Model name: model_name=MEAM_LAMMPS_KimJungLee_2009_FeTiC__MO_110119204723_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=3.611098542809487
cohesive_energy=4.242432871546096
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=[2.27478640671954e-19, 3.00839104389546e-19, 3.5595558277577994e-19, 4.0233378980017797e-19, 4.40391893564214e-19, 4.7321889061823995e-19, 5.01901056720108e-19, 5.2715776917848395e-19, 5.495065310461499e-19, 5.6932545600873e-19, 5.86907742390246e-19, 6.024889101558959e-19, 6.162548117952239e-19, 6.283608584417279e-19, 6.38938428579396e-19, 6.48099674572608e-19, 6.55937522666136e-19, 6.62535286044948e-19, 6.679682670108419e-19, 6.7229734827591e-19, 6.75583412552244e-19, 6.778745251388639e-19, 6.792203535114239e-19, 6.796593499091399e-19, 6.79183503448842e-19, 6.77642209526934e-19, 6.748335938875319e-19, 6.7051893221217e-19, 6.64411434883362e-19, 6.561618273948959e-19, 6.45350339468664e-19, 6.3146427458178595e-19, 6.1386917078719795e-19, 5.91789574594044e-19, 5.6425456696212e-19, 5.300545045327559e-19, 4.8765450209058e-19, 4.35106312848648e-19, 3.6989451949157997e-19, 2.88750681686016e-19, 1.87369750816398e-19, 5.99994321136758e-20, -1.011524604816096e-19, -3.06834449353974e-19, -5.72154899944374e-19, -9.18846697422366e-19, -1.378943761408146e-18, -2.00115065939868e-18, -2.86219242604296e-18, -4.08814594284708e-18, -5.897387885025239e-18, -8.6938910690742e-18, -1.3291320898570858e-17, -2.1528447431057998e-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: 0.020083762988628302
Energy: 0.021162669950915265
Energy: 0.8890763883111175
Energy: 0.7759043151019711
Energy: 0.770735314324503
Energy: 0.29175284259859596
Energy: 0.021081744408085735
Energy: 0.0205300828015621
Energy: 0.48073217330407453
Energy: 0.12830183824919425
Energy: 0.0886528541485885
Energy: 0.48007746134040236
Energy: 0.021616520884968328
Energy: 0.07536751537318293
Energy: 0.020645659640428915
Energy: 0.4756860058659683
Energy: 0.5882999316404659
Energy: 0.4476368273389929
Energy: 0.47545352058977236
Energy: 0.07362508945784738
Energy: 0.07512782426556362
Energy: 0.022494210920322336
Energy: 0.49977820327618044
Energy: 0.2241083705919797
Energy: 0.5040623609225382
Energy: 0.5056721837518914
Energy: 0.07426865739540477
Energy: 0.021219381683501008
Energy: 0.07458348669487924
Energy: 0.5081664639572768
Energy: 0.15227281294068176
Energy: 0.08770106191971416
Energy: 0.4727707658626244
Energy: 0.021135216280111398
Energy: 0.07550352327823019
Energy: 0.02050916595394001
Energy: 0.47204383392954447
Energy: 0.30042914702872137
Energy: 0.4737712600442623
Energy: 0.47533185977662806
Energy: 0.07353286923848926
Energy: 0.0755116528600592

minimum gb energy = 0.020083762988628302 eV
minimum distance =  2.52751901277292 Angstroms
sigma value = 5


