568793
Energy: 0.8449027864057814
Energy: 0.7851226934225726
Energy: 0.7814493250783123
Energy: 0.7634377289346526
Energy: 0.8049572238157376
Energy: 0.7878987154269478
Energy: 0.7942002502179795
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Energy: 0.7866214726584967
Energy: 0.7843687813810277
Energy: 0.7737133320686176
Energy: 0.7829424309232956
Energy: 0.7376875871006477
Energy: 0.7929364012175151
Energy: 0.7904900751302022
Energy: 0.8011293865810423
Energy: 0.770351119829652
Energy: 0.7644159557621739
Energy: 0.7877043636988278
Energy: 0.820355488825646
Energy: 0.8065702915087467
Energy: 0.752926508583129
Energy: 0.7561179030041982
Energy: 0.7671204389065301
Energy: 0.7535205857187963
Energy: 0.7305439825288872
Energy: 0.7510636344277778
Energy: 0.7847277505255777
Energy: 0.7589365720750709
Energy: 0.8433169967337854
Energy: 0.7310444200655424
Energy: 0.7288618250039578
Energy: 0.7977884961689086
Energy: 0.76254678835852
Energy: 0.8422541469355358
Energy: 0.7659115766510969
Energy: 0.767297310006899
Energy: 0.7620675029270756
Energy: 0.755574894763692
Energy: 0.8096884805312774
Energy: 0.7898999618374956
Energy: 0.7489850552476135
Energy: 0.7294748785425778
Energy: 0.7835026048255925
Energy: 0.8087559933452392
Energy: 0.7559152189177865
Energy: 0.7619836591157865
Energy: 0.754838210089921
Energy: 0.7785874690671594
Energy: 0.790128400549522
Energy: 0.7731446497870085
Energy: 0.7779227148329049
Energy: 0.7545346497118722
Energy: 0.7688335778795762
Energy: 0.7654563816549224
Energy: 0.7928322325631126
Energy: 0.7838678193804862
Energy: 0.7470533014402081
Energy: 0.806367568735658
Energy: 0.784180351443695
Energy: 0.79091333993521
Energy: 0.7571871682421446
Energy: 0.7496811467750442
Energy: 0.7377236633625461
Energy: 0.7740696163562427
Energy: 0.763493994658895
Energy: 0.7883764126091175
Energy: 0.7864908952970003
Energy: 0.8222197124958526
Energy: 0.7784652006729291
Energy: 0.7983254409235256
Energy: 0.758742711777426
Energy: 0.7885128759125569
Energy: 0.7941280063368731
Energy: 0.7846256985400567
Energy: 0.8461897498096049
Energy: 0.8137295932348427
Energy: 0.7861301642777783
Energy: 0.7828055407234021
Energy: 0.8121380327656855
Energy: 0.8196529041639444
Energy: 0.8157575131587246
Energy: 0.783749911798164
Energy: 0.7826661868750353
Energy: 0.8127940275017703
Energy: 0.8053632724462215
Energy: 0.7752221535130062
Energy: 0.7807029716745255
Energy: 0.7826947674046165
Energy: 0.803169203535414
Energy: 0.8049457740312115
Energy: 0.8009213385072667
Energy: 0.7774412028070423
Energy: 0.78730080352415
Energy: 0.7873133006606148
Energy: 0.7767061791059552
Energy: 0.804147108245752
Energy: 0.8563398942498842
Energy: 0.8207868409098459
Energy: 0.7851886737431519
Energy: 0.7969789337297614
Energy: 0.8036764584862403
Energy: 0.8717934224422685
Energy: 0.8062666305818833
Energy: 0.7921277714257268
Energy: 0.7974063991028573
Energy: 0.8589900678342139
Energy: 0.7919485731280133
Energy: 0.8330570497497318
Energy: 0.8432823442020067
Energy: 0.8306742923380698
Energy: 0.8272187135489495
Energy: 0.7950234246380526
Energy: 0.8185879405062252
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Energy: 0.7290063464991045
Energy: 0.7315686950246072
Energy: 0.7752342139082334
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Energy: 0.7499192924487885
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Energy: 0.7593088415968406
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Energy: 0.8097809798861532
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Energy: 0.8254295974936915
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Energy: 0.7941432163819112
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Energy: 0.8175642136223396
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Energy: 0.8058801027130942
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Energy: 0.8212978980624532
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Energy: 0.7970302990896133
Energy: 0.8108471807164527
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Energy: 0.776055870022012
Energy: 0.8004259260224554
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Energy: 0.7782935105631034
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Energy: 0.7586365687248067
Energy: 0.8099513865082845
Energy: 0.7870337172502063
Energy: 0.783558232640398
Energy: 0.8071012380298055
Energy: 0.8696708707476962
Energy: 0.7996642988262413
Energy: 0.7683828503033913
Energy: 0.8012545939678428
Energy: 0.8009545097969486
Energy: 0.8133777839909071
Energy: 0.7994819813630801
Energy: 0.7926962101145519
Energy: 0.7716589376723701
Energy: 0.7941204228754042
Energy: 0.8067417028916409
Energy: 0.7957124654069849
Energy: 0.7917163393709683
Energy: 0.7467437158299702
Energy: 0.7833170257224754
Energy: 0.8075011050622853
Energy: 0.8093925810709857
Energy: 0.8019904673063681
Energy: 0.8075042958665727
Energy: 0.7965722760268362
Energy: 0.8084080304434391
Energy: 0.8017141048734255
Energy: 0.7819663273587011
Energy: 0.8009442707665918
Energy: 0.7977236029911041
Energy: 0.8024366580171896
Energy: 0.7899575494555133
Energy: 0.8512313356485363
Energy: 0.793410357031109
Energy: 0.7942354302998788
Energy: 0.7288607363837789
Energy: 0.7332592783041351
Energy: 0.7637161403874788
Energy: 0.7643837926991569
Energy: 0.8137501362047493
Energy: 0.7557176239041389
Energy: 0.7718456704704068
Energy: 0.7661619235704118
Energy: 0.7830511549652054
Energy: 0.8016989352480958
Energy: 0.7410035075458851
Energy: 0.7429758570442628
Energy: 0.7527214690990363
Energy: 0.7350219196839068
Energy: 0.7777349811296305
Energy: 0.738516318349609
Energy: 0.7778111928799888
Energy: 0.7726915971363738
Energy: 0.8114878585956545
Energy: 0.8188627038400218
Energy: 0.7431467390651655
Energy: 0.7514206174325146
Energy: 0.7556072515688701
Energy: 0.7749826460212969
Energy: 0.7939988174170414
Energy: 0.7698502409040623
Energy: 0.7299928101787218
Energy: 0.7628496231949645
Energy: 0.7325072662578362
Energy: 0.780574816933796
Energy: 0.7662792363454869
Energy: 0.7666805887236691
Energy: 0.7790209366134774
Energy: 0.8295359040241247
Energy: 0.7333447596647278
Energy: 0.7462629090535255
