Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Fe__MO_492310898779_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.604343503713608
cohesive_energy=4.246784762095345
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.90808021872962e-19, 2.7468517301612997e-19, 3.36628526039838e-19, 3.8688079616524797e-19, 4.28971578517062e-19, 4.64897185181244e-19, 4.95928142228556e-19, 5.2293443157126e-19, 5.46548912979786e-19, 5.67249035091066e-19, 5.854032985309199e-19, 6.01308105976638e-19, 6.155931128453819e-19, 6.2873416559745e-19, 6.4002149998398e-19, 6.494871595376519e-19, 6.573602555171279e-19, 6.638618882979e-19, 6.69152275543368e-19, 6.733371609113759e-19, 6.76488642350454e-19, 6.786708069259619e-19, 6.79942935173358e-19, 6.8035629674493e-19, 6.79914095993946e-19, 6.784849544364179e-19, 6.7590224570241e-19, 6.719640955360379e-19, 6.6643338179547e-19, 6.590265192164879e-19, 6.494038463526839e-19, 6.37156808162388e-19, 6.2178872988906e-19, 6.0269879529495e-19, 5.791500031284179e-19, 5.5022751053145e-19, 5.148017829770759e-19, 4.71454894144206e-19, 4.1838759967285797e-19, 3.5329917391660796e-19, 2.73217579219386e-19, 1.74251128537206e-19, 5.1228796783833e-20, -1.0282801680544679e-19, -2.9750817916745996e-19, -5.464095236126279e-19, -8.70488200078344e-19, -1.3048495007921819e-18, -1.9129027703979595e-18, -2.8195905493449e-18, -4.2964769705660996e-18, -7.00445989558656e-18, -1.27711902761091e-17, -2.7399783924014397e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.020179792284663062
Energy: 0.021172399436200483
Energy: 0.9037709879175052
Energy: 0.8136908932444394
Energy: 0.806705840720577
Energy: 0.3015858240883271
Energy: 0.02110575296120847
Energy: 0.020742942279159588
Energy: 0.48965133455486276
Energy: 0.07092663592747027
Energy: 0.12584716285996642
Energy: 0.4840001963601598
Energy: 0.021880974514932268
Energy: 0.07021575622134947
Energy: 0.02067330883849075
Energy: 0.4874437804082057
Energy: 0.6676191393308785
Energy: 0.12573131303428906
Energy: 0.479909688295346
Energy: 0.06867919124323292
Energy: 0.07017606197568733
Energy: 0.022590964398781496
Energy: 0.4794038402461834
Energy: 0.12424929128158568
Energy: 0.4863791860510793
Energy: 0.4833752625884715
Energy: 0.06889136924097629
Energy: 0.021348971874185864
Energy: 0.07005608693402272
Energy: 0.49323153080368953
Energy: 0.0718786575355334
Energy: 0.12524743869340174
Energy: 0.480622570565888
Energy: 0.021540251514127338
Energy: 0.07030918356834882
Energy: 0.02057308964978546
Energy: 0.4868812846549359
Energy: 0.3663660965544215
Energy: 0.12502581251686462
Energy: 0.48566669954452596
Energy: 0.06850430189536752
Energy: 0.07007094451070024

minimum gb energy = 0.020179792284663062 eV
minimum distance =  2.52198779803044 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.036849759772341
Energy: 0.997817362154686
Energy: 0.9555732298369699
Energy: 1.0738532992481704
Energy: 0.9721015361990089
Energy: 0.8982445336538942
Energy: 0.9736243913765582
Energy: 0.9336621458630981
Energy: 0.8829271671286807
Energy: 0.8851169170037796
Energy: 0.8950808761897666
Energy: 0.8739772156842095
Energy: 0.8914159519714842
Energy: 0.9224520350592555
Energy: 0.9848903029500665
Energy: 0.8449538694565149
Energy: 0.8356321566775978
Energy: 0.9505529667700621
Energy: 0.8917242459879641
Energy: 0.8345357427929628
Energy: 0.9811880042285294
Energy: 0.9039372399103054
Energy: 0.8483566243836139
Energy: 0.904835772989213
Energy: 0.8854475681440652
Energy: 0.9418941340289537
Energy: 0.9193548422088882
Energy: 0.8924667333887847
Energy: 0.9466834565882204
Energy: 0.8644006244062867
Energy: 1.040212499297758
Energy: 0.9288007130499417
Energy: 0.9418953828433212
Energy: 1.0467427801466092
Energy: 0.947219443114949
Energy: 1.0069581238883927
Energy: 0.8165752705659923
Energy: 1.0211701030424303
Energy: 0.9105685660484781
Energy: 0.8777056436474361
Energy: 0.9231692331165036
Energy: 0.9480745512638815
Energy: 0.981384006834725
Energy: 0.9090502388419581
Energy: 0.9135731994623545
Energy: 0.8915055255942111
Energy: 0.8790098364262129
Energy: 0.9609879593087953
Energy: 0.9096590693967916
Energy: 1.064669646704184
Energy: 0.9876173407872414
Energy: 0.8659801786834026
Energy: 0.9616419201069155
Energy: 0.9420396446420469
Energy: 0.929504424835695
Energy: 0.975707654986985
Energy: 0.9811486331634055
Energy: 0.9093240282543976
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Energy: 0.8018430894126656
Energy: 0.8515922559903552
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Energy: 0.923235290197037
Energy: 0.9705672067435551
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Energy: 1.0098477923509586
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Energy: 0.9818595792761742
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Energy: 0.9081787784861048
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Energy: 0.8451208337961359
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Energy: 0.872272973492541
Energy: 0.8940680403647069
Energy: 0.9612887439346962
Energy: 0.9341278460707705
Energy: 0.9144717507851844
Energy: 0.8864315961842615
Energy: 0.9599795347331248
Energy: 0.8454900666808086
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Energy: 0.8604237816063881
Energy: 0.9948871410961128
Energy: 0.9396902449209504
Energy: 1.052991874478917
Energy: 0.9196203875123824
Energy: 0.9715814888664088
Energy: 1.1211895566983274
Energy: 0.9686196752102769
Energy: 0.9174500182239687
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Energy: 0.9972198079328004
Energy: 0.8703766923466676
Energy: 0.9409534446763739
Energy: 0.8811396916081059
Energy: 0.8558820354666566
Energy: 0.8856610447130329
Energy: 0.988667911539144
Energy: 0.8246558030805085
Energy: 0.8628478882228103
Energy: 0.8145309161178154
Energy: 0.8336042414422664
Energy: 0.9154532019485102
Energy: 0.9604683166051948
Energy: 0.9696464524830021