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

Energy: 1.0182339010344441
Energy: 1.0044678434952188
Energy: 0.9149119994140175
Energy: 1.047513250553629
Energy: 0.9741480222698128
Energy: 0.9122617254758385
Energy: 1.019249214997968
Energy: 0.9075146036661689
Energy: 0.9318584727871093
Energy: 0.8858593179305623
Energy: 0.9138571444617588
Energy: 0.8223846017451427
Energy: 0.8553139039888745
Energy: 0.8777574191435983
Energy: 0.9424046482069476
Energy: 0.8686693850964413
Energy: 0.7992358940460669
Energy: 0.8982810475826896
Energy: 0.8530223196194427
Energy: 0.7986869027993765
Energy: 0.9675193481352247
Energy: 0.9125148071641743
Energy: 0.7996117752770433
Energy: 0.8692951676919173
Energy: 0.9686107815635872
Energy: 0.9145557972901268
Energy: 0.9767103601103116
Energy: 0.9128216087050595
Energy: 0.9034684370505623
Energy: 0.8314979294708654
Energy: 1.021044146677192
Energy: 0.9481869432366098
Energy: 0.9175591783293281
Energy: 1.0501044864472353
Energy: 0.9788980619559127
Energy: 0.9988168796705931
Energy: 0.8770374197964169
Energy: 1.055984455842909
Energy: 0.8806405409363437
Energy: 0.8413697129531402
Energy: 0.9968291995217994
Energy: 0.9104510604812355
Energy: 1.0236879878204432
Energy: 0.8870119711562566
Energy: 0.9825074175083595
Energy: 0.9710778972662131
Energy: 0.9266097942573758
Energy: 0.8968567110145168
Energy: 0.8351317925665788
Energy: 1.0210208347394847
Energy: 0.9527662010987968
Energy: 0.8376732316870364
Energy: 0.9358657909396632
Energy: 0.911222337953716
Energy: 0.8929927962944801
Energy: 0.9399940936124493
Energy: 0.9232407854752068
Energy: 0.9014940366396903
Energy: 0.8582185248113537
Energy: 0.7990709779211971
Energy: 0.8213652265796287
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Energy: 0.9493014588604535
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Energy: 0.9926854227419505
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Energy: 0.9547943964178939
Energy: 0.9581831932950423
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Energy: 0.9066022974455036
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Energy: 0.873778554894783
Energy: 0.8268883637697053
Energy: 0.9433997110193298
Energy: 0.9406233436298447
Energy: 1.024073862123469
Energy: 0.8874542232396877
Energy: 0.8621029829035676
Energy: 1.0902049705455514
Energy: 0.9391239510710905
Energy: 0.9337877817846933
Energy: 0.8762997244819856
Energy: 0.9618572677158732
Energy: 0.8998186547092512
Energy: 0.9225282602953575
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Energy: 0.8574569878380668
Energy: 1.0339359877913668
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Energy: 0.8649530258994863
Energy: 0.8158208535972528
Energy: 0.7598505064161492
Energy: 0.8780359686782929
Energy: 0.8608364163180665
Energy: 0.9900137024359819
Energy: 0.9395609160182321
Energy: 0.9003443206737446
Energy: 0.9166934531978538
Energy: 0.8919689867397357
Energy: 1.074089595287768
Energy: 1.0143118376948448
Energy: 1.043360173652161
Energy: 0.8680943156296541
Energy: 0.9379233672720145
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Energy: 0.9111905998525056
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Energy: 0.8433497151041449
Energy: 0.9421679845565304
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Energy: 0.8998487589502334
Energy: 0.8541313863591229
Energy: 0.8437940284178564
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Energy: 0.944225072228769
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Energy: 0.8843561749392216
Energy: 0.89887493227375
Energy: 0.8727520886791263
Energy: 1.0326121260142638
Energy: 0.9914347108806999
Energy: 0.937155302271935
Energy: 0.885206128190772
Energy: 0.8988002001757422
Energy: 0.9245110739292025
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Energy: 0.8652933734705082
Energy: 0.9041502780695542
Energy: 0.8974474660252247
Energy: 0.8172653098530133
Energy: 0.7739799375081762
Energy: 0.8367542467331003
Energy: 0.7567235540177832
Energy: 0.8652723978314383
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Energy: 0.9220956978588012
Energy: 0.9553906755461764
Energy: 0.8497907337900353
Energy: 0.9620895744233317
Energy: 0.9003386430924221
Energy: 0.8709471335489526
Energy: 0.8943701960020201
Energy: 0.8700215602381808
Energy: 0.9767986175666218
Energy: 0.9367632856424633
Energy: 0.9653848552963281
Energy: 0.8833784748929993
Energy: 0.8484793543717895
Energy: 1.007207065255031
Energy: 0.906338991920007
Energy: 0.8878702721117397
Energy: 0.8935482385638289
Energy: 0.8774995598823241
Energy: 0.8100573041064881
Energy: 0.9348847583641621
Energy: 0.9099763511412339
Energy: 0.9464350939020697
Energy: 0.8393805814672103
Energy: 0.798493253429122
Energy: 0.8609320284553793
Energy: 0.9578025705664274
Energy: 0.7997715658960105
Energy: 0.9623036831509677
Energy: 0.8957361297619361
Energy: 0.9104325030136321
Energy: 0.8685748450369226
Energy: 0.9913585804099685
Energy: 0.9547882933434709
Energy: 0.971549132400527
Energy: 0.8748931852013032
Energy: 0.8643981285913981
Energy: 0.880634946260377
Energy: 1.0034309163724997
Energy: 0.9036918896479534
Energy: 0.8080398306674181
Energy: 0.8528424642145007
Energy: 0.8702660700323505
Energy: 0.9554013525288334
Energy: 0.8792364096086436
Energy: 1.0058318152083114
Energy: 0.8834473779766028
Energy: 0.8074014482761482
Energy: 1.0559627362539523
Energy: 0.8758377308678358
Energy: 0.9317020318229012
Energy: 0.8884067048189636
Energy: 0.9284982850544126
Energy: 0.917122372828806
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Energy: 0.7909339887473429
Energy: 0.9101928734851453
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Energy: 0.8379414790713574
Energy: 0.8839184111434784
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Energy: 1.0413033987960996
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Energy: 1.0309121599824063
Energy: 0.8849834960179854
Energy: 1.0304052376934019
Energy: 0.9356572900295003
Energy: 0.9025673332056829
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Energy: 0.8898624720678843
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Energy: 0.8440495837055669
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Energy: 0.9031383843455993
Energy: 0.8378854393460782
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Energy: 0.8468993050451807
Energy: 0.8578996894933896
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Energy: 1.0278517192143055
Energy: 0.8927813120411249
Energy: 0.9963056938128148
Energy: 1.052872356945673
Energy: 0.9195359969842877
Energy: 0.9420133332960816
Energy: 0.853534384186254
Energy: 0.9528421278560572
Energy: 0.8780214134948788
Energy: 0.9024490991636438
Energy: 0.7800430466941426
Energy: 0.7893317827944497
Energy: 0.9747538194664646
Energy: 0.8810839121839456
Energy: 0.9062437052605085
Energy: 0.8239302504842616
Energy: 0.9764874589018095
Energy: 0.9442361439402812
Energy: 0.9583996267452647
Energy: 0.8843418635040294
Energy: 0.8906993158477073
Energy: 0.9920528453642093
Energy: 0.918623410305737
Energy: 0.9766899070709296
Energy: 1.0745753741734612
Energy: 0.97683163065887
Energy: 0.8699002383210958
Energy: 0.8081831021265274
Energy: 0.8378644250854477
Energy: 0.8745918134678559
Energy: 0.8428450239024164
Energy: 0.9486089120689903
Energy: 0.8524525662183173
Energy: 0.9215036636100173
Energy: 0.8117139531768889
Energy: 0.9234813973855085
Energy: 0.8604606537374662
Energy: 0.8700565612477783
Energy: 0.825632134393402
Energy: 0.8759615723014292
Energy: 1.0261740198934148
Energy: 0.9448648789590397
Energy: 0.9622034838757431
Energy: 0.9326675916126242
Energy: 0.8892168987890886
Energy: 1.0752010392553104
Energy: 0.8027831886419895
Energy: 0.8575368291874511
Energy: 0.8436332223840117
Energy: 0.8691814574274367
Energy: 0.8994170236448583
Energy: 0.8588860340900516
Energy: 0.8642919972771289
Energy: 0.8765859970701235
Energy: 0.9025381895242244
Energy: 0.8180686597462068
Energy: 0.8713162899675615
Energy: 0.8373280334016947
Energy: 0.7931066940917794
Energy: 0.8987196428298863
Energy: 0.8450497391741543
Energy: 0.8747034152764565
Energy: 0.8854888874334474
Energy: 0.8286245299933896
Energy: 0.987092858317451
Energy: 0.8672006373556194
Energy: 0.9050140646747095
Energy: 0.9449497867768651
Energy: 0.8770295942585064
Energy: 0.8715047400534366
Energy: 0.8887264498129773
Energy: 0.9359265360711742
Energy: 0.964158825010537
Energy: 0.8542210749308455
Energy: 0.9662288619069869

minimum gb energy = 0.7567235540177832 eV
minimum distance =  2.23780943168188 Angstroms
sigma value = 401


