Model name: model_name=MEAM_LAMMPS_RoyDuttaChakraborti_2021_AlLi__MO_971738391444_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049999997019768
cohesive_energy=3.3532637301406303
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.76184955734444e-19, 2.4127177931406e-19, 2.8940917628258996e-19, 3.2773163919123595e-19, 3.5938904730244197e-19, 3.85265802118176e-19, 4.0749600291492596e-19, 4.2722841033926997e-19, 4.443749046763379e-19, 4.5932801920146e-19, 4.723825544152919e-19, 4.837772346363e-19, 4.936995145306619e-19, 5.023080095851439e-19, 5.097324961071e-19, 5.16080319931008e-19, 5.21447611654908e-19, 5.259160822871339e-19, 5.29553023246314e-19, 5.324209194211739e-19, 5.345758469939039e-19, 5.3606426908689e-19, 5.369294444692499e-19, 5.372098253802e-19, 5.36910218349642e-19, 5.359473101926079e-19, 5.34207346368084e-19, 5.315637549219839e-19, 5.2786112472081e-19, 5.22915205451652e-19, 5.1650810109228595e-19, 5.0837865685137e-19, 4.982096417553719e-19, 4.85618135588766e-19, 4.701363027744239e-19, 4.51190564077374e-19, 4.2806955307212e-19, 3.9988245955015797e-19, 3.6551256639759e-19, 3.23533936410156e-19, 2.72115281695194e-19, 2.0886615471477596e-19, 1.3063074815291218e-19, 3.31764317779014e-20, -8.92862596772154e-20, -2.44907118096606e-19, -4.45659850336806e-19, -7.09754635802196e-19, -1.0660258473748738e-18, -1.562397792531048e-18, -2.28377461763628e-18, -3.3946277650538395e-18, -5.25927297523572e-18, -8.868608431011899e-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: 0.010304355292451916
Energy: 0.6771624864007292
Energy: 0.010902518535149223
Energy: 0.012022412581788187
Energy: 0.7121114348065438
Energy: 0.01087605657004328
Energy: 0.7425341784202703
Energy: 2.3244353212390556
Energy: 2.4936510459640395
Energy: 2.3865517954132773
Energy: 0.879897411551971
Energy: 1.1009438717850404
Energy: 0.010902517333219244
Energy: 2.4936510460233947
Energy: 0.85936888904951
Energy: 0.010780169971822209
Energy: 2.4326241365775743
Energy: 0.8709880649993451
Energy: 0.012022412582038046
Energy: 2.386551850932315
Energy: 0.010779938144114992
Energy: 0.012973131400501492
Energy: 2.5087348796230957
Energy: 0.01081939903612642
Energy: 0.6656988385926131
Energy: 0.895487457076508
Energy: 2.432624135080894
Energy: 2.5106788066946564
Energy: 0.879395028851985
Energy: 2.4125595887412414
Energy: 0.010876056744166826
Energy: 0.8847480707834111
Energy: 0.8762315979056196
Energy: 0.010819396821742416
Energy: 2.4125595887429347
Energy: 0.010861163719863278

minimum gb energy = 0.010304355292451916 eV
minimum distance =  2.85643190794598 Angstroms
sigma value = 1


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

Energy: 1.0634037199262274
Energy: 1.1618392672829168
Energy: 0.9554358860068073
Energy: 0.8524749685494261
Energy: 1.372480528399426
Energy: 0.7034530596575086
Energy: 1.0903481480633819
Energy: 0.6645463119546308
Energy: 0.6221654115534069
Energy: 0.8110155042662484
Energy: 0.6350483469720236
Energy: 0.7599690129642983
Energy: 0.8932067859265691
Energy: 0.6170488645092156
Energy: 0.7424500037814851
Energy: 0.680509163631336
Energy: 0.6485543566602067
Energy: 0.7125562831575281
Energy: 1.0320714976182306
Energy: 0.7903902302730044
Energy: 0.7395427994588966
Energy: 0.7026773212064417
Energy: 0.6174867833476738
Energy: 0.7324000981330434
Energy: 0.9419803327748238
Energy: 0.6373882468916238
Energy: 0.6192605828180884
Energy: 0.7368107557188668
Energy: 0.6004113485589322
Energy: 0.6832316061424671
Energy: 0.7922193970119438
Energy: 0.7345220092988113
Energy: 0.6299683015720158
Energy: 0.6294425538725582
Energy: 0.6690742982199843
Energy: 0.6850950788154281
Energy: 0.7819500052139955
Energy: 0.7157684392847012
Energy: 0.7005187354964937
Energy: 0.5778825658402508
Energy: 0.681219644317374
Energy: 0.6609812014144918
Energy: 0.798077721760662
Energy: 0.6266396910500379
Energy: 0.6119523445797148
Energy: 0.6375697198215096
Energy: 0.5967226711051196
Energy: 0.6921155995062146
Energy: 0.6630661579366304
Energy: 0.6839698161607642
Energy: 0.6601266593713954
Energy: 0.615186659101847
Energy: 0.640864627689906
Energy: 0.6840688320161029
Energy: 0.6682334681118256
Energy: 0.7655164306559736
Energy: 0.685999291538999
Energy: 0.6046954308530724
Energy: 0.7723373358139762
Energy: 0.7083002790082794
Energy: 0.7702880372327591
Energy: 0.761154169086339
Energy: 0.6987024326058279
Energy: 0.6389393551439188
Energy: 0.722150081500182
Energy: 0.7354989072548177
Energy: 0.6465209169083108
Energy: 0.773596140246358
Energy: 0.763248416939374
Energy: 0.8157123792773575
Energy: 0.7473791992965325
Energy: 0.7361211981987605
Energy: 0.6545947931672675
Energy: 0.7681503481310484
Energy: 0.8140719172027361
Energy: 0.6453083006521454
Energy: 0.7786364112457586
Energy: 0.7561150067163349
Energy: 0.7558002229450427
Energy: 0.6755673761358858
Energy: 0.7185961710069652
Energy: 0.6438634668103363
Energy: 0.7821978103561049
Energy: 0.8348509885471789
Energy: 0.6718247516358588
Energy: 0.7617203413313878
Energy: 0.6970879591290529
Energy: 0.6437421524399868
Energy: 0.7091454364355279
Energy: 0.6951090550794751
Energy: 0.6771449547629177
Energy: 0.7088065198857582
Energy: 0.718493023822955
Energy: 0.7397606679009051
Energy: 0.703530549054173
Energy: 0.6893049307235581
Energy: 0.753584317930176
Energy: 0.6527138596855209
Energy: 0.6630812871512521
Energy: 0.7099532771654076
Energy: 0.5768973603214658
Energy: 0.7155674330210975
Energy: 0.7103534073473727
Energy: 0.648284537760331
Energy: 0.6289025616549743
Energy: 0.5776291330805271
Energy: 0.7138530534558798
Energy: 0.6070767143244222
Energy: 0.7088548606872865
Energy: 0.6505314044085527
Energy: 0.6176121342186129
Energy: 0.6026098582665356
Energy: 0.652524754251308
Energy: 0.6399481595022378
Energy: 0.9463612389702417
Energy: 0.6360954971044482
Energy: 0.6416165457006483
Energy: 0.7472719938991639
Energy: 0.5905074912863602
Energy: 0.6648212604368909
Energy: 0.9125741987143519
Energy: 0.707714679298662
Energy: 0.7467910839957257
Energy: 0.6735268943438039
Energy: 0.6438186533448801
Energy: 0.7506009973974158
Energy: 0.8580322487499058
Energy: 0.7586241035608599
Energy: 0.7197538618340082
Energy: 0.681661368004014
Energy: 0.6570904809128056
Energy: 0.7250359494763977
Energy: 1.0727901775385262
Energy: 0.6975715523075539
Energy: 0.6332488129145578
Energy: 0.822469204022999
Energy: 0.659747632826064
Energy: 0.7255245083353179

minimum gb energy = 0.5768973603214658 eV
minimum distance =  1.83439335864511 Angstroms
sigma value = 33


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

Energy: 1.1831309456705705
Energy: 1.2568971549620733
Energy: 0.8713611375624835
Energy: 0.850042869527257
Energy: 1.0587538955980276
Energy: 0.9069032956548438
Energy: 1.0109915213934937
Energy: 0.649162355032324
Energy: 0.6662937746400615
Energy: 0.7071995605355645
Energy: 0.6465553228285562
Energy: 0.8567997630072178
Energy: 0.8265884985242213
Energy: 0.7944356968653843
Energy: 0.6812664920140017
Energy: 0.6964269360255595
Energy: 0.7230592768989479
Energy: 0.8008992954417714
Energy: 0.8647129505531485
Energy: 0.9781757204855384
Energy: 0.9914074436980126
Energy: 0.6200541195707244
Energy: 0.9340984974964427
Energy: 0.6454115558090281
Energy: 0.9680944724288651
Energy: 0.7061245589825997
Energy: 0.6986102540271594
Energy: 0.779215180627178
Energy: 0.6664552072259102
Energy: 0.6907732159057929
Energy: 0.7989532200462826
Energy: 0.6820855600901023
Energy: 0.6941133315612501
Energy: 0.7391073187905057
Energy: 0.6502787449863259
Energy: 0.7413574669812759
Energy: 0.7983708085106968
Energy: 0.9320736051823918
Energy: 0.7820136439054551
Energy: 0.6886126216971562
Energy: 0.7536333819441884
Energy: 0.722827165217341
Energy: 0.8851532717767221
Energy: 0.5914892017042874
Energy: 0.6193526139851885
Energy: 0.7543390679545052
Energy: 0.5799323157643321
Energy: 0.6599750646888255
Energy: 0.7232984096508618
Energy: 0.6360175320352116
Energy: 0.7225567750518161
Energy: 0.726637896004536
Energy: 0.6493252464686732
Energy: 0.7088860885930289
Energy: 0.7026971634145994
Energy: 0.8102480574184024
Energy: 0.8053130521938922
Energy: 0.6104334557309823
Energy: 0.7028251471051421
Energy: 0.6999279850142467
Energy: 1.2220249616241243
Energy: 0.8402630271120984
Energy: 0.6527599103048068
Energy: 1.2958949442166634
Energy: 0.633209687817599
Energy: 0.6634790761961826
Energy: 0.6915416169760843
Energy: 0.7391763282636916
Energy: 0.8010659297439924
Energy: 0.7710954166636155
Energy: 0.7244809136880126
Energy: 0.7357499599894025
Energy: 0.736127779310846
Energy: 0.8399075790816105
Energy: 0.7594852279405829
Energy: 0.7118629316949276
Energy: 0.8214273925440448
Energy: 0.7351388070433434
Energy: 0.9736210803670032
Energy: 0.6522519581929719
Energy: 0.6408475130386455
Energy: 1.0268157241029567
Energy: 0.6386119219592755
Energy: 0.7121909496476332
Energy: 0.700675852125763
Energy: 0.724930288517402
Energy: 0.7168866487100131
Energy: 0.6893980731006074
Energy: 0.8670952297136675
Energy: 0.6996769983617975
Energy: 0.6999714899812582
Energy: 0.6468083978112413
Energy: 0.704774239714736
Energy: 0.6421899913076206
Energy: 0.7125231152381554
Energy: 0.788603509759582
Energy: 0.813128033338509
Energy: 0.6828600578143363
Energy: 0.6761303638663302
Energy: 0.7473566350794236
Energy: 0.6776125032876146
Energy: 0.7709231506219467
Energy: 0.6870085667059089
Energy: 0.8258721983859979
Energy: 0.7705166522768591
Energy: 0.5868204675294031
Energy: 0.824050294370427
Energy: 0.6404556186180779
Energy: 0.7028393483419574
Energy: 0.6941872609554862
Energy: 0.7146195625095006
Energy: 0.5853950865816203
Energy: 0.7010282623756583
Energy: 0.7118920296377136
Energy: 0.9288953071051879
Energy: 0.6567597969104667
Energy: 0.6497836572905676
Energy: 0.6860888872912576
Energy: 0.639108730436133
Energy: 0.6912045018033176
Energy: 0.9337256789674582
Energy: 0.8695998526490116
Energy: 0.7810905527153794
Energy: 0.6194225959974676
Energy: 1.178483580570649
Energy: 0.8435367900337141
Energy: 0.8840841084755805
Energy: 0.981960126937341
Energy: 0.8759329300681288
Energy: 0.7268997161051547
Energy: 0.7445880699928658
Energy: 0.839038488267722
Energy: 1.0724553642309202
Energy: 0.7032112221256602
Energy: 0.7509566948224005
Energy: 0.870604019545557
Energy: 0.6840775431143671
Energy: 0.7484128153701565
Energy: 0.9507678541709998
Energy: 1.0251275416064831
Energy: 1.0427153499746364
Energy: 0.7423209884397697
Energy: 1.0240971072255947
Energy: 0.8441955102620469
Energy: 1.1177796133861304
Energy: 0.7192895784509847
Energy: 0.6922589944083927
Energy: 0.826958850950612
Energy: 0.6850443040255013
Energy: 0.8010700586904786
Energy: 0.8071066111528652
Energy: 0.7436731161217476
Energy: 0.8709647813564317
Energy: 0.7145630517586951
Energy: 0.6544542723657464
Energy: 0.793342099633994
Energy: 0.8347791040836374
Energy: 0.8338652570055199
Energy: 0.780717684135484
Energy: 0.6821737872017565
Energy: 0.7267050792887856
Energy: 0.7124917047781703
Energy: 0.8416354047889156
Energy: 0.5980948367353375
Energy: 0.6286382695041438
Energy: 0.8519690801106724
Energy: 0.5902810633289673
Energy: 0.7109158049223434
Energy: 0.7473148577009896
Energy: 0.5917888766749012
Energy: 0.6424624727159313
Energy: 0.6809365814805725
Energy: 0.5850562256181754
Energy: 0.7677798411808356
Energy: 0.7095526172884288
Energy: 0.6755416335339913
Energy: 0.6727508884607837
Energy: 0.6441376772637849
Energy: 0.7410882857077038
Energy: 0.6551708137648922
Energy: 0.9148058326504104
Energy: 0.7202794840645742
Energy: 0.7391581496821825
Energy: 0.9878992143367504
Energy: 0.6943553976275258
Energy: 0.6648376224924218
Energy: 0.7054935482092756
Energy: 0.6353714521468005
Energy: 0.7390312176658763
Energy: 0.7609041643054102
Energy: 0.7179317805951365
Energy: 1.2287057223335094
Energy: 0.7089208281225818
Energy: 0.7768436113982828
Energy: 0.7267824546950293
Energy: 0.6870721184916058
Energy: 0.8041935759522384
Energy: 0.7007960345791129
Energy: 1.053477500971746
Energy: 0.6623438042363351
Energy: 0.8225570317709333
Energy: 0.8672359834897939
Energy: 0.6313357233642404
Energy: 0.7033932420404049
Energy: 0.7121434045939401
Energy: 0.8028391115457616
Energy: 0.7838747618090233
Energy: 0.6840642714789844
Energy: 0.8060396214241842
Energy: 0.7076070904622053
Energy: 0.7016553685316783
Energy: 0.7510891064465158
Energy: 0.8018938305919402
Energy: 0.6741854368782099
Energy: 0.6595026354080312
Energy: 0.6779519147328018
Energy: 0.8341653172006978
Energy: 0.8504206438112496
Energy: 0.6902579247482313
Energy: 0.7622049955023097
Energy: 0.6282419965695589
Energy: 0.7314863669828623
Energy: 0.6978327322197028
Energy: 0.718114345064485
Energy: 0.7003474122065486
Energy: 0.5988668066042718
Energy: 0.7332853425254274
Energy: 0.6812324532872666
Energy: 0.7005444460712775
Energy: 0.7493386848613495
Energy: 0.7492347065146311
Energy: 0.5752906621035546
Energy: 0.7194559387718726
Energy: 0.6513493183395355
Energy: 0.8719460028441258
Energy: 0.6320648152262625
Energy: 0.6465973101338032
Energy: 0.6942062980174629
Energy: 0.6179070803566101
Energy: 0.7533534546750834
Energy: 0.949981806837715
Energy: 0.7923516643410725
Energy: 0.7291195326759916
Energy: 0.6186947267205392
Energy: 0.6529108667705159
Energy: 0.7548716392710649

minimum gb energy = 0.5752906621035546 eV
minimum distance =  1.84717791881104 Angstroms
sigma value = 51


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

Energy: 1.0438617898024258
Energy: 1.2193545558914585
Energy: 1.0936216893231727
Energy: 0.7794221255313805
Energy: 0.7302574336088935
Energy: 0.8377999744786658
Energy: 1.047364557447637
Energy: 0.65647628203853
Energy: 0.6568090078387332
Energy: 0.8617578992077889
Energy: 0.6565926355595841
Energy: 0.6570574551015806
Energy: 0.8078177991930175
Energy: 0.6940545057749357
Energy: 0.7291484235354267
Energy: 0.7229052210168216
Energy: 0.656941087362234
Energy: 0.7866879784809814
Energy: 0.8076918619721765
Energy: 0.7838725493847755
Energy: 0.8452873592911436
Energy: 0.654051511029385
Energy: 0.6562518158861571
Energy: 0.7513040266822484
Energy: 0.8917399572453869
Energy: 0.6301290212698635
Energy: 0.6994216129627187
Energy: 0.6914940440911538
Energy: 0.6095918224237967
Energy: 0.6390146651940225
Energy: 0.6920976632606287
Energy: 0.6141782054328933
Energy: 0.6812184421304531
Energy: 0.6382312021666444
Energy: 0.6140159490656024
Energy: 0.6765215716415715
Energy: 0.7382617340057545
Energy: 0.6658430480494963
Energy: 0.648698392980377
Energy: 0.6266140783346547
Energy: 0.6134324324388901
Energy: 0.6495126308901065
Energy: 0.8223395212550636
Energy: 0.7125027750746692
Energy: 0.7167920127646807
Energy: 0.6605094164222556
Energy: 0.7025327256868487
Energy: 0.7059150162727784
Energy: 0.6489193224059556
Energy: 0.7012416423413738
Energy: 0.7245113793511136
Energy: 0.8245353140056239
Energy: 0.7108838404665004
Energy: 0.7796703405704993
Energy: 0.6491117188639083
Energy: 0.7841348440589128
Energy: 0.7069751306736948
Energy: 0.6488903409222797
Energy: 0.7568546612400975
Energy: 0.7403826693600102
Energy: 0.6488430742998493
Energy: 0.8552112802723787
Energy: 0.8183329248084052
Energy: 0.6487265884741347
Energy: 0.7047771128243595
Energy: 0.8456954297025095
Energy: 0.7261693487034618
Energy: 0.7829384045702604
Energy: 0.7206378877980728
Energy: 0.7081749224983117
Energy: 0.6852895074191281
Energy: 0.7257266887599476
Energy: 0.6805475203870359
Energy: 0.7059620018683083
Energy: 0.7242406335316872
Energy: 0.6243805478997481
Energy: 0.683889368050877
Energy: 0.7271220696846651
Energy: 0.7830893137904862
Energy: 0.6844761868454851
Energy: 0.6937436526286759
Energy: 0.7330167578349378
Energy: 0.6463614956378119
Energy: 0.6874211963188506
Energy: 0.7360959408695066
Energy: 0.7060769980552418
Energy: 0.7527905002590605
Energy: 0.6480567014446119
Energy: 0.7013646758746878
Energy: 0.6915356050673063
Energy: 0.7327489091483572
Energy: 0.7088153819349758
Energy: 0.6911004445775643
Energy: 0.6103732491254107
Energy: 0.64244219273663
Energy: 0.6467374667584057
Energy: 0.8248041553090009
Energy: 0.6823533091856301
Energy: 0.6859271064507282
Energy: 0.7301302391642227
Energy: 0.6539198797321544
Energy: 0.680662273165302
Energy: 0.8511223970348095
Energy: 0.7063683274630801
Energy: 0.7611869016135151
Energy: 0.6479746306728703
Energy: 0.6811410349927255
Energy: 0.7610605941286821

minimum gb energy = 0.6095918224237967 eV
minimum distance =  1.8845936342523 Angstroms
sigma value = 19


