Model name: model_name=MEAM_LAMMPS_JeongLee_2020_PtC__MO_716623333967_002
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.917371571063995
cohesive_energy=5.770453839794827
mass=195.084
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.14132509310734e-19, 3.08380549805784e-19, 3.8430609831440997e-19, 4.49251930350234e-19, 5.0637593605887e-19, 5.573812292022599e-19, 6.03317235475674e-19, 6.4488731042143805e-19, 6.8258652661945795e-19, 7.16788191225456e-19, 7.477758895036499e-19, 7.757771305360679e-19, 8.009729602823519e-19, 8.235187898759999e-19, 8.435411912710979e-19, 8.61150714655392e-19, 8.764402862736539e-19, 8.89493219310852e-19, 9.0038321389215e-19, 9.09175959259542e-19, 9.15929133771852e-19, 9.20694007081368e-19, 9.235218488403779e-19, 9.24455917818e-19, 9.234321269488739e-19, 9.20075566900644e-19, 9.13894369446672e-19, 9.04282911819306e-19, 8.905041927669059e-19, 8.71654584667896e-19, 8.46610961701842e-19, 8.139826345504319e-19, 7.720296393891419e-19, 7.185585964060259e-19, 6.50784922611192e-19, 5.651565924070619e-19, 4.57083369737226e-19, 3.20577920520426e-19, 1.4776778964783957e-19, -7.18573015995732e-20, -3.5247245077346394e-19, -7.1353737483507e-19, -1.182138792394122e-18, -1.79677700796564e-18, -2.6132301988857e-18, -3.71447028649926e-18, -5.2271813772567e-18, -7.35149135451096e-18, -1.041594255883008e-17, -1.498552655842782e-17, -2.20893694706214e-17, -3.3741839912039996e-17, -5.4270208688155195e-17, -9.422352719254979e-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: 0.021443149846836332
Energy: 0.13349278802335784
Energy: 0.13268248734007856
Energy: 0.13468873130186443
Energy: 0.023157487879059455
Energy: 0.023443875769765962
Energy: 0.13291152549503377
Energy: 0.13502803695694093
Energy: 0.13452579058815065
Energy: 0.02312094668813776
Energy: 0.13448325038112477
Energy: 0.13385399752398458
Energy: 0.13377545327105342
Energy: 0.13337557032247155
Energy: 0.13351536451446308
Energy: 0.1349830626620399
Energy: 0.13399829505690997
Energy: 0.13384519437672002
Energy: 0.1326618923368758
Energy: 0.13552464708480247
Energy: 0.13296171935822476
Energy: 0.022795115305844847
Energy: 0.02200378523081579
Energy: 0.13399887861725857
Energy: 0.1329659841675572
Energy: 0.13307464447534412
Energy: 0.022781660207977197
Energy: 0.021962460240544466
Energy: 0.13365242221555945
Energy: 0.1349060334647116
Energy: 0.13310066579405455
Energy: 0.022685429260773285
Energy: 0.0225183323990906
Energy: 0.13311443326139996
Energy: 0.13373117726997252
Energy: 0.13299991502308198
Energy: 0.022771247214289466
Energy: 0.02248306443713651
Energy: 0.13222925504035973
Energy: 0.13256973353148324
Energy: 0.13277503532803006
Energy: 0.13446521197442723
Energy: 0.13329184057669782
Energy: 0.022310615259023975
Energy: 0.022361535767515976
Energy: 0.13271375308287744
Energy: 0.13480587397127855
Energy: 0.1333645297881347
Energy: 0.022679489868616887
Energy: 0.13248361803381956
Energy: 0.13307525420309252
Energy: 0.1341255378301124
Energy: 0.13482521237970224
Energy: 0.022394817153734047
Energy: 0.02303819897245619
Energy: 0.1328403083653312
Energy: 0.8854914452664855
Energy: 0.13513284147367882
Energy: 0.022514920861964036
Energy: 0.023476627392326872
Energy: 0.023468025289295934
Energy: 0.13387202518412353
Energy: 0.13329437754299509
Energy: 0.13526651535165357
Energy: 0.13377316197163416
Energy: 0.023466829188370633
Energy: 0.13400246573494357
Energy: 0.13331491659010072
Energy: 0.13678925043259757
Energy: 0.13343550900754128

minimum gb energy = 0.021443149846836332 eV
minimum distance =  2.73481749384904 Angstroms
sigma value = 3