Energy: 0.9340690296488864
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Energy: 0.9204799813014165
Energy: 1.0724546594464077
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Energy: 1.1138685893253013
Energy: 0.920227819872945
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Energy: 0.8879042840958221
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Energy: 0.9274331691048915
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Energy: 0.9496308994563575
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Energy: 0.9650260858669933
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Energy: 0.9237239965649042
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Energy: 0.9225835491633563
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Energy: 0.9831114301662534
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Energy: 0.8984554560175262
Energy: 0.8163436520886664
Energy: 0.8765440112295279
Energy: 0.8269037061074571
Energy: 0.8985116643716067
Energy: 0.8525072878549066
Energy: 0.9003974194481837
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Energy: 0.8738885957716417
Energy: 1.0071969877429963
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Energy: 0.9497058470180499
Energy: 0.9344863987543853
Energy: 0.9145052682805639
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Energy: 0.8809162201249477
Energy: 0.9793621574173327
Energy: 1.017257137312817
Energy: 0.9005327197378863
Energy: 1.05695775273453
Energy: 0.932408694983176
Energy: 0.9359573989017442
Energy: 0.8905964305734245
Energy: 0.8569862455257817
Energy: 0.8408805753418868
Energy: 0.8969450729302367
Energy: 0.9391878417832366
Energy: 1.0096812352918694
Energy: 0.8829659047609936
Energy: 0.8356727127678079
Energy: 0.9693124637159503
Energy: 0.9836643734344384
Energy: 0.8361331884611715
Energy: 0.988563698593748
Energy: 0.9357485703484069
Energy: 0.9523782140310246
Energy: 0.9041286188774934
Energy: 1.0213650172060194
Energy: 1.0219406247240432
Energy: 0.8931051921899706
Energy: 0.9440709160146914
Energy: 0.8968986117913799
Energy: 0.9197988993193551
Energy: 1.0221601345260836
Energy: 0.9197100675324045
Energy: 0.8389581981295009
Energy: 0.851653632881294
Energy: 0.9400853169484403
Energy: 0.9405643017822986
Energy: 0.9180867406854386
Energy: 1.0239926740442045
Energy: 0.9127538720694062
Energy: 0.8365172703966972
Energy: 0.8984170015505604
Energy: 0.9506542532832787
Energy: 0.9531537659239382
Energy: 0.9290603008356391
Energy: 0.9333889944234715
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Energy: 1.0002781885911385
Energy: 0.8836471834739913
Energy: 0.8411189728431231
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Energy: 0.9758838558012362
Energy: 0.8667036093238012
Energy: 0.9308803248066062
Energy: 0.9891529008249444
Energy: 0.8865290048287211
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Energy: 0.8752282387940507
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Energy: 0.9230760076368815
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Energy: 0.8555222018160241
Energy: 1.0293774280857946
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Energy: 1.0544841164437921
Energy: 0.9093392661101444
Energy: 0.9463690770263258
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Energy: 0.9240007257384572
Energy: 0.9943415030468657
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Energy: 0.9072604193184607
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Energy: 0.8489516698520422
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Energy: 0.9160151016766906
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Energy: 0.8950889393456725
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Energy: 0.9447387535771136
Energy: 1.0416214913137192
Energy: 0.9781312413178114
Energy: 1.0230532323973691
Energy: 1.0777235494150246
Energy: 1.00959518418208
Energy: 1.0122164378198326
Energy: 0.8802621343126942
Energy: 0.9703905209350427
Energy: 0.9109321111536428
Energy: 0.93282191370249
Energy: 0.82785788400998
Energy: 0.8917179331675494
Energy: 1.1890605477156642
Energy: 0.9233175146909618
Energy: 0.940346180985604
Energy: 0.8556978352306771
Energy: 1.000698144427036
Energy: 0.9897495686606016
Energy: 0.9960701067315086
Energy: 0.9606125683660598
Energy: 1.0079086702597513
Energy: 1.006365028794808
Energy: 0.9509072954028648
Energy: 0.9622783030458464
Energy: 1.0874817211063144
Energy: 1.027029469159934
Energy: 1.0413335041041187
Energy: 0.8604133762315833
Energy: 0.9054866732825544
Energy: 0.9022297553801634
Energy: 0.8774147382052284
Energy: 0.8276532047230154
Energy: 0.8904165719968182
Energy: 0.9455114134745406
Energy: 0.8451850665876046
Energy: 0.9082166922005438
Energy: 0.885428144092207
Energy: 0.9076672358927637
Energy: 0.8767002498221166
Energy: 0.9305490907628908
Energy: 0.8962396046431738
Energy: 0.9354011571581975
Energy: 0.9793861662333202
Energy: 0.9727342136200278
Energy: 0.9192852549848417
Energy: 1.0707788135170775
Energy: 0.9967615444131881
Energy: 0.8904153164267126
Energy: 0.8823491282945143
Energy: 0.8715504136680784
Energy: 0.9269252243657286
Energy: 0.9216844763736373
Energy: 0.9313731492427525
Energy: 0.9215813447284317
Energy: 0.8769541372371485
Energy: 0.8531039615921635
Energy: 0.9019805014144234
Energy: 0.8711043887346918
Energy: 0.9013469443194466
Energy: 0.9284987504111358
Energy: 0.9311796960340911
Energy: 0.9876328908060772
Energy: 0.9230593475988214
Energy: 0.9238839763140899
Energy: 0.9266958598308539
Energy: 0.9638154401330515
Energy: 0.935860008723133
Energy: 0.9400906668262473
Energy: 0.9114044402210566
Energy: 0.9203208876070526
Energy: 0.9692110607953254
Energy: 0.9589191655694967
Energy: 1.0485176030972747
Energy: 0.906855423472895
Energy: 0.9320731034336042

minimum gb energy = 0.8018430894126656 eV
minimum distance =  2.2564565806009 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.0892878605276264