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

Energy: 0.8092723832040992
Energy: 1.0456533041187037
Energy: 0.7220823891902877
Energy: 0.6158911743537403
Energy: 0.594370671272334
Energy: 0.6688214375640974
Energy: 0.7579473241988739
Energy: 0.7873259745378893
Energy: 0.8019493510429406
Energy: 0.7530955908947226
Energy: 0.6381267342749679
Energy: 0.8970628129668634
Energy: 1.0756929859757067
Energy: 0.7301833541346958
Energy: 0.7701202620193941
Energy: 0.8308442620845178
Energy: 0.9389636307222933
Energy: 0.7765040002182254
Energy: 0.6830359805954695
Energy: 0.7242914433883351
Energy: 0.8954161254884359
Energy: 0.6406757334621286
Energy: 0.5945492608233237
Energy: 0.8679053925641238
Energy: 0.759003250834675
Energy: 0.6184257106142048
Energy: 0.699159915109781
Energy: 0.8245641478311475
Energy: 0.6415915202110206
Energy: 0.7505930495980517
Energy: 0.9775492015221204
Energy: 0.5831104775729582
Energy: 0.7027417649180702
Energy: 0.6507429636590152
Energy: 0.5828967419034631
Energy: 0.6888003590825813
Energy: 0.7433360782695657
Energy: 0.6777251031626177
Energy: 0.7022181010109962
Energy: 0.6566716791596877
Energy: 0.727638933813938
Energy: 0.6511568957686027
Energy: 0.5862154023393922
Energy: 0.6234489920250611
Energy: 0.6285483718702237
Energy: 0.6443335428989553
Energy: 0.6128874994321079
Energy: 0.6817756544824068
Energy: 0.5937971927548553
Energy: 0.6291508220639447
Energy: 0.6444039711515713
Energy: 0.6331033977250501
Energy: 0.6216682768597909
Energy: 0.6819966678642211
Energy: 0.5958833963857744
Energy: 0.6797244797974252
Energy: 0.7173223575538823
Energy: 0.6368511730198175
Energy: 0.6873232217888524
Energy: 0.7397591683121346
Energy: 0.5937689804227739
Energy: 0.6308616673693704
Energy: 0.641823605535162
Energy: 0.5937554113458166
Energy: 0.6070744872889695
Energy: 0.837620795763439
Energy: 0.7366240263263438
Energy: 0.8431572853622825
Energy: 0.892630173202851
Energy: 0.6559590356825356
Energy: 0.8492524349200923
Energy: 0.7579891127329532
Energy: 0.5828102659469602
Energy: 0.7423293075232928
Energy: 0.7827687618429536
Energy: 0.5845386540385722
Energy: 0.6442699819963981
Energy: 0.638502008285949
Energy: 0.7317334170856536
Energy: 0.942846722142223
Energy: 0.7287778322499998
Energy: 0.6497912247631755
Energy: 0.6657777370127241
Energy: 0.6984220258869074
Energy: 0.7355640575849715
Energy: 1.108031912826517
Energy: 0.8803579960060302
Energy: 0.6294805457215085
Energy: 0.9678318841950501
Energy: 0.6800009292486008
Energy: 0.7523504943237778
Energy: 0.7223590549778955
Energy: 0.6795433098490571
Energy: 0.6081211716931899
Energy: 0.738291648531219
Energy: 0.626444733308791
Energy: 0.7703410656113187
Energy: 0.6371356891346225
Energy: 0.8460890862703838
Energy: 0.6804733810678671
Energy: 0.6364829966608297
Energy: 0.6395408658105696
Energy: 0.6692881952775407
Energy: 0.7276380859470127
Energy: 0.7389264134984538
Energy: 0.6418257957140989
Energy: 1.0275158749512188
Energy: 0.7735315328463092
Energy: 0.6660417713201754
Energy: 0.8118995004655533
Energy: 0.8326624451966926
Energy: 0.6449342929618871
Energy: 0.7130235789958386
Energy: 0.8206399779043598
Energy: 0.7343939284295508
Energy: 0.5829805127119299
Energy: 0.735990259697782
Energy: 0.6885150104783504
Energy: 0.5828043163947939
Energy: 0.729220889648785
Energy: 0.9900182402084969
Energy: 0.6230739648703204
Energy: 0.8095186889968963
Energy: 0.6189695365520377
Energy: 0.6647177748566622
Energy: 0.6657459157077386
Energy: 0.8088716067488704
Energy: 0.7805305928134646
Energy: 0.7540670311798822
Energy: 0.8049146072805944
Energy: 0.7900378355214699
Energy: 0.8168182358380791
Energy: 0.5860703971318953
Energy: 0.646861898218528
Energy: 0.6461224073305313
Energy: 0.6481888164101844
Energy: 0.6098816451523492
Energy: 0.7153107946210702
Energy: 0.5939395204680707
Energy: 0.7910741265569176
Energy: 0.851078883798204
Energy: 0.6386101004973689
Energy: 0.62606217128024
Energy: 0.8304971519026234
Energy: 0.5937463726257275
Energy: 0.8423838004995786
Energy: 0.7388902013752522
Energy: 0.963278831409453
Energy: 0.7236350059065425
Energy: 0.7939089920168513
Energy: 0.6487416585726191
Energy: 0.6444834397564617
Energy: 0.6059756094731462
Energy: 0.5938493275821616
Energy: 0.6413518175422099
Energy: 0.8897948998185805
Energy: 0.6808961306110637
Energy: 0.7705743426455733
Energy: 0.7714438226909968
Energy: 0.7395087395569703
Energy: 0.773810370484244
Energy: 0.7394144606993474
Energy: 0.5828628953908999
Energy: 0.9294090156858477
Energy: 0.7101651698571845
Energy: 0.5828199719933729
Energy: 0.9189229579932026
Energy: 0.6349725922962637
Energy: 0.7508125791600989
Energy: 0.6807261734132978
Energy: 0.6255403637832497
Energy: 0.7007969118831137
Energy: 0.6934094151079895
Energy: 0.693483255755359
Energy: 0.7457897435639192
Energy: 0.7583562180774862
Energy: 0.6699633647126699
Energy: 0.6107098350193091
Energy: 0.7236384895349894
Energy: 0.6464820019935958

minimum gb energy = 0.5828043163947939 eV
minimum distance =  1.85045597900204 Angstroms
sigma value = 27


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

Energy: 0.7296158073441853
Energy: 1.0223735983549391
Energy: 0.8850730231742848
Energy: 0.6177854760078348
Energy: 1.0750198642466744
Energy: 0.8384641764037832
Energy: 0.989580675358967
Energy: 0.7437279793489833
Energy: 0.738093639526854
Energy: 0.820376741044286
Energy: 0.7398961835487867
Energy: 0.8253713360426788
Energy: 0.8263550456270987
Energy: 0.7546645049821405
Energy: 0.7688017385443692
Energy: 0.7524915619741365
Energy: 0.7552492825427631
Energy: 0.8421313928059085
Energy: 0.841688910847673
Energy: 0.821108440844465
Energy: 0.7339015828147628
Energy: 0.6799767244422296
Energy: 0.6682977407494023
Energy: 0.7620518501696425
Energy: 0.831350537051983
Energy: 0.64714605690611
Energy: 0.73330908622728
Energy: 0.7722176019807615
Energy: 0.6378412857135655
Energy: 0.7443970039724844
Energy: 0.6884885742691348
Energy: 0.6219275065297284
Energy: 0.6085710502277117
Energy: 0.6292464160495163
Energy: 0.5917102179040515
Energy: 0.6670649843881623
Energy: 0.6318383307863189
Energy: 0.5881078570197205
Energy: 0.5866568599195393
Energy: 0.6323613865445096
Energy: 0.5820286635150296
Energy: 0.6298217389037767
Energy: 0.7760315755197298
Energy: 0.7483691237170431
Energy: 0.741318195658198
Energy: 0.7752787809020549
Energy: 0.7323058857775611
Energy: 0.7837460015120173
Energy: 0.7585901530448138
Energy: 0.7071613549518552
Energy: 0.8531430462638508
Energy: 0.7214385929043918
Energy: 0.7161501291290677
Energy: 0.9438107376986234
Energy: 0.6833153732619189
Energy: 0.6782830377525206
Energy: 0.6622123893587232
Energy: 0.6230337998534209
Energy: 0.6865855603515083
Energy: 0.7079009547642819
Energy: 0.6980157834927776
Energy: 0.7223512775772073
Energy: 0.7296345891894088
Energy: 0.6471542121806184
Energy: 0.7067502484610886
Energy: 0.8588685049958199
Energy: 0.8282331016335726
Energy: 0.8478566471382373
Energy: 0.7468086060336374
Energy: 0.853525279250613
Energy: 0.7245949630854644
Energy: 0.7840437871070197

minimum gb energy = 0.5820286635150296 eV
minimum distance =  1.87245481808154 Angstroms
sigma value = 9


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

Energy: 1.1868995473154655
Energy: 1.4030036888775161
Energy: 1.0077558557466677
Energy: 0.9231165182067314
Energy: 1.1393074128351195
Energy: 0.8562262831557148
Energy: 1.043398238627897
Energy: 0.8189430439026999
Energy: 0.7363585674133325
Energy: 0.8711130084405395
Energy: 0.7317937199843173
Energy: 0.8335881281974844
Energy: 0.6892132867912824
Energy: 0.5997918345829255
Energy: 0.700924578962667
Energy: 0.6018082004818278
Energy: 0.6442505781190856
Energy: 0.6876132364311908
Energy: 0.6776171786854683
Energy: 0.70805799904668
Energy: 0.6874068301972808
Energy: 0.6862993470069682
Energy: 0.7630758843748218
Energy: 0.6481514101479342
Energy: 0.8209329104672872
Energy: 0.7082511784286859
Energy: 0.79820576649326
Energy: 0.7283625503716609
Energy: 0.7062727885148211
Energy: 0.797969991329029
Energy: 0.6094841585602047
Energy: 0.6518012238826025
Energy: 0.8083178966379941
Energy: 0.6098984260939417
Energy: 0.6297370612441812
Energy: 0.7900903398642597
Energy: 0.6062269950372426
Energy: 0.5680081405596819
Energy: 0.6027503124778016
Energy: 0.6071670515840158
Energy: 0.5655790924443002
Energy: 0.6065350962979927
Energy: 0.6110382776397237
Energy: 0.6299562625660549
Energy: 0.7076964267069806
Energy: 0.7339887114919897
Energy: 0.6329069586872341
Energy: 0.7789407400098107
Energy: 0.7552729631797354
Energy: 0.7261821910458426
Energy: 0.6963907071447214
Energy: 0.6060923790633042
Energy: 0.743727917879655
Energy: 0.7145405571180503
Energy: 0.7175449614643711
Energy: 0.7177446386664761
Energy: 0.775610007932449
Energy: 0.629158840039619
Energy: 0.6611853047311023
Energy: 0.6707198372374252
Energy: 0.7462687776014674
Energy: 0.682733502811006
Energy: 0.665797043027383
Energy: 0.6232867670807489
Energy: 0.6147802945208621
Energy: 0.6890207134117801
Energy: 0.9024562314040063
Energy: 0.6102606501493733
Energy: 0.748787803576837
Energy: 0.7867928783359257
Energy: 0.6116232981630707
Energy: 0.5808836557898793
Energy: 1.0473249991852773
Energy: 0.9866070117501774
Energy: 0.7675674017856594
Energy: 0.7221284004042012
Energy: 0.6165040266894277
Energy: 0.7713501252234138
Energy: 0.9079235522027007
Energy: 0.7795726253253857
Energy: 0.7473698807899714
Energy: 0.8097322513729914
Energy: 0.7131812761760228
Energy: 0.7503478382419604
Energy: 0.6000045038248645
Energy: 0.5624929139172173
Energy: 0.5942729452646135
Energy: 0.676367667871721
Energy: 0.5554073977788766
Energy: 0.6559017127902343
Energy: 0.5967093637877051
Energy: 0.6564246585192882
Energy: 0.6410325133458349
Energy: 0.597598345820568
Energy: 0.686713763948233
Energy: 0.6254968349715615
Energy: 0.5970652022743825
Energy: 0.7968879511695772
Energy: 0.8009772808017035
Energy: 0.5970095830833042
Energy: 0.7860889179760027
Energy: 0.8948434935236832
Energy: 0.6501138838223565
Energy: 0.7042811971996765
Energy: 0.8785198715208061
Energy: 0.6702917426746866
Energy: 0.7675854109242474
Energy: 0.883355389118193
Energy: 0.6413539912346461
Energy: 0.6175986970598617
Energy: 0.6958600746928252
Energy: 0.6882186327944624
Energy: 0.5588276273594485
Energy: 0.7124260501684595
Energy: 0.7338135400030104
Energy: 0.6017916375449349
Energy: 0.6214692700730547
Energy: 0.6778012585165153
Energy: 0.6294286574198953
Energy: 0.6321384410857872
Energy: 0.8009783344836278
Energy: 0.6312816962310233
Energy: 0.7337732121979776
Energy: 0.7389312458239852
Energy: 0.6394210873884628
Energy: 0.6846968665845888
Energy: 0.8430562774976353
Energy: 0.922755844701125
Energy: 0.915317084730704
Energy: 0.7461182617375318
Energy: 0.8617000190308858
Energy: 0.7888427889043427
Energy: 0.8550529478547255
Energy: 0.9125474831926598
Energy: 0.9075248123499209
Energy: 0.7457505305110961
Energy: 0.6707587990103938
Energy: 0.8312501479300058
Energy: 0.7070546004760327
Energy: 0.669285766064497
Energy: 0.7008668951364577
Energy: 0.6443181043611843
Energy: 0.689258341412937
Energy: 0.6673804072843585
Energy: 0.7638063945581117
Energy: 0.7385746409490626
Energy: 0.7439073650286422
Energy: 0.692774594008429
Energy: 0.5968310362611952
Energy: 0.7302882885046299
Energy: 0.7307684719606987
Energy: 0.8335364161203088
Energy: 0.8916803406507258
Energy: 0.7168269896283462
Energy: 0.8336991352493237
Energy: 0.7644379106796636
Energy: 0.6102943903127742
Energy: 0.7433782816547313
Energy: 0.6963522992007355
Energy: 0.6105385896046762
Energy: 0.7323010295788823
Energy: 1.0055671541308338
Energy: 0.6124378275950291
Energy: 0.7668917810387267
Energy: 0.803125030004566
Energy: 0.6113415249045686
Energy: 0.754472500212143
Energy: 0.7607073261517897
Energy: 0.6122834949591758
Energy: 0.6933101284237717
Energy: 0.6660601632268476
Energy: 0.7219396096615693
Energy: 0.6975208117207503
Energy: 0.7977550925309103
Energy: 0.6532957276976845
Energy: 0.6214290017867393
Energy: 0.7304031017395415
Energy: 0.6595634356019274
Energy: 0.6133629926677334
Energy: 0.7426334981901153
Energy: 0.7057461491556561
Energy: 0.5922311453036511
Energy: 0.7103354685735929
Energy: 0.6600424545746509
Energy: 0.6497642316355615
Energy: 0.7399686630715654
Energy: 0.7136884176550176
Energy: 0.6104822555777256
Energy: 0.7922027766423684
Energy: 0.6162814207559516
Energy: 0.6108946603538488
Energy: 0.7176123345537267
Energy: 0.7694744803057516
Energy: 0.6098336428162882
Energy: 0.6104251386647916
Energy: 0.5503008587834961
Energy: 0.6128052546083785
Energy: 0.6113207064286864
Energy: 0.777322749172918
Energy: 0.6635804573079745
Energy: 0.8619998785289328
Energy: 0.6843622272710719
Energy: 0.609534454580529
Energy: 0.7736464200842876
Energy: 0.7743451520715867
Energy: 0.6112056935470955
Energy: 0.8874806461993289
Energy: 0.6866498778562988
Energy: 0.6063485304459735
Energy: 0.8091454192568879
Energy: 0.6648923984780231
Energy: 0.5678873107167299
Energy: 0.609631461910099
Energy: 0.6688378975542879
Energy: 0.5588303638936655
Energy: 0.6072895977931008
Energy: 0.6743210872002582
Energy: 0.6384126860907177
Energy: 0.6677865908797037
Energy: 0.7252651254080772
Energy: 0.6281659689112474
Energy: 0.7401328441129221
Energy: 0.5977645953412312
Energy: 0.808143119628954
Energy: 0.9061924448330099
Energy: 0.7066426325264936
Energy: 0.8746725553084197
Energy: 0.5981421489433765
Energy: 1.0285195809466101
Energy: 0.7710378431175539
Energy: 0.767581911901177
Energy: 1.0258762255432874
Energy: 0.8397560072145004
Energy: 1.0574455302052423
Energy: 0.6742024823057533
Energy: 0.9275208656167993
Energy: 0.9227372901696944
Energy: 0.6647262045204692
Energy: 0.9543887347749263
Energy: 0.747495201836381
Energy: 0.7318602051215695
Energy: 0.646760541645345
Energy: 0.6763047485423205
Energy: 0.6662203803682528
Energy: 0.6409947583450213
Energy: 0.6442160361512655
Energy: 0.6693427174130535
Energy: 0.6328419729836647
Energy: 0.6822751712204869
Energy: 0.6215973492687791
Energy: 0.6160361210548798
Energy: 0.6776706755477524
Energy: 0.867023905657757
Energy: 0.8336572810682286
Energy: 0.8870411923859312
Energy: 0.7298373773510791
Energy: 0.6664495499185676
Energy: 0.8460679183015309

minimum gb energy = 0.5503008587834961 eV
minimum distance =  1.842318392116 Angstroms
sigma value = 57


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

Energy: 0.5273663872824126
Energy: 0.6997544505504835
Energy: 0.3773468344465753
Energy: 0.3768253323359903
Energy: 0.6977956830984707
Energy: 0.4889888523704874
Energy: 0.8626568476971394
Energy: 0.704929099258794
Energy: 0.7121641932370651
Energy: 0.7316568127432206
Energy: 1.1641215811482801
Energy: 0.7577632529782363
Energy: 1.0246210223692742
Energy: 0.7653231837470802
Energy: 0.7317638374752522
Energy: 0.9103344275515737
Energy: 0.722541695485934
Energy: 1.073282242344331
Energy: 1.1004104637669068
Energy: 0.641613032879397
Energy: 0.9011665980594031
Energy: 0.98751904501223
Energy: 0.8138509103203677
Energy: 0.8999863806060647
Energy: 0.6658471128020856
Energy: 0.4438453302686097
Energy: 0.4409144741821436
Energy: 0.9690654217752098
Energy: 0.3755791032913706
Energy: 0.6543811022337118
Energy: 0.6410044564769289
Energy: 0.4457147233807346
Energy: 0.44433226647480506
Energy: 0.5794386034887833
Energy: 0.37552164744488514
Energy: 0.39190624116193773
Energy: 0.7299199580771474
Energy: 0.9762257672365838
Energy: 0.7960539476141463
Energy: 0.7446899652259822
Energy: 0.8775582129666384
Energy: 0.8504887098763432
Energy: 0.7626946110516363
Energy: 0.9503678776492305
Energy: 0.9089897850612058
Energy: 0.7761477752759066
Energy: 0.9281357187065591
Energy: 0.9477407399102196
Energy: 0.6320431399690032
Energy: 1.017710026037842
Energy: 1.0542851522048513
Energy: 0.7934640613881756
Energy: 0.9998366414048478
Energy: 1.0712835067679385
Energy: 0.3802720036909512
Energy: 0.6386552488378009
Energy: 0.3787160622507834
Energy: 0.37542694166686164
Energy: 0.5633607167480847
Energy: 0.39359258667418756
Energy: 0.37536656880302277
Energy: 0.5382204229668391
Energy: 0.5202742606940678
Energy: 0.3754410987454127
Energy: 0.5600624780845717
Energy: 0.37691963077632146
Energy: 0.9717506777042111
Energy: 0.7061196346345388
Energy: 0.7679053669761131
Energy: 0.936921122107339
Energy: 0.7515975538131944
Energy: 0.7615167579268008
Energy: 1.3760202987652732
Energy: 0.9757054343217072
Energy: 1.0724488142327508
Energy: 0.9237400145262344
Energy: 0.6785833001436565
Energy: 1.0257739048493788
Energy: 0.9800769736420338
Energy: 0.7157474606148784
Energy: 0.7609926903262714
Energy: 1.0301568919967925
Energy: 0.6874353088701008
Energy: 1.049684722808203
Energy: 0.7004093603498924
Energy: 0.38034341682112577
Energy: 0.37582789044132886
Energy: 0.5976089854827046
Energy: 0.44405423202001126
Energy: 0.44272673457819534
Energy: 0.7067021830202382
Energy: 0.8051335973418441
Energy: 0.6398070862352397
Energy: 0.6565711339030018
Energy: 0.44468939249206346
Energy: 0.782560750928346
Energy: 0.7942841796292511
Energy: 1.0148300107146997
Energy: 0.9192337658684312
Energy: 0.7448731138439572
Energy: 0.9327229250831417
Energy: 0.9724871462254184
Energy: 0.7177668552216289
Energy: 1.0461607519099445
Energy: 0.9775916978038532
Energy: 0.7412584484675703
Energy: 0.9274715306115717
Energy: 1.0681562517421093
Energy: 0.4863309190061513
Energy: 0.6105453620114712
Energy: 0.7000320705911706
Energy: 0.37547769550457855
Energy: 0.590106653241024
Energy: 1.0304145424760327

minimum gb energy = 0.37536656880302277 eV
minimum distance =  1.87913781996638 Angstroms
sigma value = 11