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

Energy: 1.169002793419562
Energy: 0.9196788829495482
Energy: 0.9199887275674427
Energy: 0.9429114653544636
Energy: 0.9427231932916385
Energy: 0.9278522772998979
Energy: 0.9658844084348936
Energy: 0.9901516334590565
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Energy: 0.9150566994205561
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Energy: 0.957359601519479
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Energy: 0.8766574994444122
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Energy: 0.9090053082029972
Energy: 0.9032223995347681
Energy: 0.8434090974425219
Energy: 0.8434457394665241
Energy: 0.9282157709959283
Energy: 0.9300901810010995
Energy: 0.9447590007599274
Energy: 0.8725218723544613
Energy: 0.8708385077605844
Energy: 0.9485811290142233
Energy: 0.9301131377052734
Energy: 0.9214621750847486
Energy: 0.824908229920936
Energy: 0.8848597164550999
Energy: 0.8258887237805689
Energy: 0.8330611255735878
Energy: 0.8454185277129962
Energy: 0.9506411422934309
Energy: 0.9041615651908401
Energy: 0.7451886150454499
Energy: 0.8981385152863791
Energy: 0.8070596537114776
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Energy: 0.9732976479736428
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Energy: 0.9490560644903899
Energy: 0.8751538832812056
Energy: 0.9302424318135655
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Energy: 0.8074737945918962
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Energy: 0.8787783010268937
Energy: 0.9488937510685692
Energy: 0.9392252295006837
Energy: 0.8676587167175429
Energy: 0.8382043383739822
Energy: 0.9137786590312369
Energy: 0.7700312950958191
Energy: 0.8307905108797037
Energy: 0.9361537583387386
Energy: 0.9317527031706386
Energy: 0.9572659872334076
Energy: 0.8630484048036186
Energy: 0.9459462320693498
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Energy: 0.8484732043356638
Energy: 0.9929640569113523
Energy: 0.8786795520550388
Energy: 0.9294727216200092
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Energy: 0.874054401473463
Energy: 0.8935039816474557
Energy: 0.8938524747083383
Energy: 0.9500214536752238
Energy: 0.9505023197833098
Energy: 0.8837026514398717
Energy: 0.9468566236803028
Energy: 0.8817253296665605
Energy: 0.8954618978590329
Energy: 0.904258749093213
Energy: 0.9076655946642213
Energy: 0.9385231421266786
Energy: 0.7660709605633345
Energy: 0.9468764838371528
Energy: 0.8494885038660225
Energy: 0.8582023892002092
Energy: 0.8364758079583866
Energy: 0.8662325517794564
Energy: 0.9572726766743278
Energy: 0.8058123014358707
Energy: 0.8190378125975157
Energy: 0.818747559326673
Energy: 0.8890245277539568
Energy: 0.9588870045270339
Energy: 0.8931066394207414
Energy: 0.9595267390832333
Energy: 0.9526225078108681
Energy: 0.8720601823795407
Energy: 0.8464122603190688
Energy: 0.8789312677984376
Energy: 0.9242117425538208
Energy: 0.9068074145503132
Energy: 0.9370372670820336
Energy: 0.8775937090091187
Energy: 0.8401607647147591
Energy: 0.8556212224514339
Energy: 0.9013609172087178
Energy: 0.9054879283786256
Energy: 0.784136734119573
Energy: 0.9634529914549879
Energy: 0.7907553429378407
Energy: 0.8414797711515486
Energy: 0.82148729280379
Energy: 0.8471479820357627
Energy: 0.8435763967234138
Energy: 0.9288872872247219
Energy: 0.9126051555104642
Energy: 0.9466603178429399
Energy: 0.8963456168467084
Energy: 0.9265502904053331
Energy: 0.8964290896846053
Energy: 0.8772795048063966
Energy: 0.9365412218204091
Energy: 0.9424595170957566
Energy: 0.798266468969317
Energy: 0.8586056077135655
Energy: 0.8786410913226127
Energy: 0.9113536675135319
Energy: 0.864963396254288
Energy: 0.9600912932510686
Energy: 0.847352670240747
Energy: 0.8680290477351587
Energy: 0.855847814900869
Energy: 0.9301374298550653
Energy: 0.8556209393629881
Energy: 0.8295047326345143
Energy: 0.9190878956527226
Energy: 0.9851856299552778
Energy: 0.8528816872526598
Energy: 0.9782854602481443
Energy: 0.8738885915272104
Energy: 0.9817973995295696
Energy: 0.8891544767287082
Energy: 0.9617224713996828
Energy: 0.9049106660111144
Energy: 0.9076172144771074
Energy: 0.9989496101680903
Energy: 0.9000453053761107
Energy: 0.9338344540244633
Energy: 0.8571406724374451
Energy: 0.9337606790720779
Energy: 0.8234882536432087
Energy: 0.8843432012598815
Energy: 0.9703221851596932
Energy: 0.8661999286704235
Energy: 0.8467266797811588
Energy: 0.9207101112567905
Energy: 0.8676791915243499
Energy: 0.9685446936420865
Energy: 0.9578253388173608
Energy: 0.9177251962912019
Energy: 0.8301752565081492
Energy: 0.8994708535925159
Energy: 0.8759359746998707
Energy: 0.990036593551001
Energy: 0.8442847075789508
Energy: 0.9679586447238762
Energy: 0.9174923385746625
Energy: 0.8652968949435219
Energy: 0.8066854391705176
Energy: 0.9410015350308846
Energy: 0.9049771431902122
Energy: 0.8583123172711633
Energy: 0.8675540539246769
Energy: 0.8845702141809333
Energy: 0.8498677815964104
Energy: 0.8522220242201113
Energy: 0.9405809732804603
Energy: 0.9230574703682733
Energy: 0.9978406490944625
Energy: 0.8626907102585362
Energy: 0.9170467176722732
Energy: 0.933461278764484
Energy: 1.0081689619448573
Energy: 0.9648585506355101
Energy: 0.9788647243049744
Energy: 0.932845729259746
Energy: 0.8600698085359961
Energy: 0.8881088464458985
Energy: 0.9803190119633564
Energy: 0.8495519636030201
Energy: 0.8665420355353217
Energy: 0.8911623817103783
Energy: 0.9766293095239945
Energy: 0.7808668708692805
Energy: 0.8279342437287031
Energy: 0.9509454637315784
Energy: 0.7328540912794678
Energy: 0.8821757331802407
Energy: 0.8475182609638363

minimum gb energy = 0.7328540912794678 eV
minimum distance =  2.29241644247278 Angstroms
sigma value = 311