Energy: 0.7395689258072721
Energy: 0.7834074132637031

minimum gb energy = 0.7288607363837789 eV
minimum distance =  2.51571587866725 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.5165940372062071
Energy: 0.6863847687779134
Energy: 0.672863366501099
Energy: 0.4144753618119717
Energy: 0.47940781216332007
Energy: 0.6928169665415234
Energy: 0.7136072254088794
Energy: 0.5451373204373087
Energy: 0.6042586979987173
Energy: 0.5303135906146597
Energy: 0.5684730562676629
Energy: 0.7465493295074789
Energy: 0.6817378271136295
Energy: 0.5252839936163541
Energy: 0.47232735160144923
Energy: 0.47094234551507547
Energy: 0.685390666792588
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Energy: 0.588212804824794
Energy: 0.4888296344214093
Energy: 0.5356510221634365
Energy: 0.6202798217260912
Energy: 0.6939302974138616
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Energy: 0.5422599273977002
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Energy: 0.422376623618108
Energy: 0.3902422952461628
Energy: 0.5667853857770014
Energy: 0.683684296825909
Energy: 0.47676391573676047
Energy: 0.5004517554821306
Energy: 0.46054113997768076
Energy: 0.574134450452471
Energy: 0.71075294119619
Energy: 0.5734898067438587
Energy: 0.4251965948051523
Energy: 0.5172729423875947
Energy: 0.6140711494613784
Energy: 0.6141662468093739
Energy: 0.4802632366739289
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Energy: 0.6848841811249803
Energy: 0.6297777672761339
Energy: 0.5868590547639017
Energy: 0.5870643991949447
Energy: 0.4886168668478755
Energy: 0.5574316995235986
Energy: 0.4868802730588345
Energy: 0.5023636583984918
Energy: 0.3884173458611351
Energy: 0.3889915712050899
Energy: 0.5990445595773976
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Energy: 0.5657229617405415
Energy: 0.47450599530380627
Energy: 0.43824008422795496
Energy: 0.6435278998076606
Energy: 0.6211754575434942
Energy: 0.5339405575132069
Energy: 0.39004950443251085
Energy: 0.39479333092237223
Energy: 0.500973738675627
Energy: 0.5504722285232905
Energy: 0.5435938144092224
Energy: 0.4720143350152503
Energy: 0.537787781942753
Energy: 0.6596607900548596
Energy: 0.5255476669281687
Energy: 0.5653575162810751
Energy: 0.5597691840197768
Energy: 0.5486076281639589
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Energy: 0.5004736334373969
Energy: 0.5340546601789031
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Energy: 0.585570003917015
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Energy: 0.6383634274628014
Energy: 0.4813578807821578
Energy: 0.4698766278571748
Energy: 0.5165039434660109
Energy: 0.5090681546934942
Energy: 0.5712515050816417
Energy: 0.40799408873358417
Energy: 0.5266514781610836
Energy: 0.4892475513824691
Energy: 0.48065384887498364
Energy: 0.513635068350272
Energy: 0.44801450780414964
Energy: 0.5157198462383519
Energy: 0.5604224404626406
Energy: 0.5397673408473913
Energy: 0.49473303690964515
Energy: 0.4397049531835378
Energy: 0.5025508208998611
Energy: 0.5934691888795234
Energy: 0.543397852203769
Energy: 0.36145692449986877
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Energy: 0.5131871321407003
Energy: 0.6017407343231937
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Energy: 0.43649901121078205
Energy: 0.4309911325797087
Energy: 0.49213400166411936
Energy: 0.620920119408612
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Energy: 0.3840673865003356
Energy: 0.3819279246207736
Energy: 0.5657042081085175
Energy: 0.5914127386652064
Energy: 0.5490084136207083
Energy: 0.5214273897956541
Energy: 0.4831882179115289
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Energy: 0.33426006861276686
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Energy: 0.5542402747709049
Energy: 0.49775147307302814
Energy: 0.3226687216369151
Energy: 0.33320460089952864
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Energy: 0.43774920649342447
Energy: 0.47430127667617833
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Energy: 0.4878831820636549
Energy: 0.5455646961177941
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Energy: 0.3814971728849089
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Energy: 0.5759307748560947
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Energy: 0.4833668438960586
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Energy: 0.5491532747718944
Energy: 0.5659670030536484
Energy: 0.557217667347135
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Energy: 0.719322725647947
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Energy: 0.47118607889337294
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Energy: 0.5286747090124748
Energy: 0.5693140205474606
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Energy: 0.5572498337409342
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Energy: 0.3227136678295784
Energy: 0.33286685412230727
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Energy: 0.6006672934271852
Energy: 0.48575993271323215
Energy: 0.48427254929117375
Energy: 0.46901743675470703
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Energy: 0.49542072728814085
Energy: 0.3630767446935651
Energy: 0.331621486426493
Energy: 0.5543802926887563
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Energy: 0.5089374033488868
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Energy: 0.4300744766414924
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Energy: 0.6784074708861716
Energy: 0.587657075834271
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Energy: 0.6271150584129318
Energy: 0.5509098116799822
Energy: 0.4738734583570201
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Energy: 0.516446616913826
Energy: 0.48532479429561415
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Energy: 0.5574896233276062
Energy: 0.6115147447776736
Energy: 0.5416692971780512
Energy: 0.3821713001912868
Energy: 0.383306073061011
Energy: 0.5629220228195184
Energy: 0.48859458126231303
Energy: 0.5137506412799101
Energy: 0.598749164057357
Energy: 0.43660718958154354
Energy: 0.5322746830343947
Energy: 0.6802521804775787
Energy: 0.6645708636615448