Energy: 0.9331756644137901
Energy: 0.9477989236682619
Energy: 0.8419109060682755
Energy: 0.8358548487295161
Energy: 0.9422835795942943
Energy: 0.9102981057605528
Energy: 0.9638197699737393
Energy: 0.8404925588731843
Energy: 0.8157769737546231
Energy: 1.05559212267681
Energy: 0.8720485311019782
Energy: 0.8261080234473596
Energy: 0.9976539801150146
Energy: 0.9116484345214408
Energy: 0.9077312788721509
Energy: 0.8510899896863554
Energy: 0.9401166135329706
Energy: 0.9161158237883159
Energy: 0.9166505323823133
Energy: 0.8916829777470198
Energy: 0.9281145699950732
Energy: 0.9162653086812396
Energy: 0.9762871866769041
Energy: 0.9807487644448623
Energy: 0.9182754882174186
Energy: 1.0010261386168715
Energy: 1.1180567345656058
Energy: 0.9876720295760225
Energy: 0.8037183008581174
Energy: 0.9025132772097415
Energy: 0.937193415390973
Energy: 0.9033395092727713
Energy: 1.071606287345672
Energy: 1.0525108050327179
Energy: 0.9381451916395862
Energy: 0.8400724487091146
Energy: 1.0162405942752977
Energy: 0.9318887779968362
Energy: 0.8604248069668384
Energy: 0.9516124181875887
Energy: 0.9593010918680857
Energy: 0.9781289877025596
Energy: 0.8608289807882322
Energy: 0.9777600125576478
Energy: 0.9441474579996764
Energy: 0.9115092027007284
Energy: 0.991758515118285
Energy: 0.8773063723668656
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Energy: 0.989131934750922
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Energy: 0.9324525277827594
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Energy: 0.8316616012572405
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Energy: 1.0024539060180524
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Energy: 0.9785373324736728
Energy: 0.8635746815356972
Energy: 0.9763179461497654
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Energy: 0.7833551818976077
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Energy: 0.842297505532128
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Energy: 0.8760155979930364
Energy: 0.9662694091558689
Energy: 0.911417455791959
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Energy: 1.1764366205720351
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Energy: 0.9355608009022637
Energy: 0.9718432952163474
Energy: 0.9066015963347096
Energy: 0.9373690670051111
Energy: 0.8711828138456057
Energy: 0.9144912048158885
Energy: 0.83408822736802
Energy: 0.8665001516516319
Energy: 1.001709973858551
Energy: 0.9035151186707495
Energy: 0.9658821286049047
Energy: 0.8781890901850171
Energy: 1.2072995662503867
Energy: 0.8996682582172717
Energy: 0.861157236409975
Energy: 0.9977208010390939
Energy: 0.9080130945732124
Energy: 0.9285179268380876
Energy: 0.9627923206504666
Energy: 0.9739035684354238
Energy: 0.9368966672896796
Energy: 0.9795904497401585
Energy: 0.990248160121136
Energy: 0.9914401072345883
Energy: 0.9218765026318031
Energy: 0.9778515154961316
Energy: 0.9833156654223837
Energy: 0.9289979888523455
Energy: 0.9274547123662896
Energy: 0.9807059454156432
Energy: 0.9880542377630759
Energy: 0.7741120230453739
Energy: 0.9388710547488934
Energy: 0.970714692874971
Energy: 0.8950889810384846
Energy: 0.7794941400637861
Energy: 0.9179206626971141
Energy: 0.9854133613028266
Energy: 0.8011495105260051
Energy: 0.9022697491276355
Energy: 0.9383467001726562
Energy: 0.896170007379023
Energy: 0.9402143511477979
Energy: 0.9717105910895643
Energy: 0.9606775853385339
Energy: 0.9153162907676698
Energy: 0.976829363668222
Energy: 0.9722311307409411
Energy: 0.8952703931800269
Energy: 0.9933715019608997
Energy: 1.0253842006034113
Energy: 0.9630918338301215
Energy: 0.8435181939894789
Energy: 0.8425388270521066
Energy: 0.9706717981675154
Energy: 0.9406049992257005
Energy: 0.8508416423004381
Energy: 0.82410948031475
Energy: 1.039806045668969
Energy: 0.8412506292286034
Energy: 0.8410696168745244
Energy: 0.9518145985936215
Energy: 0.8811942936942634
Energy: 0.8761948134590143
Energy: 1.0041612314094222
Energy: 0.9155647942333422
Energy: 0.9781276954324101
Energy: 0.9369165312304176
Energy: 0.8700230163631946
Energy: 0.9338935243692099
Energy: 0.9561130921562467
Energy: 0.9719992464876617
Energy: 0.9036207630670801
Energy: 0.8957071998155247
Energy: 0.8730229494010867
Energy: 0.9846397962383335
Energy: 0.9305274816823043
Energy: 0.8645702284606512
Energy: 0.9447204165270252
Energy: 0.90684288006799
Energy: 0.9376110273319054
Energy: 0.8791119274405129
Energy: 1.1826554691340385
Energy: 0.8993869420490503
Energy: 0.8684057631445805
Energy: 1.0007891325313052
Energy: 0.9114013546321459
Energy: 0.85210469553553
Energy: 0.9632813279846891
Energy: 1.0129910708338108
Energy: 0.9843007688612961
Energy: 0.9793057438490483
Energy: 0.9810441371589863
Energy: 0.9058076317133597
Energy: 0.9083619641781712
Energy: 1.0164831670580745
Energy: 0.8912692888469871
Energy: 0.921419339554404
Energy: 0.9389790328424404
Energy: 1.018368060276508
Energy: 0.8677824060199285
Energy: 0.9118423204421476
Energy: 1.018113861573763
Energy: 0.9719020612561238
Energy: 0.8250599962889844
Energy: 0.9614155830847622
Energy: 1.0466167968077378
Energy: 0.9992413711994527
Energy: 0.783009806518931
Energy: 0.9090684024387072
Energy: 0.90921958464892
Energy: 0.8986845410393445
Energy: 0.9412403978309073
Energy: 1.0698128230031463
Energy: 0.911503608999766
Energy: 0.9065858492852585
Energy: 0.9767214727935536
Energy: 0.9726755343240995
Energy: 0.8934626354129981
Energy: 0.9928625529074642
Energy: 0.9709491614146083
Energy: 0.9617116799833003
Energy: 0.8422884501788327
Energy: 0.840821287219535
Energy: 0.9713232686219754
Energy: 0.945414904419651
Energy: 0.9134313816064383
Energy: 0.8606744434267002
Energy: 0.9069257265958854
Energy: 0.8782452945629557
Energy: 0.9107222962637379
Energy: 0.950679031315059
Energy: 1.0706814269871654
Energy: 0.8769197037732726
Energy: 1.0057277044971298
Energy: 0.9101525619048283