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

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Energy: 1.6296447554261535
Energy: 1.4558667786943829
Energy: 1.5498657955954556
Energy: 1.7231912076363618
Energy: 1.4644316524386403
Energy: 1.6675262652119074
Energy: 1.4541614699549528
Energy: 1.5568335406253724
Energy: 1.7372924931721245
Energy: 1.7746362517521967
Energy: 1.849089351965527
Energy: 1.635050255065081
Energy: 1.5062261974502125
Energy: 1.568261968155549
Energy: 1.6999660573437316
Energy: 1.767080683000836
Energy: 1.687780725276096
Energy: 1.4732161029796804
Energy: 1.5732883671074158
Energy: 1.5609594343702058
Energy: 1.96922589056847
Energy: 1.9297754833687002
Energy: 1.5738317538407964
Energy: 1.5441316983301079
Energy: 1.496096920474892
Energy: 1.9471239551828803
Energy: 1.9300058958839945
Energy: 1.5620404281888638
Energy: 1.5628105939177117
Energy: 1.5641205139480168
Energy: 1.592174472544595
Energy: 1.9113993625697563
Energy: 1.4486030327304746
Energy: 1.557755222848079
Energy: 1.5667668036625297
Energy: 1.8701680477948812
Energy: 1.9256676748861543
Energy: 1.5966933795294547
Energy: 1.6016598083064446
Energy: 1.8331453264982083
Energy: 1.8520137164784674
Energy: 1.7794465669694162
Energy: 1.897623442143205
Energy: 1.7828043969267098
Energy: 1.8165671219516335
Energy: 1.823543016909773
Energy: 1.7585501792981069
Energy: 1.911567254019914
Energy: 1.758424307022211
Energy: 1.8953948405066823
Energy: 1.5867856815687598
Energy: 1.762438080396221
Energy: 1.5482730994746392
Energy: 1.7529509129660787
Energy: 1.627804559424169
Energy: 1.591541389181551
Energy: 1.730575170578593
Energy: 1.734019246142206
Energy: 1.7356642294474738
Energy: 1.7207196611198048
Energy: 1.7038116577927875
Energy: 1.9564144912779895
Energy: 1.7225453806420694
Energy: 1.8029715353713573
Energy: 1.697261365640082
Energy: 1.6841287237263136
Energy: 1.9437673561730129
Energy: 1.5977017206387236
Energy: 1.7952830217771922
Energy: 1.4435549045019809
Energy: 1.6315963084804288
Energy: 2.1184744369957604
Energy: 1.7706296093463028
Energy: 1.5596199415757726
Energy: 1.4484373210597674
Energy: 1.626138986053207
Energy: 1.4728692432494621
Energy: 1.7264016406918983
Energy: 1.441015558486191
Energy: 1.692521493371191
Energy: 1.7315125965583185
Energy: 1.6634632560594889
Energy: 2.021715456178252
Energy: 1.790709945148994
Energy: 1.803875700602581
Energy: 1.7506113835734447
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Energy: 1.8043205963937436
Energy: 2.02425996840096
Energy: 1.5500294487434811
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Energy: 2.0843555268363363
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Energy: 1.733911599323908
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Energy: 1.730532104750481
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Energy: 1.6468860576012825
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Energy: 1.6712941705163666
Energy: 1.7671817387524422
Energy: 1.6699495336996142
Energy: 2.023862476075636
Energy: 1.55353831745285
Energy: 1.8881879567393438
Energy: 1.7480366040319464
Energy: 1.6568128740248171
Energy: 1.9453556889391057
Energy: 1.4658285850867718
Energy: 1.6772969883120878
Energy: 1.4438258050037944
Energy: 1.4265375392757187
Energy: 1.736724974730336
Energy: 1.5835686323129579
Energy: 1.6633170504713886
Energy: 1.4443509034906252
Energy: 1.4093026552327192
Energy: 1.712065700044986
Energy: 1.5970968984585494
Energy: 1.857867042296036
Energy: 1.6158260462399576
Energy: 1.4766642212203587
Energy: 1.5784270187469944
Energy: 2.0475738818672737
Energy: 1.7554109553614787
Energy: 1.643752556840052
Energy: 1.6434832615348594
Energy: 1.5670595279364221
Energy: 1.4957726204033746
Energy: 1.9628390231481023
Energy: 1.7442449587972666
Energy: 1.570859945392859
Energy: 1.5816464015991074
Energy: 1.559114379711638
Energy: 1.968517445132267
Energy: 1.7432267564621504
Energy: 1.5674130857936794
Energy: 1.5288854131253855
Energy: 1.5776318385157395
Energy: 1.7343566201948544
Energy: 1.9178806887406876
Energy: 1.624003718216168
Energy: 1.3007463488808602
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Energy: 1.7490353579186924
Energy: 1.9650853216505262
Energy: 1.436116762111515
Energy: 1.3204195565912542
Energy: 1.8116707227915252
Energy: 1.8109906900390629
Energy: 1.7664335267617592
Energy: 1.9106754007562359
Energy: 1.7755038701713364
Energy: 1.819606026448374
Energy: 1.8022633357863056
Energy: 1.7738807566002786
Energy: 1.92325842789613
Energy: 1.7724081245021914
Energy: 1.5949333366079987
Energy: 1.5835485789579449
Energy: 1.7785443867063115
Energy: 1.763755685059498
Energy: 1.7536288137979263
Energy: 1.6187087218353202
Energy: 1.5886388830111877
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Energy: 1.4243049047074336
Energy: 1.7393337323887432
Energy: 1.7351245731313787
Energy: 1.6927477477463257
Energy: 1.959609875501223
Energy: 1.6079613975574065
Energy: 1.8282152770530065
Energy: 1.7161953785414472
Energy: 1.6964493318767255
Energy: 1.9548740557498732
Energy: 1.5991545811191408
Energy: 1.8078013599503553
Energy: 1.4414837199791657
Energy: 1.6173834458837657
Energy: 2.1136908281457485
Energy: 1.7375182063048138
Energy: 1.637682850907484
Energy: 1.4429048853349513
Energy: 1.6974116481433557
Energy: 2.1161817082006333
Energy: 1.7300878179005912
Energy: 1.6208933072444858
Energy: 1.6615468745583546
Energy: 1.7321185041919287
Energy: 1.4671443651710048
Energy: 1.9150217413077741
Energy: 1.792761565480858
Energy: 1.680790165118816
Energy: 1.7358698282745715
Energy: 1.6605694204620953
Energy: 2.0414406916051098
Energy: 1.7900269309373813
Energy: 1.5322270303753733
Energy: 1.5350447569684367
Energy: 1.4350314189980466
Energy: 1.5941605505495489
Energy: 1.8559563246234527
Energy: 1.5780490863290402
Energy: 1.5390632785381335
Energy: 1.5691719432373668
Energy: 1.610597421762418
Energy: 2.091595063191196
Energy: 1.9874301549525704
Energy: 1.4874742529528602
Energy: 1.54016050574858
Energy: 1.575667635555517
Energy: 1.7532481395173483
Energy: 1.648896064703122
Energy: 1.5139236652744201
Energy: 1.5354431976383016
Energy: 1.5341185557764507
Energy: 1.7556423194868342
Energy: 1.790194754257146
Energy: 1.6019436931443312
Energy: 1.8313920008592115
Energy: 1.8850538377103832
Energy: 1.7137129059198422
Energy: 1.9737532462600187
Energy: 1.780004050297481
Energy: 1.8346003245563518
Energy: 1.8157863923084905
Energy: 1.8723258057687697
Energy: 1.832973602034804
Energy: 1.4234773453885439
Energy: 1.7654256848142598
Energy: 1.587121811640461
Energy: 1.6049354750498295
Energy: 1.7363936292705393
Energy: 1.9587867918174677
Energy: 1.76421380347294
Energy: 1.5826728272151511
Energy: 1.701856247689464
Energy: 1.57187676784873
Energy: 1.8829052097079728
Energy: 1.801607094591585
Energy: 1.658519380756748
Energy: 1.8879936412935665
Energy: 1.3869496133623813
Energy: 1.9174066810652182
Energy: 1.7293569586965396
Energy: 1.6424181929772457
Energy: 2.0129405750978564
Energy: 1.5869360562792905
Energy: 1.6820001752281373
Energy: 1.4418996284352845
Energy: 1.4274675968998314
Energy: 1.7099634009170217
Energy: 1.4711589280639181
Energy: 1.684601705836295
Energy: 1.4408902117166738
Energy: 1.4417852963775848
Energy: 1.7454991155478239

minimum gb energy = 1.3007463488808602 eV
minimum distance =  2.446689659784 Angstroms
sigma value = 75


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

Energy: 2.4408290523189278
Energy: 1.7672621166332048
Energy: 1.6691552420742928
Energy: 1.7956715361596998
Energy: 1.817682288070867
Energy: 2.350350588179519
Energy: 1.7657858891870384
Energy: 1.6075174726820223
Energy: 1.808891160405349
Energy: 1.7681330491190255
Energy: 2.0326236548134275
Energy: 1.9793270656385622
Energy: 1.7973129213653634
Energy: 1.5101936701237073
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Energy: 1.974363285744467
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Energy: 1.7782649732345603
Energy: 1.5256061334775115
Energy: 1.6373421356296907
Energy: 1.7858675215509745
Energy: 1.8686394594615872
Energy: 1.8395708111967162
Energy: 1.5869034432083025
Energy: 1.4981059746680008
Energy: 1.7593635317027299
Energy: 1.8626732966866628
Energy: 1.8312733466369266
Energy: 1.569982196471838
Energy: 1.4961699453108732
Energy: 1.8098969710299495
Energy: 1.7321572408180785
Energy: 1.9631323592695367
Energy: 1.5600253133956739
Energy: 1.48988116088261
Energy: 1.8325872894806647
Energy: 1.8524088829758902
Energy: 1.9685450592265916
Energy: 1.529697359613966
Energy: 1.4902940232714867
Energy: 2.1430446573233093
Energy: 1.9610604054671594
Energy: 1.7163071962391163
Energy: 1.8003681022025415
Energy: 1.6847158966516163
Energy: 1.9693716607001899
Energy: 1.802342370600904
Energy: 1.697275629626529
Energy: 1.8008539036554831
Energy: 1.6932733303025436
Energy: 1.657547689557133
Energy: 2.329768371559923
Energy: 1.8023334147358447
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Energy: 1.7924367116076034
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Energy: 1.5502121903106438
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Energy: 1.7561896576420621
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Energy: 1.5896555083128607
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Energy: 1.6489019178689157
Energy: 1.8685358457314625
Energy: 1.5187005025299665
Energy: 1.731827707990018
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Energy: 1.7050568065733123
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Energy: 1.8647066984905365
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Energy: 1.549819367768426
Energy: 1.993663797084442
Energy: 1.8279797144039922
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Energy: 1.7691580673720222
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Energy: 1.677493244292161
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Energy: 1.4922045578339316
Energy: 1.6766776422340017
Energy: 1.8333577869576345
Energy: 1.819305482595394
Energy: 1.5319436487796738
Energy: 1.6182230137857216
Energy: 1.7810103136235818
Energy: 1.6463716540937827
Energy: 1.877511994626165
Energy: 1.5004469318598483
Energy: 1.6458560094476595
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Energy: 1.59945102536664
Energy: 1.8820937649515233
Energy: 1.7614819545576115
Energy: 1.8292623752850976
Energy: 2.062898685440209
Energy: 1.688460160800246
Energy: 1.8237795382164257
Energy: 1.7904412235531733
Energy: 1.8358066040410126
Energy: 2.0592626532142626
Energy: 1.6995936742599425
Energy: 1.773692266188222
Energy: 1.746164137538371
Energy: 1.71619647595011
Energy: 1.70304242304828
Energy: 1.884196544570398
Energy: 1.584939435743395
Energy: 1.7429648871916585
Energy: 1.6894192189298665
Energy: 1.6824724308522605
Energy: 1.9152019882797546
Energy: 1.7150043880090073
Energy: 1.599566752281821
Energy: 1.6152081552401012
Energy: 1.5754183601749658
Energy: 1.6864606947515939
Energy: 1.8343363214699075
Energy: 1.5823464656997228
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Energy: 1.5341026560134297
Energy: 1.9798776889630425
Energy: 1.885540597378377
Energy: 1.7392101685676342
Energy: 1.4926798772118293
Energy: 1.4941023788715058
Energy: 1.6777886793731078
Energy: 1.834366439477203
Energy: 1.73392424243413
Energy: 1.4891295764409203
Energy: 1.4883214441141093
Energy: 1.6613411512871705
Energy: 1.8340196226915093
Energy: 1.8551130862855871
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Energy: 1.675803198859198
Energy: 1.7983459680067033
Energy: 1.6261312584384569
Energy: 1.8722470257968464
Energy: 1.712500044661238
Energy: 1.6440275780937184
Energy: 1.731798932636251
Energy: 1.6102885574436763
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minimum gb energy = 1.487786425994995 eV
minimum distance =  2.425049662443 Angstroms
sigma value = 105