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

Energy: 1.0199124813685423
Energy: 1.2366719521282417
Energy: 0.9925782273855439
Energy: 0.8493453868590753
Energy: 1.07144245878383
Energy: 0.9897843968669215
Energy: 0.9576248170189755
Energy: 0.7105814875076271
Energy: 0.6745890904442668
Energy: 0.8166092257419725
Energy: 0.653378339908907
Energy: 0.8466646668074257
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Energy: 0.6088904966114559
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Energy: 0.5948241280887197
Energy: 0.6478371486907906
Energy: 0.6078058150441688
Energy: 0.6119659522641238
Energy: 0.5915179127345649
Energy: 0.6120634991730045
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Energy: 0.5900030296271752
Energy: 0.5431216944903515
Energy: 0.5592644883271085
Energy: 0.8322451829548501
Energy: 0.8469849652717477
Energy: 0.5518200676386316
Energy: 1.1007812561496375
Energy: 0.9916652157289937
Energy: 0.7312376645814505
Energy: 0.7910959671785468
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Energy: 0.551335262096934
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Energy: 0.6170700067338104
Energy: 0.6451333833179774
Energy: 0.6731125635239488
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Energy: 0.754410088455825
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Energy: 0.8399483591976193
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Energy: 0.6745318044242589
Energy: 0.6930850017755965
Energy: 0.7460845010462274
Energy: 0.7837936013935122
Energy: 0.6620242216268702
Energy: 0.7767672488401695
Energy: 0.7855221139363134
Energy: 0.8109223576156388
Energy: 0.7393123395613581
Energy: 0.7203586671425241
Energy: 0.7932908955425428
Energy: 0.7504883481341422
Energy: 0.5431908203707775
Energy: 0.7397367879981349
Energy: 0.7695893420873711
Energy: 0.7029257411232634
Energy: 0.6501588627975701
Energy: 0.730850820137958
Energy: 0.6844072670081214
Energy: 0.8078449441143363
Energy: 0.5593466050672469
Energy: 0.7412860513489234
Energy: 0.6982438228995573
Energy: 0.5772483021761984
Energy: 0.7828633688482906
Energy: 0.7956084904844837
Energy: 0.5501358338872778
Energy: 0.5705384670202961
Energy: 0.6629231193825441
Energy: 0.5508127309863996
Energy: 0.6921706930085866
Energy: 0.6771486231623149
Energy: 0.7031877255655349
Energy: 0.6857599182897587
Energy: 0.639075853038475
Energy: 0.6308228171954754
Energy: 0.64653185976074
Energy: 0.751751134886881
Energy: 0.8447794029671156
Energy: 0.8521156065100841
Energy: 0.6407978304332296
Energy: 0.8233628775905402
Energy: 0.7145167464181055
Energy: 0.8316906977023607
Energy: 0.8528780624230042
Energy: 0.6863982460552228
Energy: 0.757054721580315
Energy: 0.8276826517350138
Energy: 0.835365055942988
Energy: 0.6279409331633654
Energy: 0.8194712881749919
Energy: 0.7615220184122911
Energy: 0.6479748526073958
Energy: 0.8246372876605914
Energy: 0.5350830794257031
Energy: 0.5868441590108994
Energy: 0.6906133582273569
Energy: 0.6411977978067032
Energy: 0.5825366385833936
Energy: 0.6339059222311849
Energy: 0.7023370587702278
Energy: 0.5888174082970075
Energy: 0.5932666452343566
Energy: 0.6187005405709242
Energy: 0.5847743633209689
Energy: 0.6267989949594325
Energy: 1.1283560486067126
Energy: 0.9310960660368484
Energy: 0.8780346512772442
Energy: 0.8926124315685263
Energy: 0.7685414449318141
Energy: 0.7475269076362581
Energy: 0.9135719128410801

minimum gb energy = 0.5350830794257031 eV
minimum distance =  1.85163065082958 Angstroms
sigma value = 41


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

Energy: 0.9758594373928097
Energy: 1.222821198773405
Energy: 1.0299702855562967
Energy: 0.8076238550704561
Energy: 0.6402159127905308
Energy: 0.813413261715385
Energy: 0.823618374648632
Energy: 0.6640387444051147
Energy: 0.815316935746474
Energy: 0.8498365384416188
Energy: 0.6898761977976628
Energy: 0.7967949721188471
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Energy: 0.5720374297979202
Energy: 0.6193677323998128
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Energy: 0.6894126611607923
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Energy: 0.7355886767879974
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Energy: 0.5591874839432356
Energy: 0.6538200260278944
Energy: 0.5656393412485676
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Energy: 0.6759038027917867
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Energy: 0.6864287896577635
Energy: 0.645435066989356
Energy: 0.5747956201361168
Energy: 0.7116830961357448
Energy: 0.8494901194370166
Energy: 0.5599728707927946
Energy: 0.5588788371113428
Energy: 0.753293121049062
Energy: 0.5606765128573967
Energy: 0.5959215286049915
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Energy: 0.7153265064811218
Energy: 0.5641277225075477
Energy: 0.7919078182571233
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Energy: 0.6412073708147985
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Energy: 0.7770868865261888
Energy: 0.6540539471908248
Energy: 0.6351082402865098
Energy: 0.6054603429742498
Energy: 0.6597280647174011
Energy: 0.6632321911312057
Energy: 0.5792924818452074
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Energy: 0.6458820396650474
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Energy: 0.796854551586631
Energy: 0.6709688288066494
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Energy: 0.8089383654606312
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Energy: 0.718750156790095
Energy: 0.738175280379025
Energy: 0.7131624923682406
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Energy: 0.8322296425256804
Energy: 0.9438715770505789
Energy: 0.8109600909838824
Energy: 0.7998361657518802
Energy: 0.9282260065678506
Energy: 0.7465300057943806
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Energy: 0.8062770579023062
Energy: 0.6643531521299655
Energy: 0.7029426211722128
Energy: 0.6748994321914892
Energy: 0.6445525230369887
Energy: 0.6441154770972704
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Energy: 0.6590077092526134
Energy: 0.7167676709373259
Energy: 0.6585447307492746
Energy: 0.6681402185318014
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Energy: 0.6472989853777247
Energy: 0.6337228914051461
Energy: 0.6359100924163236
Energy: 0.5823215317394071
Energy: 1.0324704596466507
Energy: 0.7057152168397862
Energy: 0.5829414151861383
Energy: 0.957404576841674
Energy: 0.6306623811670193
Energy: 0.7924123239191024
Energy: 0.926138853636275
Energy: 0.8163312525029064
Energy: 0.7560085355530698
Energy: 0.9408941107194244
Energy: 0.9347232711382175
Energy: 0.7158796204239312
Energy: 0.7427722894246864
Energy: 0.6612938166819207
Energy: 0.8153617064863176
Energy: 0.9856183239367047
Energy: 0.5528897595259183
Energy: 0.6896509239231321
Energy: 0.7182262414517244
Energy: 0.7428120289480921
Energy: 0.6450593187013163
Energy: 0.5906067627431324
Energy: 0.7191216302917888
Energy: 0.7625105899721103
Energy: 0.5605668298882773
Energy: 0.6061579169526097
Energy: 0.7337705942893795
Energy: 0.5611777652443682
Energy: 0.5876112443215449
Energy: 0.7723159166890704
Energy: 0.6502969277652684
Energy: 0.6659406568597079
Energy: 0.6707834055527154
Energy: 0.5641838558409956
Energy: 0.7856639752068655
Energy: 0.751757530832393
Energy: 0.7680509081326067
Energy: 0.9950623290755982
Energy: 0.7096765499336021
Energy: 0.6661341819903036
Energy: 0.7543902122946956
Energy: 0.7210049976815007
Energy: 0.6372626543875335
Energy: 0.6759586224347347
Energy: 0.6487182518266932
Energy: 0.6694758281713287
Energy: 0.6756271230313531
Energy: 0.6164998279012598
Energy: 0.8182621486847861
Energy: 0.8065524478025773
Energy: 0.6164254925556966
Energy: 0.8323558212373193
Energy: 0.7474656315794551
Energy: 0.5799791461252608
Energy: 0.727419900471797
Energy: 0.5605562284434252
Energy: 0.5653842833968994
Energy: 0.6861152527157699
Energy: 0.5614353532558546
Energy: 0.6798579157495601
Energy: 0.7931301199348707
Energy: 0.7939331486281157
Energy: 0.6748522749253653
Energy: 0.7507415891686013
Energy: 0.7456131576502486
Energy: 0.5828470034235649
Energy: 0.6448459502958609
Energy: 0.6999428683109904
Energy: 0.6751485037078984
Energy: 0.6830064227989069
Energy: 0.7405158113666415
Energy: 0.8299124642055441
Energy: 0.8218463855033764
Energy: 0.6880864412602492
Energy: 0.6494305747054602
Energy: 0.8770299526690603
Energy: 0.8230047827175258

minimum gb energy = 0.5528259751793788 eV
minimum distance =  1.88459601463944 Angstroms
sigma value = 33


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

Energy: 0.7948541447805937
Energy: 0.9807274229085629
Energy: 0.94106222960181
Energy: 0.7055350610902685
Energy: 0.7843010122240847
Energy: 0.8663867381863269
Energy: 0.7514009814092063
Energy: 0.6837854320844384
Energy: 0.7160557624749484
Energy: 0.8031348811962071
Energy: 0.7691647589592938
Energy: 0.7047960081070445
Energy: 0.7368222284727619
Energy: 0.6730034915406887
Energy: 0.72903142227722
Energy: 0.7183359732211575
Energy: 0.6388117200565815
Energy: 0.6883558595578569
Energy: 0.7377633881623492
Energy: 0.76709453443008
Energy: 0.6410730863410554
Energy: 0.7149185506095801
Energy: 0.6189889615720356
Energy: 0.65015703798367
Energy: 0.6480729771342776
Energy: 0.6871970395932253
Energy: 0.9160809860841832
Energy: 0.6257358351374488
Energy: 0.7187632031355513
Energy: 0.7832519748563406
Energy: 0.7748138346600272
Energy: 0.833020747324512
Energy: 0.7785983255854996
Energy: 0.7960168364074973
Energy: 0.8174308471294622
Energy: 0.6095692137967457
Energy: 0.7682242441820384
Energy: 0.6341710877589989
Energy: 0.6323122422181813
Energy: 0.6997580527388599
Energy: 0.6547228357660178
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Energy: 0.7864358016049064
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Energy: 0.5965890965389121
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Energy: 0.6386460701381105
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Energy: 0.5747189090365177
Energy: 0.64450087549418
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Energy: 0.9847956982482312
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Energy: 0.6710594467456416
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Energy: 0.6551941033944678
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Energy: 0.7218878593851085
Energy: 0.6967483815081577
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Energy: 0.6373579423858536
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Energy: 0.9971711158328788
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Energy: 0.9641653368622564
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Energy: 0.8466813082557006
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Energy: 0.7630019601965132
Energy: 0.7604243696952357
Energy: 0.9866705270137777
Energy: 0.9949378185387652
Energy: 0.8766742591232197
Energy: 0.7232343406109321
Energy: 0.8784989160216584
Energy: 0.8526040141291837

minimum gb energy = 0.5602232952556235 eV
minimum distance =  1.88870000510863 Angstroms
sigma value = 67


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

Energy: 0.8552171259002738
Energy: 0.9859614152595416
Energy: 0.5148288053568435
Energy: 0.7376179752780507
Energy: 0.9270817678497624
Energy: 0.7999203967668909
Energy: 0.6654186615086495
Energy: 0.8035097987999733
Energy: 0.8005818482479645
Energy: 0.8069763318121336
Energy: 0.8076861677643679
Energy: 0.7898224761316587
Energy: 0.7370482919834598
Energy: 0.49693322905005427
Energy: 0.6362478682559031
Energy: 0.6758935502314136
Energy: 0.49699697181701324
Energy: 0.7417758046671691
Energy: 0.5979627176842339
Energy: 0.6625882305930414
Energy: 0.6361148244348955
Energy: 0.5137233598019781
Energy: 0.6304215259409882
Energy: 0.7288856625370855
Energy: 0.5953390706244849
Energy: 0.981863923726628
Energy: 0.7399723610003013
Energy: 0.5958862621686375
Energy: 0.8529531988623088
Energy: 0.8978163508067435
Energy: 0.5936677847044594
Energy: 0.5128757930069002
Energy: 0.8945654234313156
Energy: 0.8928458829461224
Energy: 0.5130188849738285
Energy: 0.7711715439693996
Energy: 0.7543082167922425
Energy: 0.7654124218225957
Energy: 0.837221106987681
Energy: 0.6810956306774294
Energy: 0.8186478244678532
Energy: 0.5150165286065437

minimum gb energy = 0.49693322905005427 eV
minimum distance =  2.6336261530028 Angstroms
sigma value = 3


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

Energy: 1.1143506422913652
Energy: 1.258325841711002
Energy: 1.032417935114215
Energy: 0.9528157209865851
Energy: 1.15512106283238
Energy: 1.0345157830147464
Energy: 0.844339249089844
Energy: 0.66308458932798
Energy: 0.6637602193964277
Energy: 0.6531659887542287
Energy: 0.6672925915972236
Energy: 0.6942471981450076
Energy: 0.7764008661730496
Energy: 0.7796781774595617
Energy: 0.8260239284322205
Energy: 0.7906356171202228
Energy: 0.7721222945169103
Energy: 0.7945560850380852
Energy: 0.5297060605270241
Energy: 0.8158503697595008
Energy: 0.8060912068693525
Energy: 0.5301738638955671
Energy: 0.8089438932398428
Energy: 0.7335732473045901
Energy: 0.5746565441900233
Energy: 0.7244527631915771
Energy: 0.7941889439472263
Energy: 0.5799593638817805
Energy: 0.6985450087305486
Energy: 0.6940443590453597
Energy: 0.7329916996343787
Energy: 0.7482893641615136
Energy: 0.7264131080999054
Energy: 0.717216108256588
Energy: 0.7314724784192244
Energy: 0.7645429008933998
Energy: 0.9119259876110799
Energy: 0.6495635895835461
Energy: 0.6630718374395261
Energy: 0.8301387932866219
Energy: 0.6445720245447933
Energy: 0.6993869899795055
Energy: 0.9738570365201438
Energy: 1.0148310601549644
Energy: 0.8152473591164443
Energy: 0.9387056513410882
Energy: 1.0358412491304738
Energy: 0.9526285870096534
Energy: 0.7852801413367729
Energy: 0.6496572184386066
Energy: 0.5859389512516262
Energy: 0.8441948342400526
Energy: 0.6051689572477672
Energy: 0.710830321503689
Energy: 0.7498319334100444
Energy: 0.8746360757133497
Energy: 0.8858005852826882
Energy: 0.7729141127548835
Energy: 0.8743480579135671
Energy: 0.8647629223946917
Energy: 0.6731482945696908
Energy: 0.7499477605909557
Energy: 0.6989755631513244
Energy: 0.6869588395230943
Energy: 0.9994494693435836
Energy: 0.7567243734279018
Energy: 0.7256200929567583
Energy: 0.7368203905631902
Energy: 0.6548466334431505
Energy: 0.6944082288888895
Energy: 0.6749373928891561
Energy: 0.7116575251113902
Energy: 0.7772622176732354
Energy: 0.6970953379289739
Energy: 0.7248418753993667
Energy: 0.7164630187640317
Energy: 0.6074479558225684
Energy: 0.7249507341378676
Energy: 0.8903417511243731
Energy: 0.5340092342246131
Energy: 0.6313468128741323
Energy: 0.8252187142071974
Energy: 0.5310199127221552
Energy: 0.7004043408367722
Energy: 0.8354100376576549
Energy: 0.8512231593747612
Energy: 0.841451639634761
Energy: 0.7580937237791479
Energy: 0.8293276594271033
Energy: 0.8342948031881411
Energy: 0.7510486959764615
Energy: 0.6563302766205263
Energy: 0.6398837845345184
Energy: 0.7369448583053467
Energy: 0.7506522155672728
Energy: 0.6988351935568513
Energy: 0.8120591542973974
Energy: 1.0107255246773843
Energy: 0.940248317448655
Energy: 0.7145316816338668
Energy: 1.0162672732436786
Energy: 1.0921780990202254
Energy: 0.6646794951783439
Energy: 0.7454633722458689
Energy: 0.7371655124305039
Energy: 0.6615181162334947
Energy: 0.7011650809562087
Energy: 0.7120218141359886
Energy: 0.9730103606433231
Energy: 0.8242957906006414
Energy: 0.8363428899644095
Energy: 0.8891528994096456
Energy: 0.807117101007635
Energy: 0.8455482296623941
Energy: 0.84929002303334
Energy: 0.6990084031424745
Energy: 0.7656556860351386
Energy: 0.8585054041901911
Energy: 0.7055173261149152
Energy: 0.8201764357828379
Energy: 0.7166918854407391
Energy: 0.6394565234329587
Energy: 0.7007103731448697
Energy: 0.7323605290339855
Energy: 0.597494688325577
Energy: 0.6750742748968251
Energy: 0.7067859431518447
Energy: 0.8177992894793402
Energy: 0.7808114718433133
Energy: 0.740803313045953
Energy: 0.7129745491057627
Energy: 0.7901913215301343
Energy: 0.5718334706471622
Energy: 0.6604015791640863
Energy: 0.8002551169924704
Energy: 0.586732704711581
Energy: 0.7315877355761546
Energy: 0.523862784009902
Energy: 0.5722890546230675
Energy: 0.8452280099840174
Energy: 0.8360744870715805
Energy: 0.8912724693348353
Energy: 0.9060865692734642
Energy: 0.8759103711227813
Energy: 0.5218419568941043
Energy: 0.8196782514052514
Energy: 0.7757857345235264
Energy: 0.6849367930888982
Energy: 0.8839717944004432
Energy: 0.6946302302059548
Energy: 1.0059489419823169
Energy: 0.7329088571771657
Energy: 0.6903075642118307
Energy: 0.8758647212711408
Energy: 0.6863438274112122
Energy: 0.8629374635831837
Energy: 1.0536381017634686
Energy: 0.7756209482088049
Energy: 0.7151267127960579
Energy: 1.007539851866369
Energy: 0.6501071718160726
Energy: 0.6975538217466335
Energy: 0.7098088642796122
Energy: 0.7862647211887337
Energy: 0.7353739017704785
Energy: 0.7083473562143301
Energy: 0.7785668054593209
Energy: 0.7303794792768646
Energy: 0.533926863579285
Energy: 0.8144991154135952
Energy: 0.7980073285845842
Energy: 0.6968985664515129
Energy: 0.7998513820956636
Energy: 0.7970715592203994
Energy: 0.5336738517289381
Energy: 0.7033636423169745
Energy: 0.7167045900072695
Energy: 0.5394455439733594
Energy: 0.7670848256878062
Energy: 0.646951338357846
Energy: 0.7193328021168209
Energy: 0.7890386936881304
Energy: 0.7754078297283299
Energy: 0.7703203272022193
Energy: 0.7672008002292583
Energy: 0.8025736589773413
Energy: 0.7037936480886189
Energy: 0.7088683169641161
Energy: 0.5723643724293681
Energy: 0.6978181458520852
Energy: 0.7229167802337251
Energy: 0.6792458314292972
Energy: 0.9785635046068406
Energy: 0.7235682100945853
Energy: 0.7777926503191268
Energy: 0.9005423449421294
Energy: 0.7522028446394351
Energy: 0.8842460037069912
Energy: 1.0015463617710603
Energy: 0.7445718147006978
Energy: 0.6876266312887457
Energy: 0.9439811880963302
Energy: 0.7067919925123803
Energy: 0.7645651247965587
Energy: 0.6701870972242159
Energy: 0.906248356698463
Energy: 0.8196539171640895
Energy: 0.6796878782114084
Energy: 1.0475940589651742
Energy: 0.7311342389274902
Energy: 0.6967559401177054
Energy: 0.8638596241534588
Energy: 0.8781390340069742
Energy: 0.6301817049222509
Energy: 0.9193283999967223
Energy: 0.8921118064774591
Energy: 0.7102806299400194
Energy: 0.6066328909032149
Energy: 0.5852133651550463
Energy: 0.6562489804974793
Energy: 0.7216356162327052
Energy: 0.5954595146637293
Energy: 0.7817156856969799
Energy: 0.7603888414778545
Energy: 0.7689732375008632
Energy: 0.7354559633257327
Energy: 0.7232052114979147
Energy: 0.7880477773468428
Energy: 0.7572099227371042
Energy: 0.5331582360612696
Energy: 0.5363470430248607
Energy: 0.7061133956563633
Energy: 0.5304936845141638
Energy: 0.6861160498595723
Energy: 0.8180863496852948
Energy: 0.8033393204656295
Energy: 0.7105935463968643
Energy: 0.7807170935545844
Energy: 0.5925549757084729
Energy: 0.798964599154565
Energy: 0.8664068181295382
Energy: 0.7270752824901423
Energy: 0.5332839894838717
Energy: 0.8516221013762316
Energy: 0.7755744367806274
Energy: 0.7720605668765574
Energy: 0.6765971905004537
Energy: 0.796431211952102
Energy: 0.8300905270709025
Energy: 0.6729153804900923
Energy: 0.8490157839416462
Energy: 0.7501113338560722
Energy: 0.7805477413080549
Energy: 0.9476924946815836
Energy: 0.9873156636456828
Energy: 0.8801774416035181
Energy: 0.9930290144164494
Energy: 0.9360007680864411
Energy: 0.8075469533193311
Energy: 0.6117446144366321
Energy: 0.6404190065666236
Energy: 0.9346159832497761
Energy: 0.6950813042208032
Energy: 0.6079034318191715
Energy: 0.9377921192040174
Energy: 0.9668543562677617
Energy: 0.8978059759483877
Energy: 0.8457673408893641
Energy: 0.6296958628299306
Energy: 0.8851400712458547
Energy: 0.9299150511978731
Energy: 0.6054829925794377
Energy: 0.6311057691770713
Energy: 0.908494459036112
Energy: 0.5453570639358274
Energy: 0.6401529990153242
Energy: 0.719530226175281
Energy: 0.737333446317357
Energy: 0.6926320577366224
Energy: 0.7085017367412418
Energy: 0.6578145844758484
Energy: 0.7002661950314173
Energy: 0.6225665954277139
Energy: 0.7266212054824644
Energy: 0.69808477083645
Energy: 0.6125486418866417
Energy: 0.6622689364385189
Energy: 0.6620257676618828
Energy: 0.5799821163309445
Energy: 0.803625941763374
Energy: 0.8178004865749741
Energy: 0.5314143816741446
Energy: 0.8485381086053472
Energy: 0.7744668962215144
Energy: 0.7909006998986997
Energy: 0.8079317962902383
Energy: 0.9614755007700246
Energy: 0.7158795701023661
Energy: 0.8025340528320087
Energy: 0.9357073407210345
Energy: 0.6478501355515875
Energy: 0.7197183257965402
Energy: 0.6798930747926584
Energy: 0.7439698185147021
Energy: 0.7370902092910027
Energy: 0.6971161418386662

minimum gb energy = 0.5218419568941043 eV
minimum distance =  1.83549542015205 Angstroms
sigma value = 81


