Model name: model_name=MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_001
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.6200000196695328
cohesive_energy=3.540278438731604
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.566521795186964e-19, 2.2398589560983397e-19, 2.75700953002086e-19, 3.1792952254442397e-19, 3.53485026406152e-19, 3.8396964122127e-19, 4.10407157858904e-19, 4.3350093186138e-19, 4.53763659751578e-19, 4.715830682749259e-19, 4.8726196881525e-19, 5.0104229004428395e-19, 5.1312109968801e-19, 5.23661819763096e-19, 5.328038396366999e-19, 5.40660913849836e-19, 5.47337183883714e-19, 5.52917565099936e-19, 5.57482166330202e-19, 5.61096676816506e-19, 5.638203770943059e-19, 5.657109455224259e-19, 5.668116408699839e-19, 5.67170528436e-19, 5.6678600604383995e-19, 5.65545921329124e-19, 5.63299669688256e-19, 5.5987261386813e-19, 5.550548687296919e-19, 5.485948925414039e-19, 5.40193078272708e-19, 5.2948733400432e-19, 5.16038663338524e-19, 4.9931193927956395e-19, 4.786502694075e-19, 4.53241350168894e-19, 4.22074208107692e-19, 3.83878317153132e-19, 3.37040285434776e-19, 2.7949971380129997e-19, 2.0857936509728998e-19, 1.2076983162363238e-19, 1.1396731007099518e-20, -1.2588173639207277e-19, -3.00262320801306e-19, -5.262974003260259e-19, -8.284839352647659e-19, -1.2507423936853678e-18, -1.8773504708895e-18, -2.88213952513626e-18, -4.65358612051836e-18, -8.14102797797982e-18, -1.5905079815745778e-17, -3.55281066412866e-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: 0.015405947657096644
Energy: 0.10406524336648046
Energy: 0.10519358165394327
Energy: 0.1057011299110108
Energy: 0.01904495608690692
Energy: 0.01664178247421483
Energy: 0.10397923703237388
Energy: 0.6722234917678672
Energy: 0.10532538644278097
Energy: 0.018304502844309543
Energy: 0.1037866995714178
Energy: 0.10622809540363505
Energy: 0.10429265978240054
Energy: 0.6729110979060574
Energy: 0.10575111812150753
Energy: 0.10406551710637454
Energy: 0.10632925824119982
Energy: 0.10388395437556265
Energy: 0.672891057566099
Energy: 0.10530588737385169
Energy: 0.10601689843579522
Energy: 0.019412507153369913
Energy: 0.015789653445870157
Energy: 0.10385958565128603
Energy: 0.6718309319265405
Energy: 0.10547129575986759
Energy: 0.018414535062506166
Energy: 0.015770769369154117
Energy: 0.10369930106019243
Energy: 0.6728024246411467
Energy: 0.6729163862394515
Energy: 0.016578208136811032
Energy: 0.016632171146805624
Energy: 0.10354055106573945
Energy: 0.10435579308073047
Energy: 0.1052029622589476
Energy: 0.01640553441863079
Energy: 0.016040523357603732
Energy: 0.10307231450085556
Energy: 0.10393581108365861
Energy: 0.6731690487677113
Energy: 0.10524276416740902
Energy: 0.10644817630497518
Energy: 0.017286065513740692
Energy: 0.01630242905392828
Energy: 0.672787280196432
Energy: 0.10497583710112843
Energy: 0.10608333666839873
Energy: 0.018083301717571488
Energy: 0.10360129975468846
Energy: 0.10657868024975113
Energy: 0.6729778862552817
Energy: 0.10468431530272412
Energy: 0.016550963810158425
Energy: 0.015713971927062732
Energy: 0.10605504559984533
Energy: 0.6730083634288886
Energy: 0.10523569543617538
Energy: 0.01667361287221115
Energy: 0.015699029398655563
Energy: 0.01573483881072928
Energy: 0.1061362462349628
Energy: 0.6719451959281262
Energy: 0.10512593918544764
Energy: 0.10662587470280936
Energy: 0.015693945115543336
Energy: 0.10655993272671585
Energy: 0.6728852239502852
Energy: 0.10498209765843879
Energy: 0.10661396794786931

minimum gb energy = 0.015405947657096644 eV
minimum distance =  2.52499784440651 Angstroms
sigma value = 3


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

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Energy: 0.9010235533823469
Energy: 0.8880817136188037
Energy: 0.892196445746397
Energy: 0.957574836741266
Energy: 1.0326108064493262
Energy: 0.900736718833183
Energy: 0.8900164331602956
Energy: 0.9029741394872268
Energy: 0.9535686191064118
Energy: 0.9730302199068004
Energy: 1.0230175101055643
Energy: 0.9010209341004243
Energy: 0.8069639953481503
Energy: 0.9511553560267103
Energy: 0.9726315228157468
Energy: 0.9960345785699516
Energy: 0.9528863637599293
Energy: 0.8064443407641775
Energy: 0.9233478112082508
Energy: 0.889394115009048
Energy: 1.0657910093818976
Energy: 1.0698669094977924
Energy: 0.892048736608015
Energy: 0.8936024327549209
Energy: 0.8899999317364671
Energy: 1.0255782915392906
Energy: 0.9408082242887035
Energy: 0.8987406338626626
Energy: 0.8933896729803741
Energy: 0.896548894694263
Energy: 0.9079506421268796
Energy: 1.0713551613954229
Energy: 0.9755185637521556
Energy: 0.8920185397705583
Energy: 0.8969475299650135
Energy: 0.9558968814137299
Energy: 1.0412666022383545
Energy: 0.9747551840479882
Energy: 0.892329177407986
Energy: 1.1185336249979199
Energy: 0.9533408937182325
Energy: 0.9826209336437407
Energy: 0.9686787142613654
Energy: 0.8227165040290817
Energy: 1.1215261659061095
Energy: 0.9533260192088739
Energy: 0.9890285744241172
Energy: 0.9343946769808887
Energy: 0.9137504292761056
Energy: 0.9529942916662437
Energy: 1.0379815267166028
Energy: 0.9824716883546467
Energy: 0.8321081274946401
Energy: 0.9873570307299138
Energy: 0.9531166877415155
Energy: 1.0410368420564995
Energy: 0.8173188156224668
Energy: 1.0167091127262589
Energy: 0.987419327541203
Energy: 0.9283946303079851
Energy: 0.9639511843692886
Energy: 0.9970445130071867
Energy: 0.9944370262815264
Energy: 0.957875213532826
Energy: 0.9288047847262648
Energy: 1.0218467209525925
Energy: 1.0337574725395755
Energy: 0.9961322673868136
Energy: 0.9439250298239139
Energy: 0.9195203619287752
Energy: 0.9421227219338576
Energy: 0.977028840026544
Energy: 0.9780969477907602
Energy: 0.9420745046830461
Energy: 0.9199667696514925
Energy: 0.942673319242741
Energy: 0.9667239872737737
Energy: 0.9789751658856103
Energy: 0.9408486731229192
Energy: 0.9235541124486827
Energy: 0.8597666956867703
Energy: 0.9949355191573729
Energy: 1.0575456736409317
Energy: 0.9474301804846289
Energy: 0.9236075730255526
Energy: 0.8855968501943146
Energy: 0.940014408768764
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Energy: 0.8527222515253479
Energy: 0.8649250700375062
Energy: 0.8294086662070478
Energy: 0.9509448639045015
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Energy: 0.8837615566453286
Energy: 0.8639571381454505
Energy: 0.8199166191195221
Energy: 0.9500984024805503
Energy: 1.0388054343738118
Energy: 0.9232991238253515
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Energy: 0.8637360902347406
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Energy: 1.0430073066631345
Energy: 0.9035425732373494
Energy: 0.8214615853681992
Energy: 0.8639993512170046
Energy: 0.885112005809101
Energy: 1.0432008586565795
Energy: 1.017536063583185
Energy: 0.9365940227568247
Energy: 0.8190742203309188
Energy: 0.9577181885510827
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Energy: 0.9725133146141696
Energy: 0.9344571222989737
Energy: 0.8173546690052638
Energy: 0.9586436449326695
Energy: 0.956852413709424
Energy: 0.8217662203122097
Energy: 1.057915291642659
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Energy: 1.0385357114986278
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Energy: 0.8212169950438013
Energy: 0.9813492454130096
Energy: 0.9709826634499515
Energy: 1.0357374139255782
Energy: 0.9954557234095441
Energy: 0.906188700644075
Energy: 0.9812809822778776
Energy: 0.9449828981812739
Energy: 1.0446460435498195
Energy: 1.0351124055331347
Energy: 0.9064545814880501
Energy: 0.8894824434059919
Energy: 0.9279797844634948
Energy: 1.002313042396804
Energy: 1.0110723970702291
Energy: 0.9620970996269823
Energy: 0.9449215788048196
Energy: 0.9232210663932557
Energy: 0.925062105631964
Energy: 0.9763546862780427
Energy: 0.9628691038038617
Energy: 0.9443613901830258
Energy: 0.9258395025165481
Energy: 0.9449661875485791
Energy: 1.0010002269811211
Energy: 0.9344682216430815
Energy: 1.0178520040382544
Energy: 0.9653731914216832
Energy: 0.9825818620916573
Energy: 0.8291612665252003
Energy: 0.9346773891659669
Energy: 1.0131844249149844
Energy: 0.9326037288730037
Energy: 0.983632701720293
Energy: 0.8412912038185149
Energy: 0.8204788139916305
Energy: 1.0255759577085741
Energy: 0.9424492731677069
Energy: 0.867304085969995
Energy: 0.9351408105165941
Energy: 0.8227015630197678
Energy: 0.9916800166017181
Energy: 0.8594387231958487
Energy: 0.866373388189114
Energy: 0.839689332118057
Energy: 0.8684353699249567
Energy: 0.9380954440853755
Energy: 0.9868121301741947
Energy: 0.9148971773215147
Energy: 0.78805979437556
Energy: 0.8194234735689876
Energy: 0.8603723897821621
Energy: 1.0732838920110814
Energy: 0.9143277143892032
Energy: 0.7877728296444718
Energy: 0.9638493495776431
Energy: 0.9959991632063718
Energy: 0.9704547197469165
Energy: 1.0242255718916475
Energy: 0.9121161711245674
Energy: 0.9629387176126825
Energy: 0.9280752237523296
Energy: 0.9734297348600941
Energy: 1.025512663392114
Energy: 0.8201676776790104
Energy: 0.9522127213066971
Energy: 1.034873508459352
Energy: 0.9703168552023216
Energy: 0.9296040004520612
Energy: 0.9727776066759193
Energy: 0.9521064175236377
Energy: 1.0373539310999595
Energy: 0.9703165917211232
Energy: 0.8934690815494242
Energy: 0.9724587649142572
Energy: 0.9363959569021442
Energy: 1.0137624536362506
Energy: 1.0439903853638473
Energy: 0.9379927883150384
Energy: 0.9368082080587583
Energy: 1.0039399353171126
Energy: 0.9184189986089446
Energy: 0.8212697367367462
Energy: 0.9382798095451649
Energy: 0.935819732801306
Energy: 0.9188752291330178
Energy: 0.9415071319017195
Energy: 0.9770360289133649
Energy: 0.7615718503883568
Energy: 0.9412606038730101
Energy: 0.9197036406438682
Energy: 0.9423966099123497
Energy: 0.9783589905677359
Energy: 0.7580483048781713
Energy: 0.9400643738745359
Energy: 0.9229534582697798
Energy: 0.8621696406478943
Energy: 0.939795717748634
Energy: 0.966507966735617
Energy: 1.0044932121346544
Energy: 0.9226909800017113
Energy: 0.8607096464857151
Energy: 0.9385750643726931
Energy: 1.0519110695193006
Energy: 1.003797721564778
Energy: 0.8534279269732703
Energy: 0.8759949741780052
Energy: 0.8287839948750702
Energy: 0.9614773319597988
Energy: 1.0444536001355529
Energy: 0.8533942536189378
Energy: 0.8755800169224579
Energy: 0.819950809291013
Energy: 0.9614553291485894
Energy: 1.038624913825042
Energy: 0.9142922944084376
Energy: 0.8207201833482083
Energy: 0.8177786889889314
Energy: 0.8741801538323754
Energy: 1.0370056044151066
Energy: 0.8885294861162473
Energy: 0.8210775633445467
Energy: 0.8191373857664637
Energy: 0.8582508577978805
Energy: 1.0384314018520862
Energy: 1.0226028920429437
Energy: 0.9300989256735026
Energy: 0.8471929421756528
Energy: 0.997209100435668
Energy: 1.0065061982507897
Energy: 1.021912210785399
Energy: 0.9302862819148955
Energy: 0.9276527076623107
Energy: 0.9609123660086037
Energy: 0.895841863928759
Energy: 0.8920394279742274
Energy: 0.8916195936158492
Energy: 0.9982127200635329
Energy: 1.0371988437598045
Energy: 0.9520505554495855
Energy: 0.8938167562781351
Energy: 1.0299540570675032
Energy: 0.9977763954468919
Energy: 1.0345623131147548
Energy: 0.952321208368015
Energy: 0.9712131710776469
Energy: 1.0456959890672626
Energy: 0.9024074154341405
Energy: 0.9558313308303819
Energy: 1.0546509544401175
Energy: 0.9714242534228781
Energy: 0.9273662141774335
Energy: 0.9010602776940438
Energy: 0.9559941079758842
Energy: 1.0320673067121582
Energy: 1.0353056394002411
Energy: 0.8342472766416196
Energy: 0.891038225660258
Energy: 0.8885169589489035
Energy: 0.9941552793667684
Energy: 1.0363615967797963
Energy: 0.9015520228198288
Energy: 0.8908222597891338
Energy: 0.902768731567752
Energy: 0.9943344138120959

