Model name: model_name=MEAM_LAMMPS_ShimParkCho_2003_NiW__MO_500937681860_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391771733761
cohesive_energy=4.450349977833565
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.020522605556623576
Energy: 0.5149115745678878
Energy: 0.5149115745678878
Energy: 0.020522605556623576
Energy: 0.5149115745678878
Energy: 0.5149115745678878
Energy: 0.020522605556623576
Energy: 0.5149115745678878
Energy: 0.5149115745678878
Energy: 0.020522605556623576
Energy: 0.512035948321494
Energy: 0.024072244810459154
Energy: 0.5124628361015439
Energy: 0.512035948321494
Energy: 0.024072244810459154
Energy: 0.5124628361015439
Energy: 0.512035948321494
Energy: 0.024072244810459154
Energy: 0.5124628361015439
Energy: 0.512035948321494
Energy: 0.8991936755309846
Energy: 0.4739493998320834
Energy: 0.2506152378557777
Energy: 1.34128367632286
Energy: 1.0566005827163771
Energy: 0.021006251861006575
Energy: 2.0508098492573352
Energy: 0.3115644757859624
Energy: 0.021006251861006575
Energy: 1.2548449375264594
Energy: 0.512035948321494
Energy: 0.5124628361015439
Energy: 0.024072244811982533
Energy: 0.512035948321494
Energy: 0.5124628361015439
Energy: 0.024072244810459154
Energy: 0.512035948321494
Energy: 0.5124628361015439
Energy: 0.024072244811982533
Energy: 0.512035948321494
Energy: 0.02052260555510019
Energy: 0.5149115745694112
Energy: 0.5149115745678878
Energy: 0.02052260555510019
Energy: 0.5149115745694112
Energy: 0.5149115745678878
Energy: 0.02052260555510019
Energy: 0.5149115745694112
Energy: 0.5149115745678878
Energy: 0.02052260555510019
Energy: 0.512035948321494
Energy: 0.024072244811982533
Energy: 0.5124628361015439
Energy: 0.512035948321494
Energy: 0.024072244810459154
Energy: 0.5124628361015439
Energy: 0.512035948321494
Energy: 0.024072244811982533
Energy: 0.5124628361015439
Energy: 0.512035948321494
Energy: 1.6198203064341075
Energy: 0.3115644757859624
Energy: 0.021006251861006575
Energy: 2.2978336917275857
Energy: 0.3115644757859624
Energy: 0.021006251862495332
Energy: 1.7859381585229275
Energy: 0.3115644757859624
Energy: 0.021006251861006575
Energy: 1.6198203064341075

minimum gb energy = 0.02052260555510019 eV
minimum distance =  2.15112863150197 Angstroms
sigma value = 3


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

Energy: 1.475746167797097
Energy: 1.672115431045849
Energy: 1.6726262349600842
Energy: 1.3887188985752168
Energy: 1.672115431045849
Energy: 1.672626234956353
Energy: 1.475746167797097
Energy: 1.672115431045849
Energy: 1.672626234952689
Energy: 1.3887188985752168
Energy: 1.4844226396703621
Energy: 1.416470100942467
Energy: 1.6463592198223773
Energy: 1.4844226261459377
Energy: 1.416470100942467
Energy: 1.6463592198223773
Energy: 1.4844226336131003
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Energy: 1.4844226375592764
Energy: 1.6037559359324174
Energy: 1.77604232346837
Energy: 1.7186748751467653
Energy: 1.6185203599757378
Energy: 1.77604232346837
Energy: 1.7186748751467653
Energy: 1.6037559359324174
Energy: 1.77604232346837
Energy: 1.7186748751467653
Energy: 1.6185203599794695
Energy: 1.6698737069353948
Energy: 1.672773037032556
Energy: 1.336735188256207
Energy: 1.6698737069353948
Energy: 1.672773037032556
Energy: 1.336735188256207
Energy: 1.6698737069316634
Energy: 1.672773037032556
Energy: 1.3367351882599388
Energy: 1.6698737069316634
Energy: 1.276421184023661
Energy: 1.8698416213634568
Energy: 1.6127924709897032
Energy: 1.276421184023661
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Energy: 1.6298605794699674
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Energy: 1.8698416213597253
Energy: 1.6127924709897032
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Energy: 1.345761952397901
Energy: 1.6030643309336983
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Energy: 1.603064330911309
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Energy: 1.603064330974745
Energy: 1.7486268291976292
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Energy: 1.3455956191167753
Energy: 1.7913543807601315
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Energy: 1.3455956191167753
Energy: 1.791354380763863
Energy: 1.656759712055735
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Energy: 1.656759712055735
Energy: 1.6262427959340344
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Energy: 1.4060622165670635
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Energy: 1.4060442823183676
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Energy: 1.6723517612211327
Energy: 1.671971826705203
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Energy: 1.6719718267014716
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Energy: 1.671971826705203
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Energy: 1.8786421864103262
Energy: 1.7426445160082031
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Energy: 1.3865226632365353
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Energy: 1.6584971552344672
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Energy: 1.657078111499622
Energy: 1.336925613437837
Energy: 1.6570114952605572
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Energy: 1.6570114952605572
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Energy: 1.336925613437837
Energy: 1.6570114952605572
Energy: 1.657078111499622
Energy: 1.6253953298947208
Energy: 1.7772016840328329
Energy: 1.4165814480764172
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Energy: 1.7772016840328329
Energy: 1.4166892359212777
Energy: 1.6253953298909896
Energy: 1.7772016840291012
Energy: 1.416581448068954
Energy: 1.6253953298909896
Energy: 1.4539454735795703
Energy: 1.7366562875877039
Energy: 1.7430652277610723
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Energy: 1.7430652277573406
Energy: 1.453945473583302
Energy: 1.480338837884111
Energy: 1.7960449009884085
Energy: 1.671945337126838
Energy: 1.3969850339472252
Energy: 1.796044900984677
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Energy: 1.3969850339509566
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Energy: 1.4060926386476007
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Energy: 1.64440520968405
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Energy: 1.4060926386476007
Energy: 1.64517291623855
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Energy: 1.6723902551226972
Energy: 1.7963036213102168
Energy: 1.5774941164219978
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Energy: 1.7963036213139485
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Energy: 1.7963036213064851
Energy: 1.5774941164219978
Energy: 1.6723902551226972
Energy: 1.7645687279437245
Energy: 1.467766183763302
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Energy: 1.7645687279399929
Energy: 1.4120335782943487
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Energy: 1.7645687279399929
Energy: 1.467766183763302
Energy: 1.3431185841744333
Energy: 1.7645687279437245
Energy: 1.2764475386632899
Energy: 1.8678552883022317
Energy: 1.63716209370321
Energy: 1.2764475386632899
Energy: 1.6903030210015908
Energy: 1.7563128987951722
Energy: 1.2764475386632899
Energy: 1.8678552883059631
Energy: 1.6371629046894198
Energy: 1.2764475386670213
Energy: 1.655509478116685
Energy: 1.337036784186875
Energy: 1.6576396810767697
Energy: 1.6555094781129536
Energy: 1.3370367841906066
Energy: 1.6576396810805014
Energy: 1.6555094781129536
Energy: 1.3370367841906066
Energy: 1.6576396810767697
Energy: 1.6555094781129536
Energy: 1.4450467836765688
Energy: 1.7193901191369667
Energy: 1.5990138006026682
Energy: 1.4450467836765688
Energy: 1.7193901191332353
Energy: 1.5990138005989365
Energy: 1.4450467836765688
Energy: 1.7193901191369667
Energy: 1.5990138005989365
Energy: 1.4450467836765688
Energy: 1.4437965244215845
Energy: 1.626888917584089
Energy: 1.4158123475705318
Energy: 1.4437965244215845
Energy: 1.626888917584089
Energy: 1.4163312254057532
Energy: 1.4437965244215845
Energy: 1.6268889175803574
Energy: 1.415812347574263
Energy: 1.443796524417853
Energy: 1.394739226640943
Energy: 1.672115431045849
Energy: 1.672626234956353
Energy: 1.450742052653879
Energy: 1.672115431045849
Energy: 1.672626234956353
Energy: 1.3947392266372116
Energy: 1.6721154310495807
Energy: 1.672626234956353
Energy: 1.4507420526576105
Energy: 1.484422630651569
Energy: 1.416470100942467
Energy: 1.6463592198223773
Energy: 1.4844226405916385
Energy: 1.416470100942467
Energy: 1.6463592198223773
Energy: 1.4844226374548617
Energy: 1.4164701009461986
Energy: 1.6463592198223773
Energy: 1.4844226253290758
Energy: 1.6147589194386358
Energy: 1.77604232346837
Energy: 1.7186748751430339
Energy: 1.6064842764380987
Energy: 1.7760423234721014
Energy: 1.7186748751430339
Energy: 1.6147589194386358
Energy: 1.7760423234721014
Energy: 1.7186748751467653
Energy: 1.6064842764380987
Energy: 1.6698737069353948
Energy: 1.672773037032556
Energy: 1.336735188256207
Energy: 1.6698737069353948
Energy: 1.6727730370288247
Energy: 1.3367351882599388
Energy: 1.6698737069316634
Energy: 1.6727730370288247
Energy: 1.3367351882599388
Energy: 1.6698737069353948

