Model name: model_name=MEAM_LAMMPS_KangSaLee_2009_ZrAgCu__MO_813575892799_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.6133156493306164
cohesive_energy=3.540278409752503
mass=63.546
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: 0.015500081924802223
Energy: 0.3224304434430929
Energy: 0.3224304434430929
Energy: 0.015500081924802223
Energy: 0.3224304434430929
Energy: 0.3224304434430929
Energy: 0.015500081924802223
Energy: 0.3224304434430929
Energy: 0.32243044344450683
Energy: 0.015500081924802223
Energy: 0.31933247086694183
Energy: 0.01833857254618957
Energy: 0.3193912903728551
Energy: 0.31933247086694183
Energy: 0.018338572547636434
Energy: 0.3193912903728551
Energy: 0.31933247086694183
Energy: 0.01833857254618957
Energy: 0.3193912903728551
Energy: 0.31933247086549493
Energy: 0.7100913467838321
Energy: 0.4866379314049844
Energy: 0.6582638846636542
Energy: 1.3775223325818633
Energy: 0.17658416152356154
Energy: 0.7289365099868248
Energy: 0.8607720339888928
Energy: 0.01592065093016556
Energy: 0.7289365099868248
Energy: 0.8607755477145823
Energy: 0.31933247086694183
Energy: 0.3193912903728551
Energy: 0.01833857254618957
Energy: 0.31933247086694183
Energy: 0.3193912903728551
Energy: 0.01833857254618957
Energy: 0.31933247086694183
Energy: 0.3193912903728551
Energy: 0.018338572547636434
Energy: 0.31933247086694183
Energy: 0.015500081924802223
Energy: 0.32243044344450683
Energy: 0.32243044344450683
Energy: 0.015500081924802223
Energy: 0.32243044344450683
Energy: 0.32243044344450683
Energy: 0.015500081924802223
Energy: 0.32243044344450683
Energy: 0.32243044344450683
Energy: 0.015500081924802223
Energy: 0.31933247086694183
Energy: 0.01833857254618957
Energy: 0.3193912903728551
Energy: 0.31933247086694183
Energy: 0.01833857254618957
Energy: 0.3193912903728551
Energy: 0.31933247086694183
Energy: 0.01833857254618957
Energy: 0.3193912903728551
Energy: 0.31933247086549493
Energy: 0.8607015961596461
Energy: 0.7076897987722118
Energy: 0.4898337218103207
Energy: 0.8606777761961206
Energy: 0.33334858095870246
Energy: 0.7289365099882716
Energy: 0.8607535893612084
Energy: 0.01592065093016556
Energy: 0.7289365099868248
Energy: 0.8607743096521814

minimum gb energy = 0.015500081924802223 eV
minimum distance =  2.31382826538696 Angstroms
sigma value = 3