Energy: 0.47253148688759017
Energy: 0.5798708763765084
Energy: 0.46843603095934716
Energy: 0.597885394743894
Energy: 0.5355344911118403
Energy: 0.43485629257117225
Energy: 0.5878105182917948
Energy: 0.5265300725922408
Energy: 0.6296215900356521
Energy: 0.5797326656177052
Energy: 0.5112507110719166
Energy: 0.6122051270580596
Energy: 0.6170030676235913
Energy: 0.6445446008618151
Energy: 0.38965184791225843
Energy: 0.42947053100635113
Energy: 0.5456398783010276
Energy: 0.7257120022805925
Energy: 0.5625073084117559
Energy: 0.48853458236857483
Energy: 0.4932543340794201
Energy: 0.5018586407156698
Energy: 0.6303010173221727
Energy: 0.6463376802581234
Energy: 0.5905494470871854
Energy: 0.46969414967189654
Energy: 0.6089908104773927
Energy: 0.7154545972425033
Energy: 0.4954909983052638
Energy: 0.5257896169653411
Energy: 0.5337017190487713
Energy: 0.6977153021535113
Energy: 0.7299559099204261
Energy: 0.5894276294334131
Energy: 0.577578086970853
Energy: 0.662827402515341
Energy: 0.6719375107934148
Energy: 0.6697122193048399
Energy: 0.49023615422859673
Energy: 0.45069590068475107
Energy: 0.5275560437823282
Energy: 0.6719174487815032
Energy: 0.6697755378549136
Energy: 0.6214659486790464

minimum gb energy = 0.3226687216369151 eV
minimum distance =  2.51314953407474 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.7580763378856388
Energy: 0.691064971505893
Energy: 0.7094147355861358
Energy: 0.7112774799051834
Energy: 0.6913397713182251
Energy: 0.7419596474280385
Energy: 0.6913625793296144
Energy: 0.6837270109689219
Energy: 0.7016262183567162
Energy: 0.6945726116849
Energy: 0.6973263851984641
Energy: 0.7167821756660331
Energy: 0.6844944869366565
Energy: 0.68411372189805
Energy: 0.7177496425367785
Energy: 0.6931364071242453
Energy: 0.715662415974291
Energy: 0.6931570942071427
Energy: 0.680621435348651
Energy: 0.7186584872991604
Energy: 0.697425838878809
Energy: 0.6835988126161381
Energy: 0.6819740949812564
Energy: 0.7138719978078077
Energy: 0.6957840832931151
Energy: 0.6981796057272058
Energy: 0.6815252893241683
Energy: 0.6810374477605889
Energy: 0.7176585320880113
Energy: 0.6936116423317156
Energy: 0.7160533845448355
Energy: 0.7015727462057579
Energy: 0.6765263610082223
Energy: 0.6938382820061805
Energy: 0.7241871395249881
Energy: 0.7197651722077218
Energy: 0.7257972937849058
Energy: 0.7173142641386115
Energy: 0.6914589630066582
Energy: 0.7163915553457413
Energy: 0.6940690155295126
Energy: 0.6877314595455155
Energy: 0.6934217909854015
Energy: 0.7008325783228639
Energy: 0.6951759285133908
Energy: 0.6981279381123582
Energy: 0.7151895518565401
Energy: 0.6945008481368017
Energy: 0.7007002249607488
Energy: 0.6983583679087857
Energy: 0.7213378062908543
Energy: 0.6900127637483844
Energy: 0.7319450469902984
Energy: 0.7091547379749726
Energy: 0.6962661165117275
Energy: 0.7004306722461593
Energy: 0.7004819687353608
Energy: 0.7181587628233277
Energy: 0.7078736638989908
Energy: 0.697728518096782
Energy: 0.7178615833779576
Energy: 0.6958001802255614
Energy: 0.7100769717744058
Energy: 0.7143493871066688
Energy: 0.7071632235148245
Energy: 0.73131718410224
Energy: 0.6985903958434687
Energy: 0.7023705967184297
Energy: 0.7864305507777724
Energy: 0.6891558524967029
Energy: 0.7024253178517611
Energy: 0.6953077491317119
Energy: 0.6995189742658691
Energy: 0.7286755208872203
Energy: 0.6997622905455175
Energy: 0.7034838104878726
Energy: 0.7006861068186349
Energy: 0.6984832888128436
Energy: 0.7180233537049704
Energy: 0.6997759701619359
Energy: 0.700003500713584
Energy: 0.715274470074312
Energy: 0.6941790593491078
Energy: 0.6978352316388251
Energy: 0.7180884637723931
Energy: 0.6997709184838373
Energy: 0.71523479228841
Energy: 0.6935600250998134
Energy: 0.6971961648098227
Energy: 0.7189949780959596
Energy: 0.7184266555153744
Energy: 0.701799035609856
Energy: 0.7142581847181608
Energy: 0.7047278712289077
Energy: 0.7208984053783105
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Energy: 0.6999599234166207
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Energy: 0.731762164153417
Energy: 0.7069800791683523
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Energy: 0.7767462531889786
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Energy: 0.7081902870800375
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Energy: 0.6882485888650989
Energy: 0.7198254919545997
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Energy: 0.6921468912833406
Energy: 0.700885849007281
Energy: 0.7007857910596254
Energy: 0.7089316436735719
Energy: 0.6933272488960821
Energy: 0.7165661222180372
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Energy: 0.699599876010825
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Energy: 0.7300657159291898
Energy: 0.6906578391467018
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Energy: 0.7660744898229428
Energy: 0.6909618623608028
Energy: 0.7195764103684338
Energy: 0.7326284075748419
Energy: 0.6972255125963196

minimum gb energy = 0.6698807617020754 eV
minimum distance =  2.46204787853207 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 1.3225862577419163
Energy: 0.8808057601540042
Energy: 0.849033446387706
Energy: 0.8472970581700079
Energy: 0.8845269640554901
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Energy: 0.8974098605683588
Energy: 0.897695910617255
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Energy: 0.8457308556738171
Energy: 0.8921941528106422
Energy: 0.8810276927509664
Energy: 0.8962669364531403
Energy: 0.8464873669413191
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Energy: 0.8810513693852289
Energy: 0.8776255822419142
Energy: 0.936515719973752
Energy: 0.9089116664178387
Energy: 0.8455357783524524
Energy: 0.8800656256579182
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Energy: 0.8469243832755896
Energy: 0.8801947733252297
Energy: 0.969039764320987
Energy: 0.8805467570465058
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Energy: 0.9033343785150986
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Energy: 0.8968645924335339
Energy: 0.8797965673350455
Energy: 0.8810005942561222
Energy: 0.9829265145998765
Energy: 0.9053159139631693