minimum gb energy = 0.7580483048781713 eV
minimum distance =  2.31610423541011 Angstroms
sigma value = 75


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

Energy: 1.4522923735283235
Energy: 1.0294247649284527
Energy: 0.9139673889504105
Energy: 0.932206886385136
Energy: 0.9939424480255827
Energy: 1.3291307887956427
Energy: 1.055826413120986
Energy: 0.9213863301865852
Energy: 1.0310639829484423
Energy: 1.0088264452257718
Energy: 0.9276823107814756
Energy: 0.9640680444395344
Energy: 0.9076288125961132
Energy: 0.9297491631253074
Energy: 0.9085868006168096
Energy: 0.9379429974397205
Energy: 0.943769371520475
Energy: 0.9167218682915128
Energy: 0.9367059695451302
Energy: 0.9467225534828162
Energy: 0.9568948595314694
Energy: 1.0974666624748743
Energy: 1.0966391567551579
Energy: 0.9112495474494828
Energy: 0.9079681801136634
Energy: 0.9221061907741938
Energy: 1.096772708715314
Energy: 1.0959453109367445
Energy: 0.9604991741499375
Energy: 0.9086989671603268
Energy: 0.8870753724670446
Energy: 0.9009825985625298
Energy: 0.989002379563885
Energy: 0.9737705656577207
Energy: 0.9063990899536686
Energy: 0.8732959479577219
Energy: 0.8773228852350825
Energy: 0.9442241773080532
Energy: 0.9687923151765038
Energy: 0.9098163981819963
Energy: 0.8961731382907033
Energy: 0.854297248063951
Energy: 1.0405574546330734
Energy: 0.9724149919133808
Energy: 0.9085545987077269
Energy: 0.8985615527616825
Energy: 0.8406220327304846
Energy: 1.0478804960779726
Energy: 0.97330044454547
Energy: 0.9663313077925321
Energy: 1.0129744062105976
Energy: 1.067447947111794
Energy: 1.0672910254220893
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Energy: 0.8606445550700375
Energy: 0.924497295793691
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Energy: 1.096185155426041
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Energy: 0.9300610809660808
Energy: 0.9332806625161667
Energy: 0.9083703692635614
Energy: 0.9192678112634959
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Energy: 0.952305275661882
Energy: 0.951475159344247
Energy: 1.109960420351832
Energy: 1.00306105490227
Energy: 0.9612073585027124
Energy: 0.9385002378307373
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Energy: 0.9431728205808725
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Energy: 0.9058787743440949
Energy: 0.9438915655669314
Energy: 1.0979970489810122
Energy: 0.9743513193804745
Energy: 0.8920887514462835
Energy: 0.9057947991916239
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Energy: 0.9828117019636914
Energy: 0.9001373257449553
Energy: 0.8818300215115958
Energy: 0.8697596283809271
Energy: 0.8917326357300255
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Energy: 0.8920143600920517
Energy: 0.902783813351185
Energy: 0.8481266325042058
Energy: 0.9226723533392134
Energy: 1.1372353347815343
Energy: 1.0740015073609706
Energy: 0.9242699048821479
Energy: 0.8544383262151438
Energy: 1.0671109473091378
Energy: 1.1284907981121823
Energy: 1.061763399437119
Energy: 0.9018791931831397
Energy: 0.8544407245834775
Energy: 1.0777407739421951
Energy: 0.9635733362585229
Energy: 0.9533013875500589
Energy: 0.852105211451867
Energy: 0.9249646677242442
Energy: 0.9404239706391231
Energy: 0.9590503603460969
Energy: 0.9513148343349669
Energy: 0.8513793039960734
Energy: 0.8437093812817584
Energy: 0.9425593350441717
Energy: 0.9686594470463551
Energy: 0.9444514464977293
Energy: 0.8848201766848325
Energy: 0.8652934330851992
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Energy: 0.9589902898910881
Energy: 0.9146894914082864
Energy: 0.9000302954333094
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Energy: 0.9135270250544582
Energy: 0.8799447425561077
Energy: 0.9053890204122254
Energy: 0.9053762157025196
Energy: 0.941077514130479
Energy: 1.0990592192627626
Energy: 0.9037121304012333
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Energy: 0.8911479720682324
Energy: 1.0991340372908704
Energy: 0.8933418083771446
Energy: 0.9415265428295926
Energy: 0.933945241575381
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Energy: 0.9527342958664299

minimum gb energy = 0.8339036045081574 eV
minimum distance =  2.27634533999839 Angstroms
sigma value = 105