Energy: 0.8977474113878109
Energy: 0.9308536575739175
Energy: 0.8094634904719208
Energy: 0.9329548984660333
Energy: 0.9094718703042738
Energy: 0.9433002229838389
Energy: 0.9807164952624878
Energy: 0.8928736468895198
Energy: 0.8461926541721815
Energy: 0.9565038863772387
Energy: 0.7363890928737723
Energy: 0.8569863544724718
Energy: 0.892211149517332

minimum gb energy = 0.7363890928737723 eV
minimum distance =  2.27195261332185 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.9148599032785394
Energy: 0.916275053421963
Energy: 0.9735584695560817
Energy: 0.9668404988128159
Energy: 0.916200597917239
Energy: 0.9312506575902768
Energy: 0.9475153547306336
Energy: 0.9654055542009193
Energy: 0.9636817616719737
Energy: 0.9057863564016346
Energy: 0.9486937820934962
Energy: 0.9392783950961863
Energy: 0.9262054228391834
Energy: 0.9974951314176068
Energy: 0.8848187597975408
Energy: 0.8984469375470229
Energy: 0.864456136962805
Energy: 0.9505825039897116
Energy: 0.9249765140645019
Energy: 1.0210790694256426
Energy: 0.8458568217193176
Energy: 0.9932903786394736
Energy: 0.9322958710901139
Energy: 0.8371930679038716
Energy: 0.9638303734650591
Energy: 0.9500453992083361
Energy: 0.8824138637551195
Energy: 0.9533579520221053
Energy: 0.9588155249616935
Energy: 0.8428463484961288
Energy: 0.8903702265360969
Energy: 1.0501451682884637
Energy: 0.881461702697679
Energy: 1.008721345217642
Energy: 0.8310116994364587
Energy: 0.8924914177323864
Energy: 0.8773382419585241
Energy: 0.9059811193951489
Energy: 0.8283528545253306
Energy: 0.830440954363941
Energy: 0.9107002711691481
Energy: 0.8566600841910468
Energy: 0.915759800859471
Energy: 0.9459613434954424
Energy: 1.0020815368136031
Energy: 0.9228465433240016
Energy: 0.9398620430083146
Energy: 0.9341885289671952
Energy: 1.0045165125098092
Energy: 0.8584209992722523
Energy: 0.9621238219068949
Energy: 0.9307482834514289
Energy: 0.8914968446103408
Energy: 0.939299316127377
Energy: 1.1163152369021672
Energy: 0.9240981861403651
Energy: 0.9898605820776967
Energy: 0.9019684956533304
Energy: 0.8652688790905545
Energy: 0.9655468291277235
Energy: 0.9260184290275503
Energy: 0.8721409192034076
Energy: 0.831202214835565
Energy: 0.8903286855306419
Energy: 0.9319855023958271
Energy: 0.9473570438740854
Energy: 0.8891072757489552
Energy: 0.9499442932549139
Energy: 0.8835123758332709
Energy: 0.9301196927551867
Energy: 0.9259598305309211
Energy: 0.848242812979788
Energy: 0.891915199746777
Energy: 0.988367590656789
Energy: 0.8822498462504474
Energy: 1.0589385606919577
Energy: 0.837884437979686
Energy: 0.8929361318770019
Energy: 0.8897017837696332
Energy: 0.8909638766332227
Energy: 0.8287946088283178
Energy: 0.9056619265193769
Energy: 0.935790120552456
Energy: 0.8568263097847731
Energy: 0.91514473231445
Energy: 0.9455875431265471
Energy: 0.9427448844231942
Energy: 0.9231463843836518
Energy: 0.9439568016866777
Energy: 0.9345372791257671
Energy: 0.8905453476420925
Energy: 0.9063505178834391
Energy: 0.96176751976364
Energy: 0.9346107243627504
Energy: 0.9545483508282397
Energy: 0.9001164539962612
Energy: 0.9507575478106518
Energy: 0.9240831945545719
Energy: 0.9899985695020393
Energy: 0.9022681071794625
Energy: 0.9616302168817609
Energy: 0.902019385053616
Energy: 0.9269954112124874
Energy: 0.9080628199745051
Energy: 0.8310583805432846
Energy: 0.8725461440048529
Energy: 0.9361348023628902
Energy: 0.9126454533261902
Energy: 0.8883515036350933
Energy: 0.9456392436951223
Energy: 0.9436266560492548
Energy: 0.9651461397202228
Energy: 0.9261849887341835
Energy: 0.9397694430329109
Energy: 0.9283952829260775
Energy: 0.9082208291290517
Energy: 0.9252997640591135
Energy: 0.9815398741393682
Energy: 0.9547773212027663
Energy: 0.83000534355652
Energy: 0.8564304701032047
Energy: 0.8838661655336031
Energy: 0.8401615611313904
Energy: 0.9057894535587158
Energy: 0.9007693945097662
Energy: 0.8788753751624803
Energy: 0.9526830026950333
Energy: 0.9109176316420475
Energy: 1.0062177853402845
Energy: 0.9243614974010308
Energy: 0.8808869301049987
Energy: 0.9345958390219569
Energy: 0.8340208881683939
Energy: 0.9441271459811587
Energy: 0.8534445816622622
Energy: 0.9302556030367848
Energy: 0.985241551998511
Energy: 0.8694330230560257
Energy: 1.0499909928307187
Energy: 0.9710016804365746
Energy: 0.9943413331576163
Energy: 0.8984047087726275
Energy: 0.9515948064829258
Energy: 0.9011545996235081
Energy: 0.8330587449394247
Energy: 0.9725496559106837
Energy: 0.8430948789177022
Energy: 0.8873900279015126
Energy: 0.9644672213638936
Energy: 0.9559652013774337
Energy: 0.8235466298094704
Energy: 0.908603680943986
Energy: 0.9422193347821721
Energy: 0.9650264339318066
Energy: 0.9247562612035599
Energy: 0.9930328967592078
Energy: 0.9273852728902638
Energy: 0.944894994313202
Energy: 0.9217114329930925
Energy: 1.0169199055486742
Energy: 0.9470524968838563
Energy: 0.8963622774541303
Energy: 0.8565449767890034
Energy: 0.8357225853950917
Energy: 0.8406880521739275
Energy: 0.8953225824178105
Energy: 0.8703157858084106
Energy: 0.9260610508311524
Energy: 1.0365363539743062
Energy: 0.9272305251655839
Energy: 1.0365386614721006
Energy: 0.9504001782452429
Energy: 0.8821289173423968
Energy: 0.9347627947697985
Energy: 0.8856045272975898
Energy: 0.9958173095891846
Energy: 1.0353865369395077
Energy: 0.9307242046720808
Energy: 0.9967336776852799
Energy: 0.9220768555758675
Energy: 1.0483452844550756
Energy: 0.9781557800584405
Energy: 0.9528731008979043
Energy: 1.012066262852493
Energy: 1.0211237514643414
Energy: 0.8997944246821327
Energy: 0.9333141009314148
Energy: 0.9190499263271293
Energy: 0.959915419289956
Energy: 0.9696603675633331
Energy: 0.9651059985568312
Energy: 0.9299483336714249
Energy: 0.8231651395583863
Energy: 0.8766842960856805
Energy: 0.8891700785816652
Energy: 0.9683301050849213
Energy: 0.9244267387378978
Energy: 0.9779262620988947
Energy: 0.889696749015949
Energy: 0.8898989284697997