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Energy: 0.8808039456334331
Energy: 0.983577242247512
Energy: 0.9052454324816103
Energy: 0.8987155371206599
Energy: 0.8285319889030038
Energy: 0.8560153181132476
Energy: 0.8969876224808216
Energy: 0.8815178344215601
Energy: 0.8814146605671668
Energy: 0.856531836435002
Energy: 0.8567361017370244
Energy: 0.896696790629913
Energy: 0.8863439248242126
Energy: 0.8816650934753194
Energy: 0.8978969157382731
Energy: 0.8572477851966968
Energy: 0.8461279826097865
Energy: 0.8810503946209155
Energy: 0.8938671623263444
Energy: 0.8979251228243815
Energy: 0.856168286054605
Energy: 0.8901916391375648
Energy: 0.8808962493364431
Energy: 0.8854343522222221
Energy: 0.8838738092416494
Energy: 0.8987821985053701
Energy: 0.848369000226674
Energy: 0.8480177546595258
Energy: 0.8803201058429663
Energy: 0.8856926748840357
Energy: 0.899098690165175
Energy: 0.8474232298329131
Energy: 0.84922013330038
Energy: 0.8803129871270392

minimum gb energy = 0.8259339490932547 eV
minimum distance =  2.52574920328546 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.5678645059271965
Energy: 0.9839274760965687
Energy: 0.9876817416773637
Energy: 0.9895675385967431
Energy: 1.0322652721939212
Energy: 0.9562175017295047
Energy: 0.9939711516109982
Energy: 0.9863923828717294
Energy: 1.0088075076209213
Energy: 1.0344602621392576
Energy: 0.9740162065301898
Energy: 0.9755387394482845
Energy: 0.9677023961895614
Energy: 0.9714920788692041
Energy: 0.9794143768724708
Energy: 0.9732375531006852
Energy: 0.9750144653696745
Energy: 0.9694880600710754
Energy: 0.976654535523261
Energy: 0.9789717944888027
Energy: 1.010724643916485
Energy: 0.9859094015474495
Energy: 0.9790764848508194
Energy: 0.9570981874643156
Energy: 0.9879928884175236
Energy: 1.011272344328888
Energy: 0.9824352490778264
Energy: 0.9818745341384845
Energy: 0.9571173226809522
Energy: 0.991744314043028
Energy: 0.966348253829809
Energy: 0.971127100049685
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minimum gb energy = 0.9369808109698885 eV
minimum distance =  2.49868280908892 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.9768482951049845
Energy: 1.0025299296809866
Energy: 0.9826632670477058
Energy: 0.986964166860939
Energy: 1.0198152494381343
Energy: 0.9764057417618461
Energy: 1.0045158744934641
Energy: 0.96733983963805
Energy: 0.9837849396820125
Energy: 1.022920323725038
Energy: 0.9514601091303211
Energy: 1.0024605394553134
Energy: 0.9688027260824644
Energy: 0.9846839024035768
Energy: 1.022115189017475
Energy: 0.9694209728741185
Energy: 0.974199594328821
Energy: 1.0123825397489756
Energy: 1.0111609542765305
Energy: 0.9535756472048361
Energy: 0.965727572214883
Energy: 1.006068046083319
Energy: 0.9714458060564045
Energy: 1.0140475901256139
Energy: 0.9558682788876077
Energy: 0.9653380801454899
Energy: 1.0041206573232437
Energy: 0.9186461749064146
Energy: 1.0130904707360238
Energy: 0.9555078475903321
Energy: 0.9527467374861895
Energy: 0.9635169808654218
Energy: 0.9179483379788465
Energy: 1.001771664222208
Energy: 0.9560298657713374
Energy: 0.9523617803653748
Energy: 0.9786222797856838
Energy: 0.9804448603597987
Energy: 0.9533763276827862
Energy: 0.9558546323933671
Energy: 0.9542046994514496
Energy: 0.9596282754918295
Energy: 0.9700228820306892
Energy: 0.9537369093321575
Energy: 0.9563093461512203
Energy: 0.9543981311612738
Energy: 0.9595439481563679
Energy: 0.9844607189387495
Energy: 0.9577503561117281
Energy: 0.9579284355638703
Energy: 1.0061572992523378
Energy: 1.008553821133255
Energy: 0.9901375412997336
Energy: 0.9539788382993978
Energy: 0.9567790825280835
Energy: 0.9531193324185968
Energy: 1.006107841991956
Energy: 1.0155699585173226
Energy: 0.9206547957323465
Energy: 0.9197709802226972
Energy: 1.0016810483540781
Energy: 0.9870403891050112
Energy: 1.0186350503921786
Energy: 0.9208143486909209
Energy: 0.9202353680271581
Energy: 1.0261046385265888
Energy: 1.0072637666317512
Energy: 0.9853045551320232
Energy: 0.921350876999152
Energy: 0.9673761443130275
Energy: 0.9544612077551026
Energy: 0.9587023947472982
Energy: 0.9839634200953274
Energy: 0.9207054280661925
Energy: 0.9219291233417175
Energy: 0.9573921964346774
Energy: 0.9591435879861789
Energy: 0.9534927869917565
Energy: 0.9844654455568658
Energy: 0.9923776126302242
Energy: 0.9561400190868502
Energy: 0.9606395005967729
Energy: 0.952695243054348
Energy: 0.955511330865335
Energy: 0.9530003225392242
Energy: 0.9530542253801564
Energy: 0.960143071743368
Energy: 0.9686826194026179
Energy: 0.9494642217348462
Energy: 0.9864660299051033
Energy: 0.9526095084109797
Energy: 0.9809338108938016
Energy: 0.9519805056339564
Energy: 0.9495051619786303
Energy: 0.9853017457746641
Energy: 0.9534433294733209
Energy: 0.9801400367789781
Energy: 0.9595093864689933
Energy: 1.0212635682819875
Energy: 1.0089581199192381
Energy: 0.9848787569645423
Energy: 0.9850468113149065
Energy: 0.958448884297403
Energy: 1.0176391731678514
Energy: 1.0214578870105075
Energy: 0.9837422942058726
Energy: 0.9558532298773914
Energy: 0.979564442112923
Energy: 1.0358199079844164
Energy: 1.0044707611183297
Energy: 0.9804456944154951
Energy: 0.9961076959503852
Energy: 0.9808110619514345
Energy: 1.0072311917625894
Energy: 1.0082199872559232
Energy: 0.9796922602045393
Energy: 1.0406722217983748
Energy: 0.9560479915832549
Energy: 0.9658100536056753
Energy: 1.0179098104353028
Energy: 0.9878129272581846
Energy: 0.9706415819446279
Energy: 0.9532459101015806
Energy: 0.9677020073573492
Energy: 0.9862570737282894
Energy: 0.9908057009421682
Energy: 0.9718028480022463
Energy: 0.9532100017119479
Energy: 0.9805993984671696
Energy: 0.9178833258636562
Energy: 0.9199082396513527
Energy: 0.9654669882871513
Energy: 0.9542512808454884
Energy: 0.9807089747231277
Energy: 0.9176353524287533
Energy: 0.920096173023567
Energy: 0.9566433405600014
Energy: 0.9569847891435238
Energy: 0.9565247622530669
Energy: 0.9588689513961984
Energy: 0.9523581132548243
Energy: 0.9594707122666705
Energy: 0.9579240654679647
Energy: 0.9558763140603671
Energy: 0.9852293733115556
Energy: 0.9527811791253289
Energy: 0.9597138182098742
Energy: 0.9579586091010921
Energy: 0.9624138671397068