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

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Energy: 0.9171653218863782
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Energy: 0.9044864131370743
Energy: 0.9168959759292455
Energy: 0.8949809118490346
Energy: 0.8975176758839155
Energy: 0.874420852279128
Energy: 1.0157206684404096
Energy: 0.8638739654799028
Energy: 0.9234823258576168
Energy: 1.0243161339847004
Energy: 0.9729436787703424
Energy: 1.024926450698514
Energy: 0.9370536029090254
Energy: 0.920857001554227
Energy: 1.023627773862427
Energy: 0.9725751115375374
Energy: 0.9221383355657082
Energy: 0.9192256130974367
Energy: 1.1417049903781806
Energy: 0.9469662837894024
Energy: 0.9534663967758813
Energy: 0.922177354157754
Energy: 0.9193913386870778
Energy: 0.9422206611983652
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Energy: 0.9212113744674734
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Energy: 0.922554673254422
Energy: 0.9632080740752316
Energy: 0.9232088258825787
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Energy: 0.8943426504104236
Energy: 0.9223966134288706
Energy: 1.0675551567871595
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Energy: 0.9927650403250325
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Energy: 0.9436496458959286
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Energy: 0.972260754773444
Energy: 0.992725089105995
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Energy: 0.9429818746808932
Energy: 1.0661414822258652
Energy: 1.0319392902939548
Energy: 0.9610613947302551
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Energy: 0.874560981723802
Energy: 0.9587939779919246
Energy: 0.9792681501472434
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Energy: 0.8750265288302284
Energy: 0.9586293098804736
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Energy: 0.9920407107460424
Energy: 1.0059192324779866
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Energy: 0.970489424483331
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Energy: 0.9980098026597624
Energy: 1.0056879515764001
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Energy: 0.9702761993570443
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Energy: 0.9212870769327968
Energy: 0.9170889283091203
Energy: 0.9192220371175989
Energy: 0.9771338614208932
Energy: 0.9644343678271685
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Energy: 0.985586329989157
Energy: 0.9607055264171378
Energy: 0.9769097337026234
Energy: 0.9218940095918963
Energy: 0.9223485563678829
Energy: 0.8749727103883952
Energy: 0.9170563090922348
Energy: 0.951166404380711
Energy: 0.9220647902981387
Energy: 0.9221684115162134
Energy: 0.8752522648716136
Energy: 1.011525065229044
Energy: 0.9024293399967646
Energy: 0.9168139605900004
Energy: 1.0168407790962444
Energy: 1.0259926620992776
Energy: 0.995633002502392
Energy: 0.9027916736066448
Energy: 0.9135419145766189
Energy: 1.0159610340033804
Energy: 1.015855748960443
Energy: 0.9218184712844424
Energy: 0.9020987496969362
Energy: 0.9049515660911188
Energy: 0.9146627774614402
Energy: 0.922266735044313
Energy: 0.9220718321120763
Energy: 0.8748918097252356
Energy: 0.9052766004184584
Energy: 0.9147931534565013
Energy: 0.9219385902693342
Energy: 0.9219619981455972
Energy: 0.9213928238793486
Energy: 0.9132446894691028
Energy: 0.8952774995632069
Energy: 0.9162002112929656
Energy: 1.0215520757212686
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Energy: 0.9131604133947478
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Energy: 0.9169890600875135
Energy: 1.0053499356984419
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Energy: 0.9137323097023192
Energy: 0.8947012062934543
Energy: 0.8965605066595198
Energy: 0.8627830601832475
Energy: 0.8983358420309993
Energy: 0.8936740265547296
Energy: 0.8935894508460867
Energy: 0.896639541402097
Energy: 0.8631742244589745
Energy: 0.8980380910864001
Energy: 0.9665999246387605
Energy: 0.9033881432938512
Energy: 0.8980350827271077
Energy: 0.9046468346680049
Energy: 1.008854660862684
Energy: 0.966515389848189
Energy: 0.9038999503879047
Energy: 0.8976803139841684
Energy: 0.9034950890904984
Energy: 1.012702238924393
Energy: 0.950961550460554
Energy: 0.9031259610420953
Energy: 1.1068390187289294
Energy: 1.1109421900640735
Energy: 0.905114121716973
Energy: 0.9493233720853329
Energy: 0.9452222752574703
Energy: 1.108297591514131
Energy: 0.9754457955124033
Energy: 0.9037330099549589
Energy: 0.9230369049026055
Energy: 0.897024421487509
Energy: 0.904060382746912
Energy: 0.9213953811982323
Energy: 0.9216681354964738
Energy: 0.9221932346122754
Energy: 0.8973295264237837
Energy: 0.9046171750036309
Energy: 0.8971029113459221
Energy: 0.9566995995798993
Energy: 0.921757023128498
Energy: 0.8930305999585298
Energy: 0.9070914526824112
Energy: 0.9169162477489147
Energy: 1.285183994738806
Energy: 0.9680794192019476
Energy: 0.8933714551850147
Energy: 0.9056427987189319
Energy: 0.9174522727013528
Energy: 1.2846863691721675
Energy: 0.9219249623770027
Energy: 0.9224793320469433
Energy: 0.8952585564937986
Energy: 0.9194748254731338
Energy: 0.932351319124056
Energy: 0.9219005628843553
Energy: 0.9228521199663258
Energy: 0.8956017974132858
Energy: 0.8979852573145702
Energy: 0.93840780302219
Energy: 1.0132690128660058
Energy: 1.0919984550153743
Energy: 0.8978934702554578
Energy: 1.0064381149191592
Energy: 0.9215760091787587
Energy: 1.0125643631015684
Energy: 1.0719992707477548
Energy: 0.8980733693903635
Energy: 1.0072838597885128
Energy: 0.9213250104602374
Energy: 0.933468277872829
Energy: 0.9220451570278472
Energy: 0.9222846412355239
Energy: 1.1510116405763386
Energy: 1.0172393127664525
Energy: 0.9328209728554518
Energy: 0.9223115917231669
Energy: 0.9223528136729314
Energy: 1.1512110100345139
Energy: 0.8640921142337366
Energy: 0.9136033076349733
Energy: 0.9229005006519456
Energy: 0.922223724287585
Energy: 0.8948260503703028
Energy: 0.9759071023392256
Energy: 0.9134932377080964
Energy: 0.9223709396397125
Energy: 0.9218875181569857
Energy: 0.8969573768485902
Energy: 0.9483742613544452
Energy: 1.2865769718813198
Energy: 0.9930906783403897
Energy: 0.9846270432888625
Energy: 0.9797334155700843
Energy: 0.9823155207113458
Energy: 1.2868863477344814
Energy: 0.9930418253409841
Energy: 0.9548420869699377
Energy: 0.9913414250991568
Energy: 0.9821590471666928
Energy: 0.9561116529331325
Energy: 0.9253315967918787
Energy: 0.9642939406635381
Energy: 0.9258376123323235
Energy: 0.922186857289227
Energy: 0.9634317265972474
Energy: 0.9261374228168326
Energy: 0.9636579573886497
Energy: 0.9260444007303842
Energy: 0.921658582900739
Energy: 0.9216944443447843
Energy: 0.9879163293479787
Energy: 0.9747867474292427
Energy: 0.9222277708254054
Energy: 1.0018052813427474
Energy: 0.9214219413572652
Energy: 0.9867578309717867
Energy: 0.9865785984581507
Energy: 0.9218926720652704
Energy: 0.9177729376643768
Energy: 0.9852815810791534
Energy: 0.9781561216967048
Energy: 0.9264961521621957
Energy: 0.9210313759824637
Energy: 0.9174754312014504
Energy: 0.9222460252045034
Energy: 0.8954530558207593
Energy: 0.9261176135326362
Energy: 0.921307667290387
Energy: 0.9175401763575386
Energy: 0.9469177764708056
Energy: 0.9025990162727228
Energy: 0.922060151503999
Energy: 0.9223076318701457
Energy: 0.8874108542087612
Energy: 0.9480468768168261
Energy: 0.9025238224931184
Energy: 0.9221858933585303
Energy: 0.9223450313187745
Energy: 0.8743659023700394
Energy: 0.9193940456267695
Energy: 1.089486634820725
Energy: 1.0585961003007476
Energy: 1.0264047958747016
Energy: 1.0151105907547897
Energy: 0.9516329907537033
Energy: 1.0894554320777783
Energy: 1.0587329578539117
Energy: 1.027166776716791
Energy: 1.004036843740363
Energy: 0.9247215235366208
Energy: 0.8975614220755619
Energy: 0.9064391415795927
Energy: 0.9147446233480879
Energy: 0.9228816354715342
Energy: 0.9631670599150185
Energy: 0.9040820380821931
Energy: 0.9067592888104583
Energy: 0.9350927923463115
Energy: 0.9218351357404865
Energy: 0.9176818678567609
Energy: 0.8966158028169202
Energy: 0.8934696465961244
Energy: 0.8940977010842852
Energy: 0.9192620723394908
Energy: 0.9176005600835042
Energy: 0.8970384634537771
Energy: 0.8934222786719078
Energy: 0.9136171702314068
Energy: 0.9306192431015042

minimum gb energy = 0.8627830601832475 eV
minimum distance =  2.29964009398613 Angstroms
sigma value = 165


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

Energy: 1.090139763131965
Energy: 0.8664512564556378
Energy: 0.8641292835012298
Energy: 0.8885710030550426
Energy: 0.8392736320634804
Energy: 1.0089483145700902
Energy: 0.8805421888818133
Energy: 0.9074769055228421
Energy: 0.9052239382262903
Energy: 0.9083858596420048
Energy: 0.9128680999330812
Energy: 0.9880185071856348
Energy: 0.8883335231749839
Energy: 0.8901741039387353
Energy: 0.8938737622161704
Energy: 0.9027595198136256
Energy: 0.9138685294538131
Energy: 0.8954116222828106
Energy: 0.932450263973639
Energy: 0.9619874752819677
Energy: 0.9073136103132073
Energy: 1.022730771342223
Energy: 0.9540710272022804
Energy: 0.8912194752600989
Energy: 0.9024810927348862
Energy: 0.9354093517354645
Energy: 0.8817304468672293
Energy: 0.972995602212039
Energy: 0.896219090734634
Energy: 0.9050658572090365
Energy: 1.0135878957235283
Energy: 0.8905545979028646
Energy: 0.924138689712331
Energy: 0.9340470501219679
Energy: 1.097290605673816
Energy: 0.9995825975794712
Energy: 0.9072777541096789
Energy: 0.8710593482139168
Energy: 0.9050914155156156
Energy: 1.1033729618735661
Energy: 0.9592785122132971
Energy: 0.9039293299053608
Energy: 0.9118160066340458
Energy: 0.8589683633984733
Energy: 0.8561699704826514
Energy: 0.8917376644102016
Energy: 0.9044972100631345
Energy: 0.9026207244224419
Energy: 0.8574107409572673
Energy: 0.9048629929359264
Energy: 0.927252755090074
Energy: 1.0805538432452615
Energy: 0.9563780179913189
Energy: 0.8735816698005144
Energy: 0.9251074133951609
Energy: 0.9272319631941078
Energy: 1.080309873989744
Energy: 0.8576231395553813
Energy: 0.8721298243105933
Energy: 0.9389451722503963
Energy: 0.887182728138518
Energy: 0.9313074474836887
Energy: 0.9459016728993017
Energy: 0.9326449500140683
Energy: 0.8583661633716454
Energy: 0.8982676464091213
Energy: 0.9309504313750824
Energy: 0.9386514251987361
Energy: 0.9132722518128048
Energy: 0.8560394264868358
Energy: 1.0088180840326832
Energy: 0.9324141100135602
Energy: 0.9860498825452996
Energy: 0.9854915167188774
Energy: 0.8593559966788962
Energy: 0.88999915291311
Energy: 0.9283183333082212
Energy: 0.9853007038810736
Energy: 1.005605358264305
Energy: 0.8699203214022204
Energy: 1.0321497360881233
Energy: 0.8555727544008119
Energy: 0.9323676846820241
Energy: 0.9296876044836629
Energy: 0.9295443429526904
Energy: 0.8747567867918808
Energy: 0.8578189154911733
Energy: 0.9313518793890143
Energy: 0.9293653976418665
Energy: 0.8884735409511347
Energy: 0.9770359274903354
Energy: 0.8555403836232719
Energy: 0.933388719359976
Energy: 0.9350462221594201
Energy: 0.9302848921884384
Energy: 0.9770380044153475
Energy: 0.9004543448079391
Energy: 0.9632025984461464
Energy: 0.9487088911109329
Energy: 0.9310724330096085
Energy: 0.9952332623256419
Energy: 0.9344776010855842
Energy: 0.8699268302635506
Energy: 0.9806861665097363
Energy: 1.0948553939623213
Energy: 1.0361829702362626
Energy: 0.9698068053468116
Energy: 0.8701899616214811
Energy: 1.0503417470614518
Energy: 1.094486760885867
Energy: 0.9527631534781753
Energy: 0.9383621668567883
Energy: 0.903188263634228
Energy: 0.9189949130438866
Energy: 0.9382106130151193
Energy: 0.9371384830582558
Energy: 0.9259646585319001
Energy: 0.9019235243262106
Energy: 0.9135707177798035
Energy: 0.9054112168088797
Energy: 0.9533764092866707
Energy: 1.0801584535786857
Energy: 0.9279587217190002
Energy: 0.8771791996593552
Energy: 0.8577404187248062
Energy: 0.8777858587537145
Energy: 1.078917537781851
Energy: 0.8967859293824295
Energy: 0.9186820371150306
Energy: 0.858998916230992
Energy: 0.9042727478761324
Energy: 0.9968098483908682
Energy: 0.9353521360540469
Energy: 0.8675878009844528
Energy: 0.9076454829056111
Energy: 0.9224829994605593
Energy: 0.896470979778072
Energy: 0.9247262336743911
Energy: 0.870450945647122
Energy: 0.9163908346579123
Energy: 0.8692292043634939
Energy: 0.894968297536744
Energy: 0.9824819816677461
Energy: 0.8685747508430778
Energy: 0.8821680624427293
Energy: 0.992609089881128
Energy: 0.8952972627429786
Energy: 0.9452591290651214
Energy: 0.8677885949951806
Energy: 0.9521920990936368

minimum gb energy = 0.8392736320634804 eV
minimum distance =  2.26871956803857 Angstroms
sigma value = 41