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

Energy: 1.017839008755749
Energy: 1.3669495139764982
Energy: 0.9156883045295805
Energy: 0.8561883325068361
Energy: 1.1147730827538198
Energy: 0.8696010045146312
Energy: 0.8986913931438454
Energy: 0.72657471403588
Energy: 0.5558307105909687
Energy: 0.9392289167872708
Energy: 0.7169823175196546
Energy: 0.6285256684880101
Energy: 0.7786427831018883
Energy: 0.5976084591503334
Energy: 0.598105509560896
Energy: 0.7099586047208991
Energy: 0.5030028868434013
Energy: 0.7859224530899671
Energy: 0.503866938914528
Energy: 0.5981257642429137
Energy: 0.804809634523847
Energy: 0.5043128584519591
Energy: 0.5035626792526287
Energy: 0.7563340631550887
Energy: 0.6013869898236361
Energy: 0.7814716537968648
Energy: 0.8388597744679542
Energy: 0.6860544768842255
Energy: 0.7804999317917539
Energy: 0.8288181295017005
Energy: 0.7546023286729726
Energy: 0.8445063663383235
Energy: 0.8402795635765133
Energy: 0.7568836260280318
Energy: 0.7742353645809832
Energy: 0.8781849368341627
Energy: 1.127157203782383
Energy: 0.7818681537919362
Energy: 0.7885739897738478
Energy: 0.8822355871589915
Energy: 0.506944291966484
Energy: 0.8540205057983989
Energy: 0.8444645527446955
Energy: 0.8025993421423112
Energy: 1.0842545067380716
Energy: 0.7850208353835713
Energy: 0.7298812628979207
Energy: 0.5554207719045626
Energy: 0.9208994969734388
Energy: 0.7161964071695577
Energy: 0.6159661591670359
Energy: 0.8323514815913128
Energy: 0.6557187877946326
Energy: 0.7192363953002737
Energy: 0.7528853108100788
Energy: 0.8633273683395949
Energy: 0.8673417277427364
Energy: 0.7593088655006649
Energy: 0.8660613726137452
Energy: 0.8739968710177228
Energy: 0.7472864367237991
Energy: 0.8538393575732659
Energy: 0.8415092147140141
Energy: 0.6730453486657212
Energy: 0.8576316455325058
Energy: 0.7257313971186069
Energy: 0.5026093215514491
Energy: 0.7656715493639242
Energy: 0.7974668756366766
Energy: 0.50237476518757
Energy: 0.8770355725222181
Energy: 0.7646270126718681
Energy: 0.6442255858441176
Energy: 0.7604584386667032
Energy: 0.8067568618887679
Energy: 0.6373403912258867
Energy: 0.5033548455298876
Energy: 0.5983975998158491
Energy: 0.8565089318649203
Energy: 0.6076474831166551
Energy: 0.9755938498640461
Energy: 0.8195375080794157
Energy: 0.5047072190979952
Energy: 0.7935514358824279
Energy: 0.8534605622980818
Energy: 0.8738352357268068
Energy: 0.7496575631849329
Energy: 0.762177016165964
Energy: 0.7549497315461718
Energy: 0.8651984202074707
Energy: 0.5059285342551603
Energy: 0.9502397677687099
Energy: 0.958155358264459
Energy: 0.5063996383906487
Energy: 0.9724236387174251
Energy: 0.7683010351466365
Energy: 0.6789827639233369
Energy: 0.5205737636589202
Energy: 0.5554234059728584
Energy: 0.6454851250845152
Energy: 0.6585720354150192
Energy: 0.6773407371947383
Energy: 0.5840848528418121
Energy: 0.934830273037154
Energy: 0.7734569138552363
Energy: 0.7490285371209394
Energy: 0.9011742785948023
Energy: 0.7229592232580686
Energy: 0.9503389226509968
Energy: 0.8722978261050126
Energy: 0.8615825951474045
Energy: 0.8550479672161493
Energy: 0.7463013930757563
Energy: 0.8463071472661842
Energy: 0.9748939986791898
Energy: 0.8414904098309541
Energy: 0.8635675154404339
Energy: 0.8496208469998376
Energy: 0.7077618923720131
Energy: 0.8858449952566525
Energy: 0.7408508968367303
Energy: 0.7693975521957102
Energy: 0.715659040627345
Energy: 0.5841400223688139
Energy: 0.7167481879574845
Energy: 0.7379684608751754
Energy: 0.5031498269123117
Energy: 0.5980608665547293
Energy: 0.5969201712183726
Energy: 0.503368143363223
Energy: 0.6783245459445154
Energy: 0.5975372706468839
Energy: 0.502633423816597
Energy: 0.8728396612697268
Energy: 0.9118309106598617
Energy: 0.5032376457244477
Energy: 0.90698366620052
Energy: 0.7795817930460235
Energy: 0.6329844317116874
Energy: 0.8470906877386472
Energy: 0.8586322169403716
Energy: 0.6732191052195846
Energy: 0.7797226552469106
Energy: 0.8517967293700963
Energy: 0.8065695242706946
Energy: 0.6380875313237383
Energy: 0.7848466249349353
Energy: 0.7566947070419492
Energy: 0.775277353966336
Energy: 0.6587408671275257
Energy: 0.8496315924848097
Energy: 0.7003083756301269
Energy: 0.7747021233751511
Energy: 0.6859136913023054
Energy: 0.6859555503135832
Energy: 0.9683383661438435
Energy: 0.7838068155608038
Energy: 0.8601911257669069
Energy: 0.7723506000463494
Energy: 0.7513698051200972
Energy: 0.7960937637629328
Energy: 0.7958030457012878
Energy: 0.8854864048556875
Energy: 0.8807752979876055
Energy: 0.791554976714225
Energy: 0.8761649098822475
Energy: 0.8890235367438496
Energy: 0.7297116196349942
Energy: 0.6221028706016194
Energy: 0.8577942790093196
Energy: 0.8914791552502487
Energy: 0.6210194191087758
Energy: 0.8515282796446899
Energy: 0.8777280465714579
Energy: 0.7969819767946693
Energy: 0.744853723399781
Energy: 0.556964355461245
Energy: 0.7749436596930971
Energy: 0.7351848829132015
Energy: 0.7056596189954071
Energy: 0.703872363889108
Energy: 0.7996001448960334
Energy: 0.7849699722637198
Energy: 0.6613628666972747
Energy: 0.8029449112727811
Energy: 0.5983236627958529
Energy: 0.8299712123689769
Energy: 0.7186530317196514
Energy: 0.7564263596732222
Energy: 0.7657212927984636
Energy: 0.5047468881565428
Energy: 0.7506751514445618
Energy: 0.8253108449514222
Energy: 0.8577249179135354
Energy: 0.8460015458164989
Energy: 0.8169280243172633
Energy: 0.7120213886944305
Energy: 0.8509959501347926
Energy: 0.8119805772705395
Energy: 0.7823259708265835
Energy: 0.9533415574314043
Energy: 0.8258023048391473
Energy: 0.7665577121803614
Energy: 0.8473923162181587
Energy: 0.5062273993091642
Energy: 0.7670218350628586
Energy: 0.8097383244242649
Energy: 0.5059571159752866
Energy: 0.5195028001855088
Energy: 1.0025878201377552
Energy: 0.503438556663446
Energy: 0.520423941902729
Energy: 0.5587510778363765
Energy: 0.7707464054399238
Energy: 0.8246069426978415
Energy: 0.9346448053309185
Energy: 0.892864905558448
Energy: 0.7148994914607656
Energy: 0.7120475006101339
Energy: 0.9010985668746321
Energy: 0.8373839364173596
Energy: 0.5191472801121324
Energy: 0.9778609471410822
Energy: 1.118728304891758
Energy: 0.9442928601366973
Energy: 0.8518426082643952
Energy: 0.7934695256405383
Energy: 0.8941243169778132

minimum gb energy = 0.50237476518757 eV
minimum distance =  1.81409593548175 Angstroms
sigma value = 43


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

Energy: 1.1173568042620294
Energy: 1.1808627127623705
Energy: 1.0312946336592599
Energy: 0.9448694479899078
Energy: 1.2738028856421808
Energy: 0.7210675377466408
Energy: 0.786741146753702
Energy: 0.6042954351357535
Energy: 0.7173277329601464
Energy: 0.8180387114318596
Energy: 0.754407431787421
Energy: 0.7789185069656552
Energy: 0.8150685718030879
Energy: 0.8481733372918412
Energy: 0.7412352882879182
Energy: 0.8013556740524543
Energy: 0.8346348808013963
Energy: 0.8674795149718662
Energy: 0.5451438198192108
Energy: 0.8070940215790428
Energy: 0.7811866443410335
Energy: 0.544856691711287
Energy: 0.8464432173644229
Energy: 0.80532287864759
Energy: 0.6171796962028009
Energy: 0.7015812946030693
Energy: 0.7009211561295481
Energy: 0.6306129938986501
Energy: 0.694002290434116
Energy: 0.6792867668885355
Energy: 0.7092868778288005
Energy: 0.6625720681957944
Energy: 0.6878185124658504
Energy: 0.6852045480234813
Energy: 0.7053473391926974
Energy: 0.7236672855692671
Energy: 0.9395263427794741
Energy: 0.543934503189
Energy: 0.739328291628314
Energy: 0.9518573069125125
Energy: 0.5453148352663317
Energy: 0.7665223913296628
Energy: 0.8599292117639018
Energy: 0.8644985472899658
Energy: 0.8545278600839115
Energy: 0.806643052541491
Energy: 0.8603882980715244
Energy: 0.8915546966562037
Energy: 0.8332539461541576
Energy: 0.6832616214563143
Energy: 0.6285517075900154
Energy: 0.8161966657670571
Energy: 0.821234738868049
Energy: 0.8685954174040751
Energy: 0.7759562649981557
Energy: 0.9403739436972824
Energy: 0.7984038169686681
Energy: 0.770658601745054
Energy: 0.9004927826700186
Energy: 0.8376282494098277
Energy: 0.6688386378390849
Energy: 0.8169353899668806
Energy: 0.7974234040112346
Energy: 0.693730179446244
Energy: 0.7384885054806025
Energy: 0.7060134393279938
Energy: 0.8574838496238439
Energy: 0.8473099620023005
Energy: 0.7792653985293738
Energy: 0.9055335503839413
Energy: 0.8715636637883017
Energy: 0.7714439551847289
Energy: 0.894143599204134
Energy: 0.7509048699288021
Energy: 0.8230465925184971
Energy: 0.8657202223501689
Energy: 0.6802403904452577
Energy: 0.8456552944549504
Energy: 0.668253371964117
Energy: 0.6395217687302944
Energy: 0.5988758041201787
Energy: 0.690879604751048
Energy: 0.6438529330238153
Energy: 0.5896267683909877
Energy: 0.6648982563752279
Energy: 0.7290626279240225
Energy: 0.7340528020561782
Energy: 0.6994522747187166
Energy: 0.7043854986941688
Energy: 0.7647097242413519
Energy: 0.5301368258553941
Energy: 0.8235072285123284
Energy: 0.7070170052881785
Energy: 0.5313688370644208
Energy: 0.8856545927217645
Energy: 0.536599920760973
Energy: 0.6679966400123633
Energy: 0.7946258484162478
Energy: 0.8117312007506998
Energy: 0.6484098282137332
Energy: 0.7399945525795422
Energy: 0.7600202037391882
Energy: 0.7627525946789774
Energy: 0.7629287292085067
Energy: 0.7426144257365058
Energy: 0.7867618930900825
Energy: 0.7193110579502034
Energy: 0.5732800294266979
Energy: 0.9830282312200824
Energy: 0.7779607148478835
Energy: 0.7533150912339508
Energy: 0.8405970330932999
Energy: 0.6814343479670117
Energy: 0.8306755769834113
Energy: 0.9366472324634055
Energy: 0.769498228200818
Energy: 0.8154062725105986
Energy: 0.8551636038655259
Energy: 0.7379724868017855
Energy: 0.810305784303575
Energy: 0.7406432963053478
Energy: 0.9726926300381644
Energy: 0.9144212701250084
Energy: 0.6579679095886288
Energy: 0.8542101881770348
Energy: 0.6712518321231976
Energy: 0.8207010701521572
Energy: 0.8755860432050805
Energy: 0.879444727916225
Energy: 0.7424140933580868
Energy: 0.8132316298578205
Energy: 0.8455666684502178
Energy: 0.6694618544242329
Energy: 0.7515935560948572
Energy: 0.8137463640849162
Energy: 0.672389907421713
Energy: 0.8736117955168381
Energy: 0.7043037977025607
Energy: 0.8146352956227333
Energy: 0.7846311976492397
Energy: 0.8221525003962192
Energy: 0.7316490104117951
Energy: 0.7917563883432945
Energy: 0.8018857452639432
Energy: 0.8316651444115205
Energy: 0.6204425823073598
Energy: 0.6650870900685911
Energy: 0.7781508194336032
Energy: 0.5392756115372764
Energy: 0.718948888649632
Energy: 0.7652446747079044
Energy: 0.6420161586016285
Energy: 0.7035241194112638
Energy: 0.7621722639727377
Energy: 0.6336615214161789
Energy: 0.7326248704209183
Energy: 0.7154704607712025
Energy: 0.7283535409047025
Energy: 0.7516042172235025
Energy: 0.6974625342324082
Energy: 0.7135902628305741
Energy: 0.7010925029967388
Energy: 0.5909365228545549
Energy: 0.9014719024374256
Energy: 0.7965889647131599
Energy: 0.614811956478778
Energy: 0.817231100221144
Energy: 0.8156986628004965
Energy: 0.805330058208237
Energy: 0.8398384960197197
Energy: 0.8822834034600652
Energy: 0.8237858040601883
Energy: 0.7666362625587694
Energy: 0.831319237832743
Energy: 0.8612676557919425
Energy: 0.7603091184020855
Energy: 0.7336923495552778
Energy: 0.8528341732581664
Energy: 0.8176100146067065
Energy: 0.5593587164986241
Energy: 1.0469400843026306
Energy: 0.7553054654819642
Energy: 0.8278308988397481
Energy: 0.9745970645222759
Energy: 0.894321500454914
Energy: 0.9784040922511714

minimum gb energy = 0.5301368258553941 eV
minimum distance =  1.8488074835082 Angstroms
sigma value = 57


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

Energy: 0.8696271747492139
Energy: 1.0314692526584295
Energy: 0.9344474171774472
Energy: 0.5513893894876857
Energy: 0.9377754638863315
Energy: 0.93213809671183
Energy: 0.9902441858001242
Energy: 0.6170144085879616
Energy: 0.65125435637601
Energy: 0.9665819005045142
Energy: 0.7137225889931079
Energy: 0.6753264106015721
Energy: 0.810188315558307
Energy: 0.7544738128571468
Energy: 0.7373452182023739
Energy: 0.8013674580748932
Energy: 0.7420106982153876
Energy: 0.7521367985743279
Energy: 0.7389372193571726
Energy: 0.7340993813772693
Energy: 0.746028526062376
Energy: 0.686202379990551
Energy: 0.7408825000224604
Energy: 0.8464375300705499
Energy: 0.673125287438008
Energy: 0.7554854232909081
Energy: 0.7356975565942817
Energy: 0.6592919531708945
Energy: 0.7243482630533317
Energy: 0.7903132752445052
Energy: 0.7305278377781731
Energy: 0.7560935894772031
Energy: 0.7501510623667367
Energy: 0.7484159547647408
Energy: 0.722709826252349
Energy: 0.7130485764416781
Energy: 0.949618828216872
Energy: 0.6215343478918629
Energy: 0.6604634651445723
Energy: 0.9102305132958336
Energy: 0.6210795036985209
Energy: 0.7813727705943087
Energy: 0.7834327396103825
Energy: 0.8448967289536552
Energy: 0.8387268209557975
Energy: 0.6430303676666681
Energy: 0.8292361836909273
Energy: 0.8760873067920172
Energy: 0.8740188068667349
Energy: 0.6800481589124857
Energy: 0.7467660586435032
Energy: 0.8751498245869995
Energy: 0.839110836098001
Energy: 0.6949329579676904
Energy: 0.7719725572467915
Energy: 0.8143748183004854
Energy: 0.8724500368277176
Energy: 0.7490698314066734
Energy: 0.8078628110358579
Energy: 0.7827780659602284
Energy: 0.7815847148369517
Energy: 0.7945897305461599
Energy: 0.8138519571145941
Energy: 0.8779464574781293
Energy: 0.8307150367598117
Energy: 0.7906254781165756
Energy: 0.962853233342249
Energy: 0.9219755019224878
Energy: 0.9267697621977433
Energy: 0.9287952834445089
Energy: 0.9289691510553637
Energy: 0.7868963700815695
Energy: 0.9798283604197555
Energy: 0.9115131630899458
Energy: 0.7553485562095775
Energy: 0.8787815490985503
Energy: 0.9269766122857925
Energy: 0.902187619840467
Energy: 0.7552250689073661
Energy: 0.7830648480369224
Energy: 0.6986803356771731
Energy: 0.7297296033050434
Energy: 0.7668207355309833
Energy: 0.7814679001859052
Energy: 0.8368930280008452
Energy: 0.7783772142325899
Energy: 0.751967959307909
Energy: 0.8184580520896783
Energy: 0.7395060755595784
Energy: 0.7627686444360786
Energy: 0.634158858551453
Energy: 0.8185354885421143
Energy: 0.7747185392770272
Energy: 0.6123781145530864
Energy: 0.8368061684925715
Energy: 0.6532975561081805
Energy: 0.7048299564006955
Energy: 0.7643843529893953
Energy: 0.7303573593564461
Energy: 0.7118245034787439
Energy: 0.7333466244997286
Energy: 0.7662218638610658
Energy: 0.759942856359415
Energy: 0.6923858359472103
Energy: 0.6945120356412157
Energy: 0.724633966575446
Energy: 0.6532453677638
Energy: 0.6954605732499746
Energy: 0.9042270930184343
Energy: 0.754708347663575
Energy: 0.7535695758504136
Energy: 0.8290908648191798
Energy: 0.6730890018481961
Energy: 0.7831256728865728
Energy: 0.8881828601869275
Energy: 0.8485538234155005
Energy: 0.8326501265133359
Energy: 0.8045659806697442
Energy: 0.8131284891556728
Energy: 0.8589977933920357
Energy: 0.6803301348746326
Energy: 0.9073384318263178
Energy: 0.7705809254337201
Energy: 0.8665114149490016
Energy: 0.9225329496590395
Energy: 0.8009488666201775
Energy: 1.0888407954679455
Energy: 0.8668277446983692
Energy: 0.8787652586583479
Energy: 0.9909494446377545
Energy: 0.8830256357243927
Energy: 0.8299094597652361
Energy: 0.95799977450529
Energy: 0.9153864233966345
Energy: 0.8370334979706588
Energy: 0.7298422614119121
Energy: 0.8486471751530673
Energy: 0.8201637833006
Energy: 1.0725052705194258
Energy: 0.8205274911824352
Energy: 0.7607383986530646
Energy: 0.9202739726297623
Energy: 0.8073177215783623
Energy: 0.8936155562476165

minimum gb energy = 0.5513893894876857 eV
minimum distance =  1.84897429715241 Angstroms
sigma value = 17