Energy: 0.9500970481165872
Energy: 1.0012240786503543
Energy: 0.9599573161086352
Energy: 0.9591058911961485
Energy: 0.9629237050309021
Energy: 0.9489072349352841
Energy: 0.99723040968978
Energy: 0.9594856362389271
Energy: 0.921195130362825
Energy: 0.9709065609685835
Energy: 0.9742941300362669
Energy: 1.0063388165731009
Energy: 0.9222827738852616
Energy: 0.987433373616214
Energy: 0.9520403533928236
Energy: 0.9959882429733037
Energy: 0.9542815102135949
Energy: 0.9203760365575584
Energy: 1.0119057147036508
Energy: 0.9534716956250415
Energy: 0.9535495306785173
Energy: 1.0015687859405882
Energy: 0.926429465717788
Energy: 1.0082296644864237
Energy: 0.95380820552126
Energy: 0.9537745667159655
Energy: 0.9686901676642695
Energy: 0.9258302608825295
Energy: 0.9561251328203335
Energy: 0.9540298224215161
Energy: 0.9591391171366974
Energy: 1.0203100942876087
Energy: 0.9587065294635043
Energy: 0.9552790168138221
Energy: 0.957522175931557
Energy: 0.9572773343961775
Energy: 0.9807227558177605
Energy: 0.9592271248342328
Energy: 0.981225507755713
Energy: 0.9811403123177952
Energy: 0.9853239622335639
Energy: 0.9497446077293944
Energy: 0.9524185351194473
Energy: 0.9807813865924977
Energy: 0.9824697965507703
Energy: 0.9865315738927288
Energy: 0.9492899043143539
Energy: 1.0102468449665418
Energy: 0.9719203529395449
Energy: 0.9840531403067719
Energy: 1.048752333712317
Energy: 0.9586795629384054
Energy: 1.0008690184878741
Energy: 0.9851186175707723
Energy: 0.9853345317348404
Energy: 1.029886995941647
Energy: 0.9884369285989083
Energy: 1.0020128897569274
Energy: 0.9673110588673709
Energy: 0.9872051212342652
Energy: 1.033663511318487
Energy: 0.9508232853672639
Energy: 1.0026649764460456
Energy: 0.968398363283298
Energy: 0.9910455855468455
Energy: 1.0305542252292246
Energy: 0.9726738076318802
Energy: 1.0011770657418702
Energy: 0.9236403586573341
Energy: 1.0089404685107608
Energy: 0.9537296505762276
Energy: 0.9536796338009217
Energy: 1.0100396304228496
Energy: 0.9924073543134126
Energy: 1.0120094269157756
Energy: 0.956632982459334
Energy: 0.9541088174243886
Energy: 0.9845937002988263

minimum gb energy = 0.9176353524287533 eV
minimum distance =  2.44183408934872 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.9309624887890078
Energy: 0.9581299264262096
Energy: 0.9567532681209849
Energy: 0.9589248456772871
Energy: 0.9576840488288993
Energy: 0.9320584984121161
Energy: 0.9740818225259071
Energy: 1.0407664536100298
Energy: 0.9573608198200464
Energy: 0.9579701760190915
Energy: 1.043701571639467
Energy: 0.9582344371786724
Energy: 0.9750693545208423
Energy: 0.9751253850709184
Energy: 0.9754573496915128
Energy: 1.0231038215309587
Energy: 0.9567118516986612
Energy: 0.9595253804851152
Energy: 0.9752562752018205
Energy: 0.9755801195988865
Energy: 0.9767250931648466
Energy: 0.958089224046869
Energy: 0.9560238635727424
Energy: 0.9592918323087115
Energy: 1.0101882411699765
Energy: 0.9765196492309111
Energy: 0.9754485744639685
Energy: 0.957623750789984
Energy: 1.0424245934992469
Energy: 1.0089929251687395
Energy: 1.041726887277243
Energy: 0.933939333461636
Energy: 0.9568056153166331
Energy: 0.9750741904423446
Energy: 1.0098795005731787
Energy: 1.04401664794953
Energy: 0.9339090846059527
Energy: 0.959143230456875
Energy: 0.9756747189822943
Energy: 0.9427552436387133
Energy: 0.9599637748482925
Energy: 0.9592414388971463
Energy: 0.9326033911138704
Energy: 1.005967638754646
Energy: 0.956338029348064
Energy: 0.9748499830381331
Energy: 0.9613332039317316
Energy: 0.9330281922413748
Energy: 1.0266160632345906
Energy: 0.9577299516720941
Energy: 0.9591565359783907
Energy: 0.9622246131352794
Energy: 0.9582913293177142
Energy: 0.9576272719665353
Energy: 0.9580494051929735
Energy: 0.9577510031526905
Energy: 1.0405276304787257
Energy: 0.9575696553315673
Energy: 0.9555855463046763
Energy: 0.9575151344520443
Energy: 0.955839785179719
Energy: 0.9466556856148557
Energy: 0.975094160120372
Energy: 0.9686715124860186
Energy: 1.016216848776406
Energy: 0.9564083867550991
Energy: 0.9486023846661615
Energy: 0.9750247620753982
Energy: 0.9616971394773545
Energy: 1.0198866028539468
Energy: 0.9754953818578348
Energy: 1.0091531482394325
Energy: 0.9580406974876815
Energy: 0.9324115004961008
Energy: 0.957718820136426
Energy: 0.9755228312030463
Energy: 1.0075282601711626
Energy: 0.9565037913081904
Energy: 0.9322258652419343
Energy: 0.9573169481563572
Energy: 0.959848480064665
Energy: 0.9588962491423703
Energy: 0.9749858063763073
Energy: 0.9364249287056353
Energy: 1.0359978826693357
Energy: 0.9607863082829596
Energy: 0.9752447757786039
Energy: 0.9756386882389575
Energy: 0.9340624802908849
Energy: 0.9595737577349361
Energy: 0.9567929126817817
Energy: 0.9565149186299927
Energy: 1.0106996733416025
Energy: 0.9566950832024852
Energy: 0.958713212074299
Energy: 0.956630221464496
Energy: 0.9558079404113136
Energy: 1.008406351539049
Energy: 0.9761185307642075
Energy: 0.9706766339831323
Energy: 0.9346095769273576
Energy: 0.9751333696895002
Energy: 0.9580665021139136
Energy: 0.9563234129146141
Energy: 0.9574370741163332
Energy: 0.9338086374010598
Energy: 0.9753097251156416
Energy: 0.949191756347739
Energy: 0.9562886290411509
Energy: 0.9565579772215468
Energy: 0.9312062663999007
Energy: 0.961207625591337
Energy: 1.0441142447755536
Energy: 0.9580168387009563
Energy: 0.9578064616623734
Energy: 0.932317564530976
Energy: 0.9753287200552613
Energy: 1.0417997737255282
Energy: 0.9569989335850622
Energy: 0.9588971916752248
Energy: 1.0321005959017437
Energy: 0.9584002705757717
Energy: 0.975089396263394
Energy: 0.9760504775621864
Energy: 0.9753372880174724
Energy: 1.0249241434935428
Energy: 0.9568491391571664
Energy: 0.9596260867593058
Energy: 0.9763422553950782
Energy: 0.9776431989821175
Energy: 0.9753390404083387
Energy: 0.9586911805565197
Energy: 0.956026290683432
Energy: 0.9587976415597947
Energy: 1.0072258230631002
Energy: 0.9760960631477275
Energy: 0.9746859742114176
Energy: 0.9581835898949761
Energy: 1.042363835740927
Energy: 1.0099600652724794
Energy: 1.0394972373146143
Energy: 0.9335543166667754
Energy: 0.9568178692451828
Energy: 0.9742304959022514
Energy: 1.0110754197134364