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

Energy: 1.641846451650787
Energy: 0.7911889614337839
Energy: 0.7567858218902851
Energy: 0.7607470118185685
Energy: 0.7890194373852468
Energy: 1.5390038661970822
Energy: 0.7956178136022525
Energy: 0.7905802354130345
Energy: 0.7810026615282518
Energy: 0.8156473845977991
Energy: 0.7878256360895238
Energy: 0.7998054254677994
Energy: 0.7618556713886414
Energy: 0.7617201418293581
Energy: 0.7645892295038306
Energy: 0.7785800923221022
Energy: 0.799593122309774
Energy: 0.8096612127964585
Energy: 0.8152171733221504
Energy: 0.7576336970918202
Energy: 0.7692407798735467
Energy: 0.811091933455116
Energy: 0.8028086312803582
Energy: 0.8122433718837834
Energy: 0.8564908814286191
Energy: 0.7785303410880372
Energy: 0.8324685185196427
Energy: 0.833329265902466
Energy: 0.8364163697567206
Energy: 0.9618416710698372
Energy: 0.7954506298440424
Energy: 0.801615676227101
Energy: 0.80940893025599
Energy: 0.8006260596377073
Energy: 0.7918193683245123
Energy: 0.7958026173194064
Energy: 0.8194211433523035
Energy: 0.7746998357660709
Energy: 0.7674919278356442
Energy: 0.7926744880758302
Energy: 0.7713104963977098
Energy: 0.7998905743671337
Energy: 0.8034069077023829
Energy: 0.8175658610679818
Energy: 0.7812224295334508
Energy: 0.8118368740438222
Energy: 0.7855526035981495
Energy: 0.7689738950724847
Energy: 0.7701516193683557
Energy: 0.8938487618053702
Energy: 0.8718606397924469
Energy: 1.0873615293274834
Energy: 0.8062621211720303
Energy: 0.9089271358000267
Energy: 0.8195992215431839
Energy: 0.8892778045071074
Energy: 1.0868241268711047
Energy: 0.8144889076877141
Energy: 0.9635301649256224
Energy: 0.8325271135905464
Energy: 0.8268413991260111
Energy: 0.8229657193183486
Energy: 0.8142356967105892
Energy: 0.7916390210543434
Energy: 0.8057523428415401
Energy: 0.856817641968133
Energy: 0.8089852824660755
Energy: 0.8059646709598137
Energy: 0.7916750314146518
Energy: 0.8070630321006228
Energy: 0.8201471107297394
Energy: 0.8063709480961394
Energy: 0.8092280881260282
Energy: 0.8328916694151028
Energy: 0.7952751166321773
Energy: 0.7991830406359605
Energy: 0.8122499650598136
Energy: 0.8224981323601167
Energy: 0.8602417591148699
Energy: 0.79928974381453
Energy: 1.025411027051694
Energy: 0.8262529680156725
Energy: 0.8723941321196474
Energy: 0.8495052597372581
Energy: 0.8117545205939182
Energy: 1.0271583577811507
Energy: 0.8246060553680646
Energy: 0.9227800592658726
Energy: 0.824530877756709
Energy: 0.8066679386175177
Energy: 0.7875621554734781
Energy: 0.757114216971813
Energy: 0.785480686100951
Energy: 0.8205575021024291
Energy: 0.8134493900197747
Energy: 0.8147198961642168
Energy: 0.7725435844173689
Energy: 0.7818174890307165
Energy: 0.8245628927759967
Energy: 0.8386872850762866
Energy: 0.7743106612603937
Energy: 0.7502812212356765
Energy: 0.7868333931827328
Energy: 0.8085806717597842
Energy: 0.8003467539881871
Energy: 0.7828422045156238
Energy: 0.762519664250007
Energy: 0.7817538419414627
Energy: 0.7773965092205135
Energy: 0.8162994817436603
Energy: 0.8220359640554538
Energy: 0.7981332636103942
Energy: 0.7651728317708649
Energy: 0.7878404083853512
Energy: 1.0981237328104396
Energy: 0.8129242865202305
Energy: 0.8033136305613189
Energy: 0.7464224945709524
Energy: 0.7661142588084255
Energy: 0.8494542618149089
Energy: 0.7953236728580181
Energy: 0.827058979301957
Energy: 0.793163427407884
Energy: 0.787038025188157
Energy: 0.7699352212818076
Energy: 0.7816349964717838
Energy: 0.8043748482205255
Energy: 0.7953876160001758
Energy: 0.7978015719055696
Energy: 0.7616354622943887
Energy: 0.7794251814475924
Energy: 0.7799664689850618
Energy: 0.7781439859875355
Energy: 0.9323849218872141
Energy: 0.8048598909894426
Energy: 0.803578422250209
Energy: 0.7976077822104992
Energy: 0.7904542072132349
Energy: 0.9003228774279045
Energy: 0.8174615662965672
Energy: 0.7649192810493508
Energy: 0.7778636423882982
Energy: 0.7806943845882135
Energy: 0.9472152511762777
Energy: 0.8015623261179038
Energy: 0.7642957655776077
Energy: 0.7983711339143577
Energy: 0.7971806225350289
Energy: 0.8631274700399685
Energy: 0.8043167231998017
Energy: 1.0275656615282036
Energy: 0.8215566923934203
Energy: 0.8438162696958358
Energy: 0.7957352474568382
Energy: 0.8276973273649942
Energy: 1.0410699364887164
Energy: 0.826801956763354
Energy: 0.8543693712965255
Energy: 0.795570575985313
Energy: 0.8220153838396963
Energy: 0.8661852161384104
Energy: 0.7882947127295339
Energy: 0.7920938381547059
Energy: 0.8471391912347177
Energy: 0.8076087659875115
Energy: 0.8064994607525817
Energy: 0.7776964549189012
Energy: 0.791484063305676
Energy: 0.7955557226132455
Energy: 0.8137892814243072
Energy: 0.7891173060516417
Energy: 0.811706788980892
Energy: 0.9600376249058787
Energy: 0.8093970157494654
Energy: 0.8166083282457336
Energy: 0.7786349973928363
Energy: 0.7981863626365968
Energy: 0.9072851899200908
Energy: 0.8235510435749522
Energy: 0.8569904383718328
Energy: 0.7895191659497917
Energy: 0.7963504829118361
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Energy: 0.7835309259661654
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Energy: 0.8280393734539416
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Energy: 0.81840147656334
Energy: 0.8033802179705479
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Energy: 1.048352559785542
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Energy: 0.7775578348670589
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Energy: 0.8053288327330933
Energy: 0.8415182956592552
Energy: 0.7938679945808802
Energy: 0.8745262209786641
Energy: 0.8134645083640852
Energy: 0.8015237751306378
Energy: 0.8265726034679834
Energy: 0.8234401308080563
Energy: 1.0204402107162742
Energy: 0.8102929315978001
Energy: 0.809455646186562
Energy: 0.8378819628694105
Energy: 0.7903574453003853
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Energy: 0.8016606911922004
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Energy: 0.7958599833618679
Energy: 0.8213456264215946
Energy: 0.8137467743906919
Energy: 0.8253655431262114
Energy: 0.8509876373368612
Energy: 0.8048056534774878
Energy: 0.8365522923788021
Energy: 0.8168293133775257
Energy: 0.9185586276615336
Energy: 0.817029047345295
Energy: 0.8094313333039416
Energy: 0.8169306992553815
Energy: 0.8005950963684159
Energy: 0.9182514234308623
Energy: 0.8131925303427215
Energy: 0.985318465722672
Energy: 0.7449182990287524
Energy: 0.7478555663681293
Energy: 0.7726858500796534
Energy: 0.8059625714348554
Energy: 0.8513880524899083
Energy: 0.7782753768155289
Energy: 0.779542756565004
Energy: 0.7874600958365461
Energy: 0.812250406951472
Energy: 1.4485119291308122
Energy: 0.7446318748823777
Energy: 0.7527916292431969
Energy: 0.8077014426975697
Energy: 0.7927448298537373
Energy: 1.450822319260101
Energy: 0.8030271642089128
Energy: 0.7853655098428542
Energy: 0.7911415517034532
Energy: 0.7732582539216833
Energy: 0.8761783429500297
Energy: 0.7627739743538158
Energy: 0.7463753218169822
Energy: 0.7461945618838002
Energy: 0.7774707043417499
Energy: 0.7752237708143751
Energy: 0.780437821528194
Energy: 0.7441876591536839
Energy: 0.7871917772626212
Energy: 1.136159433909771
Energy: 0.8030951973082467
Energy: 0.8428472194431661
Energy: 0.8395252532757844
Energy: 0.8011067608724163
Energy: 0.7795210905948019
Energy: 0.764319544646859
Energy: 0.7930191906605766
Energy: 0.7638719341712136
Energy: 0.7923076259941183

minimum gb energy = 0.7441876591536839 eV
minimum distance =  2.3092848643929 Angstroms
sigma value = 185


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

Energy: 0.7220671169997561
Energy: 0.3959903752603172
Energy: 0.4409544261383922
Energy: 0.30513184563205914
Energy: 0.5016418018367031
Energy: 0.49711894886620683
Energy: 0.4059623008303319
Energy: 1.115172755260372
Energy: 0.4955804601728115
Energy: 0.6656935067920849
Energy: 0.36918446641773056
Energy: 0.5442436726490116
Energy: 0.9470441190878591
Energy: 0.3600815595996317
Energy: 0.27678971086928694
Energy: 0.2828030164913803
Energy: 0.3881388135277808
Energy: 1.0250964623429375
Energy: 0.27583054332878043
Energy: 0.3603198737856841
Energy: 0.27546738467078674
Energy: 0.2836075483106624
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Energy: 0.3949990766941547
Energy: 0.5256991751262526
Energy: 0.27569786768629084
Energy: 0.36044287449885015
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Energy: 0.4421670682371108
Energy: 0.4925667990503586
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Energy: 0.2830823277994669
Energy: 0.38491940311330897
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Energy: 0.3607867751061014
Energy: 0.36041298969740715
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Energy: 0.4355421334554839
Energy: 0.36381956691987394
Energy: 0.3582895897374833
Energy: 0.4353379047589851
Energy: 1.3906851050072844
Energy: 0.4300789403373878
Energy: 0.3605660875921702
Energy: 0.28491589497567965
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Energy: 0.5177903083553929
Energy: 0.46199468430417634
Energy: 0.43035162475404315
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Energy: 0.6771274611970975
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Energy: 0.4312431111682723
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Energy: 0.43481646885177533
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Energy: 0.43156566678721325
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Energy: 0.36023979872763295
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Energy: 1.097825789707445
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Energy: 0.4519610566959018
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Energy: 0.38326339568901224
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Energy: 0.2837457633249963
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Energy: 1.2762035374291585
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Energy: 0.49567281668906293
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Energy: 0.4619362443724509
Energy: 0.35420034131036415
Energy: 0.4720897603012446
Energy: 0.4670826321251594
Energy: 0.36793429032234104
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Energy: 0.37362501736007836
Energy: 0.46791834320339776
Energy: 0.27535108223614835
Energy: 0.4473734619239755
Energy: 0.3588900946556428
Energy: 0.3600557797684183
Energy: 0.4657299240870766
Energy: 0.39265898268027777
Energy: 0.442337924616899
Energy: 0.4428357908645252
Energy: 0.35926510110216414
Energy: 0.5055191520289032
Energy: 0.28284052224069656
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Energy: 0.3605341057006595
Energy: 0.5000895485160338
Energy: 0.5074814795548008
Energy: 0.38487760080441846
Energy: 0.984668112677049
Energy: 0.304006337454368
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Energy: 0.539620788366826
Energy: 0.2829225406049146
Energy: 0.5483085751494905
Energy: 0.3933941366072111
Energy: 0.5372577863483968
Energy: 0.5369969572408794
Energy: 0.44523086222938646
Energy: 0.7445762294403986
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Energy: 0.36267528459874243
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Energy: 0.2753326860202746
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Energy: 0.28312716833734836
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Energy: 1.0606555296980045
Energy: 0.3630809123416387
Energy: 0.49543192221857
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Energy: 0.28339023568171345
Energy: 1.0307209267419932
Energy: 0.3602387918393887
Energy: 0.43634323190514834
Energy: 0.46430028844739835
Energy: 0.3680117241362226
Energy: 0.39764136939917394
Energy: 0.359415440510491
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Energy: 0.3038024031014875
Energy: 0.2755601420719732
Energy: 0.2751768086679454
Energy: 0.27591295971705293
Energy: 0.3494649581365132
Energy: 0.30374689952250217
Energy: 0.4463377823563559
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Energy: 0.9467768183054585
Energy: 0.35974267389221354
Energy: 0.2754374864015294
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Energy: 0.36742728592036816
Energy: 0.36548385009594836
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Energy: 0.28303089158676614
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Energy: 0.2755133220333816
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Energy: 0.5138795108600115
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Energy: 0.5416863652500443
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Energy: 0.38422930672678557
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Energy: 0.3607765402886428
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Energy: 0.3609310747796306
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Energy: 0.4412099597799806
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Energy: 0.370100898689844
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Energy: 0.3677473483805245
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Energy: 0.44474753656794763
Energy: 0.27572902508394037
Energy: 0.45205761172188624
Energy: 1.1043330193573082
Energy: 0.442500678686929
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Energy: 0.4206629853673215
Energy: 0.3041702196665565
Energy: 1.3185478644302242
Energy: 0.35556779160498164
Energy: 0.4300693714220813
Energy: 0.4302676768417626
Energy: 0.444124800799861
Energy: 0.47370350689811375
Energy: 0.3599611562556126
Energy: 0.35976732321279137
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Energy: 0.2836760815834379
Energy: 0.681237579176724
Energy: 0.4420288299649206
Energy: 0.2837567733822366
Energy: 0.3893919613670847
Energy: 0.4436390750286093
Energy: 0.2753785225645711
Energy: 0.3054322678700265
Energy: 0.4900118351550447
Energy: 0.2831298284670852
Energy: 0.6015565965399214
Energy: 0.5147389945314598
Energy: 0.27580663121704163
Energy: 0.5057063024344434
Energy: 0.36770151699467546
Energy: 1.1596620237027684
Energy: 0.36080506721700006
Energy: 0.50803282379601
Energy: 0.5043809375345252
Energy: 0.4068719871239383
Energy: 1.1200529704766051
Energy: 0.3607336914876901
Energy: 0.5494488945548668
Energy: 0.5435946507467905
Energy: 0.40621064684132036
Energy: 1.4701253206820735
Energy: 0.2760616625458991
Energy: 0.3591274284937374
Energy: 0.43974293170939033
Energy: 0.4497980950615807
Energy: 0.6338338839876253
Energy: 0.43128863766710346
Energy: 0.27546545710784504
Energy: 0.35870867371469084
Energy: 0.3885439602098111
Energy: 0.7747450413283965
Energy: 0.3625726230820115
Energy: 0.6681427532674216
Energy: 0.3943324126841158
Energy: 0.38833604718696985
Energy: 0.36820019507657875
Energy: 0.4401214359889963
Energy: 0.5015559058911363
Energy: 0.3047925419822682
Energy: 0.3637089174949429
Energy: 0.36351626013330085
Energy: 0.66562997695637