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

Energy: 0.9259641164584987
Energy: 1.0461027459745698
Energy: 0.9985830608586134
Energy: 0.9035035071545569
Energy: 0.9279945599785775
Energy: 0.7049941635168034
Energy: 0.8420620854914527
Energy: 0.6803981929974116
Energy: 0.6863288291121851
Energy: 0.7805384125679868
Energy: 0.7483778177757066
Energy: 0.756103409862215
Energy: 0.7247260168395293
Energy: 0.7212359856000745
Energy: 0.7360282325829804
Energy: 0.7725143285184085
Energy: 0.7338044867308826
Energy: 0.690395683395086
Energy: 0.5825373866355148
Energy: 0.77176633494837
Energy: 0.7097968807116563
Energy: 0.649833597784495
Energy: 0.763170965032724
Energy: 0.720119421639809
Energy: 0.7347710400050805
Energy: 0.6923428156043901
Energy: 0.6476171753398262
Energy: 0.744038655233103
Energy: 0.7610346422856166
Energy: 0.6730131597908621
Energy: 0.7353544614057965
Energy: 0.6589216485324865
Energy: 0.7409346715325394
Energy: 0.7262775592360757
Energy: 0.5108013990682606
Energy: 0.6576495669267364
Energy: 0.8304919020337123
Energy: 0.5116455559794254
Energy: 0.5107745726471362
Energy: 0.7348539137205766
Energy: 0.5116596003714845
Energy: 0.8207236296397159
Energy: 0.7493549474883366
Energy: 0.6919139736912313
Energy: 0.660386742506667
Energy: 0.6859674557300337
Energy: 0.7246068011960071
Energy: 0.6592194005261384
Energy: 0.5134658670279372
Energy: 0.7833221117570816
Energy: 0.6382047887014293
Energy: 0.5141032904030721
Energy: 0.7559306678006888
Energy: 0.6679356335247262
Energy: 0.6353653438745397
Energy: 0.8112196487931342
Energy: 0.6803303648049858
Energy: 0.6917423071923874
Energy: 0.8115513797996234
Energy: 0.7326773947029124
Energy: 0.7206331751909588
Energy: 0.7380266506252114
Energy: 0.7300352655523299
Energy: 0.7044418226861616
Energy: 0.7425487559883751
Energy: 0.6574561452730057
Energy: 0.743796192891887
Energy: 0.6899319782105207
Energy: 0.6836906716102589
Energy: 0.7830842218934209
Energy: 0.5826911472158389
Energy: 0.8700124397801513
Energy: 0.769155364019728
Energy: 0.7873544701793966
Energy: 0.9054072385657318
Energy: 0.7550982020143914
Energy: 0.7829448861264326
Energy: 0.7899551205340761
Energy: 0.7401048682812064
Energy: 0.8944759787586875
Energy: 0.9492432600975143
Energy: 0.837728073128601
Energy: 0.89592004157863
Energy: 0.7249154354484475
Energy: 0.698747292749605
Energy: 0.9893700849827548
Energy: 0.8243200132863997
Energy: 1.1422023066952602
Energy: 0.9167737499504883
Energy: 0.8662191687562141
Energy: 0.7344376892072165
Energy: 0.8572831007591096
Energy: 0.7694103076246249
Energy: 0.7453525466572011
Energy: 0.7391039222655359
Energy: 0.7676849373391131
Energy: 0.7777603912052172
Energy: 0.7713139034136198
Energy: 0.7595537310523549
Energy: 0.7925033440895515
Energy: 0.7439714158735887
Energy: 0.7629642007755357

minimum gb energy = 0.5107745726471362 eV
minimum distance =  1.85523967935402 Angstroms
sigma value = 17


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

Energy: 0.9800903345168345
Energy: 1.0218438103792344
Energy: 0.8257221314252519
Energy: 0.8607382041645422
Energy: 1.0756157860271378
Energy: 0.8347913625025654
Energy: 0.7632192213297003
Energy: 0.5661404741845522
Energy: 0.66825340726233
Energy: 0.6879440036820269
Energy: 0.6630547286864696
Energy: 1.1204269542424112
Energy: 0.6762049677662797
Energy: 0.6478802623408039
Energy: 0.6951623506061205
Energy: 0.7645436723476311
Energy: 0.6799850277029384
Energy: 0.6687663119753979
Energy: 0.5635373379428119
Energy: 0.7953511397342033
Energy: 0.8117528819032662
Energy: 0.6259873124732825
Energy: 0.7008724819029245
Energy: 0.7402703667745371
Energy: 0.6778434164261924
Energy: 0.644343735869621
Energy: 0.7795280488355252
Energy: 0.6558556036306684
Energy: 0.6968549696587144
Energy: 0.7544715175028583
Energy: 0.840275440488272
Energy: 0.6292486381536686
Energy: 0.6586960695138323
Energy: 0.7902618293261379
Energy: 0.7135327337505663
Energy: 0.7639862972446966
Energy: 0.7251477225329083
Energy: 0.4930318278080494
Energy: 0.5716540040476823
Energy: 0.6908130597844433
Energy: 0.5757282671282811
Energy: 0.6329165926222574
Energy: 0.6724807348274072
Energy: 0.6419434448179075
Energy: 0.6374286003347869
Energy: 0.6215147650073999
Energy: 0.640903839224575
Energy: 0.6806679369794475
Energy: 0.4747729359232794
Energy: 0.6801557792140305
Energy: 0.6346945862206517
Energy: 0.4754694151877696
Energy: 0.7352047032112821
Energy: 0.5482542626994139
Energy: 0.60598495102828
Energy: 0.6506381250396521
Energy: 0.6234022405423412
Energy: 0.6426426620752166
Energy: 0.6650505999312609
Energy: 0.6299758287418831
Energy: 0.7345217856981122
Energy: 0.715308075487705
Energy: 0.6554458597862387
Energy: 0.6705159819074938
Energy: 0.6579508215198725
Energy: 0.5991105055671498
Energy: 0.7984451361000456
Energy: 0.5790484303437526
Energy: 0.5948012912934717
Energy: 0.7682309748631049
Energy: 0.4749290164123366
Energy: 0.6250303881846525
Energy: 0.7794823224967898
Energy: 0.603402870653514
Energy: 0.6130809239051317
Energy: 0.7421221297647669
Energy: 0.6372051015416231
Energy: 0.6671021299920198
Energy: 0.49305781038190055
Energy: 0.7110825066789431
Energy: 0.6187329399588224
Energy: 0.4941483389021996
Energy: 0.6831308324949708
Energy: 0.5533742695167385
Energy: 0.6151112951739992
Energy: 0.6807430510368558
Energy: 0.6341811662897087
Energy: 0.6380052867114083
Energy: 0.646562023047757
Energy: 0.7744915735826922
Energy: 0.6503694917604669
Energy: 0.6774280967997754
Energy: 0.6691524639612806
Energy: 0.6399683217445747
Energy: 0.6781260109344736
Energy: 0.6985744116260251
Energy: 0.8429585825620393
Energy: 0.7584597277089316
Energy: 0.8101826703876324
Energy: 0.8637029027709594
Energy: 0.5606985425783798
Energy: 0.6248551232997521
Energy: 0.8039848913194719
Energy: 0.7197574456036278
Energy: 0.6973875772458586
Energy: 0.8159113378581263
Energy: 0.6792545916815735
Energy: 0.6770785465282342
Energy: 0.6833498953802349
Energy: 0.8647709754788626
Energy: 0.7489331310831128
Energy: 0.74430739518738
Energy: 0.714888466902241
Energy: 0.9026806077708213
Energy: 0.78249553121665
Energy: 0.7376394214495466
Energy: 0.6905287224813651
Energy: 0.7026764185761868
Energy: 0.8294315091256804
Energy: 0.814238807678664
Energy: 0.6943977043613665
Energy: 0.7668400758794309
Energy: 0.849573511128981
Energy: 0.7011233633081435
Energy: 0.8055683223491383
Energy: 0.7225487737477168
Energy: 0.9230684625298817
Energy: 0.8447104351724819
Energy: 0.7043896594144308
Energy: 0.8044677823909713
Energy: 0.8350057497473027
Energy: 0.7116860467316254
Energy: 0.7802020343707322
Energy: 0.7999348091891064
Energy: 0.8069798064758774
Energy: 0.6875220506015839
Energy: 0.5642800477823156
Energy: 0.6964469372598311
Energy: 0.8113727664036605
Energy: 0.8149338015408564
Energy: 0.9458437748771589
Energy: 0.6931742759497078
Energy: 0.8280051014230664
Energy: 0.8213011095508491
Energy: 0.5600624188949764
Energy: 0.7336023165182406
Energy: 0.763336541935249
Energy: 0.5600545594612159
Energy: 0.6587060135470654
Energy: 0.710569914037903
Energy: 0.673841759700213
Energy: 0.5398670336306415
Energy: 0.7915426403244874
Energy: 0.6828627839837051
Energy: 0.783821218814604
Energy: 0.6684330558437784
Energy: 0.8386441905364618
Energy: 0.6323327981299783
Energy: 0.6605622256025601
Energy: 0.7559438924208768
Energy: 1.0140139642507757
Energy: 0.7006963388390514
Energy: 0.6900769835694396
Energy: 0.5650552162482306
Energy: 0.5920609587172192
Energy: 0.6733049447809015
Energy: 0.49519295874218267
Energy: 0.5921534481497641
Energy: 0.6628036673720752
Energy: 0.7380980877930715
Energy: 0.7080234787129905
Energy: 0.6575600717067323
Energy: 0.7615348141025345
Energy: 0.661807195745993
Energy: 0.47215437213346584
Energy: 0.6141120500949154
Energy: 0.655009541527217
Energy: 0.4723059772436751
Energy: 0.6513448267432985
Energy: 0.6667586154300779
Energy: 0.4749342054138252
Energy: 0.6297959101755604
Energy: 0.6329727562741767
Energy: 0.47235531814059983
Energy: 0.6623890897805771
Energy: 0.5400672213738757
Energy: 0.7336255289867882
Energy: 0.6454256677816983
Energy: 0.5960378662750291
Energy: 0.6755378472904978
Energy: 0.6401364065281904
Energy: 0.6709156083875065
Energy: 0.7388358827816678
Energy: 0.47400633161603734
Energy: 0.5203717415563065
Energy: 0.7062710093639355
Energy: 0.47450108920319944
Energy: 0.47235992944278304
Energy: 0.8224725106436993
Energy: 0.6803121351083203
Energy: 0.6432377906535266
Energy: 0.7410434523112105
Energy: 0.6421215291925997
Energy: 0.7201468839305306
Energy: 0.6331756176217886
Energy: 0.6066690872079644
Energy: 0.5932767470595026
Energy: 0.6622932649625594
Energy: 0.6473979456392096
Energy: 0.6298481203399577
Energy: 0.49275198329661446
Energy: 0.6468171272133835
Energy: 0.9576228108190884
Energy: 0.4929195805969153
Energy: 0.7763739593403554
Energy: 0.7279740166628378
Energy: 0.644346630424216
Energy: 0.7700945252483904
Energy: 0.7779592650382335
Energy: 0.653075643824415
Energy: 0.8107285816337578
Energy: 0.7850735299115935
Energy: 0.7223363136225298
Energy: 0.693887964793207
Energy: 0.691927520797006
Energy: 0.7207697147018282
Energy: 0.5614148875859855
Energy: 0.6984087605256827
Energy: 0.8451143262427419
Energy: 1.1171180566307177
Energy: 0.6334945897197348
Energy: 0.8031531789829213
Energy: 0.875947573615954
Energy: 0.7952917925085039
Energy: 0.7122197367675689
Energy: 0.7966098971531942
Energy: 0.683012191574234
Energy: 0.7027281628887819
Energy: 0.7903065665342741
Energy: 0.7926405149987479
Energy: 0.6520889842010913
Energy: 0.7064094751019439
Energy: 0.8669587812572342
Energy: 0.6952347113616396
Energy: 0.6863276909221326
Energy: 0.7908477696093673
Energy: 0.7126512399712088
Energy: 0.8001540762100248
Energy: 0.8796468160678153
Energy: 0.6857263994001059
Energy: 0.9137930495946475
Energy: 0.7124711049078426
Energy: 0.7315315884042365
Energy: 1.4236985698935078
Energy: 0.7087317266291928
Energy: 0.7388891000106765
Energy: 0.6745837487313804
Energy: 0.6666774866576083

minimum gb energy = 0.47215437213346584 eV
minimum distance =  1.8851653629103 Angstroms
sigma value = 57


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

Energy: 0.7913375889110018
Energy: 1.074811326843463
Energy: 0.7952444481213897
Energy: 0.8339152651059134
Energy: 0.8960873775332834
Energy: 0.8157984269993444
Energy: 1.488586682846308
Energy: 0.6965651062846592
Energy: 0.7146755988204454
Energy: 0.8438526145666877
Energy: 0.6436484412279321
Energy: 0.66070961442925
Energy: 0.633191692806438
Energy: 0.6636061836747048
Energy: 0.6708219093157645
Energy: 0.633477888021981
Energy: 0.7135071492644163
Energy: 0.6943243157089947
Energy: 0.5398159047296296
Energy: 0.6473985269220393
Energy: 0.7090249840780356
Energy: 0.5959904991210657
Energy: 0.8094194312835604
Energy: 0.6274094275297747
Energy: 0.6846085431690662
Energy: 0.6133163773843557
Energy: 0.8728869782844564
Energy: 0.6235378807403921
Energy: 0.5708043861022298
Energy: 0.6112328594376966
Energy: 0.8416705418842868
Energy: 0.7968486454047313
Energy: 0.707255622328763
Energy: 0.7615220688506219
Energy: 0.5926863008532091
Energy: 0.691705206617175
Energy: 0.7271950218375145
Energy: 0.5489432556533105
Energy: 0.5501825614683703
Energy: 0.6778898434916198
Energy: 0.4769203261132961
Energy: 0.6258582185995626
Energy: 0.6157005273743955
Energy: 0.6608869171553313
Energy: 0.6760343789499379
Energy: 0.5876031008175603
Energy: 0.6590463407942014
Energy: 1.061944184924601
Energy: 0.4502085200762868
Energy: 0.654089300446342
Energy: 0.5974761130207599
Energy: 0.45116208734817664
Energy: 0.7248108666852102
Energy: 0.5825867854711864
Energy: 0.6434197529648296
Energy: 0.5923533880551016
Energy: 0.5953814546025171
Energy: 0.5840684460526213
Energy: 0.6056515216598848
Energy: 0.6379988483970838
Energy: 0.7412513116701761
Energy: 0.5966785446291429
Energy: 0.6002384745323134
Energy: 0.671305941001169
Energy: 0.5178622125597006
Energy: 0.6095041065998837
Energy: 0.623628507071313
Energy: 0.443425278249974
Energy: 0.43753070346170636
Energy: 0.6564999999763464
Energy: 0.5000428367884342
Energy: 0.5738477388290232
Energy: 0.6771061702035271
Energy: 0.6148153420201715
Energy: 0.6051967197688726
Energy: 0.7039858661933958
Energy: 0.6585595270480487
Energy: 0.6006758444093071
Energy: 0.43746202020488545
Energy: 0.683907479875713
Energy: 0.5635530173008905
Energy: 0.4382829710986841
Energy: 0.6340385756451861
Energy: 0.5076486873730013
Energy: 0.5537864213475212
Energy: 0.6827157469727343
Energy: 0.7159772295975854
Energy: 0.6866510602561741
Energy: 0.7603273545657239
Energy: 0.6534820116349178
Energy: 0.6603141430150365
Energy: 0.5585560773079122
Energy: 0.6154223035049478
Energy: 0.6160883631954717
Energy: 0.580825373572249
Energy: 0.5687321948147872
Energy: 0.6903178481277699
Energy: 0.5584601719170043
Energy: 0.6361683229920821
Energy: 0.6284235405979786
Energy: 0.4551451623966923
Energy: 0.5864909210807938
Energy: 0.7886515263812387
Energy: 0.6072692663201655
Energy: 0.6741041615462781
Energy: 0.7426674308551403
Energy: 0.5972179791812837
Energy: 0.6886392945511693
Energy: 0.4734325056370863
Energy: 0.7290181105545992
Energy: 0.6779109455963273
Energy: 0.4744154790672521
Energy: 0.6504190017507508
Energy: 0.5810951631618363
Energy: 0.6138014441289902
Energy: 0.7147983354978654
Energy: 0.6538845909499261
Energy: 0.7869607871587564
Energy: 0.73145115101575
Energy: 0.7403821220039415
Energy: 0.8122613340086304
Energy: 0.7579753455444337
Energy: 0.8070725802619719
Energy: 0.6991025379767147
Energy: 0.6591129721454527
Energy: 0.6692292918458279
Energy: 0.7287237005956555
Energy: 0.8031625831917675
Energy: 0.5655389518334657
Energy: 0.8337946738181087
Energy: 0.7767802629695525
Energy: 0.7104417664326549
Energy: 0.7484775411177695
Energy: 0.8402367697037935
Energy: 0.7108256629391825
Energy: 0.7665387389490025
Energy: 0.7203758904582817
Energy: 0.9621249746049797
Energy: 0.6648881609863944
Energy: 0.8948789520216773
Energy: 0.7772182171799579
Energy: 0.6478296610627956
Energy: 0.650091676992272
Energy: 0.7398077831882297
Energy: 0.6562007170784435
Energy: 0.7543948793521069
Energy: 0.7189907519677377
Energy: 0.7779751476922797
Energy: 0.7337635028614322
Energy: 0.8048668368025113
Energy: 0.8176532680598084
Energy: 0.7055442830558906
Energy: 0.7113432584879945
Energy: 0.838933835752463
Energy: 1.4714128500038273
Energy: 0.7513039974907196
Energy: 1.0600687502108834
Energy: 0.8467078677701375
Energy: 0.6633416431629219
Energy: 0.8252373643376758
Energy: 0.6497298110492451
Energy: 0.6943634957084478

minimum gb energy = 0.43746202020488545 eV
minimum distance =  1.80639317357817 Angstroms
sigma value = 43