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

Energy: 0.8974620679054235
Energy: 1.2022300200517513
Energy: 1.0696315465883104
Energy: 0.8751928096154633
Energy: 1.2022300200500118
Energy: 1.0696315465843798
Energy: 0.8974620679064546
Energy: 1.2022300200507205
Energy: 1.0696315465812223
Energy: 0.8751928096154633
Energy: 1.199630810068094
Energy: 0.8593965973668941
Energy: 1.050073176813325
Energy: 1.1996308100684807
Energy: 0.8593965973657987
Energy: 1.0500731768147424
Energy: 1.1996308100695117
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Energy: 1.1996308100698982
Energy: 1.05403995619933
Energy: 1.1014483379815365
Energy: 1.1560442155673454
Energy: 1.0706477591006738
Energy: 1.1014483379808278
Energy: 1.156044215567732
Energy: 1.0540399562007479
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Energy: 1.1560442155656054
Energy: 1.0706477590995784
Energy: 1.0687179820591275
Energy: 1.2064200260744642
Energy: 0.8328221456769257
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Energy: 1.2064200260723377
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Energy: 0.9743720619154383
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Energy: 1.0473342148582339
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Energy: 1.047334214858556
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Energy: 1.0688509374603248
Energy: 1.1461542880099966
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Energy: 1.238972110209897
Energy: 0.8959214741807255
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Energy: 1.0366151331908908
Energy: 1.068755141170035
Energy: 0.8330725132475515
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Energy: 1.0650852974845164
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Energy: 1.0687551411686176
Energy: 1.0572713535168277
Energy: 1.2374293882171712
Energy: 0.8591284358655701
Energy: 1.0572713535168277
Energy: 1.2374293882164622
Energy: 0.8578525044655883
Energy: 1.057271353517923
Energy: 1.2374293882207152
Energy: 0.8591284358659568
Energy: 1.0572713535165055
Energy: 1.0131446627101885
Energy: 0.9858396028211922
Energy: 1.1327044261490269
Energy: 1.0131446627127016
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Energy: 1.013144662711606
Energy: 0.8937179019146823
Energy: 1.1676644840325612
Energy: 1.0678499362368215
Energy: 0.8731608682496752
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Energy: 1.0678499362375302
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Energy: 1.0678499362368215
Energy: 0.8731608682486443
Energy: 1.0467808848173557
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Energy: 1.0489301256201669
Energy: 1.0467808848155513
Energy: 0.8546698786692783
Energy: 1.0489301256212624
Energy: 1.0467808848166469
Energy: 1.0703881923338825
Energy: 1.3001451404618762
Energy: 1.0744807500775702
Energy: 1.0703881923342693
Energy: 1.3001451404614897
Energy: 1.0744807500793745
Energy: 1.0703881923353002
Energy: 1.3001451404629072
Energy: 1.074480750076539
Energy: 1.0703881923356868
Energy: 1.1228094349983242
Energy: 1.1025338152793946
Energy: 0.8393092414848209
Energy: 1.122809435000064
Energy: 1.0834807649567388
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Energy: 1.1228094349986464
Energy: 1.10253381528049
Energy: 0.8393092414826944
Energy: 1.1228094349979374
Energy: 0.7958237550097781
Energy: 1.1994731631224647
Energy: 1.0824069671127632
Energy: 0.7958237550111957
Energy: 1.1995631246892604
Energy: 1.0825421174334877
Energy: 0.7958237550097781
Energy: 1.1994731631224647
Energy: 1.0824069671120542
Energy: 0.7958237550104869
Energy: 1.0793154015155828
Energy: 0.8330952298431927
Energy: 1.0778772854718601
Energy: 1.0793154015145519
Energy: 0.8330952298420974
Energy: 1.0778772854718601
Energy: 1.0793154015162918
Energy: 0.8330952298420974
Energy: 1.0778772854707648
Energy: 1.0793154015177093
Energy: 0.8688197126208368
Energy: 1.3752962467979821
Energy: 1.0286444960683323
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Energy: 1.3752962467997218
Energy: 1.0286444960687187
Energy: 0.868819712620128
Energy: 1.3752962468001084
Energy: 1.0286444960694274
Energy: 0.8688197126208368
Energy: 0.9320392014958271
Energy: 1.0490876898535582
Energy: 0.8581917236687799
Energy: 0.9320392014962138
Energy: 1.0490876898525272
Energy: 0.8582292020128034
Energy: 0.9320392014958271
Energy: 1.0490876898528494
Energy: 0.8581917236698754
Energy: 0.9320392014951183
Energy: 0.8374737259814841
Energy: 1.2022300200535556
Energy: 1.0696315465836708
Energy: 0.8374737259811619
Energy: 1.2022300200514293
Energy: 1.0696315465808355
Energy: 0.8374737259814841
Energy: 1.2022300200503337
Energy: 1.0696315465780006
Energy: 0.8374737259814841
Energy: 1.199630810110945
Energy: 0.8593965973679251
Energy: 1.0500731768186733
Energy: 1.199630810110236
Energy: 0.8593965973668941
Energy: 1.0500731768186733
Energy: 1.199630810110945
Energy: 0.8593965973657987
Energy: 1.0500731768179643
Energy: 1.1996308101095272
Energy: 1.0342942554963563
Energy: 1.1014483379818587
Energy: 1.1560442155673454
Energy: 1.0436066413697862
Energy: 1.1014483379808278
Energy: 1.1560442155670232
Energy: 1.0342942554949388
Energy: 1.1014483379843718
Energy: 1.1560442155659276
Energy: 1.0436066413704952
Energy: 1.06871798205771
Energy: 1.2064200260737554
Energy: 0.8328221456776345
Energy: 1.0687179820570012
Energy: 1.2064200260737554
Energy: 0.8328221456769257
Energy: 1.0687179820573234
Energy: 1.2064200260723377
Energy: 0.8328221456790522
Energy: 1.0687179820594497