minimum gb energy = 0.2751768086679454 eV
minimum distance =  2.3841674460286 Angstroms
sigma value = 33


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

Energy: 1.3499270895611721
Energy: 0.6955162080425502
Energy: 0.7323372833403587
Energy: 0.7261403267126513
Energy: 0.6990892636863093
Energy: 1.2860288544346952
Energy: 0.6903996519570543
Energy: 0.7470504683917553
Energy: 0.6955043333303452
Energy: 0.7357580107729852
Energy: 0.7112934699380863
Energy: 0.6961580567233676
Energy: 0.7088089164275392
Energy: 0.7032002839350211
Energy: 0.7271156563781525
Energy: 0.6999007933279822
Energy: 0.6909047219891937
Energy: 0.6986182000926399
Energy: 0.6851529277762421
Energy: 0.7225290603275841
Energy: 0.7243641084602067
Energy: 0.6718099512657644
Energy: 0.6730418370523368
Energy: 0.7477806377380435
Energy: 0.7052378637576042
Energy: 0.6908059202983857
Energy: 0.6702622252770568
Energy: 0.6710872254898352
Energy: 0.738155958129598
Energy: 0.7042035372965089
Energy: 0.7114130904030576
Energy: 0.6994141308645039
Energy: 0.6930409680164518
Energy: 0.732419905615007
Energy: 0.7696979262740656
Energy: 0.7108222644392697
Energy: 0.695501915741965
Energy: 0.6716848159570978
Energy: 0.6767449997932141
Energy: 0.8193110005572621
Energy: 0.710281410852738
Energy: 0.7027290719078307
Energy: 0.6995995805843933
Energy: 0.709853997750258
Energy: 0.7061895009840318
Energy: 0.7173581472208305
Energy: 0.7208093741535675
Energy: 0.6953688032214409
Energy: 0.7099842748745507
Energy: 0.7118054410655446
Energy: 0.7211502748271825
Energy: 0.7025534526621766
Energy: 0.7391893941813218
Energy: 0.7679488780407597
Energy: 0.7448989858495236
Energy: 0.7202460916895785
Energy: 0.709923605591008
Energy: 0.7681305103125301
Energy: 0.7675028611391304
Energy: 0.7463419721715611
Energy: 0.7747358408682694
Energy: 0.7904384875322698
Energy: 0.7280934554524462
Energy: 0.7680172729201735
Energy: 0.7036893346380333
Energy: 0.7395587443786381
Energy: 0.7906032263924574
Energy: 0.7216160132519085
Energy: 0.7681446743949816
Energy: 0.670345138999275
Energy: 0.7076036037679421
Energy: 0.7481427240971867
Energy: 0.7097944062562231
Energy: 0.7649835263453314
Energy: 0.7091259210760135
Energy: 0.7082931814150383
Energy: 0.7570693483888757
Energy: 0.7097132368787595
Energy: 0.7106349212575237
Energy: 0.7081367456207446
Energy: 0.7081122296007807
Energy: 0.8068240465890686
Energy: 0.8672322880415689
Energy: 0.7494727320276979
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Energy: 0.7140691601832427
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Energy: 0.7186819058190662
Energy: 0.7808631950433486
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Energy: 0.694755967955221
Energy: 0.7357561638158452
Energy: 0.7225785585373486
Energy: 0.7735133516612344
Energy: 0.6967007972465106
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Energy: 0.7071236043258047
Energy: 0.6927471118086174
Energy: 0.7282709296013293
Energy: 0.6922235593660357
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Energy: 0.690306050319121
Energy: 0.7374770959746126
Energy: 0.7220556076194748
Energy: 0.7670156376700651

minimum gb energy = 0.6697910622691129 eV
minimum distance =  2.28533316586439 Angstroms
sigma value = 219


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

Energy: 1.2052022437637762
Energy: 0.9367291815878414
Energy: 0.9816286094441925
Energy: 0.9488595355219898
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Energy: 0.9180904172447458
Energy: 1.00012713738504
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Energy: 1.009458867761015
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Energy: 0.898903615032645
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Energy: 1.0175589486958152
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Energy: 0.9401421546642266
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Energy: 0.9433868806739866
Energy: 0.9635598597374428
Energy: 0.9861844838257124
Energy: 1.0474497445900857
Energy: 0.9701796784187132
Energy: 1.0129412739687893
Energy: 0.9982278111506576
Energy: 0.9861854026135427
Energy: 1.0468081231358388
Energy: 0.9704074000212846
Energy: 0.9437406162831986
Energy: 0.9983193947720373
Energy: 0.9688315678089795
Energy: 0.9865634600781307
Energy: 0.9904508587977391
Energy: 0.9400844623847888
Energy: 0.9562516700509115
Energy: 0.9642536984829114
Energy: 0.9862781949991972
Energy: 0.9911436070410038
Energy: 0.9400364459072652
Energy: 0.9572083025122381
Energy: 0.9494316924347749
Energy: 0.9603947722606356
Energy: 0.9530628310374928
Energy: 0.9102455005223082
Energy: 0.9549571598361418
Energy: 0.9625948339499074
Energy: 0.9606734958799374
Energy: 0.9522350307994946
Energy: 0.9104407309830966
Energy: 0.9548036872545576

minimum gb energy = 0.81523562652313 eV
minimum distance =  2.31663320581135 Angstroms
sigma value = 15


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

Energy: 1.4694202999200354
Energy: 1.0395626980860917
Energy: 1.0314954162426766
Energy: 0.9798413974509375
Energy: 1.021767269496082
Energy: 1.4164328237796908
Energy: 1.0465416232827418
Energy: 1.0795024456777549
Energy: 1.0088072888422714
Energy: 1.040764434396585
Energy: 1.0552005442443146
Energy: 0.9839394673911013
Energy: 0.9642242427438393
Energy: 0.9357675814920177
Energy: 1.0567824141465998
Energy: 1.0457124660446269
Energy: 1.0022563157058437
Energy: 0.960995391148454
Energy: 0.9680613984384291
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minimum gb energy = 0.9299363005586702 eV
minimum distance =  2.27896547690997 Angstroms
sigma value = 293