Energy: 0.8551941241383708
Energy: 0.9372465363838515
Energy: 0.9535123570952357
Energy: 0.9141300025157638
Energy: 0.8947668926584126
Energy: 1.0503209494980794
Energy: 0.8412863490468797
Energy: 0.8616148687208837
Energy: 0.9012205968867464
Energy: 0.9233703374466072
Energy: 1.0392247464004474
Energy: 0.9271122931024536
Energy: 0.8698029611651195
Energy: 0.9506164574983039
Energy: 0.9647449936683025
Energy: 0.8908651447037312
Energy: 0.8861386394291946
Energy: 0.8841180479879085
Energy: 1.0488564651532832
Energy: 0.9311875724649469
Energy: 0.9962060212355239
Energy: 0.9645532212158828
Energy: 1.0504815344884406
Energy: 0.9594340623105586
Energy: 0.9545334566102261
Energy: 1.0121911319459667
Energy: 1.0741730325688281
Energy: 0.9397688176049807
Energy: 0.9635695004884657
Energy: 0.9755940227777813
Energy: 0.9934067803400064
Energy: 0.9330472820895693
Energy: 0.8224079101051804
Energy: 0.961499542116709
Energy: 0.8228027212950324
Energy: 0.8408355056307663
Energy: 0.9807735644655077
Energy: 0.8474618938823043
Energy: 0.9253879420822967
Energy: 0.8695591678227426
Energy: 0.9102244927924059
Energy: 0.8735926623761832
Energy: 0.8929652067576076
Energy: 0.9448491239388961
Energy: 0.917732788852222
Energy: 0.9308423013953865
Energy: 0.9053951251539237
Energy: 1.0247291495791377
Energy: 0.9163523070456217
Energy: 0.885689882041918
Energy: 0.9309567110454938
Energy: 0.8779845594299052

minimum gb energy = 0.8224079101051804 eV
minimum distance =  2.25400341621842 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.9922911731915813
Energy: 1.0078367690341339
Energy: 0.9218307521376745
Energy: 0.893261448980138
Energy: 0.8369085624366686
Energy: 0.8482783405365798
Energy: 0.9876510865153635
Energy: 0.864007214487808
Energy: 0.7602956452007781
Energy: 0.8971119901501085
Energy: 0.8982190214739079
Energy: 1.041644814023288
Energy: 1.0092062167769076
Energy: 1.0364708240715486
Energy: 0.8463865586115721
Energy: 0.834838949906484
Energy: 0.9556115548616272
Energy: 0.8539593863356787
Energy: 1.0072950833771244
Energy: 1.0105959737953354
Energy: 0.788239359948519
Energy: 0.9308662650632636
Energy: 0.9109900433792144
Energy: 0.7893005262863795
Energy: 0.7201079935739879
Energy: 0.8938405067976466
Energy: 0.8941814386528467
Energy: 1.0078056433711744
Energy: 1.0376758695098882
Energy: 1.035863249061449
Energy: 0.9000621640094053
Energy: 0.9810113649660102
Energy: 0.8187151495855995
Energy: 0.9579885075122702
Energy: 0.9551698604121464
Energy: 0.9773906430543214
Energy: 0.9114703483085262
Energy: 0.8834173039294225
Energy: 0.9090389551329827
Energy: 0.8910454026934631
Energy: 1.0127354844514644
Energy: 0.9834447410952529
Energy: 0.8803207095264018
Energy: 0.9252643215616112
Energy: 0.9128108300073671
Energy: 0.9095362387463404
Energy: 0.9865057289542861
Energy: 0.9771030363615385
Energy: 1.0145784706233822
Energy: 0.9779708059139777
Energy: 0.8850261618936686
Energy: 0.8658278775469891
Energy: 0.7537774139854373
Energy: 0.8041818113777794
Energy: 0.8384169020278299
Energy: 1.1328331332757835
Energy: 0.9781581699999213
Energy: 0.884716829066905
Energy: 0.8643242919205242
Energy: 0.9065319049889847
Energy: 0.9254800806283421
Energy: 0.9519304057672033
Energy: 1.1331535729342046
Energy: 0.878326940534219
Energy: 0.7851624849890979
Energy: 0.8842639159041645
Energy: 0.9595895694467617
Energy: 1.0383302730976365
Energy: 1.0237025782850304
Energy: 0.8336144494066047
Energy: 0.9299087597672744
Energy: 0.9479054347726962
Energy: 0.7961273079928306
Energy: 0.7234241859578759
Energy: 1.0056804083544093
Energy: 1.0090461285495151
Energy: 0.7806711183609505
Energy: 1.0454322095982478
Energy: 1.0399836933158806
Energy: 0.8321436053018302
Energy: 0.9013661407375583
Energy: 0.9091741716587308
Energy: 1.0461324485866574
Energy: 0.9493259657981027
Energy: 0.9751075353051747
Energy: 1.0350115358147574
Energy: 0.9668225011251098
Energy: 0.8944219805453193
Energy: 0.7424340275788046
Energy: 0.7369200796263635
Energy: 1.011026513058973
Energy: 0.9791485180185251
Energy: 0.7261396999481905
Energy: 0.912387650359575
Energy: 0.8625333381674607
Energy: 0.9869669594433619
Energy: 0.9866568901708016
Energy: 1.018214273837318
Energy: 0.864927535756752
Energy: 0.7599843015412551
Energy: 0.8798561713820142
Energy: 1.0917557260358546
Energy: 0.9886047098740453
Energy: 0.9871494204836384
Energy: 1.0162051967903747
Energy: 0.9924046500061299
Energy: 1.0593339744515349
Energy: 0.912321898006384
Energy: 0.8916321028411175
Energy: 0.8382860314420683
Energy: 0.8465069810180853
Energy: 0.9768123898160294
Energy: 0.9552208301420073
Energy: 0.7608169048652469
Energy: 0.8969044671530065
Energy: 0.8974893943376754
Energy: 1.042185531853008
Energy: 1.010151498472002
Energy: 1.0367956414821038
Energy: 0.9162066854627515
Energy: 0.8350868572745608
Energy: 0.9548174345276957
Energy: 0.8607245589653444
Energy: 1.0076346777829983
Energy: 1.0105468827638207
Energy: 0.7891848689954859
Energy: 0.9229136360946122
Energy: 0.9100999138585271
Energy: 0.7914519234770879
Energy: 0.7637976112804362
Energy: 0.8938122864395116
Energy: 0.8817618145905906
Energy: 1.0079256593249317
Energy: 1.0376425835830678
Energy: 1.0355303070178483
Energy: 0.9006134495217258
Energy: 0.9810813323751122
Energy: 0.8196967010717134
Energy: 0.8782828379712975
Energy: 0.9574912847928189
Energy: 0.9764318485462361
Energy: 0.9120499484678073
Energy: 0.8831281630148174
Energy: 0.9089911256185694
Energy: 0.8908117673433712
Energy: 0.9877314495114826
Energy: 0.9743584260856266
Energy: 0.8801236935933994
Energy: 0.7499099718081564
Energy: 0.9123662887295856
Energy: 0.9101394774264459
Energy: 0.9870096045936148
Energy: 0.9776743574690382
Energy: 1.0156963386778597
Energy: 0.9774839218077006
Energy: 0.884375410356974
Energy: 0.8644033032843781
Energy: 0.754269309095805
Energy: 0.8046288667947874
Energy: 0.8374047309668425