minimum gb energy = 0.7958237550097781 eV
minimum distance =  2.27740635372514 Angstroms
sigma value = 75


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

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Energy: 0.9141829555522502
Energy: 0.92198579720958
Energy: 0.9803951434626396
Energy: 0.9141829555539793
Energy: 0.9219857972113092
Energy: 1.0153177387859922
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Energy: 1.042963890899621
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Energy: 1.0429638909013503
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minimum gb energy = 0.901914451754263 eV
minimum distance =  2.28217711125609 Angstroms
sigma value = 105


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

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Energy: 1.0945981963874438
Energy: 1.0730673626757012
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Energy: 1.0306457702900473
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Energy: 1.0563665127295219
Energy: 1.098045540777257
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Energy: 1.106088036816797
Energy: 1.056366512727358
Energy: 1.0980455407770795
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Energy: 1.047778251415415
Energy: 1.016310228965414
Energy: 1.016644444567567
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Energy: 1.0163102289671873
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Energy: 1.016310228965414
Energy: 1.0166444445667866
Energy: 1.047778251415628
Energy: 1.146200539104608
Energy: 1.0344380562841338
Energy: 1.0495781940599134
Energy: 1.1462005391042176
Energy: 1.0349339530540176
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Energy: 1.1462005391053882
Energy: 1.034438056285127
Energy: 1.0495781940583524
Energy: 1.1462005391049979
Energy: 1.2131942334693826
Energy: 1.1114597630655687
Energy: 1.198472420872836
Energy: 1.2131942334689922
Energy: 1.111460099193825
Energy: 1.198472420871488
Energy: 1.2131942334689922
Energy: 1.1114597630655687
Energy: 1.1984724208730488
Energy: 1.2131942334697727
Energy: 1.0663413369406116
Energy: 1.0472791780042696
Energy: 0.9626594469979509
Energy: 1.0663413369390509
Energy: 1.0472791780024961
Energy: 0.9626594469979509
Energy: 1.0663413369398314
Energy: 1.047279178002886
Energy: 0.9626594469971705
Energy: 1.0663413369403987
Energy: 1.1228170074680535
Energy: 1.0844991434527358
Energy: 1.162934018960761
Energy: 1.1228170074680535
Energy: 1.0842884665326364
Energy: 1.1629340189605482
Energy: 1.1228170074676633
Energy: 1.0844991434546867
Energy: 1.1629340189605482
Energy: 1.1228170074686212
Energy: 1.1968253240989557
Energy: 1.0911892596415473
Energy: 1.1400263755470836
Energy: 1.1968253241007292
Energy: 1.0910732882760585
Energy: 1.1400263755470836
Energy: 1.1968253241016868
Energy: 1.0911892596417245
Energy: 1.1400263755470836
Energy: 1.196825324100126
Energy: 1.0671058151610275
Energy: 1.0297358275305775
Energy: 1.1288751936621428
Energy: 1.0671058151621982
Energy: 1.0297362011551225
Energy: 1.1288751936613626
Energy: 1.067105815162766
Energy: 1.029735827532741
Energy: 1.1288751936627106
Energy: 1.0671058151614177

minimum gb energy = 0.9626594469971705 eV
minimum distance =  2.26302260084137 Angstroms
sigma value = 165