minimum gb energy = 1.276421184023661 eV
minimum distance =  2.21847930259992 Angstroms
sigma value = 75


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

Energy: 1.6045341975193546
Energy: 1.3509252353274543
Energy: 1.3507294390519076
Energy: 1.5133722217689773
Energy: 1.3509252353274543
Energy: 1.3507294390519076
Energy: 1.6045341975193546
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Energy: 1.5133722217689773
Energy: 1.3514282249635368
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Energy: 1.7221137160001225
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Energy: 1.72211371599466
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Energy: 1.3514282249653575
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Energy: 1.6511071107590416
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minimum gb energy = 1.338421585752143 eV
minimum distance =  2.21950251449227 Angstroms
sigma value = 105


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

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Energy: 1.8067473222109767
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Energy: 1.474695214663629
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Energy: 1.7250365729087698
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Energy: 1.6513120964855499
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Energy: 1.689645004119675
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Energy: 1.6606600568793568
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Energy: 1.6525015976272852
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Energy: 1.6548319710463304
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Energy: 1.6548319710483472
Energy: 1.6525015976272852
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Energy: 1.6548319710483472
Energy: 1.6525015976293396
Energy: 1.595249408180446
Energy: 1.58690836745015
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Energy: 1.588046695798858
Energy: 1.595249408180446
Energy: 1.58690836745015
Energy: 1.588046695798858
Energy: 1.595249408180446
Energy: 1.5844173935314823
Energy: 1.5999443603105725
Energy: 1.6235367010225301
Energy: 1.5844173935314823
Energy: 1.599964302217311
Energy: 1.6235367010225301
Energy: 1.5844173935314823
Energy: 1.5999443603126267
Energy: 1.6235367010225301
Energy: 1.5844173935314823
Energy: 1.8850505926653838
Energy: 1.6110354085201835
Energy: 1.6780472965488626
Energy: 1.8850505926674381
Energy: 1.6110341798192174
Energy: 1.6780472965509166
Energy: 1.8850505926674381
Energy: 1.6110354085222376
Energy: 1.6780472965488626
Energy: 1.8850505926653838
Energy: 1.5021815522879522
Energy: 1.6248256971373778
Energy: 1.4724580010256947
Energy: 1.5021815522900064
Energy: 1.6248256971394317
Energy: 1.4724580010256947
Energy: 1.5021815522900064
Energy: 1.6248256971394317
Energy: 1.4724580010256947
Energy: 1.5021815522879522
Energy: 1.720840239706581
Energy: 1.6880275138213756
Energy: 1.6151810214563787
Energy: 1.7208402397045268
Energy: 1.6880233498874406
Energy: 1.6151810214563787
Energy: 1.720840239706581
Energy: 1.6880275138213756
Energy: 1.6151810214563787
Energy: 1.7208402397045268
Energy: 1.6626464624482544
Energy: 1.661566571168377
Energy: 1.6868574416117568
Energy: 1.6626464624462003
Energy: 1.661313949634419
Energy: 1.686857441609703
Energy: 1.6626464624462003
Energy: 1.661566571168377
Energy: 1.686857441609703
Energy: 1.6626464624482544
Energy: 1.6763359385979508
Energy: 1.5644645406159376
Energy: 1.6597065967752518
Energy: 1.676335938600005
Energy: 1.5644643355898071
Energy: 1.6597065967752518
Energy: 1.6763359385979508
Energy: 1.5644645406179918
Energy: 1.6597065967752518
Energy: 1.6763359385979508

minimum gb energy = 1.4724147943851245 eV
minimum distance =  2.192952780541 Angstroms
sigma value = 165


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

Energy: 1.4258991399111032
Energy: 1.6039700986652372
Energy: 1.6039238444263229
Energy: 1.4258991399118082
Energy: 1.6039700986631218
Energy: 1.6039238444263229
Energy: 1.4258991399118082
Energy: 1.6039700986659424
Energy: 1.6039238444256176
Energy: 1.4258991399125136
Energy: 1.6044752463274206
Energy: 1.4235477919947828
Energy: 1.6410870476303692
Energy: 1.6044752465424394
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Energy: 1.6044752459496312
Energy: 1.4235477919891413
Energy: 1.6410870476303692
Energy: 1.604475245713521
Energy: 1.5432613983064396
Energy: 1.619425390456143
Energy: 1.3847198015448474
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Energy: 1.7026385528482062
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Energy: 1.7783858025705046
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Energy: 1.5788002979226572
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Energy: 1.76530825058744
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Energy: 1.76530825058744
Energy: 1.635659509994776
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Energy: 1.487145569871751
Energy: 1.7040665388748988
Energy: 1.7791002693407976
Energy: 1.487145569871046
Energy: 1.704066538875604
Energy: 1.7791002693422078
Energy: 1.4871455698724565
Energy: 1.7040665388748988
Energy: 1.7791002693415026
Energy: 1.487145569871751
Energy: 1.5349065787514384
Energy: 1.5368642325764568
Energy: 1.603392101736052
Energy: 1.534906578753554
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Energy: 1.6033921017353467
Energy: 1.5349065787521439
Energy: 1.5368642325757518
Energy: 1.603392101736052
Energy: 1.534906578753554
Energy: 1.7028511816181469
Energy: 1.4444651586483324
Energy: 1.7028721103581628
Energy: 1.7028511816195573
Energy: 1.4444651586497428
Energy: 1.7028721103602784
Energy: 1.7028511816188519
Energy: 1.4444651586483324
Energy: 1.7028721103497004
Energy: 1.7028511816188519
Energy: 1.543205415983532
Energy: 1.3845265806699798
Energy: 1.6191237835804142
Energy: 1.5432054159821218
Energy: 1.3845265806699798
Energy: 1.6191237835811194
Energy: 1.543205415983532
Energy: 1.3845265806706848
Energy: 1.6191237835811194
Energy: 1.5432054159821218
Energy: 1.6045342292802995
Energy: 1.64145955452605
Energy: 1.4234810711046693
Energy: 1.6045342292810048
Energy: 1.6414595545232291
Energy: 1.42348107110608
Energy: 1.6045342292788891
Energy: 1.6414595545133563
Energy: 1.4234810711046693
Energy: 1.6045342292817097
Energy: 1.4258991399118082
Energy: 1.6039700986708787
Energy: 1.6039238444263229
Energy: 1.4258991399125136
Energy: 1.6039700986624164
Energy: 1.6039238444270283
Energy: 1.4258991399118082
Energy: 1.6039700986701737
Energy: 1.6039238444263229
Energy: 1.4258991399118082

minimum gb energy = 1.3845265806699798 eV
minimum distance =  2.2826266083936 Angstroms
sigma value = 41