Energy: 1.1327550248499614
Energy: 0.9785253612152104
Energy: 0.8846949961614498
Energy: 0.8645162827150449
Energy: 0.9096593754191159
Energy: 0.9268136860027989
Energy: 0.837852350424865
Energy: 0.975419069995904
Energy: 0.87844782623376
Energy: 0.9860040392599986
Energy: 0.8904491594438863
Energy: 0.9594014772301098
Energy: 1.0394135237075086
Energy: 1.010649175805416
Energy: 1.013852367341551
Energy: 0.9300212340617678
Energy: 0.9475102291208182
Energy: 0.7936645632010308
Energy: 0.7236218307755019
Energy: 1.0058519067661384
Energy: 0.8957315983704235
Energy: 1.0833856294610402
Energy: 1.0454643719312215
Energy: 1.0402512319025028
Energy: 0.7613840509022799
Energy: 0.8339823604451723
Energy: 0.9085199053196772
Energy: 1.0050051768522104
Energy: 0.9485643474292118
Energy: 0.9753684286385389
Energy: 1.035505715563925
Energy: 0.9666965568189141
Energy: 0.8941199308013026
Energy: 0.7425257021391878
Energy: 0.7382945227502185
Energy: 1.0110302744200796
Energy: 0.8778872457164691
Energy: 0.72640730790983
Energy: 0.9124987576719062
Energy: 0.8626393168938721
Energy: 0.9878367631705013
Energy: 0.9864249203653092
Energy: 1.0496657754111993
Energy: 0.8654474229998289
Energy: 0.759489941552241
Energy: 0.8804564425535133
Energy: 0.9110759642883877
Energy: 0.9890136107039932
Energy: 0.9873614041804809
Energy: 0.974998202117725

minimum gb energy = 0.7201079935739879 eV
minimum distance =  2.24279030100097 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.2048331349519865
Energy: 0.9244066858368891
Energy: 0.7495922995975514
Energy: 0.8109726430181377
Energy: 0.9540430613601163
Energy: 0.8971457071269403
Energy: 0.9267676107794972
Energy: 0.9350972482622644
Energy: 0.9014903392143578
Energy: 0.7809587056076416
Energy: 0.8938436742446494
Energy: 0.9385090641553312
Energy: 0.8993663111674655
Energy: 0.929396846969546
Energy: 0.8913317100933121
Energy: 0.8094058004904293
Energy: 0.8514419542456511
Energy: 0.921668075397739
Energy: 0.9193572225978495
Energy: 0.8734984213409094
Energy: 1.000243262145396
Energy: 0.8401171167736314
Energy: 0.9683475599852539
Energy: 1.0516805128926574
Energy: 0.7845303080239324
Energy: 0.8102465998269249
Energy: 0.8918984972180065
Energy: 0.8778411211443471
Energy: 0.8850963273336315
Energy: 0.9393960326250377
Energy: 0.8550772058260897
Energy: 0.8025213165246978
Energy: 0.7678398100033176
Energy: 0.9466881490098951
Energy: 0.895700958436651
Energy: 0.8447578854809057
Energy: 0.7677386902827035
Energy: 1.0049181457002025
Energy: 0.8765916555312109
Energy: 0.6897613572646164
Energy: 0.9282286391264711
Energy: 0.8790284356321449
Energy: 0.9136612526841074
Energy: 0.6953063263617499
Energy: 0.9046370546664072
Energy: 1.023292135733722
Energy: 0.8622546006459517
Energy: 0.8612096959162044
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Energy: 0.8987320489188249
Energy: 0.7326343695359089
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Energy: 0.8321140543552413
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Energy: 0.921935678084805
Energy: 0.8904060654493191
Energy: 0.8865110921335191
Energy: 0.902493624682427
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Energy: 0.9219501505607619
Energy: 0.8616761265840046
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Energy: 0.8882399364051163
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Energy: 0.8871401400367217
Energy: 0.8370398341250492
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Energy: 0.8428854015336216
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Energy: 0.7634496759756967
Energy: 0.7648274583398458
Energy: 0.666205794651144
Energy: 1.0070413737911366
Energy: 0.41377595317607624
Energy: 0.8989779408266743
Energy: 0.9655922492880828
Energy: 0.7679434376438433
Energy: 0.9136982810503554
Energy: 0.8475069841329337
Energy: 0.7902683298533186
Energy: 0.608101757432
Energy: 0.9132128616458497
Energy: 0.8519914712609288
Energy: 0.8616709234826851
Energy: 0.8498083796083593
Energy: 0.8820027017523353
Energy: 0.8035917133859831
Energy: 0.9038814355162106
Energy: 0.917592822539873
Energy: 0.7853285204145881
Energy: 0.8486756762683841
Energy: 0.9471897693562407
Energy: 0.7194766311199345
Energy: 0.9807527152662254
Energy: 0.8219991147704044
Energy: 0.8686022271536104
Energy: 0.980674508256248
Energy: 0.8694039567896311
Energy: 0.7690725008087653
Energy: 0.9579622326723336
Energy: 0.9219089525156603
Energy: 0.9028917266821894
Energy: 0.9975723936513128
Energy: 0.7969826717703657
Energy: 0.9644478229629563
Energy: 0.9168242158978813
Energy: 0.829972143313248
Energy: 0.8135516847135165
Energy: 0.8968175826913098
Energy: 0.902953220303887
Energy: 0.9535169069887774
Energy: 0.7889160813364023
Energy: 0.9244185885253712
Energy: 0.9857113724769673
Energy: 0.8939555515521183
Energy: 0.9838328450680816
Energy: 0.9554252885796226
Energy: 0.8467819255003205
Energy: 0.8137719995698954
Energy: 0.9136726922664293
Energy: 0.8251754712538396
Energy: 0.9355157943667871

minimum gb energy = 0.41377595317607624 eV
minimum distance =  2.24068988428977 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.1452446523110784
Energy: 1.1918589848160337
Energy: -0.8132781643913353
Energy: -0.7438676283077965
Energy: -0.4012741319680174
Energy: 0.9958779330077082
Energy: 1.098659874081813
Energy: 0.9309247505622741
Energy: 0.8852119171227862
Energy: -0.4720173495487008
Energy: 0.42096479971204775
Energy: -0.42948341085053166
Energy: 0.7559765769957995
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Energy: 0.7752499740611206
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Energy: -0.2762924259607627
Energy: 0.9272839211453481
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Energy: -0.2559917016425142
Energy: 1.1501366405353175
Energy: -0.23630990732228002
Energy: -0.5682096623785274
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Energy: 0.9547554071317148