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

Energy: 0.861278713775849
Energy: 0.9000884081502062
Energy: 0.9620266285901745
Energy: 0.9419558822801113
Energy: 0.9386817209433075
Energy: 0.9046369994257998
Energy: 0.9556783672729279
Energy: 0.8506550636774067
Energy: 0.9016835161773518
Energy: 0.8804520558191816
Energy: 0.9203369921150906
Energy: 0.9645589135149275
Energy: 1.021943538282977
Energy: 0.9764844733416733
Energy: 0.9061223170022595
Energy: 0.897158068734807
Energy: 0.9427370830792747
Energy: 0.9996342154322714
Energy: 0.9373175743007209
Energy: 0.9404411824431187
Energy: 0.8895548849851951
Energy: 0.8860100105897277
Energy: 0.9027011642549388
Energy: 0.9824317952431283
Energy: 0.907729165923383
Energy: 0.8828573944380446
Energy: 0.9328034451867261
Energy: 0.8681402427852052
Energy: 0.9184383561060254
Energy: 0.8321821745181208
Energy: 0.8575693777627902
Energy: 0.8566186554078852
Energy: 0.8697286542882691
Energy: 0.9626640646690562
Energy: 0.8889013081889958
Energy: 0.884444030475376
Energy: 0.8393008486552078
Energy: 0.8613704481646052
Energy: 0.7813728348400855
Energy: 0.879681839831971
Energy: 0.8994098572339011
Energy: 0.802274404516499
Energy: 0.9287777113393134
Energy: 0.96653404242839
Energy: 0.9319133807841269
Energy: 0.894431230037577
Energy: 0.9483842185454386
Energy: 0.8841232112553561
Energy: 0.9561570554682128
Energy: 0.8648659311048876
Energy: 0.9403308558381523
Energy: 0.8723795831345322
Energy: 0.8889873663497823
Energy: 0.9307158325559849
Energy: 0.9838544389793721
Energy: 0.8490666899493408
Energy: 0.9770338022623585
Energy: 0.912455044481205
Energy: 0.8338813197707047
Energy: 0.9203453472389208
Energy: 0.8980180206889036
Energy: 0.8737483191288868
Energy: 0.928875632481695
Energy: 0.8607937120585559
Energy: 0.8591828505337534
Energy: 0.9473551566734711
Energy: 0.9037837454676483
Energy: 0.8627539409313989
Energy: 0.9255518654519606
Energy: 0.9057327284457366
Energy: 0.949345206640903
Energy: 0.8705446431275118
Energy: 0.924588189898719
Energy: 0.8840879071991977
Energy: 0.8719180921570826
Energy: 0.8296560600624032
Energy: 0.834847137258205
Energy: 0.8336403167955928
Energy: 0.8748142778256608
Energy: 0.8682584595879961
Energy: 0.8256403251675548
Energy: 0.8899839832310886
Energy: 0.8741672091691999
Energy: 0.8753368210351062
Energy: 0.9093668958910799
Energy: 0.9158480264343494
Energy: 0.9297967794908695
Energy: 0.915030019813574
Energy: 0.8514901029368785
Energy: 0.8539690462455168
Energy: 0.8966800587181106
Energy: 0.84428152968768
Energy: 0.9772474227953556
Energy: 0.31711755025005006
Energy: 0.8454708195204683
Energy: 0.8990707071544864
Energy: 0.9439681344642997
Energy: 0.8350928391238561
Energy: 0.955085076856486
Energy: 0.9284079593027064
Energy: 0.9742724748529673
Energy: 0.9144274090027651
Energy: 0.858268862489698
Energy: 0.9797471754312058
Energy: 0.8061202305522658
Energy: 0.8637574901486205
Energy: 0.8741774620126433
Energy: 0.9223350482805694
Energy: 0.7971041255270231
Energy: 0.860098530304626
Energy: 0.8601113386306234
Energy: 0.7565392732195164
Energy: 0.922387855454641
Energy: 0.9530194137057881
Energy: 0.8588828727829971
Energy: 0.886314273479501
Energy: 0.882791992819453
Energy: 0.8154878945641444
Energy: 0.8206964628786474
Energy: 0.8222067206083891
Energy: 0.8446817538247648
Energy: 0.8094248508689695
Energy: 0.8206198295036226
Energy: 0.8440379227736408
Energy: 0.8158199473933481
Energy: 0.8524037550454063
Energy: 0.9433274854588999
Energy: 0.8927807585980958
Energy: 0.8803368216940751
Energy: 0.8787946052610416
Energy: 0.8761127475454373
Energy: 0.8855086000382555
Energy: 0.8846945360450845
Energy: 0.3945139814158946
Energy: 0.8309637884587535
Energy: 0.846578195749896
Energy: 0.9135806076054905
Energy: 0.8805110577529882
Energy: 0.9222071886179731
Energy: 0.8650881054024249
Energy: 0.9513959770321355
Energy: 0.8849802845125807
Energy: 0.9275263386279982
Energy: 0.9818627238242896
Energy: 0.8191149977009791
Energy: 0.8621115698404458
Energy: 0.8038403352251456
Energy: 0.8211151800409605
Energy: 0.8718627266585264
Energy: 0.9028526161658343
Energy: 0.8181221974560083
Energy: 0.8622128879840578
Energy: 0.9540297637425698
Energy: 0.7943058437563859
Energy: 0.9145070053852364
Energy: 0.9150437429458611
Energy: 0.9007325481994916
Energy: 0.8981193817962377
Energy: 0.9073147733440762
Energy: 0.8696464074426169
Energy: 0.9004574003499781
Energy: 0.8245353241762401
Energy: 0.9008181996388344
Energy: 0.8870596268852519
Energy: 0.8357192307626455
Energy: 0.8521280702987954
Energy: 0.8404857457921484
Energy: 0.8314502778192497
Energy: 0.9832135935181748
Energy: 0.9067891669512224
Energy: 0.9804865934569901
Energy: 0.9576558932968572
Energy: 0.832612067369223
Energy: 0.8693029515577532
Energy: 0.8636700360833375
Energy: 0.990394376715445
Energy: 0.950494752897339
Energy: 0.9315615388178264
Energy: 0.9641701928620741
Energy: 0.8463386768546798
Energy: 0.9034418813951249
Energy: 0.8541983510218379
Energy: 0.8951387401780653
Energy: 0.8832358182942232
Energy: 0.9446846130694875
Energy: 0.8896902848221718
Energy: 0.8399861513608491
Energy: 0.9618100248676262
Energy: 0.8426036826030943
Energy: 0.9491567472871408
Energy: 0.8682719327541668
Energy: 0.8596696879463818
Energy: 0.8617440501093667
Energy: 0.8725340767706072
Energy: 0.843296286920263
Energy: 0.8064127337203544
Energy: 0.7843867102372403
Energy: 0.8176644252698366
Energy: 0.967956273982133
Energy: 0.675581483469331
Energy: 0.9219076721675299
Energy: 0.9891624401498385
Energy: 0.9066356828913855
Energy: 0.9232213221566437
Energy: 0.9156212509619577
Energy: 0.9574847505262007
Energy: 0.8370944310354416
Energy: 0.8529955527586364
Energy: 0.8843988286349372
Energy: 0.8642230954745865
Energy: 0.972790839834086
Energy: 0.9627867046723867
Energy: 0.8198225132385322
Energy: 0.9494595161143371
Energy: 0.9003743746705618
Energy: 0.8509000937495459
Energy: 0.9210315599261397
Energy: 0.9002443756042952
Energy: 1.0182904134846125
Energy: 0.2599960543518361
Energy: 0.937011696252052
Energy: 0.9764736824262567
Energy: 0.9628899473260735
Energy: 0.853330904440633
Energy: 0.9128951991234855
Energy: 0.9187408522873576
Energy: 0.9426861721822098
Energy: 0.956306239861752
Energy: 0.9460507380260953
Energy: 0.9237802051400734
Energy: 0.9140724022943523
Energy: 0.9153330192959489
Energy: 0.8035016566046316
Energy: 0.8574529570004481
Energy: 0.8466120800701645
Energy: 0.9007379716161267
Energy: 0.9010886172822896
Energy: 0.8121146522396093
Energy: 0.908167786007933
Energy: 0.8967011612074987
Energy: 0.9179433132671656
Energy: 0.8401455827882858
Energy: 0.8458476386948043
Energy: 0.9059743121502414
Energy: 0.8841355625946895
Energy: 0.8856937201339239
Energy: 0.8791913433115035
Energy: 0.9812961303449647
Energy: 0.9498674425381626
Energy: 0.8200358016641914
Energy: 0.8721135032784871
Energy: 0.8398335458875189