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

Energy: 1.4908946356524788
Energy: 1.4743499431262483
Energy: 1.468899921833136
Energy: 1.4502743012992165
Energy: 1.4743499431262483
Energy: 1.468899921833136
Energy: 1.490894635655215
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Energy: 1.3812500489286046
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Energy: 1.3812500489340769
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Energy: 1.3500587060811409
Energy: 1.41513027018997
Energy: 1.3752241625569595
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Energy: 1.4136564822667348
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Energy: 1.2989526237471214
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Energy: 1.2988523745642782
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Energy: 1.2989526237498574
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Energy: 1.5735735493272298
Energy: 1.3032725519888786
Energy: 1.3403917298053862
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Energy: 1.3032725519888786
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Energy: 1.4631380956707896
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Energy: 1.3522600280886319
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Energy: 1.5474206111136164
Energy: 1.273481109957642
Energy: 1.4933185278696912
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Energy: 1.273481109954906
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Energy: 1.5474206111190885
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Energy: 1.3051803137141602
Energy: 1.2936683568182425
Energy: 1.2938754679998548
Energy: 1.281377914689628
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Energy: 1.3800242267303435
Energy: 1.5001612800826725
Energy: 1.4695868193698534
Energy: 1.4926780754578752
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Energy: 1.5001612800854085
Energy: 1.4695868193671173
Energy: 1.4926780754578752
Energy: 1.4600409436740505
Energy: 1.3857568762619856
Energy: 1.4314063087944195
Energy: 1.4256996783940945
Energy: 1.3857568762619856
Energy: 1.4314063087944195
Energy: 1.4256996783940945
Energy: 1.3857568762619856
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Energy: 1.3857568762647217
Energy: 1.4013511324900503
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Energy: 1.275036140471179
Energy: 1.401351132492786
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Energy: 1.2751973468053739
Energy: 1.401351132492786
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Energy: 1.275036140471179
Energy: 1.4013511324900503
Energy: 1.4746749777366728
Energy: 1.478870816592988
Energy: 1.273169021540647
Energy: 1.4746749780484365
Energy: 1.4788708166094042
Energy: 1.2734663631050605
Energy: 1.4746749768751568
Energy: 1.478870816592988
Energy: 1.273169021540647
Energy: 1.4746749758851443
Energy: 1.30389993741288
Energy: 1.6462157268082676
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Energy: 1.3202249627722846
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Energy: 1.3351992074452865
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Energy: 1.4739275256660251
Energy: 1.3946287670677544
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Energy: 1.4739275256687614
Energy: 1.3946287670677544
Energy: 1.4254521797381288
Energy: 1.4739275256687614
Energy: 1.3946287670677544
Energy: 1.4254521797381288
Energy: 1.574898133026788
Energy: 1.4601770965797263
Energy: 1.4042041980031017
Energy: 1.574898133026788
Energy: 1.4601770965797263
Energy: 1.4042041980031017
Energy: 1.5748981330240521
Energy: 1.4601770965797263
Energy: 1.4042041980085738
Energy: 1.5748981330240521
Energy: 1.479952660107187
Energy: 1.3442769375573855
Energy: 1.4513361039768504
Energy: 1.479952660107187
Energy: 1.34427695091994
Energy: 1.4513361039741142
Energy: 1.479952660107187
Energy: 1.344276948040094
Energy: 1.451336103971378
Energy: 1.479952660107187
Energy: 1.25572482144995
Energy: 1.5221912744416308
Energy: 1.3734430602494978
Energy: 1.25572482144995
Energy: 1.5222121063581664
Energy: 1.3734430602494978
Energy: 1.255724821452686
Energy: 1.522191274447103
Energy: 1.3734430602467618
Energy: 1.25572482144995
Energy: 1.286716560358465
Energy: 1.2938711674310535
Energy: 1.2930177278539619
Energy: 1.2867165603557287
Energy: 1.2938304880282847
Energy: 1.293017066170355
Energy: 1.2867165603529926
Energy: 1.2938711674310535
Energy: 1.2930177278539619
Energy: 1.2867165603557287
Energy: 1.2760965328548277
Energy: 1.3008790922137943
Energy: 1.3049319802914257
Energy: 1.276096532857564
Energy: 1.3008779569367788
Energy: 1.3049319802968977
Energy: 1.2760965328548277
Energy: 1.3008790922137943
Energy: 1.3049319803352029
Energy: 1.2760965328548277
Energy: 1.6056125706552153
Energy: 1.302120553713191
Energy: 1.3812277095357985
Energy: 1.6056125706552153
Energy: 1.3021260702101118
Energy: 1.3812277095357985
Energy: 1.6056125706552153
Energy: 1.3021205537159268
Energy: 1.3812277095330625
Energy: 1.6056125706552153
Energy: 1.4955333515067117
Energy: 1.4228370461445146
Energy: 1.2761391011033592
Energy: 1.5481929968497505
Energy: 1.4228370461499869
Energy: 1.2761391011033592
Energy: 1.5229456141937439
Energy: 1.4228370461527227
Energy: 1.2761391011060952
Energy: 1.567229127163614

minimum gb energy = 1.25572482144995 eV
minimum distance =  2.26038050251403 Angstroms
sigma value = 185


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

Energy: 0.7959515963853276
Energy: 0.6939326625151095
Energy: 0.6938596761972111
Energy: 0.6409833584835469
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Energy: 0.6409833584835469
Energy: 0.76338676595163
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Energy: 0.9140079841535494
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Energy: 0.9140079841561478
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Energy: 0.8402112656227333
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Energy: 0.6939326625138104
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Energy: 0.8925635183729004
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Energy: 0.8920908726179022
Energy: 0.5355625882798549
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Energy: 0.8920908726182565
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Energy: 0.8920908726195556
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Energy: 1.0286758035672083
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Energy: 0.6941875911281451
Energy: 0.7116152633152563
Energy: 0.8407595536285162
Energy: 0.6941875911272003
Energy: 0.7488024923645029
Energy: 0.8407595536281618
Energy: 0.6941875911281451
Energy: 0.7116152633159059
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Energy: 0.6941875911278499
Energy: 0.892090872617607
Energy: 0.6402434499143813
Energy: 0.6938067371372899
Energy: 0.8920908726192013
Energy: 0.5875024190545785
Energy: 0.6938067371343966
Energy: 0.8920908726192013
Energy: 0.6402434499114287
Energy: 0.6938067371369948
Energy: 0.8920908726172526
Energy: 0.6043997076677652
Energy: 0.7620115007480927
Energy: 0.6940797438733057
Energy: 0.7076698670422841
Energy: 0.724617061731316
Energy: 0.6940797438739553
Energy: 0.6043997076684148
Energy: 0.7620115007480927
Energy: 0.694079743873601
Energy: 0.7076698670429337
Energy: 0.5875755209691077
Energy: 0.588586344816334
Energy: 0.7259197260959392
Energy: 0.587564190703346
Energy: 0.5885338518658204
Energy: 0.7259197260975337
Energy: 0.5875755209678084
Energy: 0.5885863448234792
Energy: 0.7259197260949355
Energy: 0.5875641907046452
Energy: 0.7426104510987314
Energy: 0.8402112656207845
Energy: 0.7243959588566175
Energy: 0.7426104511003849
Energy: 0.8402112656197807
Energy: 0.7243959588559679
Energy: 0.7426104511006802
Energy: 0.8402112656210798
Energy: 0.7243959588546688
Energy: 0.7426104511003849

minimum gb energy = 0.5355625882798549 eV
minimum distance =  2.35065442683549 Angstroms
sigma value = 33