Energy: 1.0418550599492655
Energy: 0.9336137973993344
Energy: 0.9589585670362097
Energy: 0.9756361536801833
Energy: 1.0240837658285553
Energy: 0.9664568715510967
Energy: 0.9594826763808529
Energy: 0.9325936432966746
Energy: 1.017240122132446
Energy: 0.9564294513398105
Energy: 0.975721943524886
Energy: 0.9602077605786283
Energy: 0.9329575032245009
Energy: 0.9585085729856342
Energy: 0.9572068573988682
Energy: 0.9636617353870872
Energy: 1.0378655055314245
Energy: 0.9765629220973729
Energy: 0.9570420724121337
Energy: 0.958276533314972
Energy: 0.9581923250459317
Energy: 1.0417248187772428
Energy: 0.9581203219625463
Energy: 0.9553542656201645
Energy: 0.9577861528104622
Energy: 0.9555930728998817
Energy: 0.9455917818379111
Energy: 0.9750080183112693
Energy: 0.9630751095057569
Energy: 1.0056239223760326
Energy: 0.9559755840329369
Energy: 0.9478022554548802
Energy: 0.9749628338523206
Energy: 0.9624777791950442
Energy: 1.0140093578140306
Energy: 0.9754269476700869
Energy: 1.0093494811477755
Energy: 0.9569384749271475
Energy: 0.9323962709128497
Energy: 0.9582810335456445
Energy: 0.9755969922431492
Energy: 1.0075793727457765
Energy: 0.9565962675829482
Energy: 0.9377483522384251
Energy: 0.9580632969245766
Energy: 0.9590487400287274
Energy: 0.9585647142547434
Energy: 0.9757284353138191
Energy: 0.9363254328169104
Energy: 1.0379614348445572
Energy: 0.9608339569186162
Energy: 0.9746501983095536
Energy: 0.9765983772119172
Energy: 0.9345273021837136
Energy: 0.9609014313790734
Energy: 0.9583556513509469
Energy: 0.9566178547945289
Energy: 1.008521970164069
Energy: 0.9564774802081534
Energy: 0.9567846769495747
Energy: 0.9550179529492807
Energy: 0.9562480778458793
Energy: 1.0107752066040254
Energy: 0.9759924132794278
Energy: 0.9585778889083024
Energy: 0.9338579690829649
Energy: 0.9755155543809494
Energy: 0.9576585145521247
Energy: 0.9568367063551508
Energy: 1.0326193834998034
Energy: 0.9340656614818492
Energy: 0.9752068269807492
Energy: 0.9498638009278554
Energy: 0.9561986002328101
Energy: 1.0260058935053453

minimum gb energy = 0.9309624887890078 eV
minimum distance =  2.45846676124133 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 0.9647716883911918
Energy: 0.9526396293932864
Energy: 1.0537705537241189
Energy: 0.9693151486121283
Energy: 1.0063070219337018
Energy: 0.9621580312278729
Energy: 0.9943727202838474
Energy: 1.023715831214513
Energy: 0.9704011323440731
Energy: 1.0134400637504482
Energy: 0.9496718598261965
Energy: 1.010163030608499
Energy: 0.9813276059221733
Energy: 1.013271486819968
Energy: 1.0116876033856956
Energy: 0.9264274593156562
Energy: 1.0152653673251086
Energy: 0.9785239797930726
Energy: 1.0222012149311661
Energy: 1.0437586745560672
Energy: 1.0958221753331805
Energy: 1.0174571948208697
Energy: 0.9492825936612179
Energy: 1.0136969204680035
Energy: 0.9422945705142272
Energy: 1.0354044848069528
Energy: 1.0279224553473316
Energy: 0.9649657416538546
Energy: 0.9938731635037551
Energy: 0.9442503776681085
Energy: 1.014523848880359
Energy: 0.9521267653176518
Energy: 1.0066455329093484
Energy: 1.0641773576892652
Energy: 0.9237535422238736
Energy: 1.0176446484767272
Energy: 0.9520748371405553
Energy: 1.016752173295366
Energy: 1.0931680657188796
Energy: 0.9431180175915521
Energy: 0.9658797448527352
Energy: 1.0379264357898563
Energy: 0.9402365989317066
Energy: 0.948261446023642
Energy: 0.9251675056358177
Energy: 0.9548055779938613
Energy: 1.0408433931067838
Energy: 0.9655470631596046
Energy: 0.9482658369519871
Energy: 0.9313578819099578
Energy: 0.9267070637267386
Energy: 0.945412864059031
Energy: 0.9453586790065485
Energy: 1.0423412093407278
Energy: 1.1330946111086024
Energy: 1.019559700694301
Energy: 0.9474887364441068
Energy: 0.9465135972687522
Energy: 1.1119007571365853
Energy: 1.1146690275185194
Energy: 0.9486306326060556
Energy: 0.9429589340748612
Energy: 0.9493183325772674
Energy: 0.9678650922441426
Energy: 0.9904707920099531
Energy: 0.9553173262570027
Energy: 0.948299402639621
Energy: 0.9507343268990051
Energy: 0.9779049527568114
Energy: 1.0311124877540667
Energy: 0.9720374572949894
Energy: 0.9409746555285865
Energy: 0.9606101406863173
Energy: 0.9464841984991033
Energy: 1.0197180820100977
Energy: 0.9494307774107509
Energy: 0.9431678168429051
Energy: 0.9805248820555262
Energy: 0.9405249129182832
Energy: 1.0386044841557358
Energy: 0.9495218708680825
Energy: 1.0924106120699095
Energy: 1.0500732975084939
Energy: 0.9808544156649348
Energy: 0.9545536284432787
Energy: 0.9474068268443891
Energy: 1.1289309614984993
Energy: 1.0323374900179987
Energy: 0.9488372890030715
Energy: 0.9493974678106588
Energy: 1.0094873696496136
Energy: 0.9890927703622325
Energy: 0.9785548308532911
Energy: 0.9408745526339222
Energy: 0.9638927113270785
Energy: 1.0066127853017621
Energy: 1.009516238047841
Energy: 0.9710174175263339
Energy: 0.9204931242945013
Energy: 0.9674847079877733
Energy: 1.007315035574997
Energy: 0.9912214411732291
Energy: 0.9616943898845415
Energy: 0.9678673808954866
Energy: 0.9461062611420084
Energy: 0.9492715875682751
Energy: 0.9910116058849864
Energy: 0.9686943919632912
Energy: 0.9689450517900597
Energy: 0.9454779878567727
Energy: 1.1443569968744238
Energy: 1.0542910201826556
Energy: 0.9441205849203199
Energy: 0.9217442581452947
Energy: 1.035383289140594
Energy: 1.1451201335798347
Energy: 1.000003418334352
Energy: 0.941509052518216
Energy: 0.9345252294442885
Energy: 1.0356179647243144
Energy: 1.010734243461281
Energy: 1.0138062119934739
Energy: 1.0129607798713705
Energy: 1.009751226732389
Energy: 1.000815691080561
Energy: 1.0342327459125409
Energy: 1.0178800228937332
Energy: 1.0133019616887944
Energy: 1.0063750365194595
Energy: 1.0049714744369027
Energy: 1.0155641441649008
Energy: 1.0338640660487706
Energy: 1.0665646113412957
Energy: 1.009153207266342
Energy: 1.0070520529321016
Energy: 1.011338148594923
Energy: 1.0311696529201304
Energy: 1.0373863133266958
Energy: 1.003569891749905
Energy: 1.003215278468904
Energy: 0.9412796581942243
Energy: 1.0108984730438173
Energy: 1.0792037190759585
Energy: 1.0326511988474378
Energy: 0.9534930434802321
Energy: 0.9409632232517079
Energy: 1.0084957900907072
Energy: 1.081680059569391