Energy: 0.796547522078783
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Energy: 0.9202816223988396
Energy: 0.8505235800708651
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Energy: 0.7765372599831741
Energy: -0.2802063436744729
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Energy: 0.7198163229303411
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Energy: -0.42508429609238596
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Energy: 0.9146641663480928
Energy: 0.6665058085098393
Energy: 0.7491854868034796
Energy: 0.8402491874939707
Energy: 0.8554186713651282
Energy: 1.1062635225602615
Energy: 0.7559509988396877
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Energy: 0.6557914238096736
Energy: 0.6792010017576037
Energy: 0.7763257429752543
Energy: 0.6931085430547136
Energy: 1.0689312685069567
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Energy: 0.8894541520654341
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Energy: 0.7793691449435689
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Energy: -0.31114860712951137
Energy: 0.6861926588322674
Energy: 0.8408458597928543
Energy: 0.7297849916233788
Energy: 0.737553076723003
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Energy: 0.9800945511040855
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Energy: 0.7774908417991476
Energy: 0.8123477835035939
Energy: 0.9116016486541397
Energy: 0.6960907738797215
Energy: 0.8626867079940878
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Energy: 0.6824960637901779
Energy: 0.6192026844154149
Energy: 0.9443051229556845
Energy: 0.8095618425883907
Energy: 0.8922572568673764
Energy: 0.6475168554314736
Energy: -0.4131530802627598
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Energy: -0.7245441691014245
Energy: -0.10330013065476822
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Energy: 1.0531533590416755
Energy: 0.8485564428947183
Energy: 0.22368846064208683
Energy: 0.8271933924498831
Energy: -0.3418720422537902
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Energy: 0.8292722716135784
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Energy: -0.3910628047338218
Energy: 0.3015723158370266
Energy: -0.22817672541710063
Energy: -0.39232471576871786
Energy: 0.9216369842680094
Energy: 0.8761080563748798
Energy: 0.872242559120659
Energy: 0.8908498067790039
Energy: -0.5074712024369029
Energy: 0.7397854956552317
Energy: 0.2669008881300537
Energy: 0.7979975698536477
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Energy: 0.9605120992754783
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Energy: -0.49001919301377067
Energy: -0.17481221790356508
Energy: 0.35671591493624105
Energy: 1.1132211497463316
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Energy: 0.6817349376481942
Energy: -0.6758138205687065
Energy: -0.3141580991152546
Energy: -0.36185861497739435
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Energy: 0.8219651471950461
Energy: -0.4396062522143088
Energy: -0.2897204051820342
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Energy: -0.11685108482013835
Energy: -0.4024705338662024
Energy: 0.8503488791777275
Energy: 0.8101550450773833
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Energy: -0.2977253831023833
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Energy: -0.7514890486498347
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Energy: -0.2984396035901519
Energy: -0.15687754879763882
Energy: 0.870988501561398
Energy: 0.8069343839490639
Energy: -0.321418822619035
Energy: -0.15786250366107418
Energy: 0.8852626312910918
Energy: -0.3233294171953973
Energy: 0.9195617446197547
Energy: 0.7607330632881182
Energy: 0.013031197145915267
Energy: -0.39891286361639283
Energy: -0.5668263880964538
Energy: 0.9480146578238655
Energy: 0.9208687758983434
Energy: 0.9538009806575033
Energy: -0.3736392152022419
Energy: 0.09102253494539797
Energy: -0.5308727128292559
Energy: -0.5658117341058407
Energy: 1.0612273579498457
Energy: 0.8531760461072548
Energy: 0.998036473921545
Energy: 0.7973182778077069
Energy: -0.1011466422523642
Energy: 0.7420962130975753
Energy: -0.36369878777907666
Energy: -0.3143843133554294
Energy: 0.7078868758907378
Energy: -0.43546338150645153
Energy: 0.7367367518309716
Energy: 0.9479491906494574
Energy: 0.8623036450716725
Energy: 0.5899057311916223
Energy: 0.8393416376874481
Energy: 0.9488945622049209
Energy: 0.87586458544358
Energy: 0.6809421718360482
Energy: 0.9131637127698886
Energy: 0.8603429578615329
Energy: 0.8066722839210706
Energy: 0.8045217158488517
Energy: 0.7975726715619638
Energy: 0.8343545658455047
Energy: 0.6977779124058441
Energy: 0.6894327426209165
Energy: -0.5004278091279464
Energy: -0.44713201464427427
Energy: -0.6778782403580007
Energy: 0.7329905241102358
Energy: 0.8450577905434999
Energy: 0.78959526402079
Energy: 0.8300332751576105
Energy: 0.7936506812677486
Energy: 0.8030769825045427
Energy: 0.7166980801879288
Energy: 0.8459388600304277
Energy: 0.9551572098880792
Energy: 0.7638541909057369
Energy: 0.7867199768772121
Energy: 0.6559819473121967
Energy: 0.677335156808111
Energy: -0.07180316741664673
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Energy: 1.072788541873748
Energy: 0.7372955810237111
Energy: 0.7118789935907203
Energy: 0.7440627319298875
Energy: 0.6754950353005477
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Energy: 0.8207932731868026
Energy: 0.7132249532242806
Energy: 0.6531816226838522
Energy: 0.8896636444054841
Energy: 0.85435656327928
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Energy: 0.7201966322683115
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Energy: 0.6874651964031331
Energy: 0.6776078577691921
Energy: 0.756978313084592
Energy: -0.39048167887276
Energy: 0.7027751461446896
Energy: 0.6606294579709874
Energy: 0.9134001939516755
Energy: 0.8025337517684087
Energy: 0.8641710580538767