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

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Energy: 0.985329092545516
Energy: 0.9327307133512251
Energy: 1.0720546541275768
Energy: 1.0453873690702589
Energy: 0.9983368683632405
Energy: 0.9376570725746882
Energy: 0.9340504329988394
Energy: 1.024297687962665
Energy: 0.9853892452922738
Energy: 1.0506120215961914
Energy: 0.9345911995039164
Energy: 0.936088707156844
Energy: 1.0263572443732376
Energy: 1.0110181124418176
Energy: 1.0508421440993565
Energy: 0.9900344390364513
Energy: 0.9739800211197779
Energy: 0.9322921977619884
Energy: 0.9919101857370716
Energy: 0.9423609127932071
Energy: 0.9926555576507211
Energy: 0.9729166719099959
Energy: 0.9325131733191608
Energy: 0.9859461970927935
Energy: 0.9422728124039789
Energy: 1.0414984987713825
Energy: 0.9702288896040775
Energy: 0.9351663246228599
Energy: 0.9336631255514599
Energy: 1.0509711901854675
Energy: 1.0391413955281783
Energy: 1.0188346742789816
Energy: 0.9353839279535928
Energy: 0.9341076798325585
Energy: 1.050573218649735
Energy: 1.196593635148067
Energy: 1.0407640829434894
Energy: 0.932855262263446
Energy: 0.9857841825667643
Energy: 0.9283298503948207
Energy: 1.1971142221542457
Energy: 1.0293687334068782
Energy: 0.9328020241720536
Energy: 0.9858163455785869
Energy: 0.9282373266984841
Energy: 0.9966303541612656
Energy: 0.9865712631842705
Energy: 0.9345397224315996
Energy: 0.9330484634312257
Energy: 0.9930165251231544
Energy: 1.0637536320899912
Energy: 0.9872259099166926
Energy: 0.9325696258683112
Energy: 0.9337470623080325
Energy: 1.0019852055117089
Energy: 0.9627420850746501
Energy: 0.9927230174102712
Energy: 0.9855068485832704
Energy: 1.0362785677369424
Energy: 1.0778386463876821
Energy: 1.0275213424002563
Energy: 0.9903367534783217
Energy: 0.9854927012843496
Energy: 1.0364325117383655
Energy: 1.0772320385358378
Energy: 1.0394417858897975
Energy: 0.9255190020910997
Energy: 1.1987271942914464
Energy: 1.0275268402425148
Energy: 1.0782720638164596
Energy: 1.0364485555160234
Energy: 0.9253049646933457
Energy: 1.199035237403038
Energy: 1.0278628709293598
Energy: 1.0786129809600016
Energy: 0.9740014773476259
Energy: 0.9257760085479586
Energy: 0.9247622196368681
Energy: 0.9374444212791017
Energy: 0.9863755047718114
Energy: 0.9415202264277565
Energy: 1.0655799918481301
Energy: 0.9249229862469573
Energy: 0.937911430391476
Energy: 0.988202494086579
Energy: 0.9879576134648068
Energy: 1.0160832655306533
Energy: 0.9792532033665826
Energy: 0.9313995495517714
Energy: 0.9376702443201126
Energy: 0.9877081853343882
Energy: 0.9853401203896414
Energy: 0.9789824921435413
Energy: 0.9296923056712336
Energy: 0.9384197575952763
Energy: 0.9696644386877077
Energy: 1.11112068567997
Energy: 1.0231113510684324
Energy: 0.9394248918561239
Energy: 0.9920818760266902
Energy: 0.9696947721313428
Energy: 0.9986864586226776
Energy: 1.024395324791543
Energy: 0.9384039686322831
Energy: 0.9866471026719741
Energy: 0.9951652374862381
Energy: 1.0630746079827567
Energy: 1.0553555520496536
Energy: 0.9375255361450471
Energy: 0.934847692439699
Energy: 0.9704442284019408
Energy: 1.0633065286897074
Energy: 1.0561262059460133
Energy: 0.9342319925109593
Energy: 0.9353834663493396
Energy: 0.9841797609781268
Energy: 1.07474493537315
Energy: 1.0526816758173012
Energy: 1.013647982029333
Energy: 0.9622504106063079
Energy: 1.0144827460342056
Energy: 1.0515272358603602
Energy: 1.0513059084808758
Energy: 1.013667730542011
Energy: 0.9618589328477963
Energy: 1.076540838951843
Energy: 0.9374972783525408
Energy: 1.0389837739065224
Energy: 1.0635665817570539
Energy: 0.989683222289684
Energy: 1.0787223526675165
Energy: 0.9374577126186734
Energy: 1.0390777786880414
Energy: 1.063318331832226
Energy: 0.9347419228855004
Energy: 0.9333002258555807
Energy: 0.9340703065080787
Energy: 1.1982256379369165
Energy: 0.9219798567127685
Energy: 0.9333569408520193
Energy: 0.9337750753137916
Energy: 0.9346945372854881
Energy: 1.1987806902779936
Energy: 0.9219185224141426
Energy: 0.9327064281465131
Energy: 0.9316713399740789
Energy: 0.93571707059393
Energy: 0.9881937708788322
Energy: 0.972346526046136
Energy: 0.9854894905443103
Energy: 0.9314334402608158
Energy: 0.9353833311689926
Energy: 1.0156843445658839
Energy: 0.9415097456918443
Energy: 0.985937499722487
Energy: 0.9856069537428958
Energy: 0.9275257891438762
Energy: 1.0702410704452754
Energy: 1.0085564753022274
Energy: 0.9936970603456717
Energy: 0.9868542786654866
Energy: 0.967567418841213
Energy: 1.0714400828623558
Energy: 1.0080192526626388
Energy: 0.9903414104021449
Energy: 0.9277256205933907
Energy: 0.9966754862598606
Energy: 1.0180443790789402
Energy: 1.0475621508876
Energy: 1.1990862596189593
Energy: 0.9423551729415308
Energy: 0.9969919859162311
Energy: 1.0180502355061352
Energy: 1.0371229948980307
Energy: 1.197452553027551
Energy: 1.0361901271353862
Energy: 0.9857436956977227
Energy: 0.9916124122005766
Energy: 1.0690001557543611
Energy: 0.9259514547161796
Energy: 1.0367866367494434
Energy: 0.9857305849210645
Energy: 1.0283592948377085
Energy: 1.0690149146660193
Energy: 0.9281167642404817
Energy: 0.9367640801190656
Energy: 0.9298708389289734
Energy: 0.9856228212189022
Energy: 1.0637663694250987
Energy: 0.9691254346364799
Energy: 0.9341622598266621
Energy: 0.9317276716413253
Energy: 0.9855228271367243
Energy: 1.063080053477916
Energy: 0.9695782524188644
Energy: 0.9867634860571304
Energy: 0.9828008722517397
Energy: 1.0667618247461887
Energy: 1.1300931679731954
Energy: 0.9694438992185761
Energy: 0.9862945579460572
Energy: 1.0146707874422722
Energy: 1.0674133097723646
Energy: 1.1097514475219135
Energy: 0.9697042264612767
Energy: 0.9365738156188742
Energy: 0.9348086670322983
Energy: 1.0261080939203187
Energy: 1.0190894661516112
Energy: 1.0849496054956203
Energy: 0.935665293282147
Energy: 0.9348678124998961
Energy: 1.0254062141254736
Energy: 0.9896777721117451
Energy: 1.0507137577249352
Energy: 0.9906317355052796
Energy: 0.9739071075616489
Energy: 0.9317616581555548
Energy: 0.9901338432212008
Energy: 0.9867165310216371
Energy: 0.9862460799588553
Energy: 0.9738538118756032
Energy: 0.931459467550751
Energy: 0.9899723531379186
Energy: 0.9728756565632953
Energy: 1.2104104213628455
Energy: 1.055022427776193
Energy: 0.9357600240176308
Energy: 0.9318823580893222
Energy: 1.053111027243442
Energy: 1.209363404078246
Energy: 1.0531192957512576
Energy: 1.0747760760696228
Energy: 0.9320536764139857
Energy: 1.0611771932806398

minimum gb energy = 0.9219185224141426 eV
minimum distance =  2.32399674471167 Angstroms
sigma value = 293


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

Energy: 0.8330495038983972
Energy: 0.8567828646831201
Energy: 0.9405718389308505
Energy: 0.8559011926258122
Energy: 0.8365407073248464
Energy: 0.8335918668806396
Energy: 0.8561058151835542
Energy: 0.9406565064521561
Energy: 0.9334128864470396
Energy: 0.8361366880890511
Energy: 0.9151699534345379
Energy: 0.8549950848571208
Energy: 0.8527440453538746
Energy: 0.8515769986806091
Energy: 0.8571067645357118
Energy: 0.9147573578277796
Energy: 0.856018063995287
Energy: 0.8359896918600257
Energy: 0.8553528758755748
Energy: 0.8567315887656809
Energy: 0.861848354096135
Energy: 0.8548322198826449
Energy: 0.8562880566041015
Energy: 0.9408064315618812
Energy: 0.9137324183576792
Energy: 0.8622822249348525
Energy: 0.8554618106125579
Energy: 0.8551236549265446
Energy: 0.9200063029693584
Energy: 0.9153060860982134
Energy: 0.9163971159438772
Energy: 0.8343255761781991
Energy: 0.8359894276434582
Energy: 0.8624891198589261
Energy: 0.9174204354480208
Energy: 0.9197712444244346
Energy: 0.8345467370264037
Energy: 0.8362530695261278
Energy: 0.862383493116427
Energy: 0.8380605539657046
Energy: 0.9329866194175587
Energy: 0.8357249868372809
Energy: 0.8343067412814821
Energy: 0.9444553621663577
Energy: 0.8555327839429462
Energy: 0.9343988009617397
Energy: 0.8359041851816286
Energy: 0.8351022869521648
Energy: 0.8557199350916004
Energy: 0.8554055166780683
Energy: 0.855457914317576
Energy: 0.9247530712938549
Energy: 0.8558054461031713
Energy: 0.9329874384610283
Energy: 0.8359297236178738
Energy: 0.8558179382917089
Energy: 0.940885191818478
Energy: 0.8558291457178626
Energy: 0.9314087794157249
Energy: 0.8358101059820772
Energy: 0.9430918099044677
Energy: 0.8379830020618337
Energy: 0.8553395383664563
Energy: 0.8552981736414773
Energy: 0.8560236414854573
Energy: 0.9163940340507059
Energy: 0.8374040086953265
Energy: 0.8558754793558229
Energy: 0.8551853734321818
Energy: 0.8539947011612572
Energy: 0.9344498651398369
Energy: 0.9125927370584428
Energy: 1.0029807767154264
Energy: 0.8339314678117502
Energy: 0.8359257980079633
Energy: 0.9337630160780424
Energy: 0.9098404943117834
Energy: 0.9422579694954566
Energy: 0.8336098122298738
Energy: 0.9330627985044826
Energy: 0.8546635620034384
Energy: 0.8359434726822892
Energy: 0.8537721084297107
Energy: 0.835389206531958
Energy: 0.916066712849793
Energy: 0.8552453178800649
Energy: 0.8518319597718711
Energy: 0.853032619459881
Energy: 0.8347749081142743
Energy: 0.9161433711996849
Energy: 0.9318761569637657
Energy: 0.8562923161713359
Energy: 0.9096135999386599
Energy: 1.0036833809182
Energy: 1.0407047547436032
Energy: 0.9317165866091298
Energy: 0.8565819340259844
Energy: 0.9096823851940826
Energy: 0.8614257197369256
Energy: 1.040116103275261
Energy: 0.8351195920758745
Energy: 0.9335115432868927
Energy: 0.9157783998988741
Energy: 0.9431208035061739
Energy: 0.8570771181130484
Energy: 0.8352140552832854
Energy: 0.8571813048253182
Energy: 0.8374656410641977
Energy: 0.9426740985367823
Energy: 0.8563037135496234
Energy: 0.8331239098356593
Energy: 0.8565180618750161
Energy: 0.9409799405238796
Energy: 1.0395341200962434
Energy: 0.83579043363335
Energy: 0.8334256490510651
Energy: 0.8564768707134554
Energy: 0.9412064162750976
Energy: 0.9335517526526407
Energy: 0.836060841894174
Energy: 0.9157534370624758
Energy: 0.8549720884633095
Energy: 0.8527878587324652
Energy: 0.8515519383090298
Energy: 0.8567943214890834
Energy: 0.9151682322326539
Energy: 0.8552921753828097
Energy: 0.8359940348492809
Energy: 0.8542880887354884
Energy: 0.8573366515545287
Energy: 0.8613731889347559
Energy: 0.8549502042923003
Energy: 0.8568736170873275
Energy: 0.9409454775527797
Energy: 0.9141607148137887
Energy: 0.8623109677583708
Energy: 0.8554738816503481
Energy: 0.8558780098959079
Energy: 1.002203090718738
Energy: 0.9147811368001442
Energy: 0.9160976933184308
Energy: 0.8345479652307627
Energy: 0.8356379174759585
Energy: 0.8623115923770845
Energy: 0.915115704759879
Energy: 0.9203810680434501
Energy: 0.8348848463586077
Energy: 0.8360336627774586
Energy: 0.8622507639948744
Energy: 0.9147272404818596
Energy: 1.1160791388227373
Energy: 0.8356902390297924
Energy: 0.8342785238036765
Energy: 0.8563024139578167
Energy: 0.8554933424811927
Energy: 0.9342367747019333
Energy: 0.8359229873374234
Energy: 0.834478219273638
Energy: 0.8555253832558111
Energy: 0.8546832756906854
Energy: 0.8554761223214329
Energy: 0.9223501662958132
Energy: 0.856109691357662
Energy: 0.9328046186243178
Energy: 0.8357651482827162
Energy: 0.8557972818197296
Energy: 0.9407859138601664
Energy: 0.8561509549109059
Energy: 0.9313616086119034
Energy: 0.8356865318303632
Energy: 0.9426242856219045
Energy: 0.8383158114485408
Energy: 0.8559608933680423
Energy: 0.8558697678149144
Energy: 0.9449836319982741
Energy: 0.9434607523506255
Energy: 0.837466255609027
Energy: 0.8556198191490133
Energy: 0.8554249276958747
Energy: 0.9168366551901823
Energy: 0.9344302246599518
Energy: 0.9125968987236625
Energy: 1.0023596381180895
Energy: 0.8339774637615128
Energy: 0.8356749892894855
Energy: 0.9338616184244509
Energy: 0.9097056457976237
Energy: 0.8573229904567389
Energy: 0.8335785918178272
Energy: 0.9325121052859828
Energy: 0.8544746566804897
Energy: 0.8357202616199654
Energy: 0.8563482656854464
Energy: 0.8354108049065196
Energy: 0.9162005633739884
Energy: 0.854792931839773
Energy: 0.8519180396702533
Energy: 0.8535660826743601
Energy: 0.834939149413702
Energy: 0.8553714093995755
Energy: 0.9323274179744333
Energy: 0.8553350337571445
Energy: 0.9094930865239693
Energy: 1.0037268690222247
Energy: 1.0410325377348426
Energy: 0.9323594096121199
Energy: 0.8563735786842605
Energy: 0.9118304038788716
Energy: 0.9340460930448048
Energy: 1.0406188141349462
Energy: 0.8346786222270796
Energy: 0.9348766494095425
Energy: 0.916419353054457
Energy: 0.9431838013260151
Energy: 0.9152877361181492
Energy: 0.8350780023472252
Energy: 0.8567641855632657
Energy: 0.8374315519714177
Energy: 0.9429471214637085
Energy: 0.9148240025235898