minimum gb energy = 0.2599960543518361 eV
minimum distance =  2.30565438497016 Angstroms
sigma value = 39


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

Energy: 0.9775140054695489
Energy: 0.8722299277344151
Energy: 0.8891115610728345
Energy: 1.13603633086804
Energy: 0.7819039977715884
Energy: 0.7894354051905884
Energy: 0.972126682612047
Energy: 0.8076464159801401
Energy: 0.7087610754324994
Energy: 0.861070894757659
Energy: 0.8745504871555161
Energy: 1.0282305784432708
Energy: 0.9901967210889083
Energy: 0.9843477491875829
Energy: 0.7950265125197745
Energy: 0.9656597284314037
Energy: 0.9220016074729044
Energy: 0.8176218817103807
Energy: 0.9846773164967418
Energy: 0.9909659095954467
Energy: 0.9250528980862394
Energy: 0.8235729357518239
Energy: 0.8856620064873536
Energy: 0.7506667210866089
Energy: 0.6746337868700446
Energy: 0.8690408851580583
Energy: 0.8342457317752808
Energy: 0.9821116285014101
Energy: 1.0228900597041335
Energy: 1.022165306166059
Energy: 0.8658332112385098
Energy: 0.8873840066966723
Energy: 0.7215661727450053
Energy: 0.8626507852992368
Energy: 0.9931059721313716
Energy: 0.8054695534322884
Energy: 0.890596972027704
Energy: 0.8463147977650679
Energy: 0.8772494948076398
Energy: 0.7612455401898496
Energy: 0.761325398720635
Energy: 0.944134931192382
Energy: 0.8247478220160344
Energy: 0.8842930797465492
Energy: 0.885387113218644
Energy: 0.8820657693474521
Energy: 0.9704456227970191
Energy: 0.9716215928187587
Energy: 0.9920556193494876
Energy: 0.9622528978384904
Energy: 0.8456407491531698
Energy: 0.8827613410147717
Energy: 0.7028361917125815
Energy: 0.7514606768148316
Energy: 0.7858388399634664
Energy: 0.8297749176790985
Energy: 0.9622587162785796
Energy: 0.8453388889502534
Energy: 0.7226831823265202
Energy: 0.8819810926019384
Energy: 0.7410540244075812
Energy: 0.8482482403179632
Energy: 0.7869744581705063
Energy: 0.8217461928861244
Energy: 0.7349436322604181
Energy: 0.8437249066844879
Energy: 0.9452831141261789
Energy: 1.0289939144039502
Energy: 1.0074193174389197
Energy: 0.9934208769207251
Energy: 0.8237117002858031
Energy: 0.9355826022048591
Energy: 0.7469832737050713
Energy: 0.6765162643157121
Energy: 0.9336306162047082
Energy: 0.9223496421432017
Energy: 0.7384656874767412
Energy: 0.9263064299094604
Energy: 1.028031302838585
Energy: 0.7285486341311967
Energy: 0.7285485295637003
Energy: 0.7152030087160777
Energy: 0.7172337880647378
Energy: 0.9841936479074237
Energy: 0.9600837293143766
Energy: 1.0215338025339844
Energy: 0.9314571559164501
Energy: 0.8355176928074131
Energy: 0.7018112027928596
Energy: 0.8198850299987406
Energy: 0.9905161022688936
Energy: 0.9302063733843378
Energy: 0.8413162912176907
Energy: 0.8336182296454765
Energy: 0.874334820147302
Energy: 0.9717139525661014
Energy: 0.969918633981414
Energy: 0.9276905073630302
Energy: 0.8075600169562807
Energy: 0.7073812349792918
Energy: 0.8393715119660232
Energy: 1.0812511089565733
Energy: 0.9721712186728474
Energy: 0.8975201020230119
Energy: 0.928112038320228
Energy: 0.9775834931642788
Energy: 0.68361057268001
Energy: 0.8773911491268781
Energy: 0.856286257332047
Energy: 0.781523028578159
Energy: 0.7908440791071906
Energy: 0.9704089195947877
Energy: 0.9126424636809031
Energy: 0.7070687772723165
Energy: 0.8610422527034282
Energy: 0.8732440994877869
Energy: 1.027426746158968
Energy: 0.9902402696383368
Energy: 0.9817115424413614
Energy: 0.8656792126548722
Energy: 0.9652975772229503
Energy: 0.9212699846784447
Energy: 0.8174766964116545
Energy: 0.9852248233861925
Energy: 0.9920118550607671
Energy: 0.9014029863866321
Energy: 0.823613896516991
Energy: 0.8845236876097172
Energy: 0.7510021843137711
Energy: 0.7282703714852856
Energy: 0.8689403841229417
Energy: 0.8351383390381341
Energy: 0.9812732698285958
Energy: 1.0211411986794403
Energy: 1.021648470842773
Energy: 0.8663239649846824
Energy: 0.8866176915323434
Energy: 0.7220007066610811
Energy: 0.8318948667939517
Energy: 0.9909609681314948
Energy: 0.8051856164265556
Energy: 0.8915544891056053
Energy: 0.8457170284953256
Energy: 0.8773119498435051
Energy: 0.7611456629444527
Energy: 0.9010587007554374
Energy: 0.9447150266587149
Energy: 0.8247063978596266
Energy: 0.7008962303496667
Energy: 0.8855650039185446
Energy: 0.8824157821959713
Energy: 0.9712763517568361
Energy: 0.9613947958745485
Energy: 0.9921307397916965
Energy: 0.9619702917904732
Energy: 0.8451340081114131
Energy: 0.8833360844106501
Energy: 0.7032505921301389
Energy: 0.7519500012219109
Energy: 0.7863767480937941
Energy: 0.7865790050517912
Energy: 0.9623606615187257
Energy: 0.8456267135086
Energy: 0.8302459039213095
Energy: 0.8817134542813704
Energy: 0.740561852816073
Energy: 0.6690946126917604
Energy: 0.9443429925318845
Energy: 0.8213665878560623
Energy: 0.7340226599125067
Energy: 0.8529248627078077
Energy: 0.9451220815515831
Energy: 1.0290024713113595
Energy: 0.9906285771670638
Energy: 0.9931483450903259
Energy: 0.8259054637415721
Energy: 0.9352229430232576
Energy: 0.7467444181083303
Energy: 0.6765326659702231
Energy: 0.9332761457953574
Energy: 0.8370927499381274
Energy: 0.7386628554023836
Energy: 0.9279595549530042
Energy: 1.0286106308421192
Energy: 0.8025262585733317
Energy: 0.8033817038671497
Energy: 0.7152934721452012
Energy: 0.8021110443221768
Energy: 0.9837363691737216
Energy: 0.9595884935080485
Energy: 1.0219585872704435
Energy: 0.9316960430718093
Energy: 0.8349872861308729
Energy: 0.6993507655300752
Energy: 0.8084131824699208
Energy: 0.9903378997968804
Energy: 0.9303381392869396
Energy: 0.8415560143041333
Energy: 0.8387105514585811
Energy: 0.8215581858402723
Energy: 0.9715243304717763
Energy: 0.9692512833478095
Energy: 0.9934583062151566
Energy: 0.8081484180351851
Energy: 0.7086050718218536
Energy: 0.8363467025600022
Energy: 0.8791277749846573
Energy: 0.9718172247997537
Energy: 0.898405005281857
Energy: 0.9013582230117831