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

Energy: 1.2941241736388576
Energy: 1.3582885292274993
Energy: 1.3582621023796562
Energy: 1.2941241736388576
Energy: 1.3582885292274993
Energy: 1.3582621023796562
Energy: 1.2941241736388576
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Energy: 1.3723519958379176
Energy: 1.2074384041955908
Energy: 1.315426841366662
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Energy: 1.2376911033672482
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Energy: 1.3484440758785161
Energy: 1.3685720455749901
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Energy: 1.348444075876733
Energy: 1.3238159817771677
Energy: 1.416328416408469
Energy: 1.2410799474909562
Energy: 1.323815981773602
Energy: 1.416328416408469
Energy: 1.2410799474909562
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Energy: 1.3626457042906344
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Energy: 1.2968550376184036
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Energy: 1.4741036145778783
Energy: 1.487265587952188
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Energy: 1.4741036145796613
Energy: 1.487265587950405
Energy: 1.3187403922633054
Energy: 1.4741036145778783
Energy: 1.487265587953971
Energy: 1.3187403922633054
Energy: 1.3542452673280643
Energy: 1.317793708251157
Energy: 1.3015736434513148
Energy: 1.3542452673280643
Energy: 1.3177937082529398
Energy: 1.3015736434513148
Energy: 1.3542452673298475
Energy: 1.317793708251157
Energy: 1.3015736434513148
Energy: 1.3542452673280643
Energy: 1.323568613425768
Energy: 1.4067372929330162
Energy: 1.3262310813824805
Energy: 1.323568613425768
Energy: 1.4067372929347992
Energy: 1.3262310813806975
Energy: 1.3235686134239852
Energy: 1.4067372929330162
Energy: 1.3262310813824805
Energy: 1.323568613427551
Energy: 1.171511896010036
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Energy: 1.171511896011819
Energy: 1.2446112895873507
Energy: 1.2959856589907397
Energy: 1.171511896011819

minimum gb energy = 1.1369713749566588 eV
minimum distance =  2.21221484148707 Angstroms
sigma value = 219


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

Energy: 1.4003996943860588
Energy: 1.7092013387834386
Energy: 1.7091625145467788
Energy: 1.4003996943860588
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Energy: 1.4849682270434315
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Energy: 1.523840930703665
Energy: 1.505868019656008
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Energy: 1.4749976051620353
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Energy: 1.4749976051608553
Energy: 1.3980991386965187
Energy: 1.5102158706172657
Energy: 1.420556789384339
Energy: 1.3980991387000588
Energy: 1.3987103741670779
Energy: 1.6949784472603717
Energy: 1.709066233389925
Energy: 1.3987103741682578
Energy: 1.6949784472603717
Energy: 1.7090662333911049
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Energy: 1.6949784472603717
Energy: 1.709066233389925
Energy: 1.3987103741670779
Energy: 1.7381946078211137
Energy: 1.6070050265594629
Energy: 1.6810008108631451
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Energy: 1.607005026558283
Energy: 1.6810008108619652
Energy: 1.7381946078222936
Energy: 1.607005026558283
Energy: 1.6810008108631451
Energy: 1.7381946078211137

minimum gb energy = 1.3888152940724319 eV
minimum distance =  2.26039458533424 Angstroms
sigma value = 15


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

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Energy: 1.8242082289215102
Energy: 1.5852320160834577
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Energy: 1.7012934472409778
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Energy: 1.715502902851013
Energy: 1.5944642641592872
Energy: 1.7012934472344885
Energy: 1.7155029028466604
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minimum gb energy = 1.5852320160834577 eV
minimum distance =  2.19887380545396 Angstroms
sigma value = 293


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

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Energy: 1.922410363987638
Energy: 1.5970400323217062
Energy: 1.6777232071372983
Energy: 1.922410363987638
Energy: 1.5970400323243714
Energy: 1.6777232071372983
Energy: 1.5772488735197583
Energy: 1.5881175127029814
Energy: 1.5978073402244748
Energy: 1.5772488735197583
Energy: 1.5881175127029814
Energy: 1.5978073402244748
Energy: 1.5772488735197583
Energy: 1.5881175127029814
Energy: 1.5978073402244748
Energy: 1.5772488735197583
Energy: 1.662834198930912
Energy: 1.686083781497838
Energy: 1.634179000119676
Energy: 1.662834198930912
Energy: 1.6860837814925071
Energy: 1.634179000119676
Energy: 1.662834198930912
Energy: 1.6860837814951724
Energy: 1.634179000119676
Energy: 1.662834198930912
Energy: 1.6209882579316486
Energy: 1.942390425550489
Energy: 1.942310758407825
Energy: 1.6209882579316486
Energy: 1.942390425550489
Energy: 1.942310758407825
Energy: 1.6209882579316486
Energy: 1.942390425550489
Energy: 1.942310758407825
Energy: 1.6209882579316486
Energy: 1.6626986624870412
Energy: 1.6342173610321757
Energy: 1.6867924270291235
Energy: 1.6626986624870412
Energy: 1.6342173610321757
Energy: 1.6867924270291235
Energy: 1.6626986624870412
Energy: 1.6342173610321757
Energy: 1.6867924270291235
Energy: 1.6626986624870412
Energy: 1.5776706918855843
Energy: 1.5976660054220297
Energy: 1.5884144198425758
Energy: 1.5776706918855843
Energy: 1.5976660054220297
Energy: 1.5884144198425758
Energy: 1.5776706918855843
Energy: 1.5976660054220297
Energy: 1.588414419845241
Energy: 1.57767069188825
Energy: 1.6777151218685318
Energy: 1.596947835614454
Energy: 1.923859352389576
Energy: 1.6777151218685318
Energy: 1.596947835614454
Energy: 1.923859352389576
Energy: 1.6777151218685318
Energy: 1.596947835614454
Energy: 1.9238593523869107
Energy: 1.6777151218685318
Energy: 1.7860474552949646
Energy: 1.5963218955073848
Energy: 1.6536813233125802
Energy: 1.7860474552949646
Energy: 1.5963218955073848
Energy: 1.6536813233125802
Energy: 1.7860474552949646
Energy: 1.5963218955073848
Energy: 1.6536813233125802
Energy: 1.7860474552949646
Energy: 1.7506014349184011
Energy: 1.7089268273853995
Energy: 1.6537545301493988
Energy: 1.7506014349210666
Energy: 1.7089268273853995
Energy: 1.6537545301493988
Energy: 1.7506014349237322
Energy: 1.7089268273853995
Energy: 1.6537545301467333
Energy: 1.7506014349210666
Energy: 1.6349756745938486
Energy: 1.601709017125364
Energy: 1.6320161510315228
Energy: 1.6349756745938486
Energy: 1.601709017125364
Energy: 1.6320161510315228
Energy: 1.6349756745938486
Energy: 1.601709017125364
Energy: 1.6320161510315228
Energy: 1.6349756745911834
Energy: 1.7059219073092728
Energy: 1.5758915230509598
Energy: 1.5762408084564472
Energy: 1.7059219073092728
Energy: 1.5758915230509598
Energy: 1.5762408084564472
Energy: 1.7059219073092728
Energy: 1.5758915230536252
Energy: 1.5762408084564472
Energy: 1.7059219073066074
Energy: 1.6340496583181505
Energy: 1.6367779615506295
Energy: 1.601374755188417
Energy: 1.6340496583181505
Energy: 1.6367779615559603
Energy: 1.601374755188417
Energy: 1.6340496583181505
Energy: 1.6367779615506295
Energy: 1.601374755188417
Energy: 1.6340496583181505
Energy: 1.7019287020095653
Energy: 1.6535215231532514
Energy: 1.7091996474653268
Energy: 1.7019287020095653
Energy: 1.6535215231532514
Energy: 1.7091996474679922
Energy: 1.7019287020068998
Energy: 1.6535215231532514
Energy: 1.7091996474653268
Energy: 1.7019287020095653
Energy: 1.7861994727496102
Energy: 1.65379972539765
Energy: 1.5959789829647975
Energy: 1.7861994727496102
Energy: 1.65379972539765
Energy: 1.5959789829674629
Energy: 1.7861994727496102
Energy: 1.65379972539765
Energy: 1.5959789829647975
Energy: 1.7861994727496102
Energy: 1.6777232071372983
Energy: 1.922410363987638
Energy: 1.5970400323217062
Energy: 1.6777232071372983
Energy: 1.922410363987638
Energy: 1.5970400323243714
Energy: 1.6777232071372983
Energy: 1.922410363987638
Energy: 1.5970400323217062
Energy: 1.6777232071372983