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

Energy: 0.9473932384541077
Energy: 1.4634099258175135
Energy: 0.785204234263201
Energy: 0.759105148055174
Energy: 0.9162908429154294
Energy: 0.7794111163961962
Energy: 0.8059959153230155
Energy: 1.0473042663429322
Energy: 0.6612225243778496
Energy: 0.571768118990761
Energy: 0.5820588589870358
Energy: 0.6705742964760747
Energy: 0.5461931572472729
Energy: 0.6459122615290156
Energy: 0.6332107594787235
Energy: 0.5392306204642195
Energy: 0.7565588420878453
Energy: 0.626922964630052
Energy: 0.4755364543276211
Energy: 0.8375149811046926
Energy: 0.6971799424738202
Energy: 0.6180733608292738
Energy: 0.5907026658204965
Energy: 0.6473913484481577
Energy: 0.6311619543076984
Energy: 0.9305953709964431
Energy: 0.5843096992973158
Energy: 0.7336279296760555
Energy: 0.5640678372145489
Energy: 0.60804195184062
Energy: 0.6285414038039875
Energy: 0.7045415937812368
Energy: 0.5920982747851309
Energy: 0.5182808633757178
Energy: 0.561766627914615
Energy: 0.654155885001277
Energy: 0.8424150263970017
Energy: 0.5154272920939668
Energy: 0.5166570672810803
Energy: 0.6753458134803557
Energy: 0.4905479989192591
Energy: 0.5468832114874431
Energy: 0.5280461016484618
Energy: 0.5188852141249914
Energy: 0.7874543989327055
Energy: 0.6070682834308934
Energy: 0.6817638069185646
Energy: 1.0459275878696104
Energy: 0.4045048418932132
Energy: 0.6146004202482105
Energy: 0.553375342552658
Energy: 0.4057127090156085
Energy: 0.6527950600217793
Energy: 0.559080995982665
Energy: 0.5273503307753779
Energy: 0.5877988532497319
Energy: 0.5523343388249679
Energy: 0.664561185505335
Energy: 0.5374325098875062
Energy: 0.6514740162716457
Energy: 0.5735049742948111
Energy: 0.5255785639258097
Energy: 0.7807807528785409
Energy: 0.600255643169217
Energy: 0.47579540845641927
Energy: 0.6114997471918022
Energy: 0.5639613654340406
Energy: 0.42966246596967034
Energy: 0.4807737270409914
Energy: 0.5531187259791287
Energy: 0.38592274001501053
Energy: 0.49456191171012315
Energy: 0.5156140795080343
Energy: 0.5256059214954777
Energy: 0.5602222828785856
Energy: 0.569636731479627
Energy: 0.6646552281777386
Energy: 0.5467454408373892
Energy: 0.3758613822355652
Energy: 0.6420755562641967
Energy: 0.5781620402395231
Energy: 0.3771646939381549
Energy: 0.630094747936636
Energy: 0.41444762650343653
Energy: 0.6093985351518134
Energy: 0.5692497001769143
Energy: 0.4863878086801656
Energy: 0.5616444803688883
Energy: 0.5657800736602511
Energy: 0.5562820970987931
Energy: 0.8495099715794107
Energy: 0.5077584106346222
Energy: 0.548108339980731
Energy: 0.5240165663679828
Energy: 0.37037079002730144
Energy: 0.5086785999149499
Energy: 0.6009518979581959
Energy: 0.3702990716246026
Energy: 0.46331660289867554
Energy: 0.6168716639716301
Energy: 0.44266423904514024
Energy: 0.4980194338404862
Energy: 0.5773970830445406
Energy: 0.587239524580245
Energy: 0.5108436018894682
Energy: 0.5684294745857961
Energy: 0.5694630066501783
Energy: 0.517821692221175
Energy: 0.37027221288393775
Energy: 0.5378730753211901
Energy: 0.5426927169012677
Energy: 0.37153690785383314
Energy: 0.5242500852369105
Energy: 0.4405540428975806
Energy: 0.5785890846141198
Energy: 0.5212356676276494
Energy: 0.524051753912077
Energy: 0.5372151855294236
Energy: 0.6265129891313498
Energy: 0.5575061129869526
Energy: 0.5505545272278708
Energy: 0.47700900718479317
Energy: 0.429988946252363
Energy: 0.562213449400459
Energy: 0.3753209074104693
Energy: 0.49133824467092474
Energy: 0.6669240478094768
Energy: 0.5080185590083067
Energy: 0.6145862988217813
Energy: 0.6446618237734227
Energy: 0.3754971970345536
Energy: 0.5309551003207112
Energy: 0.6886747520497022
Energy: 0.5166149713396379
Energy: 0.5904154101156999
Energy: 0.6012229892824392
Energy: 0.5229408497908851
Energy: 0.5392564481331765
Energy: 0.3863992896541376
Energy: 0.5819816530941858
Energy: 0.5491583875979
Energy: 0.3877427673534315
Energy: 0.7676080418904084
Energy: 0.49411519803255094
Energy: 0.5219566320249982
Energy: 0.5566479607535638
Energy: 0.5334190654986762
Energy: 0.8308508249328906
Energy: 1.0067021770876015
Energy: 0.5919872937218962
Energy: 0.5861132017524728
Energy: 0.4952683008863311
Energy: 0.47604248664743254
Energy: 0.545324026405962
Energy: 0.5109493105089139
Energy: 0.512789892740159
Energy: 0.6394751946609746
Energy: 0.6228971397893397
Energy: 0.5529873620877651
Energy: 0.5952283734019982
Energy: 0.5178182211795437
Energy: 0.6247017287903454
Energy: 0.6136387034752617
Energy: 0.8638243580277188
Energy: 1.02906532456161
Energy: 0.6943029090287721
Energy: 0.5019081047995867
Energy: 1.2041215998504307
Energy: 0.4282375152543244
Energy: 0.90109208636665
Energy: 0.64466670646391
Energy: 0.4295387624632548
Energy: 0.6624080989351644
Energy: 0.5160458620877669
Energy: 0.5308515055865056
Energy: 0.5648264896908541
Energy: 0.6286086467896046
Energy: 0.8357961088299183
Energy: 0.6461316502783288
Energy: 0.6338254781262362
Energy: 0.7075641804235137
Energy: 0.5430875330045538
Energy: 1.1056568506553683
Energy: 0.6404980504661747
Energy: 0.5341123119746198
Energy: 0.5731853818583778
Energy: 0.6494923326772376
Energy: 0.627016842351309
Energy: 0.6041312661910501
Energy: 0.5613562078174915
Energy: 0.4741604879347357
Energy: 0.7071335595751524
Energy: 0.6922036696781542
Energy: 0.592396303070176
Energy: 0.6218010662368599
Energy: 0.8095727529660152
Energy: 0.7770428196041422
Energy: 1.0553877898155601
Energy: 0.5428441544172836
Energy: 0.6545477729770759
Energy: 0.6805682162294707
Energy: 0.6504563398723685
Energy: 0.5936625899096412
Energy: 0.7271629065127619
Energy: 0.5557222011749756
Energy: 0.7482129982672691
Energy: 0.6225143459580731
Energy: 0.7119902876688639
Energy: 0.7087248837383991
Energy: 0.7224680379931466
Energy: 0.8049518918007034
Energy: 0.6541515683132205
Energy: 0.7173865677392549
Energy: 1.4367797620447096
Energy: 0.5800630406552372
Energy: 0.6723160722033884

minimum gb energy = 0.37027221288393775 eV
minimum distance =  1.7903423510546 Angstroms
sigma value = 81


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

Energy: 0.08050163478502853
Energy: 0.8350229626602004
Energy: 0.0810565696705247
Energy: 0.08206041205915393
Energy: 0.10850701601356516
Energy: 0.0808400606022374
Energy: 0.10992541320831016
Energy: 0.5427104596641339
Energy: 0.08111218264911432
Energy: 0.5483538450205063
Energy: 0.08359871086821544
Energy: 0.5627027708558593
Energy: 0.7350596707965436
Energy: 0.08065615774650452
Energy: 0.08080756634125381
Energy: 0.540118591069446
Energy: 0.08057423857114328
Energy: 0.10928840956279287
Energy: 0.7478168169230992
Energy: 0.08082457883350581
Energy: 0.08103675800137199
Energy: 0.4671889815826233
Energy: 0.08065640681983392
Energy: 0.1099188949512023
Energy: 0.10927049009520036
Energy: 0.5716361042653346
Energy: 1.32074923751031
Energy: 0.11031086412801511
Energy: 0.1088149115662691
Energy: 0.5263044647780801
Energy: 0.08143783404564646
Energy: 0.11242916820363455
Energy: 0.08110324893461975
Energy: 0.08273609310035704
Energy: 0.5193269960061054
Energy: 0.08085460349297352
Energy: 0.11097414406052712
Energy: 0.08072705275710802
Energy: 0.48281523733526527
Energy: 0.11154267455026859
Energy: 0.4651311274429547
Energy: 0.08095108058892424
Energy: 0.11110406070684263
Energy: 0.080582013394375
Energy: 0.08079476411996446
Energy: 0.6242649561548661
Energy: 0.08087929311357678
Energy: 0.10957922349931899
Energy: 1.1236581431348691
Energy: 0.08076147365625642
Energy: 0.1109039302949463
Energy: 0.08295261856987365
Energy: 0.08089148827902376
Energy: 0.1111773847442724
Energy: 0.08091496744162158
Energy: 0.10865942710099386
Energy: 0.5089820214180661
Energy: 0.08080190700022793
Energy: 0.530289703336123
Energy: 0.592977630493815

minimum gb energy = 0.08050163478502853 eV
minimum distance =  1.87113764096145 Angstroms
sigma value = 3


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

Energy: 0.8834847578074022
Energy: 0.8128942853985293
Energy: 0.7001541498085986
Energy: 0.5941603376641007
Energy: 0.8210301229635404
Energy: 0.6449507677545185
Energy: 0.650366960376334
Energy: 0.5852029214615385
Energy: 0.7291475551637463
Energy: 0.5580996929150369
Energy: 0.5234762451021384
Energy: 0.7115311533751657
Energy: 0.5192924316227719
Energy: 0.5636832833714838
Energy: 0.5896636515116478
Energy: 0.7063522838941032
Energy: 0.616955817624783
Energy: 0.580284946521344
Energy: 0.47301735819544155
Energy: 0.7549155076851978
Energy: 0.5295283160746753
Energy: 0.6577944766423486
Energy: 0.6024578498221407
Energy: 0.5424045154227946
Energy: 0.5977486233285854
Energy: 0.5019754548053093
Energy: 0.6432410634465785
Energy: 0.5887506585332128
Energy: 0.6229380854713777
Energy: 0.740637570831373
Energy: 0.6711511708544142
Energy: 0.696130876550612
Energy: 0.5747327626634817
Energy: 0.5874002767369753
Energy: 0.7075047425387113
Energy: 0.5345128161177816
Energy: 0.6024523412407891
Energy: 0.4796891385701658
Energy: 0.4718292654674054
Energy: 0.7262676371624094
Energy: 0.44959240592524297
Energy: 0.647348448012035
Energy: 0.4867576534817026
Energy: 0.592405107192045
Energy: 0.5538112124523666
Energy: 0.5698121134330356
Energy: 0.5373260132764305
Energy: 0.5244614789186964
Energy: 0.5663799881088057
Energy: 0.5034055035994504
Energy: 0.5553286167783046
Energy: 0.547609332271919
Energy: 1.0067075838262927
Energy: 0.5431899380260018
Energy: 0.5638478469570901
Energy: 0.5543558062616278
Energy: 0.6100657161422044
Energy: 0.9474412736365445
Energy: 0.4558861959660969
Energy: 0.5544775380686348
Energy: 0.6941397843346238
Energy: 0.5371741641819393
Energy: 0.5737134394861125
Energy: 0.9121097744003565
Energy: 0.4862542106508715
Energy: 0.5166733052620512
Energy: 0.4442807007135185
Energy: 0.45775493928862504
Energy: 0.47183510931396166
Energy: 0.4921312974115166
Energy: 0.5282904033804915
Energy: 0.5024045881221358
Energy: 0.42444910714361433
Energy: 0.5129173961344695
Energy: 0.5145537776732897
Energy: 0.4245038038700592
Energy: 0.5498666176171888
Energy: 0.5038753959318731
Energy: 0.5468121482197082
Energy: 0.6745475597495992
Energy: 0.5205505219144356
Energy: 0.48125828799551656
Energy: 0.5270402005258035
Energy: 0.5287818972295372
Energy: 0.5744066637194696
Energy: 0.4101098442644743
Energy: 0.41053141140402355
Energy: 0.5618191754224097
Energy: 0.4103667059331433
Energy: 0.5629540045208452
Energy: 0.6062726670959615
Energy: 0.4962933170160905
Energy: 0.5357162574876133
Energy: 0.6002548479628865
Energy: 0.5822459819762569
Energy: 0.5071649713128882
Energy: 0.3995372364526184
Energy: 0.4845349398531122
Energy: 0.4828411932645433
Energy: 0.3997255706150366
Energy: 0.6151368141976801
Energy: 0.46660490424718754
Energy: 0.4566344336973496
Energy: 0.48692996069849115
Energy: 0.5015843521095397
Energy: 0.46089298733923345
Energy: 0.49361201852468384
Energy: 0.47116563562581143
Energy: 0.5936338900121964
Energy: 0.6012178096649342
Energy: 0.5105843031490552
Energy: 0.5364677754007471
Energy: 0.4747561555986565
Energy: 0.48238514965753065
Energy: 0.5928132023703981
Energy: 0.40180544112760797
Energy: 0.4949790680062547
Energy: 0.5849083117272595
Energy: 0.40323525951225386
Energy: 0.5167398635778735
Energy: 0.5488734981841954
Energy: 0.5118318510843622
Energy: 0.5286757759519342
Energy: 0.535012771092772
Energy: 0.5711992412345543
Energy: 0.4951909379591944
Energy: 0.4107850383827575
Energy: 0.560937810927605
Energy: 0.4897301571441901
Energy: 0.44691840719026604
Energy: 0.5683880143760642
Energy: 0.5335577665139262
Energy: 0.4862856242001954
Energy: 0.503279735815015
Energy: 0.6581766002523526
Energy: 0.45559234901050993
Energy: 0.50720943455587
Energy: 0.5028778078627232
Energy: 0.7345093823312315
Energy: 0.4944259678093945
Energy: 0.5341644833259691
Energy: 0.5600550238679921
Energy: 0.9683431961396994
Energy: 0.5137271453186514
Energy: 0.5478917824516675
Energy: 0.4788692550887648
Energy: 0.5508564128001627
Energy: 0.492065626636818
Energy: 0.48436322797323916
Energy: 0.5293688480216805
Energy: 0.5516101977919227
Energy: 0.5836117188037181
Energy: 0.55235229509222
Energy: 0.49037025618856794
Energy: 0.5151619611216748
Energy: 0.6338839579937255
Energy: 0.4547519582415515
Energy: 0.6871715406858843
Energy: 0.4868281535022767
Energy: 0.5127215883149442
Energy: 0.6039398643753561
Energy: 0.5595231955170552
Energy: 0.8548579568689292
Energy: 0.5174994200621389
Energy: 0.6012463078200451
Energy: 0.6237949422658366
Energy: 0.528647894122448
Energy: 1.0391460982367584
Energy: 0.7422064838520197
Energy: 1.153103454940968
Energy: 0.5941972485513349
Energy: 0.5661869680042412
Energy: 0.6456875977502935
Energy: 0.5182573567546204
Energy: 0.5402443188569098
Energy: 0.6183595742153298
Energy: 0.6064760993977751
Energy: 0.555482230400981
Energy: 0.547169921023067
Energy: 0.5053896918290955
Energy: 0.476526411976911
Energy: 0.5992270402473203
Energy: 0.6472806266463818
Energy: 0.5102438123121914
Energy: 0.5470495505298928
Energy: 0.5605271959622342
Energy: 0.5644412497848907
Energy: 0.5551855646707329
Energy: 0.6350174029687532
Energy: 0.6788837904778584
Energy: 0.591366335611993
Energy: 0.6213357480260353
Energy: 0.6558449956542574
Energy: 0.6664378647854694
Energy: 0.676950338992323
Energy: 0.5702174639643129
Energy: 0.5706598649504817
Energy: 0.6149444373860039

minimum gb energy = 0.3995372364526184 eV
minimum distance =  1.79619101450418 Angstroms
sigma value = 67


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

Energy: 0.831280548957751
Energy: 0.852695028781576
Energy: 0.7532607344321853
Energy: 0.6054057482804673
Energy: 0.9250274374016347
Energy: 0.7383075896326783
Energy: 0.678341931011245
Energy: 0.6552729783142014
Energy: 0.8364366847023287
Energy: 0.7613548295177451
Energy: 0.6633500297097805
Energy: 0.7683829808439392
Energy: 0.6258056695962534
Energy: 0.5980534267763188
Energy: 0.6616924646215638
Energy: 0.72565591198256
Energy: 0.7621325602857887
Energy: 0.6141622678233036
Energy: 0.5630820371687635
Energy: 0.6841630506827661
Energy: 0.6697538381649089
Energy: 0.6208763939826305
Energy: 0.6199008212136292
Energy: 0.6568371378857933
Energy: 0.6514936865646388
Energy: 0.7339057068340593
Energy: 0.85056544589583
Energy: 0.7243956393095711
Energy: 0.7757839827516356
Energy: 0.7216173541941712
Energy: 0.734851321752701
Energy: 0.6909883492661831
Energy: 0.6637873476434312
Energy: 0.6786865988256005
Energy: 0.7416202481112713
Energy: 0.6332896012426181
Energy: 0.6085295919834742
Energy: 0.6435436961660739
Energy: 0.5886294922276184
Energy: 0.6728976320064877
Energy: 0.6098625007683817
Energy: 0.6614726614207491
Energy: 0.562040249778148
Energy: 0.5828419641769226
Energy: 0.5782907052153633
Energy: 0.6954499186516815
Energy: 0.6932578064459567
Energy: 0.6477690412804591
Energy: 0.5838279602222605
Energy: 0.6225897165244189
Energy: 0.6707649868921371
Energy: 0.6004696554071792
Energy: 0.6783768881620434
Energy: 0.672087415393156
Energy: 0.7024268187691338
Energy: 0.63464965182553
Energy: 0.5218292969510874
Energy: 0.7090628928774656
Energy: 0.5232008066027217
Energy: 0.661417885216247
Energy: 0.7661955595136865
Energy: 0.6216257159839151
Energy: 0.6179758688044454
Energy: 0.6659407638023679
Energy: 0.5626753896025237
Energy: 0.6485647719507076
Energy: 0.48945594460038383
Energy: 0.6795102546526107
Energy: 0.6226417260590917
Energy: 0.5713119223559919
Energy: 0.609641097987355
Energy: 0.5828042070653451
Energy: 0.5623714503091652
Energy: 0.5812736759774244
Energy: 0.6144304601945278
Energy: 0.5222244999649555
Energy: 0.5904889638481401
Energy: 0.5935838585289874
Energy: 0.6592635300815298
Energy: 0.6034746323085689
Energy: 0.6256672995115018
Energy: 0.5920529343648714
Energy: 0.687834648558112
Energy: 0.6172762332536053
Energy: 0.6982328641323057
Energy: 0.5888640899560559
Energy: 0.5024263831075142
Energy: 0.7012940540885684
Energy: 0.49721838776651917
Energy: 0.5843164364613969
Energy: 0.6538545805090181
Energy: 0.6343229486084538
Energy: 0.6258918462962492
Energy: 0.6328735185501406
Energy: 0.6376292330539777
Energy: 0.5927988574946703
Energy: 0.5163166876211419
Energy: 0.5758950987710739
Energy: 0.5549732881076581
Energy: 0.6363578705554257
Energy: 0.6612465765955188
Energy: 0.6915549037072173
Energy: 0.6052496293884714
Energy: 0.5915304680707606
Energy: 0.6194171859238724
Energy: 0.5710455618328791
Energy: 0.6626846409092912
Energy: 0.6894084333482587
Energy: 0.725246393386299
Energy: 0.6118506827118436
Energy: 0.6343850028315695
Energy: 0.6431520312185377
Energy: 0.651507819951154
Energy: 0.6442024003443556
Energy: 0.6411012936432273
Energy: 0.6796313112653318
Energy: 0.5954857124290156
Energy: 0.6352729155715117
Energy: 0.6110171158641963
Energy: 0.6616077215047538
Energy: 0.5772125344722614
Energy: 0.6365135512372712
Energy: 0.6224604454028084
Energy: 0.611180999245524
Energy: 0.7352738328560867
Energy: 0.6122000027588093
Energy: 0.6257708478824506
Energy: 0.624687814348683
Energy: 0.6766154550299208
Energy: 0.7172637149427362
Energy: 0.6823145803361597
Energy: 0.6196814188375772
Energy: 1.3022582490282093
Energy: 0.6730353987884912
Energy: 0.6797636731783596
Energy: 0.6934745332156856
Energy: 0.6601893603098121
Energy: 0.686277360386838

minimum gb energy = 0.48945594460038383 eV
minimum distance =  1.81429172802442 Angstroms
sigma value = 33