minimum gb energy = 0.6690946126917604 eV
minimum distance =  2.22906779533124 Angstroms
sigma value = 21


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

Energy: 1.2079327559180393
Energy: 0.36652523197380676
Energy: 0.8409348319516919
Energy: 1.2711093131396332
Energy: 0.8804229047049664
Energy: 0.8702755516628975
Energy: 0.8915710516180528
Energy: 0.897419415521739
Energy: 0.864855922709945
Energy: 0.884858094480413
Energy: 0.8620163472726318
Energy: 0.915394973923938
Energy: 0.944938413773958
Energy: 0.9120212402861285
Energy: 0.8656747660332831
Energy: 0.7712970307323664
Energy: 0.7535551263813072
Energy: 0.8901994814377313
Energy: 0.9636688471259042
Energy: 0.8351184900802318
Energy: 0.8462630511556456
Energy: 0.8012894271344954
Energy: 0.8802868073131287
Energy: 1.0336861794264411
Energy: 0.6949074915786381
Energy: 0.9750305998386717
Energy: 0.9852861994209082
Energy: 0.8470763563949458
Energy: 0.8471826322120873
Energy: 0.9026819698541677
Energy: 0.8592928293161768
Energy: 0.7032821176371997
Energy: 0.7326513232715148
Energy: 0.9190752516903207
Energy: 0.8613420250531123
Energy: 0.8101356826097801
Energy: 0.7321501110277269
Energy: 1.0187690326481094
Energy: 0.8210557274009366
Energy: 0.6572584339451507
Energy: 0.847829485926282
Energy: 0.8476585966494123
Energy: 0.9060664628889781
Energy: 0.8146201973578608
Energy: 0.9552888609407958
Energy: 1.004652387401017
Energy: 0.8310749194980129
Energy: 0.8286923945354083
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Energy: 0.8741715586722575
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Energy: 0.7944071248764136
Energy: 0.8699570024642722
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Energy: 0.7900902246730497
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Energy: 0.8470897675996469
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Energy: 0.9229427196248242
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Energy: 0.6956241167246907
Energy: 0.7294976783636586
Energy: 0.8001573367049997
Energy: 0.8933845458233195
Energy: 0.2875834593891298
Energy: 0.770009551704687
Energy: 0.7991043951204335
Energy: 0.879379748254274
Energy: 0.8846852926673734
Energy: 0.809399120900358
Energy: 0.7617319142215135
Energy: 0.5041845414327071
Energy: 0.8262796970589723
Energy: 0.8180772630463709
Energy: 0.8301360145405406
Energy: 0.8127596080464804
Energy: 0.8440426735704927
Energy: 0.7747622538221737
Energy: 0.8722224578235539
Energy: 0.893817354513796
Energy: 0.6964879820942073
Energy: 0.7952028883295293
Energy: 0.7313805211462625
Energy: 0.8938756666694917
Energy: 0.9473534690702793
Energy: 0.8997691181095909
Energy: 0.8310336081453308
Energy: 0.8480911009834946
Energy: 0.8342086118234886
Energy: 0.7575657847062113
Energy: 0.8176059801420604
Energy: 0.8157799555194998
Energy: 0.8724327654840751
Energy: 0.9692982596801335
Energy: 0.7532721778140654
Energy: 0.7870643520540251
Energy: 0.8038461125601403
Energy: 0.7837217745791278
Energy: 0.779774642969597
Energy: 0.8624268057156091
Energy: 0.7939168582390281
Energy: 0.7524012413124508
Energy: 1.0107355978308878
Energy: 0.978852530578105
Energy: 0.9606041284588991
Energy: 0.8661655496685613
Energy: 0.9591028520766316
Energy: 0.9135990114635223
Energy: 0.6586366811871166
Energy: 0.9408729228115504
Energy: 0.8664888016817743
Energy: 0.7599713564179172
Energy: 0.8492859927729648

minimum gb energy = 0.2875834593891298 eV
minimum distance =  2.3113035501133 Angstroms
sigma value = 113