minimum gb energy = 1.5758915230509598 eV
minimum distance =  2.20835009787644 Angstroms
sigma value = 293


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

Energy: 1.4839504848712155
Energy: 1.4845717045954439
Energy: 1.4845151771310714
Energy: 1.4839504848712155
Energy: 1.4845717045949622
Energy: 1.4845151771310714
Energy: 1.4839504848712155
Energy: 1.4845717045954439
Energy: 1.4845151771310714
Energy: 1.4839504848712155
Energy: 1.4821576270851111
Energy: 1.4844187368298014
Energy: 1.4845999770106828
Energy: 1.4821576270851111
Energy: 1.4844187368302835
Energy: 1.4845999770102012
Energy: 1.4821576270851111
Energy: 1.4844187368298014
Energy: 1.4845999770111646
Energy: 1.482157627085593
Energy: 1.4814037068969819
Energy: 1.481638381675623
Energy: 1.7330180733369218
Energy: 1.4814037068965
Energy: 1.481638381675623
Energy: 1.7330180732411002
Energy: 1.4814037068974635
Energy: 1.481638381675141
Energy: 1.7330180743471664
Energy: 1.4814037068969819
Energy: 1.7329850179249975
Energy: 1.4815335030853842
Energy: 1.4814111216993378
Energy: 1.7329850176264523
Energy: 1.4815335030849026
Energy: 1.4814111216998196
Energy: 1.732985019217408
Energy: 1.4815335030849026
Energy: 1.4814111216998196
Energy: 1.7329850163263343
Energy: 1.4847060902716793
Energy: 1.4844584171116881
Energy: 1.4820789682062405
Energy: 1.4847060902716793
Energy: 1.4844584171112063
Energy: 1.4820789682067221
Energy: 1.4847060902716793
Energy: 1.4844584171112063
Energy: 1.4820789682062405
Energy: 1.4847060902711977
Energy: 1.4845717045959257
Energy: 1.4845151771305898
Energy: 1.4839504848712155
Energy: 1.4845717045954439
Energy: 1.4845151771320348
Energy: 1.4839504848707337
Energy: 1.4845717045954439
Energy: 1.4845151771315532
Energy: 1.4839504848707337
Energy: 1.4845717045949622
Energy: 1.4844187368302835
Energy: 1.4845999770111646
Energy: 1.482157627085593
Energy: 1.4844187368298014
Energy: 1.4845999770106828
Energy: 1.482157627085593
Energy: 1.4844187368298014
Energy: 1.4845999770102012
Energy: 1.4821576270851111
Energy: 1.4844187368298014
Energy: 1.481638381675623
Energy: 1.7330180794363583
Energy: 1.4814037068974635
Energy: 1.481638381675141
Energy: 1.7330180746967754
Energy: 1.4814037068974635
Energy: 1.481638381675141
Energy: 1.733018075358856
Energy: 1.4814037068969819
Energy: 1.481638381675623
Energy: 1.4815335030853842
Energy: 1.4814111216998196
Energy: 1.732985024242091
Energy: 1.4815335030853842
Energy: 1.4814111216993378
Energy: 1.7329850262033264
Energy: 1.4815335030849026
Energy: 1.4814111217003012
Energy: 1.7329850295720635
Energy: 1.4815335030849026
Energy: 1.4844584171112063
Energy: 1.4820789682067221
Energy: 1.4847060902721612
Energy: 1.4844584171112063
Energy: 1.4820789682062405
Energy: 1.4847060902716793
Energy: 1.4844584171116881
Energy: 1.4820789682081674
Energy: 1.4847060902716793
Energy: 1.4844584171112063
Energy: 1.4845151771315532
Energy: 1.4839504848712155
Energy: 1.4845717045954439
Energy: 1.4845151771305898
Energy: 1.4839504848712155
Energy: 1.4845717045949622
Energy: 1.4845151771315532
Energy: 1.4839504848712155
Energy: 1.4845717045954439
Energy: 1.4845151771310714
Energy: 1.4845999770102012
Energy: 1.4821576270851111
Energy: 1.4844187368298014
Energy: 1.4845999770102012
Energy: 1.4821576270851111
Energy: 1.4844187368298014
Energy: 1.4845999770102012
Energy: 1.4821576270851111
Energy: 1.4844187368302835
Energy: 1.4845999770116465
Energy: 1.7330180809888187
Energy: 1.4814037068969819
Energy: 1.481638381675623
Energy: 1.733018082649582
Energy: 1.4814037068969819
Energy: 1.481638381675623
Energy: 1.7330180769791534
Energy: 1.4814037068979453
Energy: 1.4816383816761047
Energy: 1.733018080050309
Energy: 1.4814111217003012
Energy: 1.7329850396459545
Energy: 1.4815335030844208
Energy: 1.4814111216993378
Energy: 1.7329850386357537
Energy: 1.4815335030853842
Energy: 1.4814111216998196
Energy: 1.732985042544736
Energy: 1.4815335030849026
Energy: 1.4814111216998196
Energy: 1.4820789682067221
Energy: 1.484706090270716
Energy: 1.4844584171116881
Energy: 1.4820789682067221
Energy: 1.4847060902721612
Energy: 1.4844584171112063
Energy: 1.4820789682062405
Energy: 1.4847060902711977
Energy: 1.4844584171116881
Energy: 1.482078968207204
Energy: 1.4839504848712155
Energy: 1.4845717045954439
Energy: 1.4845151771315532
Energy: 1.4839504848712155
Energy: 1.4845717045959257
Energy: 1.4845151771310714
Energy: 1.4839504848712155
Energy: 1.4845717045959257
Energy: 1.4845151771315532
Energy: 1.4839504848716971
Energy: 1.4821576270851111
Energy: 1.4844187368302835
Energy: 1.4845999770106828
Energy: 1.482157627085593
Energy: 1.4844187368298014
Energy: 1.4845999770106828
Energy: 1.482157627085593
Energy: 1.4844187368298014
Energy: 1.484599977012128
Energy: 1.482157627085593
Energy: 1.4814037068969819
Energy: 1.481638381675141
Energy: 1.7330180921081206
Energy: 1.4814037068974635
Energy: 1.4816383816761047
Energy: 1.7330180881533739
Energy: 1.4814037068979453
Energy: 1.481638381675623
Energy: 1.733018089885872
Energy: 1.4814037068974635
Energy: 1.7329850539419125
Energy: 1.4815335030853842
Energy: 1.4814111216998196
Energy: 1.7329850548514738
Energy: 1.4815335030849026
Energy: 1.4814111216998196
Energy: 1.7329850553744204
Energy: 1.4815335030853842
Energy: 1.4814111217003012
Energy: 1.7329850534815476
Energy: 1.4847060902716793
Energy: 1.4844584171107247
Energy: 1.4820789682067221
Energy: 1.4847060902716793
Energy: 1.4844584171112063
Energy: 1.482078968207204
Energy: 1.4847060902721612
Energy: 1.4844584171107247
Energy: 1.4820789682062405
Energy: 1.4847060902711977
Energy: 1.4845717045949622
Energy: 1.4845151771305898
Energy: 1.4839504848712155
Energy: 1.4845717045959257
Energy: 1.4845151771320348
Energy: 1.4839504848712155
Energy: 1.4845717045959257
Energy: 1.4845151771310714
Energy: 1.4839504848707337
Energy: 1.4845717045944804
Energy: 1.4844187368298014
Energy: 1.4845999770111646
Energy: 1.482157627085593
Energy: 1.4844187368302835
Energy: 1.4845999770116465
Energy: 1.482157627085593
Energy: 1.4844187368302835
Energy: 1.4845999770106828
Energy: 1.482157627085593
Energy: 1.4844187368293198