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

Energy: 0.9297572536065494
Energy: 0.8685121472101608
Energy: 0.7995736910800091
Energy: 0.6982687091122526
Energy: 0.8301700390554287
Energy: 0.6996087801207805
Energy: 0.8130785854881911
Energy: 0.7191067933900473
Energy: 0.7616243499445501
Energy: 0.742672256538422
Energy: 0.7081028386013964
Energy: 0.7531934530948613
Energy: 0.7540835056272907
Energy: 0.7694577843997832
Energy: 0.7254740440053308
Energy: 0.7986126733211316
Energy: 0.8230789889587006
Energy: 0.7139737429147845
Energy: 0.6885957062944055
Energy: 0.7842156711957903
Energy: 0.7065911601214561
Energy: 0.8472476564271505
Energy: 0.7234512693962555
Energy: 0.7984614517257858
Energy: 0.7242704846970809
Energy: 0.7255729703380381
Energy: 0.7044694007899629
Energy: 0.7204434974990286
Energy: 0.7222925943426954
Energy: 0.7495685180410293
Energy: 0.7896228422709282
Energy: 0.8734809765361314
Energy: 0.846937117823498
Energy: 0.6872181555178921
Energy: 0.766404156074926
Energy: 0.6896631567505124
Energy: 0.6827371450200026
Energy: 0.6926673206425572
Energy: 0.6770649797913545
Energy: 0.6647292933416623
Energy: 0.6952441313530157
Energy: 0.7415670003461523
Energy: 0.6320526759995573
Energy: 0.7626707752625013
Energy: 0.7119216058836882
Energy: 0.6205762769241009
Energy: 0.7644635807773881
Energy: 0.6810059749537342
Energy: 0.6471742534066922
Energy: 0.7497251670058387
Energy: 0.6765380543712528
Energy: 0.638348427623809
Energy: 0.7353707302969116
Energy: 0.661231655201447
Energy: 0.687219964532053
Energy: 0.579118871248446
Energy: 0.6809855885975141
Energy: 0.6994383357897008
Energy: 0.5678823221515713
Energy: 0.6983310678976867
Energy: 0.7092703867925206
Energy: 0.7122687255612098
Energy: 0.6485093944735414
Energy: 0.6845284724152704
Energy: 0.678737078474574
Energy: 0.6362839111963604
Energy: 0.6324765087827953
Energy: 0.7409467322068372
Energy: 0.6721783280184904
Energy: 0.5832482014995153
Energy: 0.6157244913158529
Energy: 0.7265166931738484
Energy: 0.6424170024359941
Energy: 0.6544364953692563
Energy: 0.66657501350735
Energy: 0.566027022948244
Energy: 0.7345543695245872
Energy: 0.6902778176795993
Energy: 0.6939110548588728
Energy: 0.9149665229789304
Energy: 0.7514044137437291
Energy: 0.6850566199357511
Energy: 0.8271722146163091
Energy: 0.6346564403267788
Energy: 0.6926683564230013
Energy: 0.6472939223438612
Energy: 0.71372186812509
Energy: 0.6915041841963034
Energy: 0.6543069404781475
Energy: 0.7411104469696026
Energy: 0.6875388496899976
Energy: 0.703322636402295
Energy: 0.6314760827392862
Energy: 0.6883977460464631
Energy: 0.7012023271559388
Energy: 0.6909860920442364
Energy: 0.6904778258935341
Energy: 0.8409040681466579
Energy: 0.7392653193113431
Energy: 0.8056836658888146
Energy: 0.8312183612707497
Energy: 0.6953517273972349
Energy: 0.7659593990103785
Energy: 0.6402586619511328
Energy: 0.6750975846536789
Energy: 0.7313019355643765
Energy: 0.7870074949528715
Energy: 0.8637726489003184
Energy: 0.7776857165010553
Energy: 0.8301143234777989
Energy: 0.7719526987744751
Energy: 0.6848485258899613
Energy: 0.7789687938550467
Energy: 0.6859290777365562
Energy: 0.7168000314809042
Energy: 0.7490553447692568
Energy: 1.1806908461897805
Energy: 0.7080235761648415
Energy: 0.8316195168125325
Energy: 0.8030661695287405
Energy: 0.764930181061175
Energy: 0.7895378673225095
Energy: 0.7140054343008903
Energy: 0.7648014290319656
Energy: 0.7192692129206045
Energy: 0.6883609765824132
Energy: 0.7075064687625836
Energy: 0.7437757060082101
Energy: 0.7218473709185542
Energy: 0.8651272950780126
Energy: 0.7567571555753341
Energy: 0.8296842425670112
Energy: 0.7220809041159835
Energy: 0.7121184502514318
Energy: 0.7152607692528943
Energy: 0.7198165106583708
Energy: 0.6412100557860516
Energy: 0.7459174386698466
Energy: 0.8096817943209522
Energy: 1.015010844436614
Energy: 1.0963183837777786
Energy: 0.7436555798462533
Energy: 0.8762512388351836
Energy: 0.6718349003142547
Energy: 0.6961024568330141
Energy: 0.693187147410549
Energy: 0.751887216069104
Energy: 0.695658636871189
Energy: 0.6718531429321323
Energy: 0.7933315263423625
Energy: 0.6070910591448518
Energy: 0.716999868280149
Energy: 0.6927433653270211
Energy: 0.6051566934641088
Energy: 0.7006318258474137
Energy: 0.671608416370814
Energy: 0.6870484454854651
Energy: 0.697272882416501
Energy: 0.7040244053596323
Energy: 0.6965896860857815
Energy: 0.8730062963613043
Energy: 0.7095398678435146
Energy: 0.7079994512048151
Energy: 0.6243216513202405
Energy: 0.6101193340766802
Energy: 0.6956632450988823
Energy: 0.5710862804378473
Energy: 0.7132469370502396
Energy: 0.7109416838105991
Energy: 0.6768008295990867
Energy: 0.637955527356069
Energy: 0.6506867307043361
Energy: 0.6670269217431409
Energy: 0.6289834498119753
Energy: 0.6913351525331394
Energy: 0.6777141157608023
Energy: 0.8098240207786064
Energy: 0.746591453954103
Energy: 0.618107001115084
Energy: 0.6810257894468542
Energy: 0.5994566415835932
Energy: 0.7264907453990492
Energy: 0.6890742143402041
Energy: 0.5630311011649666
Energy: 0.7153035796082604
Energy: 0.6731896112396384
Energy: 0.7065540546120491
Energy: 0.9058497292505022
Energy: 0.8685050482300984
Energy: 0.6767303784652705
Energy: 0.7341935197211251
Energy: 0.6420867362299011
Energy: 0.6931666751420964
Energy: 0.637618994303358
Energy: 0.7563132138750153
Energy: 0.683319406998623
Energy: 0.6464230217533904
Energy: 0.7333181668854962
Energy: 0.6685665614231653
Energy: 0.7701410675137956
Energy: 0.6865976817175564
Energy: 0.6920981873070583
Energy: 0.7359143571397763
Energy: 0.6961182671180972
Energy: 0.7632994865409692
Energy: 0.699084994001172
Energy: 0.7294724445274946
Energy: 0.8148586057995252
Energy: 0.654190630583607
Energy: 0.6925465766452784
Energy: 0.7313295718127455
Energy: 0.694157562267648
Energy: 0.6056179108371817
Energy: 0.7140101327652812
Energy: 0.7170684143169143
Energy: 0.7895592087697979
Energy: 0.7521755120280901
Energy: 0.8065727147709606
Energy: 0.7278600442167025
Energy: 0.7112109527446415
Energy: 0.6300110836066702
Energy: 0.6960171192029335

minimum gb energy = 0.5630311011649666 eV
minimum distance =  1.83056117570733 Angstroms
sigma value = 41


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

Energy: 0.749322296995167
Energy: 0.9931071827460575
Energy: 0.8799794830523767
Energy: 0.689524102134117
Energy: 1.064963492052316
Energy: 0.8642124929230989
Energy: 0.8401811203489526
Energy: 0.7525008230145537
Energy: 0.6754492303444098
Energy: 0.8755143950884494
Energy: 0.7942828661697818
Energy: 0.7587404158869812
Energy: 0.7471845140864952
Energy: 0.7428027660081099
Energy: 0.7277180586250952
Energy: 0.8038103803343044
Energy: 0.7269900821312171
Energy: 0.7988826051234886
Energy: 0.7472301298477428
Energy: 0.7432474729274515
Energy: 0.75808547582073
Energy: 0.7560443643451898
Energy: 0.7936654883974273
Energy: 0.8319253929738072
Energy: 0.781494788393911
Energy: 0.7979088491565081
Energy: 0.675784527120429
Energy: 0.7834583424623287
Energy: 0.6865087000232994
Energy: 0.7576996353291195
Energy: 0.6947262897540303
Energy: 0.8318046415967416
Energy: 0.7961633682267439
Energy: 0.6902299400991809
Energy: 0.8667857635574155
Energy: 0.7317418430456619
Energy: 0.7376481653042057
Energy: 0.7350725969010439
Energy: 0.7407589523655812
Energy: 0.746901702716084
Energy: 0.7589785557216767
Energy: 0.723129643776367
Energy: 0.7109372698515224
Energy: 0.7372971486304409
Energy: 0.7394428032577768
Energy: 0.6361781592741862
Energy: 0.7977219998243664
Energy: 0.7685931509434613
Energy: 0.654448345096548
Energy: 0.7558818801730142
Energy: 0.7499814823482772
Energy: 0.6765440845537067
Energy: 0.7770911422277534
Energy: 0.755493504646053
Energy: 0.8010705334223399
Energy: 0.7320055111151499
Energy: 0.7365181263034567
Energy: 0.7859653492173846
Energy: 0.7203487148672589
Energy: 0.7477719793546548
Energy: 0.7093667880358325
Energy: 0.7468750013468424
Energy: 0.7409883747296367
Energy: 0.7012182471103781
Energy: 0.7123977891812256
Energy: 0.7960048390771048
Energy: 0.712239448211666
Energy: 0.6922891745759246
Energy: 0.6761862490835162
Energy: 0.6731568815133274
Energy: 0.6830579441087311
Energy: 0.7544210142444812
Energy: 0.8620476098031495
Energy: 0.7302892229244243
Energy: 0.7510619169918419
Energy: 0.8448876798271915
Energy: 0.7376722402614057
Energy: 0.7561955709328334
Energy: 0.806528939722491
Energy: 0.7459779209892413
Energy: 0.75251549688244
Energy: 0.714317833265114
Energy: 0.6755485161475347
Energy: 0.7542106656437917

minimum gb energy = 0.6361781592741862 eV
minimum distance =  1.87163435660351 Angstroms
sigma value = 11


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

Energy: 0.8478596829516113
Energy: 1.0980134476236059
Energy: 0.9422691745487585
Energy: 0.8283320926031064
Energy: 1.0444505541313112
Energy: 0.9063904347972755
Energy: 0.7828256170838315
Energy: 0.7330384315434495
Energy: 0.7381790565446232
Energy: 0.8027442283799415
Energy: 0.7347301826286101
Energy: 0.6785268456039877
Energy: 0.7613689430266586
Energy: 0.7401488458805823
Energy: 0.7461889055572808
Energy: 0.7110718999286929
Energy: 0.7146556989647412
Energy: 0.7538670595715978
Energy: 0.7548467313309288
Energy: 0.7146776411434929
Energy: 0.7700305797143047
Energy: 0.73295082961075
Energy: 0.7160284241121255
Energy: 0.7758742424759235
Energy: 0.7159714524351972
Energy: 0.6652885004254099
Energy: 0.711077174066798
Energy: 0.7309924088047819
Energy: 0.6898873113012742
Energy: 0.7324088938523738
Energy: 0.7108409396819015
Energy: 0.7644032781099721
Energy: 0.7269481124017253
Energy: 0.7036375188810374
Energy: 0.7662950138756041
Energy: 0.7445140193441768
Energy: 0.7225147565414071
Energy: 0.7386296069455013
Energy: 0.7478145450333791
Energy: 0.7514922908470837
Energy: 0.7190205802762248
Energy: 0.7331113753638608
Energy: 0.7065706028272167
Energy: 0.7163312135010061
Energy: 0.7401109540761989
Energy: 0.6757225969350203
Energy: 0.706751153550157
Energy: 0.66475490079837
Energy: 0.7266466354040084
Energy: 0.7527787829997241
Energy: 0.7648692614415827
Energy: 0.7188051629631652
Energy: 0.8157593258992769
Energy: 0.7468405300531097
Energy: 0.7244254644501383
Energy: 0.7622794583575868
Energy: 0.7524843679614235
Energy: 0.7268812534294499
Energy: 0.7783171610016755
Energy: 0.7583547008514558
Energy: 0.701215440264564
Energy: 0.7242743591887139
Energy: 0.7434110939470986
Energy: 0.7465588460872513
Energy: 0.7564735090727583
Energy: 0.7608455521314644
Energy: 0.6676859445365891
Energy: 0.8400498550344325
Energy: 0.7895381228880957
Energy: 0.7440121626806465
Energy: 0.790804750527822
Energy: 0.7905195336792861
Energy: 0.7328645673660236
Energy: 0.7251738069933302
Energy: 0.6842358916195629
Energy: 0.7196417930589143
Energy: 0.7800944365502906
Energy: 0.6641054489562596
Energy: 0.7583784609808729
Energy: 0.756346286893639
Energy: 0.7634669298721198
Energy: 0.7381479890346198
Energy: 0.7546931028191245
Energy: 0.7495587821199372
Energy: 0.7321200782958555
Energy: 0.7858650560356377
Energy: 0.7557174561964758
Energy: 0.8271201871804196
Energy: 0.7320421708970406
Energy: 0.7681326557088548
Energy: 0.6735552582505947
Energy: 0.7505596908631437
Energy: 0.7225223040478773
Energy: 0.674417871191134
Energy: 0.7254653737281048
Energy: 0.7228389728835597
Energy: 0.7251328583919673
Energy: 0.7297021775952021
Energy: 0.7487569604396531
Energy: 0.7107285686853686
Energy: 0.6963997666843607
Energy: 0.7384807694210289
Energy: 0.7593449046512003
Energy: 0.7345075846663542
Energy: 0.7526320876343253
Energy: 0.746608980002147
Energy: 0.741779232246528
Energy: 0.7497213154529603
Energy: 0.7174415104322018
Energy: 0.6657807110918552
Energy: 0.6657122821686882
Energy: 0.7139159762561608
Energy: 0.7661679778706554
Energy: 0.7035003366603635
Energy: 0.676372333778299
Energy: 0.7479718134553273
Energy: 0.7502023193763269
Energy: 0.7647779811694653
Energy: 0.7270338020110332
Energy: 0.7537819928013937
Energy: 0.7214083150824412
Energy: 0.7485924287943232
Energy: 0.7464414533590235
Energy: 0.7806845784742283
Energy: 0.7159707709868804
Energy: 0.8000831258311568
Energy: 0.7376096045149666
Energy: 0.7573650206937014
Energy: 0.7466953093340852
Energy: 0.7223813351042869
Energy: 0.7621560782215482
Energy: 0.7865167975249062
Energy: 0.7461622126599448
Energy: 0.7578370150691653
Energy: 0.7837930103833739
Energy: 0.7596830440600847
Energy: 0.7721841934668767
Energy: 1.0873062163097997
Energy: 0.7577115822983453
Energy: 0.7134890969526686
Energy: 0.7483073684799526
Energy: 0.7381804492667883
Energy: 0.7275681989084084
Energy: 0.6656765679699433
Energy: 0.7037516296380969
Energy: 0.7657432854622773
Energy: 0.753630008754585
Energy: 0.7525326516361125
Energy: 0.7371602428343472
Energy: 0.8096521842416886
Energy: 0.7170488741145725
Energy: 0.7597245420396553
Energy: 0.7369760778484933
Energy: 0.707609673296206
Energy: 0.7438740093559005
Energy: 0.7859054519678509
Energy: 0.72617553874777
Energy: 0.667659682631483
Energy: 0.7013906892676544
Energy: 0.7362019750905434
Energy: 0.6752018607112542
Energy: 0.7193214922931263
Energy: 0.7572729071462125
Energy: 0.7079630905408739
Energy: 0.7420105042093825
Energy: 0.7411778379634959
Energy: 0.7226913288873424
Energy: 0.7876956992784017
Energy: 0.7501785881882644
Energy: 0.7294787348487324
Energy: 0.7366251922633521
Energy: 0.6850999205432015
Energy: 0.7587532726194379
Energy: 0.7374426417671254
Energy: 0.7950029222447217
Energy: 0.7420889766648331
Energy: 0.7388445169588909
Energy: 0.7502055252455502
Energy: 0.7107769301193615
Energy: 0.6830374561036733
Energy: 0.7636484704870529
Energy: 0.8729683195349232
Energy: 0.8390568864645753
Energy: 0.7192930898698932
Energy: 0.7557229506871278
Energy: 0.8488465868928354

minimum gb energy = 0.6641054489562596 eV
minimum distance =  1.86544871839718 Angstroms
sigma value = 57


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

Energy: 0.939643764245251
Energy: 1.135588353132664
Energy: 0.8422460738481446
Energy: 0.7304225990839779
Energy: 1.2523063310967946
Energy: 0.7370289256729743
Energy: 0.735522691543433
Energy: 0.6902465066691427
Energy: 0.6219862551407571
Energy: 0.7313253656008583
Energy: 0.7536230795741038
Energy: 0.6190859419014041
Energy: 0.6563937515084042
Energy: 0.6234893432431803
Energy: 0.6247590260221197
Energy: 0.6564354232554561
Energy: 0.6418804027974983
Energy: 0.7772652383447133
Energy: 0.6759074628557115
Energy: 0.643609758448029
Energy: 0.8082727971401498
Energy: 0.7042517340715329
Energy: 0.6342304146678087
Energy: 0.7952010871191367
Energy: 0.662672545254331
Energy: 0.6177356565332087
Energy: 0.6190257808213168
Energy: 0.6549431108464961
Energy: 0.7300575272914595
Energy: 0.6743203785383016
Energy: 0.6717353689584108
Energy: 0.8713226524139888
Energy: 0.8462638991591896
Energy: 0.6551992433106466
Energy: 0.6746076577650945
Energy: 0.8204381148573389
Energy: 0.8191893631563897
Energy: 0.5903988493153491
Energy: 0.5906168230646591
Energy: 0.826898401169749
Energy: 0.5934315724454787
Energy: 0.7509707091031829
Energy: 0.797263411504714
Energy: 0.6624591980958671
Energy: 0.6768936884809923
Energy: 0.6947898065327794
Energy: 0.6566787051704771
Energy: 0.7188089495213729
Energy: 0.6731279659157466
Energy: 0.6213670654679105
Energy: 0.7171376914754988
Energy: 0.671034015434645
Energy: 0.6217019320040339
Energy: 0.7026186000432917
Energy: 0.6721907351950787
Energy: 0.6174941898019172
Energy: 0.6844924315875935
Energy: 0.6543886718704252
Energy: 0.6579244471580037
Energy: 0.695134206591597
Energy: 0.7338837931984992
Energy: 0.6668076092650873
Energy: 0.7468908464319258
Energy: 0.7091388720916193
Energy: 0.7032037257244407
Energy: 0.7845911224691091
Energy: 0.8596965815728024
Energy: 0.6244961002447394
Energy: 0.6247583954796686
Energy: 0.8545079233803753
Energy: 0.6248417982502733
Energy: 0.8761279262877956
Energy: 0.6525351920740904
Energy: 0.8550428286717235
Energy: 0.7097131564375412
Energy: 0.6528666922503835
Energy: 0.6927416980169419
Energy: 0.7995402448632842
Energy: 0.6762381089429957
Energy: 0.7062734710382761
Energy: 0.714090757240966
Energy: 0.6561785928527699
Energy: 0.7324172632552433
Energy: 0.7064848302513771
Energy: 0.6986624882660444
Energy: 0.5909765419555223
Energy: 0.83522388692628
Energy: 0.7149088519811804
Energy: 0.5914653863031826
Energy: 0.8193689454144213
Energy: 0.6569328354029164
Energy: 0.5906631997386829
Energy: 0.5930332343328726
Energy: 0.6573605577596829
Energy: 0.5906732415123526
Energy: 0.6908659075459855
Energy: 0.6708546259575318
Energy: 0.6601314891372835
Energy: 0.7372539809148334
Energy: 0.6581120694665203
Energy: 0.6700946857004637
Energy: 0.706437431363232

minimum gb energy = 0.5903988493153491 eV
minimum distance =  1.87493033812941 Angstroms
sigma value = 9


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

Energy: 0.7831537261393186
Energy: 1.1733999274678235
Energy: 0.8847002125099448
Energy: 1.0068659603599333
Energy: 1.3386916386459689
Energy: 0.994009353091531
Energy: 0.753428407256841
Energy: 0.6993569839722035
Energy: 0.6964839911543449
Energy: 0.7140737713757125
Energy: 0.7027783127880823
Energy: 0.6286220343996031
Energy: 0.7051578759956463
Energy: 0.6918641112525616
Energy: 0.7129076599003548
Energy: 0.7050588824931604
Energy: 0.6795152089989062
Energy: 0.6759422077632298
Energy: 0.6787069689215243
Energy: 0.7164411025263681
Energy: 0.730730473718263
Energy: 0.7107162760996719
Energy: 0.6989842771325891
Energy: 0.6997980257579518
Energy: 0.6743892242613049
Energy: 0.7419447443775496
Energy: 0.7054028713668326
Energy: 0.6705032678643766
Energy: 0.6959602671736995
Energy: 0.6938430183799129
Energy: 0.684032536297565
Energy: 0.6415142374056967
Energy: 0.62649787099608
Energy: 0.6775429090775752
Energy: 0.7020764768530505
Energy: 0.6451502486508645
Energy: 0.6613685141583963
Energy: 0.7387759143697056
Energy: 0.753200120213466
Energy: 0.6612996552891505
Energy: 0.8947775180708161
Energy: 0.8003783316873091
Energy: 0.6664257870205829
Energy: 0.696083580943948
Energy: 0.6669828432102234
Energy: 0.6669061474153679
Energy: 0.6531184075035151
Energy: 0.6286692310430573
Energy: 0.7164162926024598
Energy: 0.7466247594063937
Energy: 0.6912695105321961
Energy: 0.6965066994164564
Energy: 0.7460931417248658
Energy: 0.7021140768750036
Energy: 0.7611376132202228
Energy: 0.7227552851400257
Energy: 0.7078796923261531
Energy: 0.6848076508718715
Energy: 0.7131985853019279
Energy: 0.7342934521635068
Energy: 0.6671288891167199
Energy: 0.6782590493487034
Energy: 0.6778970286059186
Energy: 0.6666038766769272
Energy: 0.6521872188293475
Energy: 0.6871914618251467
Energy: 0.7130590269925176
Energy: 0.6678771549433351
Energy: 0.6739538099434059
Energy: 0.6968708604898731
Energy: 0.657950958836752
Energy: 0.7752322639355492
Energy: 0.8225092325185759
Energy: 0.6876082059607882
Energy: 0.633006216070286
Energy: 0.7676554851505119
Energy: 0.8001700418787971
Energy: 0.7391087358311781
Energy: 0.7438796161426328
Energy: 0.6315967287434955
Energy: 0.6281161698327353
Energy: 0.7183556100721041
Energy: 0.6876513065778646
Energy: 0.6962240765485358
Energy: 0.6847866233896799
Energy: 0.7230907643394512
Energy: 0.6518573216320368
Energy: 0.6858334332259063
Energy: 0.7156444204810106
Energy: 0.7544282362807895
Energy: 0.6831787469984426
Energy: 0.7264933582142055
Energy: 0.6750734222196481
Energy: 0.6831537502004201
Energy: 0.7101533714505266
Energy: 0.6262428697088681
Energy: 0.6975257021859338
Energy: 0.6437944498527829
Energy: 0.6286280460312991
Energy: 0.6956810160341598
Energy: 0.6709304523929281
Energy: 0.6950783117837571
Energy: 0.808886821129036
Energy: 0.8522115060517421
Energy: 0.7641940310267087
Energy: 0.7371218626106217
Energy: 0.7051095187090459
Energy: 0.7012337913806269
Energy: 0.6967413535145607
Energy: 0.6950178372289894
Energy: 0.7433396148625003
Energy: 0.7698372316644153
Energy: 0.6373344327286897
Energy: 0.7697597115747399
Energy: 0.9043766189177409
Energy: 0.6854222903913151
Energy: 0.7039871553715551
Energy: 0.705925302980978
Energy: 0.6846695512207299
Energy: 0.6709595608399391
Energy: 0.6790926768214164
Energy: 0.6576204282712517
Energy: 0.6574417744615848
Energy: 0.6550296165672483
Energy: 0.6863192648028014
Energy: 0.6283179491547364

minimum gb energy = 0.6262428697088681 eV
minimum distance =  2.45151399568478 Angstroms
sigma value = 27