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

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Energy: 2.0241095149619714
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Energy: 1.578371917802604
Energy: 1.645395533395017
Energy: 1.8114405925604253
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Energy: 1.7201094859934583
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Energy: 1.6092027962819826
Energy: 1.7011721341925283
Energy: 1.7257349109700537
Energy: 1.6778402385691693
Energy: 1.7362741390671073
Energy: 1.6088583765886022
Energy: 1.5795332684119645
Energy: 1.6131176376586924
Energy: 1.560069386042958
Energy: 1.8815234453572443
Energy: 2.0654179014244436
Energy: 1.601976400335823
Energy: 1.589713865039931
Energy: 1.5682008758061554
Energy: 1.788783465548109
Energy: 2.0460719531765905
Energy: 1.9048834680650273
Energy: 1.5682900463835636
Energy: 1.5554673061393982
Energy: 1.5916455874221782
Energy: 1.7685265359423052
Energy: 1.863003141136688
Energy: 1.5616990541621818
Energy: 1.5378427988431396
Energy: 1.5753023397967238
Energy: 1.764777646219023
Energy: 1.8590701321956467
Energy: 1.8608767452165822
Energy: 1.5428208189338712
Energy: 1.6229817366765174
Energy: 1.6524764222160013
Energy: 1.8491781178968916
Energy: 1.6003831760075244
Energy: 1.5628391313455614
Energy: 1.7048154727144045
Energy: 1.7034689129574094
Energy: 1.5752332752268539
Energy: 2.106816361331783
Energy: 1.8987150712009344
Energy: 1.6833459630542298
Energy: 1.813158896637469
Energy: 1.7013690750682138
Energy: 2.182880719861978
Energy: 1.8219106985622453
Energy: 1.6817469553928952
Energy: 1.7826289874137906
Energy: 1.5623632864693338
Energy: 1.6242544680305928
Energy: 1.5690298313860878
Energy: 1.6203497570765213
Energy: 1.8314678134207694
Energy: 1.6231525236521953
Energy: 1.5704990700241803
Energy: 1.5786367570267352
Energy: 1.8232460468429035
Energy: 1.8988876846849498
Energy: 1.9918602956816809
Energy: 1.5373950324856551
Energy: 1.4464477028880127
Energy: 1.4397253245258883
Energy: 1.5921897732526151
Energy: 1.7029473280659495
Energy: 1.522133539952205
Energy: 1.4248337244224025
Energy: 1.4170561003557918
Energy: 1.8633744551564768

minimum gb energy = 1.4037559497343106 eV
minimum distance =  2.44618020138509 Angstroms
sigma value = 165


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

Energy: 1.6525916045811595
Energy: 1.4852254230704145
Energy: 1.5667109547484122
Energy: 1.5518640008232396
Energy: 1.7135313846039377
Energy: 1.654020328870018
Energy: 1.3716027472623487
Energy: 1.5545254378703945
Energy: 1.6598471643067785
Energy: 1.712960596612234
Energy: 1.5681512369275705
Energy: 1.6329455096330374
Energy: 1.4792846991210469
Energy: 1.4161262419577276
Energy: 1.460458505298739
Energy: 1.5693480584862078
Energy: 1.6272330066855938
Energy: 1.4790573494995667
Energy: 1.4181354442505825
Energy: 1.4605728775321154
Energy: 1.598187732961056
Energy: 1.4166578740289806
Energy: 1.487962962698566
Energy: 1.5217615867492584
Energy: 1.7080210814145314
Energy: 1.5964087436788255
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Energy: 1.4830561514068272
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Energy: 2.023486015035058
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Energy: 1.4598956684430704
Energy: 2.024163535669932
Energy: 1.876789560184293
Energy: 1.4825490140555346
Energy: 1.4118849685548989
Energy: 1.3681913323693846
Energy: 1.578764281722089
Energy: 1.4982104422512483
Energy: 1.506907068447136
Energy: 1.4785171242792232
Energy: 1.5755509448597735
Energy: 1.5798130645352146
Energy: 1.6170843366677872
Energy: 1.4636780716156996
Energy: 1.4795737237757989
Energy: 1.5393374488863791
Energy: 1.662010229074497
Energy: 1.4400269154366556
Energy: 1.5112385199078724
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Energy: 1.6585042446105764
Energy: 1.4817000227964565
Energy: 1.4400293753001001
Energy: 1.7779273431666696
Energy: 1.5153808379892268
Energy: 1.6575804753830354
Energy: 1.6914515639079701
Energy: 1.6511638381896598
Energy: 1.5070373563911332
Energy: 1.4188597896239163
Energy: 1.6336428368076064
Energy: 1.7388794984567808
Energy: 1.6631561732665814
Energy: 1.5076265728244478
Energy: 1.4429951885128067
Energy: 1.6464404972114541
Energy: 1.721980065680635
Energy: 2.1362650472071065
Energy: 1.3978639269688227
Energy: 1.49659769921679
Energy: 1.5330477349049012
Energy: 2.115310139183987
Energy: 2.13570278884647
Energy: 1.3975521039236272
Energy: 1.4957872337015041
Energy: 1.7256605040320205
Energy: 1.460737378362557
Energy: 1.8318968525471389
Energy: 1.5843692284972022
Energy: 1.3350511410595243
Energy: 1.3984098933861624
Energy: 1.7235974204832833
Energy: 1.8317094206132034
Energy: 1.737836608365797
Energy: 1.3354254953556857
Energy: 1.469148444911501
Energy: 1.8536518143228555
Energy: 1.4698352552409526
Energy: 1.6452264123837648
Energy: 1.4497985441305843
Energy: 1.503863314892421
Energy: 1.8529960902056601
Energy: 1.4694820359312482
Energy: 1.5689861013680404
Energy: 1.6744198377946078
Energy: 1.5069888582081854

minimum gb energy = 1.3350511410595243 eV
minimum distance =  2.47151716332518 Angstroms
sigma value = 41