minimum gb energy = 1.4814037068965 eV
minimum distance =  2.29077542630256 Angstroms
sigma value = 15


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

Energy: 1.5771050669061268
Energy: 1.7006290917050992
Energy: 1.6539745738393898
Energy: 1.556724102569597
Energy: 1.7006290917029157
Energy: 1.653974573830655
Energy: 1.5771050669061268
Energy: 1.7006290917029157
Energy: 1.6539745737892044
Energy: 1.556724102569597
Energy: 1.5658077530012433
Energy: 1.6268152586047302
Energy: 1.7297814100276485
Energy: 1.5658077530012433
Energy: 1.6268152586047302
Energy: 1.729781410032016
Energy: 1.5658077530034271
Energy: 1.626815258606914
Energy: 1.7297814100298323
Energy: 1.5658077530034271
Energy: 1.7155217421675957
Energy: 1.5620726074635107
Energy: 1.7895625379569897
Energy: 1.7155217421697795
Energy: 1.5620726074656943
Energy: 1.789562537954806
Energy: 1.715521742165412
Energy: 1.5620726074656943
Energy: 1.7895625379591733
Energy: 1.7155217421675957
Energy: 1.539343563787859
Energy: 1.5628923275531983
Energy: 1.5399408150898939
Energy: 1.539343563785675
Energy: 1.5628923275510147
Energy: 1.5399408150877103
Energy: 1.539343563787859
Energy: 1.5628923275531983
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Energy: 1.539343563787859
Energy: 1.7354229679477156
Energy: 1.575963556023863
Energy: 1.6944136026543746
Energy: 1.7354229679477156
Energy: 1.5759635560260465
Energy: 1.6944136026521908
Energy: 1.7354229679477156
Energy: 1.575963556023863
Energy: 1.6944136026565582
Energy: 1.7354229679477156
Energy: 1.6231824409022455
Energy: 1.6925399647132364
Energy: 1.537347549307517
Energy: 1.6231824409022455
Energy: 1.6925399647132364
Energy: 1.537347549307517
Energy: 1.6231824409022455
Energy: 1.6925399647110526
Energy: 1.537347549307517
Energy: 1.623182440900062
Energy: 1.5638083320558143
Energy: 1.6939452966934516
Energy: 1.6157924662361087
Energy: 1.5637708671548687
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Energy: 1.6157924662361087
Energy: 1.5638083320558143
Energy: 1.6939452966956354
Energy: 1.615792466233925
Energy: 1.5637708671548687
Energy: 1.5819320377979254
Energy: 1.7708503160041815
Energy: 1.7830671104339193
Energy: 1.5819320377979254
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Energy: 1.783067110436103
Energy: 1.5819320377979254
Energy: 1.770850316006365
Energy: 1.783067110438247
Energy: 1.5819320377979254
Energy: 1.7787519145060886
Energy: 1.5571474483494143
Energy: 1.556040030832478
Energy: 1.778751914503905
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Energy: 1.556040030832478
Energy: 1.7787519145060886
Energy: 1.5571474483494143
Energy: 1.5560400308346616
Energy: 1.778751914503905
Energy: 1.5771414556136778
Energy: 1.7253168568867192
Energy: 1.765043500226054
Energy: 1.577142333107159
Energy: 1.7253168569260258
Energy: 1.7650435002282379
Energy: 1.5771414556093104
Energy: 1.7253168565156487
Energy: 1.7650435002282379
Energy: 1.5771423331027914
Energy: 1.5905761052148408
Energy: 1.5659784716012883
Energy: 1.652579096012921
Energy: 1.5905761052126572
Energy: 1.5659784716034721
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Energy: 1.5905761052148408
Energy: 1.5659784716034721
Energy: 1.6525790960107374
Energy: 1.5905761052148408
Energy: 1.6478143697433176
Energy: 1.5389938173063034
Energy: 1.7134171219508443
Energy: 1.6478143697433176
Energy: 1.5389932229460208
Energy: 1.7134171219508443
Energy: 1.6478143697433176
Energy: 1.5389938173063034
Energy: 1.7134171219530279
Energy: 1.6478143697433176
Energy: 1.8875742552387513
Energy: 1.5392653839011996
Energy: 1.7119487016526287
Energy: 1.8875742552387513
Energy: 1.5392653839011996
Energy: 1.7119487016548125
Energy: 1.8875742552409347
Energy: 1.5392653839033834
Energy: 1.711948701656996
Energy: 1.8875742552387513
Energy: 1.5384682941127104
Energy: 1.5382519374286252
Energy: 1.977224011492667
Energy: 1.538468294114894
Energy: 1.5382519374242576
Energy: 1.9772240114904835
Energy: 1.5384682941127104
Energy: 1.538251937422074
Energy: 1.9772240114904835
Energy: 1.5384682941105268
Energy: 1.6552702247031303
Energy: 1.820350147798925
Energy: 1.5552970922216927
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Energy: 1.820350147798925
Energy: 1.5552975379291827
Energy: 1.6552702247031303
Energy: 1.8203501477967414
Energy: 1.555297092219509
Energy: 1.6552702247031303
Energy: 1.5577111997624418
Energy: 1.7818139970154832
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Energy: 1.7818139970154832
Energy: 1.7173595687318832
Energy: 1.5577111997668094
Energy: 1.7818139970176672
Energy: 1.717359568734067
Energy: 1.5577111997624418
Energy: 1.5575639653886955
Energy: 1.7393711758277113
Energy: 1.7611211110302467
Energy: 1.5575639653865119
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Energy: 1.5575639653865119
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Energy: 1.761121111036798
Energy: 1.5575639653865119
Energy: 1.8034598340379098
Energy: 1.6265593016565765
Energy: 1.544548067219683
Energy: 1.8034598340400936
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Energy: 1.544548067219683
Energy: 1.8034598340357262
Energy: 1.6265593016587603
Energy: 1.5445480672240506
Energy: 1.8034598340379098
Energy: 1.5647248237567404
Energy: 1.7127893330970099
Energy: 1.7167793872615627
Energy: 1.5647248237567404
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Energy: 1.7167793872637462
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Energy: 1.7127893330970099
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Energy: 1.5647248237567404
Energy: 1.692563220952283
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Energy: 1.5546721568049058
Energy: 1.6181940894338083
Energy: 1.692563220952283
Energy: 1.5546721568070898
Energy: 1.6181940894338083
Energy: 1.6925632209500994
Energy: 1.6274142031798797
Energy: 1.578170876526573
Energy: 1.722867280495248
Energy: 1.6274142031820633
Energy: 1.5781708765222056
Energy: 1.7228672804974319
Energy: 1.6274142031820633
Energy: 1.5781708765243894
Energy: 1.7228672804974319
Energy: 1.6274142031820633
Energy: 1.73382785736456
Energy: 1.992452538050273
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Energy: 1.992452538050273
Energy: 1.5382294463887114
Energy: 1.7338278573623764
Energy: 1.992452538048089
Energy: 1.5382294463843442
Energy: 1.7338278573623764
Energy: 1.5609337395962675
Energy: 1.5629128234312981
Energy: 1.6171898613241085
Energy: 1.56094555475928
Energy: 1.562971824605592
Energy: 1.6171898613241085
Energy: 1.560933739598451
Energy: 1.5629128234312981
Energy: 1.6171898613262923
Energy: 1.56094555475928
Energy: 1.5414633382147542
Energy: 1.5887584640620134
Energy: 1.5650737327412272
Energy: 1.5414633382169378
Energy: 1.5887584640598296
Energy: 1.5650737327412272
Energy: 1.5414633382147542