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

Energy: 1.1495933981447444
Energy: -0.5116724011076607
Energy: 1.0792997249881577
Energy: -1.0758497597888474
Energy: 0.8959321875425416
Energy: 0.9786105025971732
Energy: -0.6012074971035277
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Energy: 0.9209735326073651
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Energy: 0.7026576624344734
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Energy: 0.9082905965378778
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Energy: 1.0717645631567603
Energy: -0.3647417679066513
Energy: 0.8562477129386087
Energy: 0.8825237820181735
Energy: 0.7895823464160264
Energy: 0.957126501736405
Energy: 0.7372880302871142
Energy: 0.8843653038873119
Energy: 0.8170174295232793
Energy: 0.8535319291653939
Energy: 0.776998803513305
Energy: 0.7756327781252945
Energy: 0.9310223757878867
Energy: 0.6535866617126727
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Energy: 0.7597302432370999
Energy: 0.800253558021061
Energy: 0.7844517237174904
Energy: 0.653594060375955
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Energy: 1.0978250176325872
Energy: 0.7930348190064777
Energy: 0.7367302234248487
Energy: 0.7311093620454512
Energy: 0.6482244349001416
Energy: 0.7260273167482139
Energy: 0.7283351285683078
Energy: 1.05723256681472
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Energy: 0.8744069039313349
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Energy: 0.6834355194960697
Energy: 0.9764698504529278
Energy: 0.6537490985257587
Energy: 0.9021138671468337
Energy: 0.8274380050434694
Energy: 0.7053806403318413
Energy: -0.7513172438707489
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Energy: 0.9333562299188624
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Energy: 0.8444052679967424
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Energy: 0.6614428598456199
Energy: 0.6732518683966913
Energy: 0.9264071055193994
Energy: 0.781164098661183
Energy: 0.8640343904912343
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Energy: -0.6727508753240344
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Energy: -0.979740911353313
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Energy: 0.9854987439094158
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Energy: 0.23956990997556651
Energy: 0.7989063472816518
Energy: -0.9815422570283954
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Energy: 0.717716319894092
Energy: -0.6874188457301953
Energy: 0.7849531776770422
Energy: -0.6149715540443605
Energy: -0.11957922938739848
Energy: 1.0255592605876185
Energy: 0.8823041933813711
Energy: 0.8036102666826668
Energy: 0.8641175802164104
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Energy: -0.5872139776932531
Energy: 0.7271985935992493
Energy: 0.12681187925507537
Energy: 0.8944039457745873
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Energy: 0.8045803495263388
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Energy: -0.7920469717275285
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Energy: -0.8369695239025633
Energy: -0.5797015534929969
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Energy: -0.6799523431373105
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Energy: 0.8005106752817486
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Energy: 0.8411034137971529
Energy: 1.0807136055225832
Energy: -1.050624269011075
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Energy: 0.9763187393473088
Energy: 0.8975925956638583
Energy: 0.04485471000455478
Energy: 0.84049534988474
Energy: -0.4419776916444888
Energy: -0.4780856491914565
Energy: -0.4632482506830536
Energy: -0.6808184809511122
Energy: 0.8961917991750388
Energy: 0.965663407360958
Energy: 0.8717448677625883
Energy: -0.8323914995956586
Energy: -0.7687638474433194
Energy: 1.0557114829789025
Energy: 0.9006801980090119
Energy: 0.9402098623935277
Energy: 0.9691375366346947
Energy: -0.6493921785070605
Energy: 0.1324810623468196
Energy: -0.8021309997056493
Energy: -0.8007215713205229
Energy: 0.9082041357503515
Energy: 0.8167755878515925
Energy: -0.5368476734237753
Energy: 0.7624749873217727
Energy: -0.5928924656537541
Energy: 0.7003891252588178
Energy: 0.7378928354752645
Energy: -0.5049130514869304
Energy: 0.8254774897703152
Energy: -0.6577727717207155
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Energy: 1.0705686315536136
Energy: 0.8080105000807862
Energy: 0.8565229570302569
Energy: 0.8669071827342093
Energy: 0.9752198427432437
Energy: 0.8498071133982799
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Energy: 0.9269884168923971
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Energy: -0.9073722876187015
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Energy: 0.7716518780405316
Energy: 0.9637576639109166
Energy: 0.7123091574520632
Energy: 0.6528774249086353
Energy: 0.7351179629576033
Energy: -0.6385299739561354
Energy: -1.002168938764932
Energy: 0.6897145289872763
Energy: 0.8182801298030121
Energy: 0.7632036668907889
Energy: 0.9315347867874336
Energy: 0.6945385265609804
Energy: 0.8197185131275666
Energy: 0.6215316868825856
Energy: 0.8278573709883609
Energy: 0.9217028815614813
Energy: 0.7268606767892463
Energy: 0.7800794949902939
Energy: 0.7170016708253195
Energy: 0.6590882653485394
Energy: 0.6491321609265924
Energy: 0.7303522545428047
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Energy: 0.7049051143591614
Energy: 0.6647731441489131
Energy: 0.7552578895125821
Energy: 0.7134014010115926
Energy: 0.7128064109081389
Energy: 0.7378886514764268
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Energy: 0.6795577783808041
Energy: 0.9926550510553048
Energy: 0.86578036138232
Energy: 0.8231836371274044
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Energy: 0.6528793741058883
Energy: 0.7255161093234351
Energy: 0.7661754038785324
Energy: 0.7535837778928708
Energy: 0.6346705776650998
Energy: 1.0550932969184874
Energy: 0.8095300396885338
Energy: 0.8459142460633795
Energy: 0.7399229703764884
Energy: 0.7862204031182553
Energy: 0.8838656634374141
Energy: 0.683277378738037
Energy: 0.8375223095611103
Energy: 0.13977522264847514
Energy: 1.0763559124204376
Energy: 0.6608933455752962
Energy: 0.6965876628215348
Energy: 0.854487453542519
Energy: 0.6941661678168926
Energy: -0.6351884268290273
Energy: 0.6187802985744992
Energy: 0.7538704498904063
Energy: 0.8032269239984798
Energy: 0.6257620653447024
Energy: -0.9131313327782868
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Energy: 0.8690615004814608
Energy: 0.7665437845592187
Energy: 0.09600176888838166
Energy: 0.7993508884081107
Energy: -0.9774037619866107
Energy: 0.9682605781460607
Energy: 0.7344920784305222
Energy: 0.9185340517844879
Energy: 0.7974012534924775
Energy: 0.025092088341353107
Energy: -0.39790025506050697
Energy: -0.8036050322484273
Energy: 0.8348066105277142
Energy: -0.3860746048187104
Energy: 1.0116662090624666
Energy: 0.7918428202407453
Energy: -1.0741401910297583
Energy: -0.5709986691489379
Energy: -0.46846384875954866
Energy: -0.45350591301718757
Energy: -0.5360952401230645
Energy: 1.0022769843522326
Energy: -0.43876991380399893
Energy: 1.1358850920685133
Energy: -0.937406161702332
Energy: -0.4441859896065172
Energy: 0.9773503915057282
Energy: 0.8873507021429379
Energy: 0.9541379555600566
Energy: 0.9585683767228634
Energy: -0.4343100665876266
Energy: -0.6847612692232377
Energy: -0.6406869171609687
Energy: 0.8207015163343504
Energy: -0.3124023825452611
Energy: -0.44659602778211455
Energy: -0.48239541426321764
Energy: 0.5238915176735719
Energy: -0.36990927682631886
Energy: -0.6776477608779611
Energy: 0.8697436431083868
Energy: -0.9440422952491849
Energy: -0.549425301370519
Energy: 0.84662556582606
Energy: -0.8155730594689897
Energy: -1.051814253813676
Energy: 0.916190963015303
Energy: -0.6077030843854331
Energy: -0.49196874830390686