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

Energy: 2.5201826298234704
Energy: 1.3090983554003004
Energy: 1.4457754359927204
Energy: 1.329108392196259
Energy: 1.2667122054015405
Energy: 2.4782145478955466
Energy: 1.3939539157829448
Energy: 1.3538655364134868
Energy: 1.2973702089089734
Energy: 1.6664381145834142
Energy: 1.6321977221762767
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Energy: 1.8297317157970743
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Energy: 1.6041760039694084
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Energy: 1.4334103215239076
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Energy: 1.8902406929277966
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Energy: 1.3179674860410182
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Energy: 1.9074303018114591
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Energy: 1.2946724539436105
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Energy: 2.0461553610348697
Energy: 1.3700659317939183
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Energy: 1.3687100615567533
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Energy: 1.37020541015972
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Energy: 2.2421815977354234
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Energy: 1.327034270365665
Energy: 1.997299987938319
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Energy: 1.3156363531361286
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Energy: 1.3992600861190339
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Energy: 1.2947388656068524
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Energy: 1.4404464584194403
Energy: 1.8424800076980836
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Energy: 1.6427681772199585
Energy: 1.5221314625534088
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Energy: 1.4963829396223662
Energy: 1.6422855653065618
Energy: 1.480805535329315
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Energy: 1.6726744241776932
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Energy: 1.771468592515226
Energy: 1.280456548394756
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Energy: 1.4802021763925537
Energy: 1.6822010577068751
Energy: 1.8325929615995373
Energy: 1.851448188697931
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Energy: 1.5722370287883358
Energy: 1.7271927110750875
Energy: 1.8312036202199689
Energy: 1.8861351416074
Energy: 1.8906621766341178
Energy: 1.5746732022619665
Energy: 1.7298148631011139
Energy: 1.297173754682774
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Energy: 1.5879575213936328
Energy: 1.647218979690551
Energy: 1.655213792934501
Energy: 1.3090664103999277
Energy: 1.3256816874520918
Energy: 1.4852368839006507
Energy: 1.6294436601311262
Energy: 1.4869960109336007
Energy: 1.292559779769904
Energy: 1.5511197921434734
Energy: 1.6521309925569947
Energy: 1.9044208012163084
Energy: 1.310696432668336
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Energy: 1.552875437005068
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Energy: 1.2935270146838262
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Energy: 1.3903248950537836
Energy: 2.2543422911425095
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Energy: 1.383901294636483
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Energy: 1.3607426823467061
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Energy: 1.5549592390898443
Energy: 1.4599726108643352
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Energy: 1.5259791601009671
Energy: 1.660743014734025
Energy: 1.2877584399240276
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Energy: 1.2852260571192085
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Energy: 1.8625864734962476
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Energy: 1.8055752511480478
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Energy: 1.56784159358664
Energy: 1.7007618404752438
Energy: 1.3021089108961046
Energy: 1.7858547600486696
Energy: 1.6996233363710194
Energy: 1.4612453816021849
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Energy: 1.3211819864741363
Energy: 1.3298614563080267
Energy: 1.7481147331509637
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Energy: 1.5839504299858305
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Energy: 1.30742983037338
Energy: 1.5713635240574342
Energy: 2.031857482134305
Energy: 1.8800694809174832
Energy: 1.3071652160447536
Energy: 1.4476539290074473
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Energy: 2.037866902891074
Energy: 1.5842667855720052
Energy: 1.30760533429495
Energy: 1.5042167141302154
Energy: 1.47724649750516
Energy: 1.3781229514227833
Energy: 1.5132784303479407
Energy: 1.4006565372048119
Energy: 1.6044902014381042
Energy: 1.393188986458724
Energy: 1.6538266963112411
Energy: 1.4522126636505255
Energy: 1.3890901039917005
Energy: 1.5774237717161883
Energy: 1.4697770004135347
Energy: 1.9465960658757382
Energy: 1.3179937807069861
Energy: 1.256484593476887
Energy: 1.2976216572188402
Energy: 1.4641385675080154
Energy: 1.8249851358290416
Energy: 1.3176710121007693
Energy: 1.2644190466123058
Energy: 1.2888000084179845
Energy: 1.2899708454767307
Energy: 2.243935921413039
Energy: 1.3097654567179133
Energy: 1.3654226668958984
Energy: 1.3576410391058311
Energy: 1.2906589476021788
Energy: 2.2506345530625973
Energy: 1.3076657848573456
Energy: 1.3527000436085892
Energy: 1.3897254716096004
Energy: 1.5398810786310344
Energy: 1.5209223328654398
Energy: 1.5042697450596967
Energy: 1.394637184511619
Energy: 1.3557965936975578
Energy: 1.6666793963025048
Energy: 1.471342693641855
Energy: 1.4552289415200699
Energy: 1.399518062939671
Energy: 1.4252556621307766
Energy: 1.9191648123577598
Energy: 1.342596079550564
Energy: 1.3578436828780804
Energy: 1.3885724472276935
Energy: 1.3853178668862614
Energy: 1.7108969940674115
Energy: 1.3064531715549919
Energy: 1.3368816467549165
Energy: 1.3299511837994906
Energy: 1.3908869019031975

minimum gb energy = 1.250226964857223 eV
minimum distance =  2.46981484921621 Angstroms
sigma value = 185


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

Energy: 0.947584267269676
Energy: 1.324261565208743
Energy: 1.956247969960354
Energy: 1.1342614830709747
Energy: 0.6218145271483788
Energy: 0.6210750483119927
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Energy: 1.858846384645248
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Energy: 0.9482412749563538
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Energy: 1.0579936489602337
Energy: 1.2839997016499836
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Energy: 1.2929025096365125
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Energy: 1.2705314191294292
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Energy: 0.6667642584622115
Energy: 1.3725980108134344
Energy: 2.520197399141822
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Energy: 0.5724176831845382
Energy: 0.5821073013911487
Energy: 1.2202040097464417
Energy: 1.9712754081706825
Energy: 1.321888518673291
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Energy: 0.7109741467236012
Energy: 1.3183593079940987
Energy: 1.2730098778668097
Energy: 1.2093942191263392
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Energy: 1.0765874909151596
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Energy: 1.2882825709546657
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Energy: 2.0027118056590596
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Energy: 0.7961727980789671
Energy: 1.3212285584304386
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Energy: 1.1025744018906478
Energy: 0.7163162483035941
Energy: 1.269791779895428
Energy: 1.3026491014626083
Energy: 1.3776263798845432
Energy: 1.081340589188071
Energy: 1.0043165457398322
Energy: 1.2618240096091398
Energy: 1.2709971691063902
Energy: 1.27364665743421
Energy: 0.7038961873119509
Energy: 1.0538184645336766
Energy: 1.3963720418635888
Energy: 1.2910384436525473
Energy: 1.1660454715131021
Energy: 0.7277923625157939
Energy: 0.6691659740410978
Energy: 1.2826677124758592
Energy: 1.3204022212231452
Energy: 1.1630499910113843
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Energy: 0.6686400749309792
Energy: 1.3170574303117657
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Energy: 0.6685069453790438
Energy: 0.6682249697965629
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Energy: 1.955749961394305
Energy: 1.312663879661807
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Energy: 1.1199475516526445
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Energy: 0.5720407789733094
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Energy: 1.2867941616902743
Energy: 1.3386644663452667
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Energy: 0.7166472817537479
Energy: 1.3229891363260302
Energy: 1.3011322186622836
Energy: 1.2571465353520421
Energy: 0.9106824101355592
Energy: 0.717200866220442
Energy: 1.3038312194530917
Energy: 1.2719755929519934
Energy: 1.1554894439792307
Energy: 1.1480663169947654
Energy: 1.2394955430856847
Energy: 1.9829540512941
Energy: 1.2720133108406446
Energy: 1.1931609127156364
Energy: 0.9787419126958788
Energy: 1.1207823997941966
Energy: 1.965378516444527
Energy: 1.3062528356614063
Energy: 0.6568554801864319
Energy: 0.6653934310867792
Energy: 1.2691046894128981
Energy: 1.9630190478606235
Energy: 1.3228691998620483
Energy: 0.6684165879996845
Energy: 0.6682993463627604
Energy: 1.223083857514373
Energy: 1.9803567038139387
Energy: 1.1840014661428113
Energy: 1.0331554138709944
Energy: 0.6567658708056929
Energy: 1.2790270993911443
Energy: 1.3119760986356657
Energy: 1.0535453618950712
Energy: 0.9909801793638594
Energy: 1.0650132527417524
Energy: 1.2986728035847122
Energy: 1.2995807270421111
Energy: 1.2287944813004557
Energy: 0.7232960726181464
Energy: 1.1394609632613983
Energy: 2.525394735322533
Energy: 1.2738303799192718
Energy: 1.0295403993126802
Energy: 0.717054628661205
Energy: 0.9987806984786064
Energy: 2.546136417068924
Energy: 1.2794982078340635
Energy: 0.6682177017027792
Energy: 0.6731859202949643
Energy: 1.0203406189296758
Energy: 1.929332806860649
Energy: 1.274932267421768
Energy: 0.6685422048739788
Energy: 0.6762617865459164
Energy: 1.0437776318089718
Energy: 1.9712443028817739
Energy: 1.2720741935470556
Energy: 1.1021925565138275
Energy: 1.0810508713387714
Energy: 1.275213755308178
Energy: 1.9902685958252102
Energy: 1.0427592956823442
Energy: 0.9827970297202046
Energy: 0.9189339769219932
Energy: 1.2640490391142198
Energy: 1.2602296984871972
Energy: 1.1096133785610667
Energy: 0.948265921511232
Energy: 1.112548768426014
Energy: 1.3133030467209885
Energy: 1.3262953409757465
Energy: 0.8532884439255387
Energy: 0.6203957633330797
Energy: 0.9338855452183296
Energy: 1.8220991351509959
Energy: 1.2954726446320781
Energy: 0.948194771557602