Energy: 1.588758464057646
Energy: 1.565073732743411
Energy: 1.5414633382125704
Energy: 1.7245832013955862
Energy: 1.579747719626345
Energy: 1.5795154865779633
Energy: 1.7245832013934026
Energy: 1.579747719626345
Energy: 1.5795154865757794
Energy: 1.7245832013955862
Energy: 1.5797477196241612
Energy: 1.5795154865757794
Energy: 1.7245832013955862
Energy: 1.5773877980714741
Energy: 1.7609242856041563
Energy: 1.6511449350107543
Energy: 1.5773837899018368
Energy: 1.7609242856063398
Energy: 1.6511449350107543
Energy: 1.5773877980714741
Energy: 1.7609242856063398
Energy: 1.6511449350107543
Energy: 1.5773837899040206
Energy: 1.631203249842904
Energy: 1.570115592583477
Energy: 1.6504218283881498
Energy: 1.631203249842904
Energy: 1.57011559257911
Energy: 1.6504218283838221
Energy: 1.631203249842904
Energy: 1.5701155925812935
Energy: 1.6504218283838221
Energy: 1.6312032498450881
Energy: 1.71161725659729
Energy: 1.770318480070164
Energy: 1.7137666907281484
Energy: 1.7116172565951062
Energy: 1.770318480070164
Energy: 1.713766690730332
Energy: 1.7116172565951062
Energy: 1.7703184800723475
Energy: 1.7137666907325158
Energy: 1.71161725659729
Energy: 1.8255790216481358
Energy: 1.5394485023309665
Energy: 1.72770613253777
Energy: 1.8989107232273421
Energy: 1.5394486944485664
Energy: 1.72770613253777
Energy: 1.8255790216437684
Energy: 1.539448502328783
Energy: 1.7277061325355865
Energy: 1.8989107232295261
Energy: 1.7264201309847111
Energy: 1.5379651838586414
Energy: 1.7180709818205944
Energy: 1.7264201309847111
Energy: 1.5379651838564576
Energy: 1.7180709818227387
Energy: 1.7264201309803437
Energy: 1.5379651838586414
Energy: 1.7180709818227387
Energy: 1.7264201309847111
Energy: 1.8219462587983069
Energy: 1.715070122970079
Energy: 1.5531721285245246
Energy: 1.8219462587939395
Energy: 1.715070122970079
Energy: 1.552874075470874
Energy: 1.821946258796123
Energy: 1.715070122970079
Energy: 1.5531721285267084
Energy: 1.8219462587939395
Energy: 1.5624271979653
Energy: 1.7806811273284564
Energy: 1.7039050726279072
Energy: 1.5624271979631161
Energy: 1.7806811273284564
Energy: 1.7039050726279072
Energy: 1.5624271979631161
Energy: 1.7806811273284564
Energy: 1.7039050726235396
Energy: 1.5624271979653
Energy: 1.5784362363978441
Energy: 1.6889758068496354
Energy: 1.6744348824145756
Energy: 1.5567010183087768
Energy: 1.6889758068496354
Energy: 1.6744348824123918
Energy: 1.5784362363978441
Energy: 1.6889758068496354
Energy: 1.6744348824123918
Energy: 1.5567010183131442
Energy: 1.5768768750521074
Energy: 1.7757665011500412
Energy: 1.6956155204877714
Energy: 1.557336901466171
Energy: 1.7757665011500412
Energy: 1.684655308246156
Energy: 1.5768768750521074
Energy: 1.7757665011522248
Energy: 1.6956155204899552
Energy: 1.557336901466171
Energy: 1.5691683456315169
Energy: 1.849369148057155
Energy: 1.7554617681636953
Energy: 1.5691683456271497
Energy: 1.8493691480593386
Energy: 1.7554617681680627
Energy: 1.5691683456271497
Energy: 1.8493691480615224
Energy: 1.7554617681702465
Energy: 1.5691683456293333
Energy: 1.8309802692311536
Energy: 1.5537489194833312
Energy: 1.618531961937149
Energy: 1.8309802692311536
Energy: 1.5537489194833312
Energy: 1.6185319619284142
Energy: 1.8309802692311536
Energy: 1.5537489194833312
Energy: 1.6185319619305978
Energy: 1.8309802692333372
Energy: 1.7376735640406187
Energy: 1.7015789309251816
Energy: 1.5445157114536878
Energy: 1.7376735640406187
Energy: 1.7015789309229978
Energy: 1.5439107454486025
Energy: 1.7376735640428023
Energy: 1.7015789309229978
Energy: 1.5445157114558716
Energy: 1.7376735640428023
Energy: 1.9013000591732316
Energy: 1.7155262243497529
Energy: 1.5388313562274285
Energy: 1.9013000591754157
Energy: 1.7155262243497529
Energy: 1.5388313562274285
Energy: 1.9013000591754157
Energy: 1.7155262243475693
Energy: 1.5388313562252447
Energy: 1.9013000591732316
Energy: 1.6944928282832958
Energy: 1.6930823928490912
Energy: 1.742809212609412
Energy: 1.6944928282832958
Energy: 1.6930823928469074
Energy: 1.7428092126115955
Energy: 1.6944928282854397
Energy: 1.6930823928469074
Energy: 1.7428092126115955
Energy: 1.6944928282832958
Energy: 1.8479713275124068
Energy: 1.8203816860602813
Energy: 1.565806531771783
Energy: 1.8479713275124068
Energy: 1.8203816860602813
Energy: 1.565806531773967
Energy: 1.8479713275124068
Energy: 1.8203816860602813
Energy: 1.565806531771783
Energy: 1.8479713275124068
Energy: 1.5793385464162746
Energy: 1.7311444962308575
Energy: 1.5903671629290446
Energy: 1.5793385464097236
Energy: 1.7311444962330411
Energy: 1.5903671629268608
Energy: 1.5793385464119072
Energy: 1.7311444962308575
Energy: 1.5903671629268608
Energy: 1.579338546414091
Energy: 1.711730848078752
Energy: 1.559621329155911
Energy: 1.5595613874857444
Energy: 1.711730848080936
Energy: 1.5596213291537273
Energy: 1.5595613874879282
Energy: 1.711730848080936
Energy: 1.559621329155911
Energy: 1.5595613874857444
Energy: 1.711730848078752
Energy: 1.7817121376477
Energy: 1.5635490821416898
Energy: 1.8612307396494177
Energy: 1.7817121376477
Energy: 1.5635490821438738
Energy: 1.8612307396516012
Energy: 1.7817121376455163
Energy: 1.5635490821438738
Energy: 1.8612307396516012
Energy: 1.7817121376455163
Energy: 1.5634920803149701
Energy: 1.9737438317996778
Energy: 1.561810219828845
Energy: 1.5634920803149701
Energy: 1.9737438317974938
Energy: 1.5618102198244774
Energy: 1.563492080312826
Energy: 1.9737438318018612
Energy: 1.5618102198222936
Energy: 1.5634920803171537
Energy: 1.6168860291544487
Energy: 1.538992604551633
Energy: 1.8295845099958568
Energy: 1.616886029152265
Energy: 1.5389930946078532
Energy: 1.8295845099958568
Energy: 1.6168860291544487
Energy: 1.5389926045538167
Energy: 1.8295845100002242
Energy: 1.6168860291566327
Energy: 1.5618531171237864
Energy: 1.5482993213361749
Energy: 1.711115030617733
Energy: 1.56185311733771
Energy: 1.5482993213361749
Energy: 1.7111150306155494
Energy: 1.5618531172372991
Energy: 1.5482993213361749
Energy: 1.7111150306133656
Energy: 1.56185311727875
Energy: 1.6740424110891365
Energy: 1.6254224260960952
Energy: 1.5551204068801923
Energy: 1.6740424110891365
Energy: 1.6254224260960952
Energy: 1.5551204806347367
Energy: 1.6740424110891365
Energy: 1.6254224261004628
Energy: 1.5551204068801923
Energy: 1.6740424110913201
Energy: 1.5651500474936315
Energy: 1.6955712558408924
Energy: 1.6916349332585505
Energy: 1.565150047491448
Energy: 1.6955712558408924
Energy: 1.691634933256367
Energy: 1.565150047491448
Energy: 1.6955712558430762
Energy: 1.691634933260734
Energy: 1.565150047491448
Energy: 1.5573338526970744
Energy: 1.6904219003317182
Energy: 1.769576104335995
Energy: 1.557333852701442
Energy: 1.6904219003339018
Energy: 1.769576104335995
Energy: 1.5573338526970744
Energy: 1.6904219003339018
Energy: 1.769576104335995
Energy: 1.5573338526970744