minimum gb energy = -1.0758497597888474 eV
minimum distance =  2.27882201697125 Angstroms
sigma value = 365


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

Energy: 1.0066703945697548
Energy: 0.4608542534867339
Energy: 0.46830666756199335
Energy: 0.46495663793412256
Energy: 0.46849925330708564
Energy: 0.46804815442098957
Energy: 0.45707683664849774
Energy: 0.4416006583861849
Energy: 0.4908396123312421
Energy: 0.9511033692256651
Energy: 0.4603757051315398
Energy: 0.46508361795852937
Energy: 0.9124726724131013
Energy: 0.48430081309020123
Energy: 0.9584208237187779
Energy: 0.4904113702317572
Energy: 0.46581737478346963
Energy: 0.46141801799807186
Energy: 0.4628642143577666
Energy: 0.46502725380956045
Energy: 0.4595708832544463
Energy: 0.959559249041567
Energy: 0.48919335896626914
Energy: 0.4643717413982461
Energy: 0.46547962500340934
Energy: 0.46628887417687387
Energy: 0.46552003545387505
Energy: 0.45964094432420477
Energy: 0.9894666081282495
Energy: 0.48449663736875104
Energy: 0.8808518846768437
Energy: 0.47097328189695814
Energy: 0.9398774662334973
Energy: 0.8800418597137621
Energy: 0.4825297226750176
Energy: 1.007387975834743
Energy: 0.876443970228332
Energy: 0.4666273037432128
Energy: 0.4637648394173004
Energy: 0.46706341241427984
Energy: 0.4683082582449799
Energy: 0.45877338267903295
Energy: 0.9571297763550629
Energy: 0.4910842461651706
Energy: 0.9134974845637492
Energy: 0.4582358681710285
Energy: 0.46192565469814084
Energy: 0.4664467468385024
Energy: 0.45760887098222597
Energy: 0.9576304091759112
Energy: 0.4899048998485155
Energy: 0.4663847152858525
Energy: 0.458374520654436
Energy: 0.4611362504943818
Energy: 0.4621293520903124
Energy: 0.4958631308363156
Energy: 0.9561603308181761
Energy: 0.8765679047555099
Energy: 0.46677708046251004
Energy: 0.4670737065261059
Energy: 0.4666133678891298
Energy: 0.46772659768759534
Energy: 0.45758697174922963
Energy: 0.9895220429967945
Energy: 0.468400746445332
Energy: 0.8797861818040456
Energy: 0.4505904320063732
Energy: 0.4542854102577894
Energy: 0.8803880836800513
Energy: 0.46325845425747186
Energy: 0.9589762127303624
Energy: 0.5026211352492651
Energy: 0.46797953309692764
Energy: 0.46670827638075185
Energy: 0.4672493573534401
Energy: 0.4672448202753268
Energy: 0.45686311455801415
Energy: 0.9575325904303557
Energy: 0.4901172369759374
Energy: 0.463678861439616
Energy: 0.4594826849298042
Energy: 0.46230116718783515
Energy: 0.46432681368183687
Energy: 0.467095616068056
Energy: 0.9570961217796279
Energy: 0.4572345810154102
Energy: 0.9111806929134707
Energy: 0.45870426137028253
Energy: 0.46108259273716523
Energy: 0.4591735098706284
Energy: 0.4929331590054934
Energy: 1.0069506181830763
Energy: 0.8777219740533488
Energy: 0.469072555561111
Energy: 0.4636998712311566
Energy: 0.46589301479688117
Energy: 0.4683349160986408
Energy: 0.4579215782245455
Energy: 0.4426296170877029
Energy: 0.48696712857576596
Energy: 0.8802915787301595
Energy: 0.6217892005917565
Energy: 0.46785883325079064
Energy: 0.949592450167407
Energy: 0.483538535937493
Energy: 0.9585286826539953
Energy: 0.4943289850894198
Energy: 0.4644421110598759
Energy: 0.463093421865922
Energy: 0.4660073741080588
Energy: 0.46589392177535816
Energy: 0.4579150624853736
Energy: 0.9588569541944488
Energy: 0.49256169265052235
Energy: 0.46705883651328484
Energy: 0.46443613739705536
Energy: 0.4633038441909533
Energy: 0.4644411094869248
Energy: 0.4601401588477604
Energy: 0.4423088787061976
Energy: 0.48103497941491336
Energy: 0.9509311980790255
Energy: 0.46330480241242217
Energy: 0.46478248357178154
Energy: 0.9491822953417073
Energy: 0.4900787314018752
Energy: 1.0067991403003798
Energy: 0.47232500839031044
Energy: 0.46925405125739583
Energy: 0.46441540087072114
Energy: 0.47266596052322557
Energy: 0.4703197675632299
Energy: 0.4600756213750068
Energy: 0.9571604675996986
Energy: 0.4937175465436389
Energy: 0.9503760244266878
Energy: 0.45974502095836367
Energy: 0.4620020031550094
Energy: 0.9117529921769559
Energy: 0.4890026560663638

minimum gb energy = 0.4416006583861849 eV
minimum distance =  2.41632360718164 Angstroms
sigma value = 23