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

Energy: 0.9121845997166337
Energy: 1.0081070196911308
Energy: 1.0089751051861973
Energy: 0.9121845997166337
Energy: 1.0081070196911308
Energy: 1.008975105187537
Energy: 0.9121845997166337
Energy: 1.0081070196904611
Energy: 1.0089751051882068
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Energy: 1.0074765508714028
Energy: 0.9085904596450116
Energy: 1.0321583154686982
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Energy: 0.9085904596443418
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Energy: 0.9085904596456813
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Energy: 1.170799656742553
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Energy: 1.0723603529512915
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Energy: 0.9213761886929902
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Energy: 1.0723603528649222
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Energy: 0.9213761886956693
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Energy: 1.012672207948897
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Energy: 1.0119745031274565
Energy: 1.0906819684459341
Energy: 0.9220476209707186
Energy: 1.146382653292881
Energy: 1.0906819684479436
Energy: 0.9220476209707186
Energy: 1.1463826532915413
Energy: 1.0906819684506226
Energy: 0.9220476209707186
Energy: 1.146382653292881
Energy: 1.0906819684506226
Energy: 0.9833328695957867
Energy: 1.0502934496832461
Energy: 1.170874046329843
Energy: 0.9833328695957867
Energy: 1.0502934496845855
Energy: 1.1708740463285034
Energy: 0.9833328695957867
Energy: 1.0502934496832461
Energy: 1.170874046326494
Energy: 0.9833328695944471
Energy: 1.0081544870634982
Energy: 1.0325043145579984
Energy: 0.9086190381138942
Energy: 1.0081544870568007
Energy: 1.0325043143899786
Energy: 0.9086190381138942
Energy: 1.0081544870400563
Energy: 1.0325043141857915
Energy: 0.908619038114564
Energy: 1.0081544870293402
Energy: 0.9121845997166337
Energy: 1.0081070196924704
Energy: 1.0089751051868672
Energy: 0.9121845997166337
Energy: 1.0081070196938098
Energy: 1.008975105187537
Energy: 0.9121845997173037
Energy: 1.0081070196904611
Energy: 1.008975105187537
Energy: 0.9121845997166337

minimum gb energy = 0.9085904596443418 eV
minimum distance =  2.34572047701938 Angstroms
sigma value = 41