minimum gb energy = 0.8330495038983972 eV
minimum distance =  2.29737807286658 Angstroms
sigma value = 15


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

Energy: 1.5461844998081984
Energy: 0.9934722164394291
Energy: 1.03436188183671
Energy: 1.0121040457560104
Energy: 1.0062291163229788
Energy: 0.9371607040649723
Energy: 1.0032503053882416
Energy: 1.0379443509904493
Energy: 1.0104939883966118
Energy: 1.1097440700083516
Energy: 0.9206782937804134
Energy: 0.9859199103018587
Energy: 0.9516039441082218
Energy: 0.9623248678904551
Energy: 1.0588515300284944
Energy: 0.914097409051839
Energy: 0.9861779267897903
Energy: 0.9574124440909759
Energy: 1.0175623990509945
Energy: 1.042447403556142
Energy: 1.056709679525291
Energy: 0.964435576118869
Energy: 0.9310771816004534
Energy: 0.9812338306672447
Energy: 1.0138458669776436
Energy: 1.0369786894532285
Energy: 0.9569000486103536
Energy: 0.933473298954576
Energy: 0.9770673119228547
Energy: 1.0104106159543929
Energy: 1.0249338405751267
Energy: 0.9221431653956768
Energy: 1.0370329963507676
Energy: 1.0658656076387316
Energy: 1.0145532633130991
Energy: 1.0308864959808501
Energy: 0.9251990083357574
Energy: 1.0203107698536367
Energy: 1.035069466172427
Energy: 1.0104435218395338
Energy: 0.9428047023739982
Energy: 1.0917320554119077
Energy: 1.1003407576019941
Energy: 0.9234404597515288
Energy: 0.9184161784101028
Energy: 0.9552428477312265
Energy: 1.0981614445441203
Energy: 0.9864834588155813
Energy: 0.9222203706991646
Energy: 0.9177744827987021
Energy: 1.0904899214209454
Energy: 0.9218012270737973
Energy: 0.926477055015531
Energy: 1.0757605122756742
Energy: 1.0556660569771337
Energy: 1.0490041864271327
Energy: 0.9241499719854569
Energy: 0.9388194105745172
Energy: 1.0810745819872318
Energy: 1.15837659153765
Energy: 0.9233000137742123
Energy: 0.9216165258105586
Energy: 0.9286657758078504
Energy: 0.9695809949229277
Energy: 1.0345806848714607
Energy: 0.9238626026672236
Energy: 0.9221761308689403
Energy: 0.9288304634253661
Energy: 0.9870307091897407
Energy: 1.0256260247198559
Energy: 0.9738187511070836
Energy: 0.9259596061448553
Energy: 0.9369226375459629
Energy: 1.09059500745803
Energy: 1.1031536441027072
Energy: 0.9421690492998869
Energy: 0.9230600468514628
Energy: 0.9388153807918919
Energy: 0.9969608334397213
Energy: 1.0678474520394459
Energy: 0.9698905522463763
Energy: 1.0538143781986309
Energy: 1.0609961646302575
Energy: 0.9242790020670585
Energy: 0.9314499727150398
Energy: 0.9747342374180953
Energy: 1.0532410981103042
Energy: 1.0656731173887437
Energy: 0.91831705346165
Energy: 0.9332110380684642
Energy: 1.0594272685475128
Energy: 1.000322165594546
Energy: 0.9544410250322423
Energy: 0.9321927551132886
Energy: 0.9426940035045681
Energy: 1.0298771932999897
Energy: 0.9804098271752634
Energy: 0.9466165168624869
Energy: 0.9336084242423804
Energy: 0.9455801587740646
Energy: 0.931506894956872
Energy: 1.0140631352785663
Energy: 0.9425743044570506
Energy: 0.933605616977875
Energy: 0.9358629841596547
Energy: 1.0577977174089102
Energy: 0.9506914779877057
Energy: 0.943895806517689
Energy: 0.9324673454999756
Energy: 0.9161422301616449
Energy: 1.0301104160675154
Energy: 1.0782091729411791
Energy: 1.0424080090342687
Energy: 0.9111832946764024
Energy: 1.074413804554517
Energy: 1.0308810964636457
Energy: 1.0622467511537235
Energy: 0.9273287064705581
Energy: 1.0435947552746747
Energy: 1.0759166250837437
Energy: 1.023881360511959
Energy: 1.0502004648589691
Energy: 1.087238954127648
Energy: 1.0845382180199867
Energy: 1.0580052508328173
Energy: 1.0196697090052032
Energy: 1.0176859516972334
Energy: 0.9707599160809288
Energy: 1.0843050568364951
Energy: 1.0297719762089124
Energy: 0.9528924664629179
Energy: 1.0018169921868638
Energy: 1.0484421426609682
Energy: 0.9893428537429649
Energy: 0.9791877759871365
Energy: 0.9531741725139975
Energy: 1.0107477980546162
Energy: 0.9148470946409467
Energy: 1.0075531863697922
Energy: 1.0045062872936468
Energy: 0.9337931155915101
Energy: 0.9331948459824383
Energy: 1.0292851661472429
Energy: 1.0348358583896595
Energy: 0.9562111855614641
Energy: 0.9347069845792205
Energy: 1.0395296998608818
Energy: 1.0312781232144672
Energy: 1.0369849994151599
Energy: 0.9566679755841443
Energy: 1.0689783291572448
Energy: 1.0405133602506087
Energy: 1.0385372027249677
Energy: 1.0385421860252306
Energy: 0.9992548287373226
Energy: 1.0950282631815564
Energy: 1.040410744122744
Energy: 1.0387788033862946
Energy: 1.0341893525802879
Energy: 1.0001200119594866
Energy: 0.9970397828275191
Energy: 0.9859352336792113
Energy: 1.0032964777390756
Energy: 1.0993350476711068
Energy: 0.9741928579217379
Energy: 1.007296537451313
Energy: 1.0085922416039108
Energy: 0.9621453669215214
Energy: 1.098786886680788
Energy: 0.973195194093309
Energy: 1.0784824156937445
Energy: 1.1132377988456281
Energy: 1.073661560797802
Energy: 1.048086862348302
Energy: 0.9264303040859644
Energy: 1.0887201444818564
Energy: 1.112386209700677
Energy: 1.1090399307775112
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Energy: 0.9279394522345407
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Energy: 0.932980164152816
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Energy: 0.9303052170596778
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Energy: 0.9364326130662555
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Energy: 1.071290835556572
Energy: 0.9250100035101194
Energy: 0.9250737591722159
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Energy: 0.9769536785205262
Energy: 1.061187979955111
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Energy: 0.9031913537323115
Energy: 1.1106260988161651
Energy: 1.0532682836519551
Energy: 0.9729388263463691
Energy: 0.9432356792764318
Energy: 0.9078286238816696
Energy: 1.1233057462637555
Energy: 1.0536478842484194
Energy: 0.9215974640392324
Energy: 0.9766291534809264
Energy: 0.9409375299208343
Energy: 0.965792601100272
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Energy: 0.9443929692081283
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Energy: 0.9416386542426701
Energy: 0.9660993416758847
Energy: 0.946811011111729
Energy: 0.958636742936308
Energy: 0.9069349380852885
Energy: 1.0614061440962506
Energy: 1.0492126670047541
Energy: 1.053480173070709
Energy: 0.9900806380957784
Energy: 0.9179217519281134
Energy: 1.0350803035243492
Energy: 1.036046215547285
Energy: 1.0688002663762026
Energy: 0.9622627931137969
Energy: 1.4727466964305007
Energy: 1.045405033805216
Energy: 1.0439920979256663
Energy: 1.098021119207193
Energy: 1.1389939537794105
Energy: 0.9191865918976911
Energy: 1.023105586585211
Energy: 1.0554230592838496
Energy: 1.0945678049930634
Energy: 1.0817413681075272
Energy: 0.9164043912030532
Energy: 0.9719102904210053
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Energy: 0.9805043206625365
Energy: 1.0522689588349092
Energy: 0.9163489068012884
Energy: 0.9744718755704336
Energy: 0.9505124968065066
Energy: 0.9801860094508874
Energy: 1.058311930740355
Energy: 1.0411329412509116
Energy: 0.9768426298033408
Energy: 0.9271689349233129
Energy: 0.932370894716231
Energy: 1.0301402608605388
Energy: 1.0341114855417741
Energy: 0.9647119548400355
Energy: 0.9319623080058923
Energy: 0.9930976724125749
Energy: 0.9028272032980654
Energy: 1.0485614600424296
Energy: 1.0260788786646466
Energy: 1.0217584204006311
Energy: 1.0581752172589582
Energy: 1.0296177038669456
Energy: 1.0486090093256344
Energy: 1.0253594026990829
Energy: 1.0380366115955952
Energy: 1.058244424536596
Energy: 1.0309979871501367
Energy: 0.965961977887308
Energy: 1.0599246338901747
Energy: 0.9750034554347132
Energy: 0.9454264581101809
Energy: 1.0190890468853644
Energy: 0.9827703064141673
Energy: 0.9833029541283425
Energy: 1.0738152421258989
Energy: 0.9455297656536338
Energy: 1.0137739474373815
Energy: 1.1087963606139033
Energy: 0.9253780365191727
Energy: 0.9404139719582745
Energy: 1.0882421668909348
Energy: 1.0891444561039465
Energy: 1.1139794815212798
Energy: 0.92556384290725
Energy: 0.9522245360960829
Energy: 1.1183306771546715
Energy: 1.1551887893222308
Energy: 0.9290611803780835
Energy: 0.9316922665558705
Energy: 0.9259250070799512
Energy: 0.9793453438382816
Energy: 1.0214793282810963
Energy: 0.928097228478055
Energy: 0.925052646854055
Energy: 0.9620526696392115
Energy: 0.9723353334508837
Energy: 1.010422863407518
Energy: 0.9290701114899772
Energy: 0.9300135018497595
Energy: 0.9357859353277558
Energy: 1.0972610669317884
Energy: 1.0383853347343606
Energy: 0.9280008136721837
Energy: 0.9295249396772677
Energy: 0.9365156502899877
Energy: 0.9629309685664347
Energy: 1.0563290237524512
Energy: 0.997756035847047
Energy: 0.9409155845340054
Energy: 1.0562780330823065
Energy: 0.9722928668441464
Energy: 0.9283828761072482
Energy: 0.9818310231513795
Energy: 0.9665855342675379
Energy: 1.0556946936676448
Energy: 0.972063090667357
Energy: 0.9293490140480253
Energy: 1.0814379249725337
Energy: 1.1099789952718964
Energy: 0.9732768850980723
Energy: 0.9113259714586708
Energy: 0.9398576214907304
Energy: 1.0755544821030212
Energy: 1.0874871631619345
Energy: 0.9559290241702012
Energy: 0.9124861220919069
Energy: 0.9473572931237432
Energy: 1.0734044292994687
Energy: 1.0401216564553395
Energy: 0.9507388448700204
Energy: 0.934812719323901
Energy: 0.9371487602897136
Energy: 1.0353574454557497
Energy: 1.0513724407574117
Energy: 0.9515823563440163
Energy: 0.9360397976007608
Energy: 0.9287893305959981
Energy: 1.0304177083339587
Energy: 0.986340895312481
Energy: 0.9286109372065077
Energy: 0.9111258898223308
Energy: 1.0839595109299405
Energy: 1.0308808456637324
Energy: 1.1152774896137136
Energy: 0.9222170247994737
Energy: 0.9131870096402106
Energy: 1.0835954182123004
Energy: 0.9209253526253603
Energy: 0.9866782265125152
Energy: 1.0828645894916598
Energy: 1.06593353448951
Energy: 0.9394218252362972
Energy: 0.9221022494044729
Energy: 0.9796287946368959
Energy: 1.0628723400291469
Energy: 1.073932536733579
Energy: 0.9479866428061058
Energy: 0.9499604679886193
Energy: 0.9846981599745182
Energy: 1.1087829169431513
Energy: 0.9335607947211395
Energy: 0.96352815319718
Energy: 0.9529549199738871
Energy: 0.9835456769381935
Energy: 0.9534486867284839
Energy: 0.9449722097926063
Energy: 0.9633494274312677
Energy: 0.9337375227274014
Energy: 0.9815501468683973
Energy: 0.9150750403709387
Energy: 1.015940833345047
Energy: 0.9571514541256629
Energy: 0.9337868253999765
Energy: 0.9706370469623987
Energy: 0.9150667903164827
Energy: 0.9423053760900023
Energy: 0.960607701092056
Energy: 1.1050823492288353
Energy: 1.0455949446208952
Energy: 1.042221384877381
Energy: 1.0209734010831946
Energy: 1.016121262654846
Energy: 1.062783199533965
Energy: 1.043623549065285
Energy: 1.0411953535233678
Energy: 1.0208330576878635
Energy: 0.9527343650151503
Energy: 1.0432269243643237
Energy: 0.9727949582641744
Energy: 0.9230139127751992
Energy: 0.9853422529994343
Energy: 1.0062828642680643
Energy: 1.1265467344285165
Energy: 0.9738708917138338
Energy: 0.9193858524041997
Energy: 0.9725014115933667
Energy: 1.348748244510878
Energy: 1.0691304168505478
Energy: 1.0998083832493628
Energy: 1.0677242860192286
Energy: 1.1049265298926036
Energy: 0.9260406121530691
Energy: 1.0729127603554107
Energy: 1.099324061187176
Energy: 1.1043205742948192
Energy: 1.068364468541684
Energy: 0.9237871765568477
Energy: 0.9572642637960554
Energy: 0.9448123191025535
Energy: 0.9345465781308631
Energy: 0.926886610065022
Energy: 0.9269961462148852
Energy: 0.9258126586197686
Energy: 0.9546982366067226
Energy: 0.9230286016418305
Energy: 0.9310542583333216
Energy: 0.9359104822881709
Energy: 0.923290806172501
Energy: 0.9719755716606094
Energy: 1.0458508941798537
Energy: 0.9238235569317129
Energy: 0.9242981332857266
Energy: 0.9363320263301816
Energy: 0.9729210492608854
Energy: 1.0389586826330999
Energy: 0.9247381310681204
Energy: 0.9233853991424523
Energy: 1.0571320324898206
Energy: 0.9629989280242975
Energy: 0.9492602315645702
Energy: 0.9887284594150278
Energy: 0.9916403342086129
Energy: 1.1029476775201432
Energy: 1.0984215215106912
Energy: 0.9213184196301852
Energy: 0.9589863015080645
Energy: 1.0075693877977725
Energy: 0.9207950415362911
Energy: 0.9210244756745322
Energy: 1.0712663382544385
Energy: 1.057977773637608
Energy: 1.0708527937694097
Energy: 0.9141786292789799
Energy: 0.9155031804751661
Energy: 1.0871735906772015
Energy: 1.0564844681897523
Energy: 0.9951736921216536
Energy: 0.9422568767570677
Energy: 0.9202017534036794
Energy: 0.9231940454491572
Energy: 1.0379978815769502
Energy: 0.944294205030823
Energy: 0.9309457987846308
Energy: 0.9244000480693925
Energy: 0.9470428115146092
Energy: 1.0373930360457113
Energy: 0.9451846379196949
Energy: 0.9214326796034719
Energy: 0.9141580026588404
Energy: 1.0520442477019651
Energy: 1.0521940561681762
Energy: 1.0804533059379036
Energy: 0.9151121796578314
Energy: 0.9724711236010486
Energy: 1.0314619857011265
Energy: 1.0846954252230263
Energy: 1.0598096582305685
Energy: 0.9516408533176252
Energy: 1.0785534157589318
Energy: 0.9519620454899235
Energy: 0.9710716473862151
Energy: 0.9913844447265265
Energy: 0.9426220257616555
Energy: 1.058914197969084
Energy: 1.0428719174869512
Energy: 1.021062581212083
Energy: 0.9545523977412942