Energy: 1.0545119423909934
Energy: 0.9557457015301276
Energy: 1.0755223580191935
Energy: 1.094034082716423
Energy: 0.9644794887647236
Energy: 0.9998839074638873
Energy: 0.969455879270322
Energy: 1.0737606107717543
Energy: 1.095181635447991
Energy: 0.9660141603208161
Energy: 1.0000806838612841
Energy: 0.9182195404395611
Energy: 0.9269055875825498
Energy: 1.036431802491011
Energy: 0.9330368086504742
Energy: 1.0653291948789012
Energy: 1.0073530195268117
Energy: 0.9264729737619669
Energy: 1.0488288380450723
Energy: 0.9413168259540077
Energy: 1.0661691577772572
Energy: 0.9811393571661782
Energy: 1.0920406218624827
Energy: 1.1047817555276647
Energy: 1.0939563567267026
Energy: 0.9517962406291969
Energy: 0.9522668121031587
Energy: 1.0738655355166493
Energy: 1.0933802024509696
Energy: 1.0934321472549764
Energy: 0.9509906102952521
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Energy: 0.9942363203573245
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Energy: 1.0540535587858415
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Energy: 0.9843966269094343
Energy: 1.1094547118015363
Energy: 0.9314595740925747
Energy: 0.9326939003485004
Energy: 0.928702530323052
Energy: 1.0168738795040608
Energy: 1.095153006772917
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Energy: 0.9692327201353659
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Energy: 0.9591529303242692
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Energy: 1.1224564435454407
Energy: 1.1207048385252365
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Energy: 1.0037384087425165
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Energy: 0.9835675673343584
Energy: 0.9597125706548126
Energy: 1.0016125501697934
Energy: 0.9950367003189486
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Energy: 0.9827045946893405
Energy: 0.9625529685347658
Energy: 1.0109787808835895
Energy: 0.9073386003563918
Energy: 1.0034031121021818
Energy: 0.9560274701603311
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Energy: 0.9277664593050173
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Energy: 0.9974740148959411
Energy: 0.909263451675948
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Energy: 1.0716877516870555
Energy: 1.027379264710794
Energy: 1.1031546356601765
Energy: 1.099995476851506
Energy: 0.9942552072913816
Energy: 1.0676192589867985
Energy: 1.0127561982438584
Energy: 1.0698553657214698
Energy: 1.1207927127499477
Energy: 0.9460010010675453
Energy: 1.0396254226785129
Energy: 0.9448387629633541
Energy: 0.9504228181650972
Energy: 1.029635032710071
Energy: 0.9699929914915449
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Energy: 0.9481287699100831
Energy: 0.9528952592943972
Energy: 0.9902215530358006
Energy: 1.0960328851959926
Energy: 0.9497726559249551
Energy: 0.9492728412959202
Energy: 1.122039019290417
Energy: 1.0948662166657586
Energy: 1.097450134784815
Energy: 0.9475169836235942
Energy: 0.9466482633097527
Energy: 1.0913827392324942
Energy: 1.1386806677128762
Energy: 0.9556180460691145
Energy: 0.9499742640043002
Energy: 0.9531973992246792
Energy: 0.9626430380414475
Energy: 1.0201839824065857
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Energy: 0.951821519210625
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Energy: 0.9530456761079485
Energy: 0.9898593368170581
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Energy: 0.9460776312656908
Energy: 0.9936486627088702
Energy: 0.9383493365378405
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Energy: 0.9547435267086984
Energy: 0.9440804441117183
Energy: 0.9667345929370933
Energy: 0.936790760216693
Energy: 1.0476508551779442
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Energy: 1.016801763313763
Energy: 1.0600201563865652
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Energy: 0.9937323548541817
Energy: 1.0012336978263148
Energy: 1.0307532938149435
Energy: 0.948598933234397
Energy: 0.9835337097601771
Energy: 1.0059835076147425
Energy: 0.9183510468916346
Energy: 0.966296175140012
Energy: 0.9206925178935726
Energy: 0.9298826018080418
Energy: 1.0011449146247697
Energy: 0.919150632694534
Energy: 0.9826685003346995
Energy: 0.9203915230965837
Energy: 0.9494575492123017
Energy: 1.0083678918330437
Energy: 0.9957081771085767
Energy: 0.9598264130192173
Energy: 0.9648435454273071
Energy: 0.9515130063945929
Energy: 1.0109414498086362
Energy: 0.9477220228702405
Energy: 0.9688889454260868
Energy: 0.9666493439385584
Energy: 0.9458884914384839
Energy: 1.1444691821839388
Energy: 1.0141762350002255
Energy: 0.9444158861969074
Energy: 0.9267840545224084
Energy: 1.0306837771144657
Energy: 1.1441172843652707
Energy: 1.048846521496746
Energy: 0.9262263339587252
Energy: 0.9253859378065447
Energy: 1.0235651535648331
Energy: 1.010644978196029
Energy: 0.9234170264341768
Energy: 0.9513687305243285
Energy: 0.9956361384156921
Energy: 1.0213622354853988
Energy: 1.011963216510954
Energy: 0.9213630685661391
Energy: 1.0035494866739105
Energy: 0.9965496340856815
Energy: 0.9845540391837848
Energy: 1.0166542144738273
Energy: 1.035725151776495
Energy: 1.00225039070432
Energy: 0.9833636807867185
Energy: 0.9857862257874842
Energy: 1.0162108115359507
Energy: 1.0289131450803541
Energy: 0.9856089708947128
Energy: 0.9822660227332473
Energy: 0.9869500037322481
Energy: 0.9410801283039582
Energy: 0.9859161587471853
Energy: 0.926020474233004
Energy: 1.0534905130578651
Energy: 0.9741373382468643
Energy: 0.9412338437399809
Energy: 0.9959607410581658
Energy: 0.928298750377071
Energy: 1.0667827206825768
Energy: 0.9727364101892867
Energy: 1.130255473552529
Energy: 1.0948795124211095
Energy: 0.9671341825853411
Energy: 1.094640091499074
Energy: 0.9504949724933881
Energy: 1.0863162755003124
Energy: 1.0930908855580286
Energy: 0.969272112605184
Energy: 1.0776864987586734
Energy: 0.9198229749606911
Energy: 0.9996197609278722
Energy: 0.9984323398098371
Energy: 0.9874285442121414
Energy: 0.9689643211779047
Energy: 1.026753952559017
Energy: 1.004959545095222
Energy: 1.0873356897190996
Energy: 0.9489640741729702
Energy: 0.979480676174933
Energy: 1.0207578409451945
Energy: 1.0862544554275881