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

Energy: 0.8660392538604451
Energy: 0.9338186819832327
Energy: 0.6081902118822943
Energy: 0.8209837083240278
Energy: 0.9511271654594
Energy: 0.8180614651219169
Energy: 0.8367212322058666
Energy: 0.6995631423839066
Energy: 0.7039163847055863
Energy: 0.753794768683574
Energy: 0.7728644172115655
Energy: 0.6773740867714417
Energy: 0.8404245805131889
Energy: 0.8132747512712256
Energy: 0.8563463756953912
Energy: 0.8992488609328521
Energy: 0.7157595858829262
Energy: 0.8700225546548606
Energy: 0.7451739589572449
Energy: 0.8250557628074443
Energy: 0.7576930766019081
Energy: 0.775108438119125
Energy: 0.7876545010566804
Energy: 0.7691768883355322
Energy: 0.6995640279280774
Energy: 0.7586637173069967
Energy: 0.7176885618302805
Energy: 0.6483264345248639
Energy: 0.8519178381265827
Energy: 0.7230937940341222
Energy: 0.7888517687806257
Energy: 0.6998010146292536
Energy: 0.6660990265471272
Energy: 0.6803983564119725
Energy: 0.7501278146234576
Energy: 0.7049573662848209
Energy: 0.780788137355681
Energy: 0.6285672197749949
Energy: 0.5896227018941694
Energy: 0.8024216985931512
Energy: 0.6737419691990724
Energy: 0.5895285335368948
Energy: 0.775745759483664
Energy: 0.5933207445249361
Energy: 0.9335012844090644
Energy: 0.7825320521432354
Energy: 0.5897563322795518
Energy: 0.7801988929403582
Energy: 0.7933929240344104
Energy: 1.0023385366957813
Energy: 0.7223908180664214
Energy: 0.7929989828020023
Energy: 0.7199624219937641
Energy: 0.7369940787581689
Energy: 0.7912778953008771
Energy: 0.7932248061189803
Energy: 0.7744477406871716
Energy: 0.8749959537036922
Energy: 0.7664729236154607
Energy: 0.7888357628288554
Energy: 0.8660378937447073
Energy: 0.7147218452486414
Energy: 0.9325371201255875
Energy: 0.874553436350912
Energy: 0.6473422502115528
Energy: 0.7264668285360268
Energy: 0.7791561017218908
Energy: 0.6971377299997246
Energy: 0.7426565835336503
Energy: 0.8032814866953362
Energy: 0.6939193990786537
Energy: 0.7453783186684927
Energy: 0.6778222773025523
Energy: 0.7861096869248304
Energy: 0.5896643086638503
Energy: 0.6972759925132814
Energy: 0.8588235286901322
Energy: 0.5896039342491217
Energy: 0.6781496003112786
Energy: 0.7686666740521108
Energy: 0.7809653877623893
Energy: 0.68920961036934
Energy: 0.8648706405315152
Energy: 0.5904918126468031
Energy: 0.7914121624817831
Energy: 0.9168160274381575
Energy: 0.7133064030612163
Energy: 0.7656604397624733
Energy: 0.7604365702916552
Energy: 0.7531217057901816
Energy: 0.8190223861743371
Energy: 0.8099646363163047
Energy: 0.8534257982134352
Energy: 0.8191427909321752
Energy: 0.7652976260566783
Energy: 0.849318525217484
Energy: 0.6724598750215823
Energy: 0.7437745672921761
Energy: 0.7468876039321818
Energy: 0.6440343812621506
Energy: 0.8753335655010724
Energy: 0.7154455115774744
Energy: 0.7262588659161733
Energy: 0.7449091758488925
Energy: 0.6873169666807315
Energy: 0.6924653457266938
Energy: 0.7695238095238652
Energy: 0.7061066155955011
Energy: 0.7406354626235567
Energy: 0.589840791080911
Energy: 0.593736105999219
Energy: 0.8161030900358618
Energy: 0.6392989700890988
Energy: 0.5934305488232853
Energy: 0.811286120177418
Energy: 0.5897155751638848
Energy: 0.593436767927356
Energy: 0.8099041682819682
Energy: 0.6907687535260291
Energy: 0.5931172703076708
Energy: 0.8140750434666576
Energy: 0.6966004823881352
Energy: 0.651163172118221
Energy: 0.7433117428439204
Energy: 0.7317777587654795
Energy: 0.6999155573026128
Energy: 0.7053944731346865
Energy: 0.8475989874206253
Energy: 0.9380247649029794
Energy: 0.7033250294066361
Energy: 1.309808048609109
Energy: 0.8079673896313645
Energy: 0.8196532298242705
Energy: 0.696629292652808
Energy: 0.772360032437633
Energy: 0.7885351868389678
Energy: 0.7331457052195961
Energy: 0.7786922908792779
Energy: 0.8739680596088368
Energy: 0.7662019838863731
Energy: 0.761315224316819
Energy: 0.7348029717317306
Energy: 0.8998856333281616
Energy: 0.7060043399941913
Energy: 0.7297888699662045
Energy: 0.6385464848627024
Energy: 0.6825367700006554
Energy: 0.669343444788613
Energy: 0.6479224830178217
Energy: 0.6314572154177233

minimum gb energy = 0.5895285335368948 eV
minimum distance =  2.42619450168496 Angstroms
sigma value = 19


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

Energy: 0.9254646157896673
Energy: 0.9728645020978784
Energy: 0.9107158122583654
Energy: 0.8763964917566419
Energy: 1.165964335837142
Energy: 0.9589493107207109
Energy: 0.8114275761420003
Energy: 0.7135077315541886
Energy: 0.6874875930162146
Energy: 0.7146574957734543
Energy: 0.6986750306793449
Energy: 0.711099171729396
Energy: 0.777326818971308
Energy: 0.6983402894041989
Energy: 0.6857799874988979
Energy: 0.7780777710231327
Energy: 0.7201669127213294
Energy: 0.6882348254202605
Energy: 0.7127274443481372
Energy: 0.6615939505572874
Energy: 0.6854063053204118
Energy: 0.6840930581332638
Energy: 0.6727499605897207
Energy: 0.6755025008556206
Energy: 0.7162960184297268
Energy: 0.6998349497689919
Energy: 0.7950966406100561
Energy: 0.7163635663953039
Energy: 0.7220799598163453
Energy: 0.7409810830293443
Energy: 0.7255207547054946
Energy: 0.6620573103473815
Energy: 0.6629057322475653
Energy: 0.7243375014831144
Energy: 0.6941497507427052
Energy: 0.6296646757604699
Energy: 0.6857839010001673
Energy: 0.7132673362577506
Energy: 0.7307725513095761
Energy: 0.6860565157277871
Energy: 0.7742252099632281
Energy: 0.9801502275392451
Energy: 0.7172881916701777
Energy: 0.6798237737552445
Energy: 0.6870339256067363
Energy: 0.7136456092390219
Energy: 0.6936427860210032
Energy: 0.681691902828565
Energy: 0.7197998351017706
Energy: 0.6358074211580461
Energy: 0.6795396191814638
Energy: 0.7139804085634806
Energy: 0.7711706679808839
Energy: 0.6766890091706366
Energy: 0.6901849845249534
Energy: 0.7192667314065313
Energy: 0.6742089965419057
Energy: 0.6788209153091075
Energy: 0.6720186688718777
Energy: 0.6611250999999368
Energy: 0.6950373816432892
Energy: 0.7046467781839618
Energy: 0.7234739042477577
Energy: 0.7318824762138022
Energy: 0.712816365440227
Energy: 0.6840524564359982
Energy: 0.7230323171250753
Energy: 0.6545337630288568
Energy: 0.6659904849271902
Energy: 0.7332070466541928
Energy: 0.6733869300734836
Energy: 0.6267840856545526
Energy: 0.7195863654856218
Energy: 0.7544883126353948
Energy: 0.6491688630797322
Energy: 0.6930565133396092
Energy: 0.7149503542283518
Energy: 0.7339284222180161
Energy: 0.6882168290266945
Energy: 0.7036262762256148
Energy: 0.6795763502499422
Energy: 0.7151724381060468
Energy: 0.6844660299005088
Energy: 0.692064308258919
Energy: 0.7365585282517012
Energy: 0.7218528207360874
Energy: 0.6959994616813695
Energy: 0.7376842327855015
Energy: 0.7120740621037522
Energy: 0.6807249845341008
Energy: 0.719000647961447
Energy: 0.6814261595528034
Energy: 0.6542989878859654
Energy: 0.7186385517887037
Energy: 0.6707963954501317
Energy: 0.6556022751564011
Energy: 0.686286271835202
Energy: 0.7115352937316995
Energy: 0.770017081061728
Energy: 0.6869633778691389
Energy: 0.728563058331031
Energy: 0.7367967870440089
Energy: 0.701738468029205
Energy: 0.6207186915110161
Energy: 0.6473050862392282
Energy: 0.680167103323927
Energy: 0.683066389098656
Energy: 0.6453732081597048
Energy: 0.7103504588852801
Energy: 0.6894677009285415
Energy: 0.6886553972746159
Energy: 0.7019588162594012
Energy: 0.7023106221191802
Energy: 0.6701789093384022
Energy: 0.702692684013651
Energy: 0.70595281415898
Energy: 0.6655282587787553
Energy: 0.709634691986165
Energy: 0.6834023686836559
Energy: 0.7214373977023679
Energy: 0.7143947239180086
Energy: 0.6849488078398535
Energy: 0.6686861909367501
Energy: 0.7315866531469675
Energy: 0.7159161157768791
Energy: 0.6753649637647307
Energy: 0.7230062012154407
Energy: 0.654509712604494
Energy: 0.6789072115761406
Energy: 0.7071088169446061
Energy: 0.7280352320713239
Energy: 0.6644203447017146
Energy: 0.6850171923380511
Energy: 0.6811444936452115
Energy: 0.6717353405581692
Energy: 0.6258342670206015
Energy: 0.6876697260865292
Energy: 0.6554188802833996
Energy: 0.6759686075789807
Energy: 0.6454035703404616
Energy: 0.6778929093357491
Energy: 0.6759813291985634
Energy: 0.6742548831893174
Energy: 0.6206616535814723
Energy: 0.7209102378415255
Energy: 0.6726081785771971
Energy: 0.6730269147325454
Energy: 0.7191381608340265
Energy: 0.7242053012465471
Energy: 0.6849061688589768
Energy: 0.6921549426039174
Energy: 0.6833748787320315
Energy: 0.6814478445571676
Energy: 0.735027777076129
Energy: 0.7632097266022587
Energy: 0.7226853957521164
Energy: 0.7214811492098495
Energy: 0.6722866843903489
Energy: 0.6729160065445056
Energy: 0.7054556687253349
Energy: 0.6692396541155391
Energy: 0.6674909146480964
Energy: 0.7663538894378035
Energy: 0.6659685661388947
Energy: 0.6587947205939569
Energy: 0.7709781125735605
Energy: 0.7225116945606193
Energy: 0.6524728221839571
Energy: 0.6929779388729832
Energy: 0.7393573122797771
Energy: 0.7530688336594087
Energy: 0.6737431073803792
Energy: 0.7696174384916068
Energy: 0.6207477215946927

minimum gb energy = 0.6206616535814723 eV
minimum distance =  2.47117327973297 Angstroms
sigma value = 101


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

Energy: 0.8748018741150635
Energy: 0.9549687679272687
Energy: 0.9520534028354123
Energy: 0.8113551439857403
Energy: 0.9741870503112805
Energy: 0.6797405815293649
Energy: 0.8811098741749548
Energy: 0.6657993334580147
Energy: 0.6257590244242451
Energy: 0.7342215675757439
Energy: 0.7245922439053218
Energy: 0.7232794078930851
Energy: 0.730014365520739
Energy: 0.6700878219432159
Energy: 0.6911101148473701
Energy: 0.7658687484708139
Energy: 0.654192841246704
Energy: 0.6832353857263876
Energy: 0.7342418357366253
Energy: 0.6664768643908877
Energy: 0.6591276224797614
Energy: 0.6752531546346239
Energy: 0.6593243914903989
Energy: 0.6607129540507398
Energy: 0.6714230395829397
Energy: 0.7351115291731888
Energy: 0.7472434303478327
Energy: 0.6818889589868027
Energy: 0.7289303893721203
Energy: 0.7132986556017419
Energy: 0.7225813549284833
Energy: 0.7879930669748151
Energy: 0.6306812579396079
Energy: 0.7068499687306489
Energy: 0.7918242322058755
Energy: 0.6249032072270504
Energy: 0.6955696167272356
Energy: 0.6700611086397759
Energy: 0.6764976385680103
Energy: 0.695442237137741
Energy: 1.0452942567928545
Energy: 0.7792274008693155
Energy: 0.7404641370361678
Energy: 0.6979649239284312
Energy: 0.7170091120733619
Energy: 0.7392260227087925
Energy: 0.6715388539477742
Energy: 0.6983950844923541
Energy: 0.6789668914090148
Energy: 0.6323259580470634
Energy: 0.6518545239802775
Energy: 0.6891120424669713
Energy: 0.7741831630032089
Energy: 0.7247303056865604
Energy: 0.7067321337321166
Energy: 0.6965021504758203
Energy: 0.6873252905144858
Energy: 0.6818136554496123
Energy: 0.699165769056915
Energy: 0.7008070331000584
Energy: 0.701199400495904
Energy: 0.646501275722136
Energy: 0.692997044658018
Energy: 0.760627631946124
Energy: 0.6492969248874136
Energy: 0.6999973743487525
Energy: 0.717593282872728
Energy: 0.669776504073061
Energy: 0.6887114876318899
Energy: 0.6958072365288017
Energy: 0.6513430866340899
Energy: 0.6514388620008671
Energy: 0.6692493114590776
Energy: 0.7367264258349404
Energy: 0.7464495645431806
Energy: 0.6752766523160882
Energy: 0.6995953095796985
Energy: 0.727342450228006
Energy: 0.6539019203821292
Energy: 0.6619800325841585
Energy: 0.7064841596137165
Energy: 0.7036868626703913
Energy: 0.6710455167403392
Energy: 0.7574178748066637
Energy: 0.7658320353939077
Energy: 0.7093325120925301
Energy: 0.6908686491566444
Energy: 0.7500192072310308
Energy: 0.7063402497073654
Energy: 0.7238978474036025
Energy: 0.8258433876412673
Energy: 0.6763200398822047
Energy: 0.627357628578685
Energy: 0.7754592482348792
Energy: 0.6936488050695714
Energy: 0.6915320132155346
Energy: 0.6504843549813369
Energy: 0.866055899082127
Energy: 0.7488433458508983
Energy: 0.6621285492377219
Energy: 0.624628766556815
Energy: 0.6807201347466827
Energy: 0.695672246236391
Energy: 0.7450580772229076
Energy: 0.7281337972632298
Energy: 0.6859607159829931
Energy: 0.7426272985807945
Energy: 0.6894143751710066
Energy: 0.7902946782578678
Energy: 0.6684792640322885
Energy: 0.6589103435189848
Energy: 0.7343146433009993
Energy: 0.664946897031976
Energy: 0.6721310123374974
Energy: 0.7169046593272692
Energy: 0.7422917262935178
Energy: 0.6634481804939869
Energy: 0.6827275506577097
Energy: 0.6843677126650844
Energy: 0.660776170302132
Energy: 0.6750938166056413
Energy: 0.7632619527058263
Energy: 0.7111593400995241
Energy: 0.6775113336023757
Energy: 0.7550129330039438
Energy: 0.6892906557575912
Energy: 0.6700014057710206
Energy: 0.7543853580875519
Energy: 0.6273021260161677
Energy: 0.6690040830685186
Energy: 0.7612182582975063
Energy: 0.6484156142711126
Energy: 0.6668455544971523
Energy: 0.6962795405106436
Energy: 0.7161354119469491
Energy: 0.6626287752584114
Energy: 0.6683478790741416
Energy: 0.6791277776348178
Energy: 0.7081098214173942
Energy: 0.6793312130080557
Energy: 0.6791079099475641
Energy: 0.7623952522770829
Energy: 0.6733577561851262
Energy: 0.7648770211546008
Energy: 0.6744354234672074
Energy: 0.713839235929638
Energy: 0.631936281214899
Energy: 0.675972406411866
Energy: 0.7433924537956225
Energy: 0.6476291023291321
Energy: 0.6797945873398394
Energy: 0.6855981987775266
Energy: 0.6628341702745509
Energy: 0.6774788183142303
Energy: 0.7440970422735973
Energy: 0.6646706825127034
Energy: 0.7030211797398787
Energy: 0.6807979953847163
Energy: 0.6525423809292746
Energy: 0.6327412289796889
Energy: 0.6490828112196595
Energy: 0.6615889637433501
Energy: 0.7344728877776833
Energy: 0.6451326246038936
Energy: 0.6566957386989822
Energy: 0.6949469624145642
Energy: 0.6481312361614607
Energy: 0.7047804032535603
Energy: 0.6850261015482224
Energy: 0.6323894659753978
Energy: 0.6561659791520189
Energy: 0.6751797948691146
Energy: 0.7004473652181885
Energy: 0.6977833314394829
Energy: 0.6669052502936201
Energy: 0.72339378964927
Energy: 0.766617880009057
Energy: 0.6790644900472353
Energy: 0.6971645465823048
Energy: 0.7101308097830067
Energy: 0.7401005101783998
Energy: 0.6937183612748143
Energy: 0.7167058955580669
Energy: 0.8260638232797005
Energy: 0.6906917464869915
Energy: 0.6786367321157625
Energy: 0.7735367800046419
Energy: 0.6549384269751453
Energy: 0.6628649968412665
Energy: 0.7721578480414261
Energy: 0.7135575901521932
Energy: 0.6582759180644423
Energy: 0.6397424203802143
Energy: 0.803686911970136
Energy: 0.6766634829837964
Energy: 0.6261527488426473
Energy: 0.7633348774365545
Energy: 0.6960779894631861

minimum gb energy = 0.624628766556815 eV
minimum distance =  1.86508299512274 Angstroms
sigma value = 33


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

Energy: 0.011658047205069567
Energy: 0.8663647182972988
Energy: 0.013487386427507898
Energy: 0.013346369687751294
Energy: 1.053157706293871
Energy: 0.012830938848420702
Energy: 0.48000769369891794
Energy: 0.5577125998853035
Energy: 0.32795621332238106
Energy: 0.3353435907624466
Energy: 0.3989483610489633
Energy: 0.22615142127014512
Energy: 0.9633116397646418
Energy: 0.6892647362709144
Energy: 0.6678318559298305
Energy: 1.0025508817385949
Energy: 0.6075302202580047
Energy: 0.9739181040570778
Energy: 0.48000768650877035
Energy: 0.5571668979617372
Energy: 0.3392151307470063
Energy: 0.3651207367298883
Energy: 0.35076391859032724
Energy: 0.20969178198635216

minimum gb energy = 0.011658047205069567 eV
minimum distance =  1.92254475563064 Angstroms
sigma value = 1