minimum gb energy = 0.9028272032980654 eV
minimum distance =  2.24856793137373 Angstroms
sigma value = 437


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

Energy: 1.1746612691984024
Energy: 1.0880281411057837
Energy: 1.0282557496321545
Energy: 0.9760937067546062
Energy: 0.8882728418342978
Energy: 1.1756307808582571
Energy: 1.099339278883138
Energy: 1.0272548767093248
Energy: 0.9169939732920136
Energy: 1.1156035744945876
Energy: 0.916985940764353
Energy: 1.1016890262494068
Energy: 1.035692205712723
Energy: 1.0395291202413286
Energy: 0.9942451700514897
Energy: 0.8956395066959095
Energy: 1.0913774679636947
Energy: 1.0116881523401149
Energy: 1.118622989716704
Energy: 1.073124409707137
Energy: 0.9749894838448233
Energy: 1.0118424238696095
Energy: 0.9927895954991598
Energy: 0.9649599222222551
Energy: 0.9495565193078273
Energy: 0.9736753740450664
Energy: 1.0123125330212392
Energy: 0.9895555678389326
Energy: 0.9622553496057398
Energy: 0.949798282418738
Energy: 0.9599110921729627
Energy: 0.9605882095815942
Energy: 1.0330582841515206
Energy: 0.9697554853121068
Energy: 0.9502940464880445
Energy: 0.9608067885700704
Energy: 0.8952818825624828
Energy: 1.0380163908615163
Energy: 0.9696725533682504
Energy: 0.949877585653977
Energy: 0.9017503539434679
Energy: 1.075833146381786
Energy: 0.8949829986324614
Energy: 0.9774416862175673
Energy: 0.8902670515767405
Energy: 0.9022252198777085
Energy: 1.0762320113091943
Energy: 0.895582662168676
Energy: 0.9781415404381965
Energy: 0.9263303978284423
Energy: 0.8892343560717073
Energy: 0.9000019133447268
Energy: 0.9196676740749609
Energy: 0.9073145217971446
Energy: 1.1778776754533222
Energy: 0.8923670193878696
Energy: 0.9004835350578344
Energy: 0.9205652416958264
Energy: 0.9070812625643428
Energy: 1.1777737690809273
Energy: 0.978339299545258
Energy: 0.9690262073317253
Energy: 0.9548283307702988
Energy: 0.9754037673813619
Energy: 0.9321863634637748
Energy: 0.9791688010510576
Energy: 0.9662899897645529
Energy: 0.9680023249344866
Energy: 0.9755931043426639
Energy: 0.9505624847021861
Energy: 1.0025240461881952
Energy: 0.9199857823672903
Energy: 0.9562330468686319
Energy: 1.095713954846175
Energy: 1.1200233899362837
Energy: 1.0031106880799334
Energy: 0.9095201201805033
Energy: 0.9562735750201777
Energy: 1.1001235909830818
Energy: 1.1207856647424255
Energy: 0.9821764030364923
Energy: 1.0967043118268942
Energy: 0.9949250568578433
Energy: 1.0052938742314492
Energy: 0.961064618528673
Energy: 0.9781979373162285
Energy: 1.0976568521299621
Energy: 0.9948928266244357
Energy: 1.0028712558016262
Energy: 0.9595286098024652
Energy: 1.0137990914860906
Energy: 1.092019644040505
Energy: 0.8954065104042859
Energy: 0.8962964447606186
Energy: 1.007374200137013
Energy: 0.9562460701131362
Energy: 1.1064163859182865
Energy: 0.8937252825640615
Energy: 1.1129164155116702
Energy: 0.9159919708354243
Energy: 0.8957290292638422
Energy: 0.894345345063623
Energy: 1.0036597296304772
Energy: 1.193161796386221
Energy: 0.8985149029919801
Energy: 0.895341099106779
Energy: 0.8944539498370249
Energy: 1.0027632889954878
Energy: 1.1828391967503469
Energy: 0.8961670041527778
Energy: 0.8985493916166787
Energy: 0.9117144173388515
Energy: 0.8977769791838104
Energy: 1.0717442538624098
Energy: 0.8999863134432745
Energy: 0.9101402044589445
Energy: 0.8963812923568217
Energy: 0.9160210791537526
Energy: 0.9877111253723075
Energy: 0.898339348232131
Energy: 0.895811171031229
Energy: 0.8998553380378682
Energy: 1.1146575441685922
Energy: 1.11550822007023
Energy: 1.0134583019226755
Energy: 0.8961848756737858
Energy: 0.9571148592703865
Energy: 1.0964527431736206
Energy: 1.1160233859911783
Energy: 0.9210534400369828
Energy: 1.0106510122238617
Energy: 0.9150158438567428
Energy: 1.097730959226098
Energy: 0.975731380537976
Energy: 0.9673477612310887
Energy: 1.0106720799232312
Energy: 0.9280642054295546
Energy: 0.9976949117953513
Energy: 0.9759554977741244
Energy: 0.8872907227204501

minimum gb energy = 0.8872907227204501 eV
minimum distance =  2.26136553339328 Angstroms
sigma value = 33