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

Energy: 0.9400370448452623
Energy: 0.9963720020523351
Energy: 1.027891284384914
Energy: 0.8846988178390109
Energy: 0.9963720020523351
Energy: 1.027891284384914
Energy: 0.9400370448478138
Energy: 0.9963720020497364
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Energy: 1.097150253973033
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Energy: 0.8362565574475759
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Energy: 0.9013581853479496
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Energy: 0.8908716324603001
Energy: 1.0898513025071346
Energy: 0.8894962223102885
Energy: 1.017281045687858
Energy: 1.0898513025071346
Energy: 0.8894962223102885
Energy: 1.0172810456904564
Energy: 1.0898513025045358
Energy: 0.8894962223076898
Energy: 1.017281045687858
Energy: 1.0898513025019372
Energy: 0.8743855641175167
Energy: 1.0004129417571015
Energy: 0.9452927229184552
Energy: 0.8743855641201153
Energy: 1.0004129417571015
Energy: 0.9456076059857471
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Energy: 1.0004129417571015
Energy: 0.9452927229210538
Energy: 0.8743855641149181
Energy: 0.9143382569676571
Energy: 0.9884694987403727
Energy: 0.7990828703639404
Energy: 0.9143382569676571
Energy: 0.9884694987377741
Energy: 0.7990135917567034
Energy: 0.9143382569650585
Energy: 0.988469498732577
Energy: 0.799082870366539
Energy: 0.9143382569650585
Energy: 0.8211583811473813
Energy: 1.0941476891776118
Energy: 0.8590874537256328
Energy: 0.8211583811499799
Energy: 1.0941476891776118
Energy: 0.8590874537256328
Energy: 0.8211583811473813
Energy: 1.0941476891776118
Energy: 0.8590874537256328
Energy: 0.8211583811473813
Energy: 0.8305907448059943
Energy: 0.8538289626126866
Energy: 0.817564501968513
Energy: 0.8305907448059943
Energy: 0.8538289626126866
Energy: 0.817564501968513
Energy: 0.8305907448085929
Energy: 0.8538289626126866
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Energy: 0.8305907448059943
Energy: 0.9279452776068742
Energy: 0.9072379666312623
Energy: 0.9462399415584271
Energy: 0.9279452776068742
Energy: 0.9072379666312623
Energy: 0.9462399415558285
Energy: 0.9279452776042757
Energy: 0.9072379666338609
Energy: 0.9462399415558285
Energy: 0.9279452776068742
Energy: 0.9755685515685041
Energy: 0.9385760241812486
Energy: 1.0618364397771853
Energy: 0.9755685515685041
Energy: 0.9385760241812486
Energy: 1.061836439774634
Energy: 0.9755685515659055
Energy: 0.9385760241812486
Energy: 1.0618364397771853
Energy: 0.9755685515659055
Energy: 0.9640082878920904
Energy: 0.87870229349296
Energy: 0.9132890014320822
Energy: 0.964008287894689
Energy: 0.87870229349296
Energy: 0.8855170595342161
Energy: 0.9640082878920904
Energy: 0.8787022934903614
Energy: 0.9132890014294837
Energy: 0.9640082878920904
Energy: 0.8425913548178608
Energy: 0.9766653625917923
Energy: 0.9517640906698952
Energy: 0.8425913548178608
Energy: 0.9390387164124484
Energy: 0.9452539251991957
Energy: 0.8425913548178608
Energy: 0.9766653625917923
Energy: 0.9517640906698952
Energy: 0.8425913548204594
Energy: 0.8107614623810318
Energy: 0.8148632602985459
Energy: 0.8226434697758519
Energy: 0.8107614623836303
Energy: 0.8149829464122532
Energy: 0.8225666068405368
Energy: 0.8107614623810318
Energy: 0.8148632602959472
Energy: 0.8226434697732533
Energy: 0.8107614623836303
Energy: 0.8992287634945257
Energy: 0.8215094156639833
Energy: 0.8105804923092135
Energy: 0.8992287634945257
Energy: 0.8215301341530057
Energy: 0.8105804923092135
Energy: 0.899228763499723
Energy: 0.8215094156639833
Energy: 0.8105804923118122
Energy: 0.8992287634971243
Energy: 1.125328203868689
Energy: 0.8498972504443681
Energy: 0.9875692190114777
Energy: 1.125328203868689
Energy: 0.8490904893847393
Energy: 0.9875692190114777
Energy: 1.125328203868689
Energy: 0.8498972504443681
Energy: 0.9875692190114777
Energy: 1.125328203868689
Energy: 1.045933791943359
Energy: 0.9015183923963802
Energy: 0.8023196501151312
Energy: 1.0459337919511549
Energy: 0.9015183923937814
Energy: 0.8023196501151312
Energy: 1.045933791961549
Energy: 0.9015183923937814
Energy: 0.8023196501177298
Energy: 1.0459337919407603

minimum gb energy = 0.778933062623095 eV
minimum distance =  2.25984415754004 Angstroms
sigma value = 185