minimum gb energy = 1.537347549307517 eV
minimum distance =  2.21889458543344 Angstroms
sigma value = 437


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

Energy: 1.5306532140437252
Energy: 1.5293125252489579
Energy: 1.5294639713985647
Energy: 1.5306532140453164
Energy: 1.5293125252489579
Energy: 1.5294639713993603
Energy: 1.5306532140437252
Energy: 1.5293125252489579
Energy: 1.5294639713985647
Energy: 1.5306532140453164
Energy: 1.6871247735604966
Energy: 1.501075161354442
Energy: 1.7185132969276105
Energy: 1.6871247735573145
Energy: 1.5010751613528508
Energy: 1.718513296928406
Energy: 1.6871247735581103
Energy: 1.501075161354442
Energy: 1.7185132969276105
Energy: 1.6871247735589057
Energy: 1.660014342753173
Energy: 1.48583076314667
Energy: 1.8562202931584881
Energy: 1.660014342754764
Energy: 1.4858307631434877
Energy: 1.856219208979319
Energy: 1.660014342753173
Energy: 1.48583076314667
Energy: 1.8562254066319686
Energy: 1.660014342754764
Energy: 1.6181238413664811
Energy: 1.7635939127524096
Energy: 1.6215387120663767
Energy: 1.6181238413656855
Energy: 1.7635939127516143
Energy: 1.6215387120830833
Energy: 1.6181238413656855
Energy: 1.7635939127524096
Energy: 1.6215387120735365
Energy: 1.6181238413656855
Energy: 1.6809270230636
Energy: 1.5356442700142678
Energy: 1.8704096707631244
Energy: 1.6809270230636
Energy: 1.5356442700134723
Energy: 1.8704096708760218
Energy: 1.6809270230628044
Energy: 1.5356442700142678
Energy: 1.870409670755169
Energy: 1.6809270230636
Energy: 1.7009901660054252
Energy: 1.7244715208091403
Energy: 1.5016497919825722
Energy: 1.7009901660054252
Energy: 1.7244715208091403
Energy: 1.5016497919825722
Energy: 1.7009901660054252
Energy: 1.7244715208091403
Energy: 1.501649791983368
Energy: 1.7009901660054252
Energy: 1.6227177255831473
Energy: 1.5613935275527646
Energy: 1.4857967741116243
Energy: 1.622717725583943
Energy: 1.5613935275535602
Energy: 1.48579677411242
Energy: 1.622717725583943
Energy: 1.6224070540211337
Energy: 1.4857967741116243
Energy: 1.6227177255831473
Energy: 1.6182178043101463
Energy: 1.7760166628798306
Energy: 1.6167757826233369
Energy: 1.6182178043101463
Energy: 1.7760166628806262
Energy: 1.616775782622541
Energy: 1.6182178043101463
Energy: 1.7760166628798306
Energy: 1.6167757826233369
Energy: 1.6182178043101463
Energy: 1.8989807120487807
Energy: 1.7186543810038502
Energy: 1.5339606969232318
Energy: 1.8989807120487807
Energy: 1.7186543810038502
Energy: 1.5339606969232318
Energy: 1.8989807120495763
Energy: 1.7186543810038502
Energy: 1.5339606969232318
Energy: 1.8989807120495763
Energy: 1.619100436627067
Energy: 1.681458321406713
Energy: 1.7318791106058018
Energy: 1.619100436627067
Energy: 1.6814583214194418
Energy: 1.7318791106050064
Energy: 1.619100436627067
Energy: 1.681458321409895
Energy: 1.7318791106058018
Energy: 1.619100436627067
Energy: 1.60716456541301
Energy: 1.6070318249906836
Energy: 1.765580166987811
Energy: 1.6071645654122144
Energy: 1.6070318249922746
Energy: 1.7655801669870155
Energy: 1.6071645654138056
Energy: 1.6070318249914792
Energy: 1.7655801669870155
Energy: 1.60716456541301
Energy: 1.680862825685914
Energy: 1.5068810414912137
Energy: 1.6876503534160774
Energy: 1.6808628256867095
Energy: 1.5068810414904181
Energy: 1.6876503534152818
Energy: 1.6808628256875051
Energy: 1.5068810414904181
Energy: 1.6876503534160774
Energy: 1.680862825685914
Energy: 1.4988448065177142
Energy: 1.629536194320666
Energy: 1.499120881250868
Energy: 1.4988448065193052
Energy: 1.6295361943182791
Energy: 1.4991208812532546
Energy: 1.4988448065169186
Energy: 1.6295361943190747
Energy: 1.4991208812516637
Energy: 1.4988448065177142
Energy: 1.5235405825987813
Energy: 1.5890954546452836
Energy: 1.6205888950224607
Energy: 1.523540582599577
Energy: 1.5890954546460792
Energy: 1.620588895018483
Energy: 1.5235405825979857
Energy: 1.5890954546452836
Energy: 1.6205888950247753
Energy: 1.5235405825987813

minimum gb energy = 1.4857967741116243 eV
minimum distance =  2.22803350385216 Angstroms
sigma value = 33