minimum gb energy = 0.5720029255845074 eV
minimum distance =  2.5634818762152 Angstroms
sigma value = 33


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

Energy: 2.0239634516809453
Energy: 1.3585447108913102
Energy: 1.37990074679174
Energy: 1.3373205669948374
Energy: 1.3748117556425925
Energy: 1.9984089862642596
Energy: 1.240632576603716
Energy: 1.3580678398435042
Energy: 1.371942195593469
Energy: 1.4671515637394406
Energy: 1.3969361594295644
Energy: 1.1699380498220475
Energy: 1.1653802543718428
Energy: 1.1565245567207505
Energy: 1.1417224756498032
Energy: 1.1905489369840145
Energy: 1.1497226805828886
Energy: 1.1607042769269211
Energy: 1.155490136658657
Energy: 1.1704360852992555
Energy: 1.1674162812188114
Energy: 1.1408172470711875
Energy: 1.1451399781531753
Energy: 1.2539191837055539
Energy: 1.1512262612539637
Energy: 1.1480594118653984
Energy: 1.1354683480601682
Energy: 1.1500278018481311
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Energy: 1.5722484994371422
Energy: 1.4163415595474127
Energy: 1.2116331651339964
Energy: 1.292911184108885
Energy: 1.3429954496989867
Energy: 2.0547627894591662
Energy: 1.3403160276702035
Energy: 1.2408672795689968
Energy: 1.345838708623601
Energy: 1.3407287335754114
Energy: 2.0547952460799412
Energy: 1.152210450396012
Energy: 1.1607864651960407
Energy: 1.2021690499008066
Energy: 1.15926082192846
Energy: 1.4167223426513404
Energy: 1.1524986093668608
Energy: 1.3426575728702332
Energy: 1.205607855085112
Energy: 1.15919904670112
Energy: 1.190136775114961
Energy: 1.1508958599339936
Energy: 1.1753474196667644
Energy: 1.2955020649896656
Energy: 1.6754330017998578
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Energy: 1.2199840424097275
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Energy: 1.2927685077889626
Energy: 1.3663858363717454
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Energy: 1.412386664243905
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Energy: 1.3863260311489694
Energy: 1.3821649817170043
Energy: 1.443800704120045
Energy: 1.4227890080064662
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Energy: 1.3536495253130594
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Energy: 1.405095193100254
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Energy: 1.6898895838292296
Energy: 1.1380407907437076
Energy: 1.173085529340106
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Energy: 1.2466769886791806
Energy: 1.233522493545778
Energy: 1.1379818436546363
Energy: 1.2416539502165158
Energy: 1.4090146806229558
Energy: 1.8619121313105658
Energy: 1.6431885755521867
Energy: 1.1969668419433168
Energy: 1.2424768763199294
Energy: 1.300234521027108
Energy: 1.8733222931811773
Energy: 1.4075062625200883
Energy: 1.1936945764412716
Energy: 1.4134686351486803
Energy: 1.5433936077631294
Energy: 1.1786185778722542
Energy: 1.1462247780302792
Energy: 1.329496011505559
Energy: 1.7171076974269375
Energy: 1.368315760202294
Energy: 1.1601684753512178
Energy: 1.1435892733166177
Energy: 1.2102389443630373
Energy: 1.5855131995840528
Energy: 1.3454094961328276
Energy: 1.494542090763012
Energy: 1.1359868997655869
Energy: 1.1811041956604975
Energy: 1.5706858259254208
Energy: 1.332045801757006
Energy: 1.4233554859353434
Energy: 1.137753086881971
Energy: 1.1850335231887368
Energy: 1.3861005450976949
Energy: 1.4073148827483637
Energy: 1.8785971620495028
Energy: 1.4238382787516364
Energy: 1.718292410315118
Energy: 1.3847921799911782
Energy: 1.4076344844673794
Energy: 1.7072514089248385
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Energy: 1.13889722270418
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Energy: 1.153814681424553
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Energy: 1.3978312779858122
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Energy: 1.162566226031642
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Energy: 2.1063378253163307
Energy: 1.220454730348902
Energy: 1.356894597232926
Energy: 1.2519533663793272
Energy: 1.5715554614054599

minimum gb energy = 1.1240658618360795 eV
minimum distance =  2.42690254995517 Angstroms
sigma value = 219


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

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Energy: 1.6750114083571601
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Energy: 1.7816827649904183
Energy: 1.6450012730017998
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Energy: 1.6641799723193103
Energy: 1.4520803439013998
Energy: 1.6931428239586956
Energy: 1.426384540501005
Energy: 1.4397489899909783

minimum gb energy = 1.3571925532818727 eV
minimum distance =  2.5135222281342 Angstroms
sigma value = 15


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

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Energy: 2.089953894976297
Energy: 1.7956845061543683
Energy: 1.7586896512679253
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Energy: 2.1559691353095864
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Energy: 1.9824413090854498
Energy: 1.6203295801952422
Energy: 1.5501347877727687
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Energy: 1.9458943828110924
Energy: 1.6518688220985338
Energy: 1.555516790846897
Energy: 1.6940194004937765
Energy: 1.8840936876949905
Energy: 2.113261678476976
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minimum gb energy = 1.5171817952772197 eV
minimum distance =  2.4865227282552 Angstroms
sigma value = 293