Energy: 0.7807999202121312
Energy: 0.810304692186186
Energy: 0.9131425406532478
Energy: 0.6968390686340526
Energy: 0.8630821863131259
Energy: 0.8734195053892051
Energy: 0.9469199872690777
Energy: 0.737390230401032
Energy: 0.6514003003732076
Energy: 0.9528548750353625
Energy: 0.7989230965775233
Energy: 0.9534479863464779
Energy: 0.638592440878531
Energy: 0.7860804206445614
Energy: 0.8291875999818664
Energy: -0.7342965042651926
Energy: -0.46192500956930926
Energy: 0.7042815047603939
Energy: 1.056331717700672
Energy: 0.8494919947486504
Energy: -0.460664869303134
Energy: 0.8279887195461045
Energy: -0.7256169951395673
Energy: 0.9788546992380038
Energy: 0.7895921994004977
Energy: -0.4809211004681563
Energy: 0.8266884539518412
Energy: -0.32260570846693376
Energy: 0.7048454173821244
Energy: -0.5504302644781554
Energy: 0.8595178157345352
Energy: 0.8790579733212253
Energy: 0.4457098246572584
Energy: 0.9019331597998443
Energy: -0.001440175831697687
Energy: 0.842407463688583
Energy: -0.17478879238112868
Energy: -0.24272805397226277
Energy: -0.4732790591020313
Energy: 0.9653507163347357
Energy: -0.15296719865817152
Energy: -0.5077507273134503
Energy: -0.7861093440091728
Energy: -0.308600823103299
Energy: 0.12553249458998045
Energy: 0.8916159319626074
Energy: 0.9707595895833749
Energy: 0.6780192893459703
Energy: -0.7603474435025507
Energy: -0.4091380945358577
Energy: -0.45981449549525527
Energy: 0.8504667704064872
Energy: -0.26996077364146537
Energy: -0.2565611653184374
Energy: -0.31203544071388123
Energy: -0.7474297958778501
Energy: -0.3347839962973211
Energy: -0.16170900352334394
Energy: 0.9128646649768333
Energy: 0.8167765086091756
Energy: -0.38353307298328565
Energy: -0.405865852244146
Energy: -0.8259679216170907
Energy: -0.751441847624547
Energy: -0.23356721361867835
Energy: -0.17823789850331714
Energy: -0.3250334128961267

minimum gb energy = -1.242764885296276 eV
minimum distance =  2.25772687305284 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.0128750576695473
Energy: 0.5350595983440695
Energy: 0.5363099375589102
Energy: 0.5339916628248806
Energy: 0.5371789325973594
Energy: 0.5369278419951503
Energy: 0.5350325524032664
Energy: 0.5142664859781442
Energy: 0.5822750477347379
Energy: 0.5388001468834406
Energy: 0.5320703071202836
Energy: 0.5330052647111335
Energy: 0.5347405121708779
Energy: 0.5838262805243798
Energy: 0.9568696817009262
Energy: 0.580069112084372
Energy: 0.5342405485395143
Energy: 0.5369744350467832
Energy: 0.5369884419380453
Energy: 0.5386701243064899
Energy: 0.5300122237184269
Energy: 0.9586016531247953
Energy: 0.5816256744086622
Energy: 0.5386479706525713
Energy: 0.533982508731706
Energy: 0.5370802287633839
Energy: 0.5366902726541155
Energy: 0.5354172829733642
Energy: 0.9944948248932819
Energy: 0.5799538222261735
Energy: 0.8838978895601827
Energy: 0.5845412147407999
Energy: 0.6603523303873979
Energy: 0.883293993957017
Energy: 0.578793531943382
Energy: 1.0134770473518206
Energy: 0.9050042508324551
Energy: 0.5362983284778083
Energy: 0.5366402043507378
Energy: 0.5356897674782974
Energy: 0.5367659139288512
Energy: 0.5329169509363408
Energy: 0.9557800333270186
Energy: 0.5798388597098926
Energy: 0.5356589515216286
Energy: 0.5312444749982033
Energy: 0.5329174002329654
Energy: 0.5365106500884687
Energy: 0.5817482089226048
Energy: 0.9559910713698523
Energy: 0.5799728098794422
Energy: 0.5351309760138956
Energy: 0.5373847532867144
Energy: 0.5313540731042108
Energy: 0.5396139502587509
Energy: 0.5790250365076651
Energy: 0.9594843925339441
Energy: 0.9051025568733592
Energy: 0.5377297565376932
Energy: 0.5345881788385255
Energy: 0.5351191675337442
Energy: 0.5357141972710477
Energy: 0.5361733434227514
Energy: 0.9947288979659937
Energy: 0.5786921932201649
Energy: 0.883049709780266
Energy: 0.5742466815032318
Energy: 0.5747648271469205
Energy: 0.8828477987380615
Energy: 0.5744572816609889
Energy: 0.9591946915801093
Energy: 0.5800707156223075
Energy: 0.5373035971852467
Energy: 0.5359585531663406
Energy: 0.5347923249712077
Energy: 0.5375870783552704
Energy: 0.5318919693854892
Energy: 0.9562513583097616
Energy: 0.5839083956365668
Energy: 0.5390728688998759
Energy: 0.5314615738986049
Energy: 0.534794765184321
Energy: 0.5354374235707478
Energy: 0.5780206223234965
Energy: 0.9556213186103446
Energy: 0.5799890866394833
Energy: 0.5349157542231949
Energy: 0.5330326924130175
Energy: 0.5311627128394754
Energy: 0.5358339555195791
Energy: 0.581596838227259
Energy: 1.0133255373529182
Energy: 0.9056093973384725
Energy: 0.5368773253645507
Energy: 0.5340374692580553
Energy: 0.5370053998189457
Energy: 0.5363927940371851
Energy: 0.5352673843587289
Energy: 0.5158109517781174
Energy: 0.5776187578350468
Energy: 0.8840134391105775
Energy: 0.6587880738404138
Energy: 0.5341821867596479
Energy: 0.5431872137180114
Energy: 0.5765969346790629
Energy: 0.9581097815986224
Energy: 0.5776169651207087
Energy: 0.5376957868283768
Energy: 0.5362540444960107
Energy: 0.5348693954840422
Energy: 0.5384653700083429
Energy: 0.5312356955086773
Energy: 0.9574584801411188
Energy: 0.5867671115697554
Energy: 0.5378274979177758
Energy: 0.536152261944665
Energy: 0.5358543088882753
Energy: 0.5368758894857432
Energy: 0.5372525043965203
Energy: 0.5145290939525126
Energy: 0.5775888232471004
Energy: 0.5401064030765816
Energy: 0.5331272318608725
Energy: 0.5342505382061769
Energy: 0.54056006480135
Energy: 0.5826042325335408
Energy: 1.0130208921771333
Energy: 0.5833082030616108
Energy: 0.5365082204119492
Energy: 0.5362367543780633
Energy: 0.5368686890708317
Energy: 0.5369248003844458
Energy: 0.5342016432297814
Energy: 0.9558684005922201
Energy: 0.5801766163371745
Energy: 0.5341531781852568
Energy: 0.5310018182086945
Energy: 0.5324019480014334
Energy: 0.5360474384301392
Energy: 0.5808720809161555

minimum gb energy = 0.5142664859781442 eV
minimum distance =  2.39922758939717 Angstroms
sigma value = 23