Energy: 1.0962100405238266
Energy: 1.1009507264840745
Energy: 1.0173816818425312
Energy: 0.9514728030290567
Energy: 1.069945782740791
Energy: 1.098604688065631
Energy: 1.0968838415145465
Energy: 1.0262837851326487
Energy: 0.9481988616051653
Energy: 0.9505073206478915
Energy: 0.9577894435124086
Energy: 0.952921641938597
Energy: 0.941639197245294
Energy: 0.9527061349756435
Energy: 0.9523611649864878
Energy: 0.9343958986265141
Energy: 0.9501012157214552
Energy: 0.9405705780404674
Energy: 0.9618699615482956
Energy: 0.9614969178964541
Energy: 0.9483968192536418
Energy: 1.0654660527618574
Energy: 0.9441314264704495
Energy: 0.9498562961923337
Energy: 0.9626840911944915
Energy: 0.9491343450932956
Energy: 1.0219918153732441
Energy: 0.9414127917516684
Energy: 0.9491554475238807
Energy: 1.0290562236073477
Energy: 0.9366896555481536
Energy: 0.9400894697675773
Energy: 1.0274201343849234
Energy: 0.9936106574186591
Energy: 0.9989194275839305
Energy: 0.9377728297225971
Energy: 0.9283529576169007
Energy: 1.0532585127043343
Energy: 1.0243438555983309
Energy: 0.9503133918103388
Energy: 0.9429267368774275
Energy: 1.0090729358312915
Energy: 1.1290384593045106
Energy: 0.9478506723059205
Energy: 0.9244042159101641
Energy: 0.9237848670343123
Energy: 1.0395591710489223
Energy: 1.130043459394441
Energy: 0.9520181339150142
Energy: 0.9601208189217226
Energy: 0.9450339951221546
Energy: 0.9589801673972598
Energy: 0.9435032361171536
Energy: 0.9245942797188242
Energy: 0.9589791091218783
Energy: 0.9663332724486265
Energy: 0.9499976085750942
Energy: 0.9421535277231465
Energy: 0.9454600246927805
Energy: 0.9509002272096032
Energy: 0.9863747875567933
Energy: 0.9603064360562508
Energy: 1.1166542628404459
Energy: 1.0486402790988
Energy: 0.9291288231710598
Energy: 0.9239107120397058
Energy: 0.9614694247730465
Energy: 1.0189561668247544
Energy: 1.0374819466261398
Energy: 0.9626250858910651
Energy: 1.0448434159878475
Energy: 0.9831036031413328
Energy: 0.9765903775896482
Energy: 0.9133364936378304
Energy: 0.974731798721045
Energy: 1.0026739994512492
Energy: 0.946991536677695
Energy: 0.9591588949705361
Energy: 0.9184816899340971

minimum gb energy = 0.9073386003563918 eV
minimum distance =  2.42944224024843 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.331226324191132
Energy: 0.990990865369602
Energy: 1.0158388650832497
Energy: 0.9637901943440002
Energy: 1.0252147423378493
Energy: 1.3303247877596278
Energy: 0.9695758065556033
Energy: 1.0136862687051236
Energy: 0.8975418111789865
Energy: 0.9962634876935546
Energy: 0.8809285323114026
Energy: 0.9748453406245571
Energy: 0.9202768850769582
Energy: 1.036602703700459
Energy: 0.9018404318900511
Energy: 0.8816526314159834
Energy: 0.9744386588872919
Energy: 0.8886167659914256
Energy: 0.9734594987409002
Energy: 0.9016946568627164
Energy: 0.9655757765757088
Energy: 0.9763848012231738
Energy: 0.8957347264536127
Energy: 0.9064829371541232
Energy: 0.9767951321857484
Energy: 0.9653879923062537
Energy: 0.9855887333437617
Energy: 0.8980139976678255
Energy: 0.9047419164091555
Energy: 0.9689106667633418
Energy: 0.9057686937274304
Energy: 0.9146554751248073
Energy: 0.8924110199311414
Energy: 0.9710056634800555
Energy: 0.8798379305051344
Energy: 0.9069937465807666
Energy: 0.9065549258231266
Energy: 0.9772571368712298
Energy: 0.9577558986693145
Energy: 0.8804573333850982
Energy: 1.0480071917052938
Energy: 0.9825656245471767
Energy: 0.9129869949234866
Energy: 0.9149653574620707
Energy: 0.8866663916952899
Energy: 1.0456118466282815
Energy: 0.9786236967195157
Energy: 0.9113032716402446
Energy: 0.9086002116005562
Energy: 0.9071361740954594
Energy: 0.9154891080450975
Energy: 0.901464786747899
Energy: 0.8774147176240507
Energy: 0.9687544921166001
Energy: 0.9035167743782712
Energy: 0.9159453847756318
Energy: 0.9006010633129344
Energy: 0.8774568105413695
Energy: 0.9688070520266719
Energy: 0.9036759104523798
Energy: 0.96090172929326
Energy: 0.9638496094180224
Energy: 0.9591767519007263
Energy: 0.9041924454147504
Energy: 0.8906230507325926
Energy: 0.9591223248207564
Energy: 0.9596982373355757
Energy: 0.9590874972985819
Energy: 0.9123410897071542
Energy: 0.8900571102665417
Energy: 0.981393968742886
Energy: 0.8813246246834693
Energy: 0.9012310470223995
Energy: 0.9139598060953485
Energy: 0.9696441030021614
Energy: 0.981320459644677
Energy: 0.8836096887784505
Energy: 0.9019616449494025
Energy: 0.9675323873897946
Energy: 0.9690191624648408
Energy: 0.9042087329878229
Energy: 0.8957075335350951
Energy: 0.9130749857874294
Energy: 0.9026268987895608
Energy: 0.905321590936943
Energy: 0.9029120297161162
Energy: 0.9700459499653977
Energy: 0.981535055704345
Energy: 0.9767733385626348
Energy: 0.902223510305791
Energy: 0.9198542455612179
Energy: 0.968056849473318
Energy: 0.8852977122641055
Energy: 1.031578236720841
Energy: 0.9783470120455114
Energy: 0.9731616063243606
Energy: 0.999013351067478
Energy: 0.8875098794104733
Energy: 1.0469799900388748
Energy: 0.9791893338141171
Energy: 0.8802603608899258
Energy: 0.8783815295088161
Energy: 0.979846263056802
Energy: 0.9041143014024209
Energy: 0.8878113017152092
Energy: 0.8774022373769458
Energy: 0.8787841474254342
Energy: 0.9785156903042378
Energy: 0.9042674097705292
Energy: 0.9103212919922257
Energy: 0.8827966108886494
Energy: 0.8808205652305525
Energy: 0.8830719488550663
Energy: 0.9767466580552396
Energy: 0.8813655856407694
Energy: 0.883406829980107
Energy: 0.8829009292330764
Energy: 0.8840568620711677
Energy: 0.9724379230906455
Energy: 0.881267138339046
Energy: 0.8803909456675699
Energy: 0.8828685912401656
Energy: 0.9173937104765684
Energy: 0.9727432577561005
Energy: 0.9798847572048343
Energy: 0.8809577277085803
Energy: 0.8843074417793749
Energy: 0.9041104038862914
Energy: 0.9706408545283135
Energy: 0.9843530291754441
Energy: 0.8791647896658266
Energy: 0.9193874404528445
Energy: 0.9794817480616688
Energy: 0.9060095949226986
Energy: 0.891632041989005
Energy: 0.8855696861670034
Energy: 0.9178405348576978
Energy: 1.0321068448787218
Energy: 0.8973304229617973
Energy: 0.9135021940228274

minimum gb energy = 0.8774022373769458 eV
minimum distance =  2.53470362157732 Angstroms
sigma value = 33