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

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Energy: 1.8260199357434446
Energy: 1.675084110431772
Energy: 1.5076334628298482
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Energy: 1.5876489323882301
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Energy: 1.6578375882721392
Energy: 1.8881245005534384
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Energy: 1.5077332943356632
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Energy: 1.794628382374674
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Energy: 1.8046883583671394
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Energy: 1.7269381449571646
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Energy: 1.7845356688796792
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Energy: 1.6155501571551352
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Energy: 1.8154586817874838
Energy: 1.5935301856159865
Energy: 1.6740917005222598
Energy: 1.8264725561721544
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Energy: 1.798113521182873
Energy: 1.593654984027582
Energy: 1.6184097736952214
Energy: 1.646432433144125
Energy: 1.7942579076289082
Energy: 1.6241447806861733
Energy: 2.02726244823314
Energy: 2.0915674817089265
Energy: 1.6868049535195497
Energy: 1.6445551437191894
Energy: 1.6256504085488634
Energy: 2.009221556971909
Energy: 2.0887239402839874
Energy: 1.810791767879483
Energy: 1.6670431385740228
Energy: 1.5947996472938677
Energy: 1.6809603042934067
Energy: 2.090089570677056
Energy: 1.822195000030948
Energy: 1.6636287642298009
Energy: 1.5817869211909272
Energy: 1.6376434112811287
Energy: 2.0895041193931667
Energy: 1.5288273303203457
Energy: 1.5793838223571408
Energy: 1.7781272562403025
Energy: 1.6918211830407746
Energy: 1.551829825246073
Energy: 1.5284018437600375
Energy: 1.5822409465759724
Energy: 1.7398314263278103
Energy: 1.6916581453456336
Energy: 1.552288742337368
Energy: 1.732565929497842
Energy: 1.7999115216474066
Energy: 1.795175480638474
Energy: 2.5487132721115486
Energy: 2.2559778531745067
Energy: 1.7354345197468453
Energy: 1.8142973630295467
Energy: 1.7950436236850398
Energy: 2.5476134689036303
Energy: 1.88617516217682
Energy: 1.5289706152123956
Energy: 1.5196759622987182
Energy: 1.5519816999107399
Energy: 1.8902873055281946
Energy: 1.6901760050123775
Energy: 1.5173029372189504
Energy: 1.5206701112269863
Energy: 1.5521501847919903
Energy: 1.8903960370871067
Energy: 1.657433915445798
Energy: 1.8189999041163782
Energy: 1.6780361885573707
Energy: 1.9537169634486593
Energy: 1.8650539478709707
Energy: 1.62970735956686
Energy: 1.6635201678858753
Energy: 1.6996344342446912
Energy: 1.9585512233159736
Energy: 1.6174520551454215
Energy: 1.6301928199582958
Energy: 2.005334346857181
Energy: 1.8533223948131854
Energy: 1.8882527011918764
Energy: 1.9179773487099385
Energy: 1.8238315649138053
Energy: 2.003684226068946
Energy: 1.77364898909077
Energy: 1.8870891901325662
Energy: 1.9571878918540622
Energy: 1.9211788047072988

minimum gb energy = 1.5045085377845009 eV
minimum distance =  2.46264994307141 Angstroms
sigma value = 293


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

Energy: 1.3462743510250157
Energy: 1.3716172443443282
Energy: 1.8919160052064796
Energy: 1.8806606202540739
Energy: 1.3477294481801059
Energy: 1.3479306980252266
Energy: 1.688032688248843
Energy: 1.8771597153801345
Energy: 1.9166852314449974
Energy: 1.348229086151157
Energy: 1.7256394367134484
Energy: 1.7102566033744928
Energy: 1.3707000008160968
Energy: 1.6342402582642308
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Energy: 1.710945130320795
Energy: 1.6587008134192318
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Energy: 1.8934984983479246
Energy: 1.3720493394168867
Energy: 1.6382256115845457
Energy: 1.6221434044555718
Energy: 1.6249989057998826
Energy: 1.7002490519417972
Energy: 1.6383445523129117
Energy: 1.662704181261928
Energy: 1.6225888501075467
Energy: 1.8781598513565532
Energy: 1.919243273798587
Energy: 1.8747517105645195
Energy: 1.3479438229521314
Energy: 1.3474220933158243
Energy: 1.371741402079898
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Energy: 1.8733524574258025
Energy: 1.9208728385966212
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Energy: 1.3707782885290085
Energy: 1.4020402946763653
Energy: 1.7271436307842822
Energy: 1.3611057918650464
Energy: 1.6665562312382518
Energy: 1.6676358479135422
Energy: 1.851136153120651
Energy: 1.7272728150697594
Energy: 1.3590427203461326
Energy: 1.6686914341917345
Energy: 1.6640430584365733
Energy: 1.9105787487678996
Energy: 1.8332814863635174
Energy: 1.699745423061852
Energy: 1.624350248655639
Energy: 1.3474467989909804
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Energy: 1.7246504772627531
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Energy: 1.3477867857862198
Energy: 1.622083451755164
Energy: 1.6213574354481486
Energy: 1.635495118444256
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Energy: 1.728687796472799
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Energy: 1.634784132346178
Energy: 1.6352189557917745
Energy: 1.3472886707477323
Energy: 1.8010441546456772
Energy: 1.7075546815444718
Energy: 1.3722464978440492
Energy: 1.794871567049254
Energy: 1.8915337227507678
Energy: 1.638039736016501
Energy: 1.7098137112946774
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Energy: 1.7526978344963193
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Energy: 1.7542716081088634
Energy: 1.6227018786225502
Energy: 1.7267725794306883
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Energy: 1.3465540383534462
Energy: 1.7371082522874828
Energy: 1.8913440364613585
Energy: 1.880401924633304
Energy: 1.3480748402527276
Energy: 1.3481859503103315
Energy: 1.737793062226676
Energy: 1.6251877014254101
Energy: 1.9176214353055974
Energy: 1.3480178949562047
Energy: 1.72559051751526
Energy: 1.6227089832813921
Energy: 1.3700054478607755
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Energy: 1.9230697281292652
Energy: 1.7261979008801394
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Energy: 1.944518231385826
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Energy: 1.6630582953240476
Energy: 1.6224800345662098
Energy: 1.6245381109289494
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Energy: 1.3700756167057795
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Energy: 1.6995989108822838
Energy: 1.874876724674192
Energy: 1.347642787824978
Energy: 1.3475568380582754
Energy: 1.3717271189812972
Energy: 1.8767217266647258
Energy: 1.8756606098607083
Energy: 1.3477929149007188
Energy: 1.3477199944918405
Energy: 1.376544298241434
Energy: 1.699392104622522
Energy: 1.9710505672424727
Energy: 1.3476861437732675
Energy: 1.3479774842857697
Energy: 1.718606493109814
Energy: 1.6224641658783379
Energy: 2.005137960821292
Energy: 1.3475096754227087
Energy: 1.3476775034057422
Energy: 1.7190304571669053
Energy: 1.873352141032121
Energy: 1.921443695094577
Energy: 1.8924437701702372
Energy: 1.785011501631408
Energy: 1.665361854724145
Energy: 1.658128453793274
Energy: 1.9221569363290432
Energy: 1.8771907257484244
Energy: 1.6690436002347564
Energy: 1.7408435613106703
Energy: 1.4032748529637777
Energy: 1.7267800469969523
Energy: 1.3614158121258213
Energy: 1.6668858925625982
Energy: 1.6645202440151994
Energy: 1.8511101135465342
Energy: 1.726850446274074
Energy: 1.358742184913695
Energy: 1.666945835351613
Energy: 1.6643496271545046
Energy: 1.8508421552130172
Energy: 1.8333906538586724
Energy: 1.7536637088835816
Energy: 1.6254087872815663
Energy: 1.347388782583122
Energy: 1.3476067353378764
Energy: 1.7248251127837677
Energy: 1.7549247605110492
Energy: 1.3726009974587445
Energy: 1.3471639260983355
Energy: 1.3477695537550003
Energy: 1.6223397807386222
Energy: 1.6209708790423187
Energy: 1.6373459218341095
Energy: 1.3479802107977543
Energy: 1.8258536636357745
Energy: 1.62262490284247
Energy: 1.6338523498972413
Energy: 1.6365037098719883
Energy: 1.3484671892032756
Energy: 1.6235396878007424
Energy: 1.7102824420246825
Energy: 1.372141046519467
Energy: 1.7944989404563103
Energy: 1.7248263883714516
Energy: 1.6708667436663507
Energy: 1.7113153950793902
Energy: 1.3707495330546642
Energy: 1.794349248284364
Energy: 1.67460568341599
Energy: 1.6626969549414974
Energy: 1.3482512394533455
Energy: 1.7524033947749291
Energy: 1.478504290499132
Energy: 1.7271537010684976
Energy: 1.8268348370009098
Energy: 1.347770102431308
Energy: 1.7531614084272638
Energy: 1.622913430640361
Energy: 1.7269726371793257
Energy: 1.7814158717213129

minimum gb energy = 1.3462743510250157 eV
minimum distance =  2.48910053084193 Angstroms
sigma value = 15


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

Energy: 2.5513351485740214
Energy: 2.093926350472639
Energy: 2.036647731632532
Energy: 1.9479243152582923
Energy: 2.062422229653935
Energy: 2.5211613527479058
Energy: 2.068948124670022
Energy: 1.977436290546204
Energy: 1.9110804981627074
Energy: 2.253688108256487
Energy: 1.890642933894051
Energy: 1.8381199545049032
Energy: 1.5891845703852874
Energy: 1.5700732059089633
Energy: 1.9490576693651143
Energy: 1.8412136322282104
Energy: 1.8280616082219683
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Energy: 1.792043105180628
Energy: 1.8029199028210097
Energy: 1.8099855107989453
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Energy: 1.765463322986514
Energy: 1.692169705375599
Energy: 1.6408580282067937
Energy: 1.8509035306813746
Energy: 1.763442056102644
Energy: 1.760321809768718
Energy: 1.7557084326179957
Energy: 1.6204761488220638
Energy: 1.8425912339796773
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Energy: 2.008814126096118
Energy: 1.83828826735503
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Energy: 2.2435090986644375
Energy: 1.8388622750063564
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Energy: 1.971028847556574
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Energy: 2.045167614801845
Energy: 2.0197872517029767
Energy: 2.042951415340882
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Energy: 1.9788950768686493
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Energy: 1.9801942849266128
Energy: 1.7401305639499338
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Energy: 1.9639789158471568
Energy: 2.0753805819816344
Energy: 1.9252410278432461
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Energy: 1.6675962407169924
Energy: 1.640924976849132
Energy: 1.525822907534779
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Energy: 1.6183901355489858
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Energy: 1.9318435944050847
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Energy: 1.7321719994859583
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Energy: 1.6400764886322277
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Energy: 1.6981508511809533
Energy: 1.7884609417506625
Energy: 1.855604081441941
Energy: 1.5635582610912422
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Energy: 1.6989669455222807
Energy: 1.9656106091246135
Energy: 1.7292542280745777
Energy: 1.617330297323169
Energy: 1.9127988632758957
Energy: 1.94261835900536
Energy: 1.9409521174835398
Energy: 2.0508334695945405
Energy: 2.1938608346950637
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Energy: 2.0078636051556993
Energy: 1.9635811895183501
Energy: 2.2641562826807515
Energy: 2.019001461308317
Energy: 1.5530060391947642
Energy: 1.8626809337222305
Energy: 1.9253640689922844
Energy: 1.8918376537383572
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Energy: 1.8661757964052625
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Energy: 1.8054803828132107
Energy: 1.6781609511574602
Energy: 1.6308029157548407
Energy: 1.797036569087395
Energy: 1.7632698310543897
Energy: 1.7507874073663907
Energy: 1.809790087775409
Energy: 1.6558374451811104
Energy: 1.757393028746314
Energy: 1.7593882367606277
Energy: 1.7441892119809441
Energy: 1.8211836754977755
Energy: 1.9798131572437756
Energy: 1.7826129081227278
Energy: 1.7224196960697318
Energy: 1.9137742607654338
Energy: 1.8608114151644424
Energy: 1.9774476367163454
Energy: 1.7663403622672442
Energy: 1.7270064869193478
Energy: 1.991971356846805
Energy: 1.8526660650277766
Energy: 1.9830749444635463
Energy: 1.9005055530052901
Energy: 2.0247943485849764
Energy: 2.1283497429649882
Energy: 2.2398327852355413
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Energy: 1.901886602302615
Energy: 2.0124357242886304
Energy: 2.1082649174287185
Energy: 2.238507663917773
Energy: 1.7938526587755557
Energy: 1.921836621189277
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Energy: 1.580820121123986
Energy: 1.6444483267654908
Energy: 1.8040562214254354
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Energy: 1.952754972094248
Energy: 1.4957584478691028
Energy: 1.6569478323601006
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Energy: 1.988597579783471
Energy: 1.8545611337652776
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Energy: 1.5523093465697968
Energy: 1.74103071250814
Energy: 2.0029476140182627
Energy: 1.8232292823603502
Energy: 1.5012449968490915
Energy: 1.5537482962306257
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Energy: 2.2741153143161394
Energy: 1.7186742124994483
Energy: 1.5451162826221263
Energy: 1.5421424540409396
Energy: 1.9405457207028964
Energy: 2.1960864566824
Energy: 1.728119572091737
Energy: 1.5319841759780706
Energy: 1.5242506027446945
Energy: 1.8584707778849183
Energy: 1.8119060681610892
Energy: 2.020760662542386
Energy: 1.682902521304549
Energy: 1.9545806451643326
Energy: 2.060369670163757
Energy: 1.8339369250579969
Energy: 2.042151551620731
Energy: 1.943447330847523
Energy: 2.0336108211056954
Energy: 1.6185060516293917
Energy: 1.687947823263602
Energy: 1.798384677875564
Energy: 1.9549891839610536
Energy: 1.8065238602215554
Energy: 1.6054263884805766
Energy: 1.6881078582368239
Energy: 1.8559034994249486
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Energy: 1.8182753340874431
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Energy: 2.0123673338478083
Energy: 1.9277535431712582
Energy: 1.8216530717005004
Energy: 1.5580252074673233
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Energy: 2.083738385630524
Energy: 1.9477585366204069
Energy: 1.6426614724406283
Energy: 1.5493867466881608
Energy: 1.7988006282129618
Energy: 1.96399057302299
Energy: 1.9500255800016177
Energy: 1.6404757432684545
Energy: 1.5170230655513777
Energy: 1.7312135185292923
Energy: 1.9434631512048197
Energy: 1.8023583150821372
Energy: 1.6407013109349515
Energy: 1.5232363892913692
Energy: 1.7474374591526765
Energy: 1.6990044131666646
Energy: 2.025436111942156
Energy: 1.7173267955465823
Energy: 1.5743282438534218
Energy: 1.9353670320649838
Energy: 1.6998500174457576
Energy: 1.9139801089442727
Energy: 1.7191804446996697
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Energy: 1.6819520069259888
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Energy: 2.0236486368581588
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Energy: 2.056720023306758
Energy: 1.9137257156510394
Energy: 2.0349971300281404
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Energy: 1.557357062329675
Energy: 1.8726997501185993
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Energy: 1.900646667904973
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Energy: 1.5582889661673467
Energy: 1.846452170304457
Energy: 2.0748796829082767
Energy: 1.850211894094431
Energy: 1.692329820913874
Energy: 1.581616082740808
Energy: 1.8073837510805015
Energy: 1.7779911071720942
Energy: 1.7343474246961637
Energy: 1.80381525561617
Energy: 1.6372519253006073
Energy: 1.7734327817432767
Energy: 1.775353998386035
Energy: 1.7455395602498314
Energy: 1.7224035500199584
Energy: 1.9916554870378003
Energy: 1.7483803813760972
Energy: 1.695890337081392
Energy: 1.9307903701188154
Energy: 1.7598773266780752
Energy: 1.9630586145898028
Energy: 1.7442082184205883
Energy: 1.7300149493366568
Energy: 1.9414795390880126
Energy: 1.8411950183303885
Energy: 1.9488727958888534
Energy: 1.942038707867559
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Energy: 2.2367539074525826
Energy: 2.094099228517356
Energy: 1.9538965672451332
Energy: 1.9731200806043667
Energy: 2.1106186723865368
Energy: 2.2362675307577717
Energy: 1.8369141375264404
Energy: 1.9591658982243165
Energy: 1.8162671610033476
Energy: 2.0502240621147263
Energy: 1.6573577040382583
Energy: 1.847741586177798
Energy: 1.9595062135554557
Energy: 1.93853247912996
Energy: 2.0515964680133743
Energy: 1.7046868683214933
Energy: 1.679401987124472
Energy: 1.9857450505563
Energy: 1.8205097399291992
Energy: 1.508153480856584
Energy: 1.534238595016214
Energy: 1.7345014545853572
Energy: 2.01622032761994
Energy: 1.8133452162299804
Energy: 1.5071137947143132
Energy: 1.5499340239902835
Energy: 1.8496548244126232
Energy: 2.1931979009269957
Energy: 1.8576513161694537
Energy: 1.5287942804174781
Energy: 1.5488192679877768
Energy: 1.8546988543051646
Energy: 2.190505186220563
Energy: 1.7758296678595973
Energy: 1.5286058551208612
Energy: 1.5396952990126571
Energy: 1.934533050649614
Energy: 2.134581007389538
Energy: 2.034383403176904
Energy: 1.7834265495243529
Energy: 2.0109778393170687
Energy: 1.892292325489673
Energy: 2.1336337261561615
Energy: 1.932202638212456
Energy: 1.7958471872975863
Energy: 2.0293714718128135
Energy: 1.551988724952418
Energy: 1.7003149765099568
Energy: 1.8086099679791185
Energy: 1.9539997825323363
Energy: 1.7995630154233375
Energy: 1.563170113154029
Energy: 1.686581369592537
Energy: 1.8091961848247322
Energy: 1.9462717141415269
Energy: 1.739734730491625
Energy: 1.5727148314555002
Energy: 1.5073299959229938
Energy: 1.788488505376425
Energy: 2.0205662635073636
Energy: 1.6948344898903362
Energy: 1.521832719086111
Energy: 1.5264971453185368
Energy: 1.7965431766313151
Energy: 1.9961849354721344
Energy: 1.667592724825134
Energy: 1.5799735627208504
Energy: 1.6116721960709681
Energy: 1.7129970833100634
Energy: 1.7392009923414093
Energy: 1.7802277182214052
Energy: 1.591378772149848
Energy: 1.6455240510626747
Energy: 1.7079655240028777
Energy: 1.8305697183489376
Energy: 1.793622738995392
Energy: 2.561695229353053
Energy: 2.0499871527139604
Energy: 2.032947082980282
Energy: 1.933028234226838
Energy: 2.101181850589757
Energy: 2.533831084077822
Energy: 2.0190518700125524
Energy: 2.0438235476489606
Energy: 1.9397487577804255
Energy: 2.145447157444175

minimum gb energy = 1.4788491978812304 eV
minimum distance =  2.4435078130331 Angstroms
sigma value = 437


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

Energy: 1.9017660965262753
Energy: 2.160868847014351
Energy: 2.0456114109824486
Energy: 1.939702044498204
Energy: 2.1286646316427635
Energy: 1.9033088328051662
Energy: 2.160603140866714
Energy: 2.0446982658606974
Energy: 1.90979044194955
Energy: 2.2311535123317103
Energy: 1.6704992435160946
Energy: 1.8461548894100908
Energy: 1.675415479081249
Energy: 1.7219369670047064
Energy: 1.6782365354918523
Energy: 1.6311095313115531
Energy: 1.855625925081736
Energy: 1.649688010301505
Energy: 1.8871446640346086
Energy: 1.6647123662368444
Energy: 1.5784113254501022
Energy: 1.5226397709215675
Energy: 1.879680518633731
Energy: 1.6717126695379114
Energy: 1.5136309387041091
Energy: 1.5776426508348198
Energy: 1.5618439701037912
Energy: 1.8771909784898355
Energy: 1.657746129659606
Energy: 1.5226549189794494
Energy: 1.5571846890460697
Energy: 1.703609256077434
Energy: 2.083411470232813
Energy: 1.7848300247228912
Energy: 1.5375631992747487
Energy: 1.5643442985381566
Energy: 1.815569544823574
Energy: 2.1025374615206602
Energy: 1.7281628101452122
Energy: 1.5370249266037928
Energy: 1.9981846371145668
Energy: 1.9456414264745794
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Energy: 1.8509625136010701
Energy: 1.9446483348243802
Energy: 1.7630622445325044
Energy: 1.7366990248141903
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Energy: 1.650263399043732
Energy: 1.6418971484242284
Energy: 1.790238135157505
Energy: 1.7098531919475048
Energy: 1.9051307162611266
Energy: 1.7140556060632317
Energy: 1.6416933083479757
Energy: 1.789521424788299
Energy: 1.8383109530174027
Energy: 1.9047478377648377
Energy: 1.5946341741909889
Energy: 1.5536149676591953
Energy: 1.558998679909947
Energy: 1.8478320753868973
Energy: 1.844136854587965
Energy: 1.591841922525504
Energy: 1.5563503543650523
Energy: 1.5565040647922448
Energy: 1.8607556513090608
Energy: 1.8473002659833546
Energy: 1.56275946504207
Energy: 1.6087003818794143
Energy: 1.5454459362270436
Energy: 1.7985062820898416
Energy: 1.8216834357275975
Energy: 1.5606871726623193
Energy: 1.6379586162385915
Energy: 1.5814555300312845
Energy: 1.7860615421569472
Energy: 1.8292479744677719
Energy: 1.8465286094197129
Energy: 2.186766181745906
Energy: 1.9820298636707683
Energy: 1.9718222382788635
Energy: 1.8129364712837333
Energy: 1.8353495591950957
Energy: 2.1631078220761633
Energy: 1.978431938935851
Energy: 1.956084922466122
Energy: 1.7582717558353067
Energy: 1.9822714584458752
Energy: 1.9245237125343295
Energy: 1.9413537220391122
Energy: 1.8886915003738434
Energy: 1.9475652146270608
Energy: 1.9316090422969814
Energy: 1.9214420816071152
Energy: 1.8064584951603697
Energy: 1.987183069039266
Energy: 1.9269622265019277
Energy: 1.421076111077504
Energy: 1.611192062792273
Energy: 1.6767526314665138
Energy: 2.0064621548087906
Energy: 1.9189571414370608
Energy: 1.419111198213625
Energy: 1.5886743821798917
Energy: 1.6645286101537877
Energy: 1.9154574124282462
Energy: 1.7614071674851242
Energy: 1.4209246767835038
Energy: 1.4322441652035096
Energy: 1.5313109379727785
Energy: 2.0202410068550924
Energy: 1.6297041432214654
Energy: 1.4203463085667967
Energy: 1.4207829558454268
Energy: 1.740907465766296
Energy: 2.0221072410738716
Energy: 1.5870258066874017
Energy: 1.5023484292741984
Energy: 1.4276541648041792
Energy: 1.8058511025106267
Energy: 1.8173103764660938
Energy: 1.6660633092194375
Energy: 1.511680118596107
Energy: 1.4278326907567633
Energy: 1.7719488470917417
Energy: 1.8476382099223316
Energy: 1.6649942098592656
Energy: 2.4507007027887013
Energy: 2.1787192262186594
Energy: 2.0770822769180532
Energy: 1.9281122334747502
Energy: 1.482603146089241
Energy: 2.450807779057614
Energy: 2.111109204392491
Energy: 2.039911453840826
Energy: 1.929322628579879
Energy: 1.5979229299272106

minimum gb energy = 1.419111198213625 eV
minimum distance =  2.49320196145416 Angstroms
sigma value = 33