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

Energy: 0.9067031254533384
Energy: 0.46945418569939185
Energy: 1.018952226648423
Energy: 0.7291319969738601
Energy: 0.46945418569939185
Energy: 1.018952226648423
Energy: 0.9067031254527215
Energy: 0.4694541856984664
Energy: 1.0189522266493483
Energy: 0.7291319969738601
Energy: 0.7974807105269486
Energy: 0.3830181941415158
Energy: 0.5129714890088183
Energy: 0.7662378211658245
Energy: 0.3830181941405904
Energy: 0.8967777797297791
Energy: 0.7974807105275655
Energy: 0.3830181941396649
Energy: 0.5129714890078929
Energy: 0.7662378211670583
Energy: 0.7291436877486643
Energy: 0.3900517490484828
Energy: 0.7468089461301317
Energy: 0.8016708948336497
Energy: 0.3900517490481743
Energy: 0.6773155350275791
Energy: 0.7291436877480475
Energy: 0.3900517490478658
Energy: 0.7468089461295147
Energy: 0.801670894830565
Energy: 0.6886267006888168
Energy: 0.4094330725510334
Energy: 0.7146026264549321
Energy: 0.6886267006891252
Energy: 0.4094330725510334
Energy: 0.7546309525078455
Energy: 0.6886267006897423
Energy: 0.4094330725507249
Energy: 0.7146026264555491
Energy: 0.6886267006903591
Energy: 0.3900186599010991
Energy: 1.0204421529387722
Energy: 0.7219683815183529
Energy: 0.3900186599004821
Energy: 1.0204421529384637
Energy: 0.7433400112747616
Energy: 0.39001865990017365
Energy: 1.0204421529381555
Energy: 0.7219683815177359
Energy: 0.3900186599004821
Energy: 0.5906896909577588
Energy: 0.5470441035852297
Energy: 0.723059466478844
Energy: 0.5906896909574503
Energy: 0.8422425015478734
Energy: 0.6935292380132962
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Energy: 0.5470441124831407
Energy: 0.7230594664785356
Energy: 0.5906896909568334
Energy: 0.3908047152535059
Energy: 0.6655084543908576
Energy: 0.8573476568385193
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Energy: 0.3908047152526085
Energy: 0.6655084543893152
Energy: 0.8573476568388279
Energy: 0.39080471525137467
Energy: 0.5885487829758858
Energy: 0.7061136960294004
Energy: 0.3832199269008188
Energy: 0.5885487829743434
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Energy: 0.5885487829758858
Energy: 0.5373828427305396
Energy: 0.6883920915723672
Energy: 0.39003511134626606
Energy: 0.5692007204125394
Energy: 0.6483496118435619
Energy: 0.39003511134595764
Energy: 0.5373828427333158
Energy: 0.6883920915708248
Energy: 0.3900351113453407
Energy: 0.5692007204103802
Energy: 0.6976054530139228
Energy: 0.6751581935786676
Energy: 0.38343670219459575
Energy: 0.6983774607223172
Energy: 0.6844634258875397
Energy: 0.38343670219305337
Energy: 0.6976054530129975
Energy: 0.675158193578359
Energy: 0.38343670219428727
Energy: 0.6983774607223172
Energy: 0.6975043015716891
Energy: 0.8535981578204639
Energy: 0.40784645897393884
Energy: 0.6718287232358101
Energy: 0.8535981578207724
Energy: 0.4078464589745558
Energy: 0.6975043015704552
Energy: 0.8535981578210808
Energy: 0.4078464589742473
Energy: 0.6718287232364271
Energy: 0.7329484100387571
Energy: 0.46945418569939185
Energy: 1.018952226648423
Energy: 0.6619577062116397
Energy: 0.46945418569877495
Energy: 1.0189522266487312
Energy: 0.7329484100387571
Energy: 0.469454185698158
Energy: 1.0189522266487312
Energy: 0.6619577062104058
Energy: 0.717913691546156
Energy: 0.3830181941412073
Energy: 0.6644148195783122
Energy: 0.6806055133226858
Energy: 0.38301819414028193
Energy: 0.6538425337505782
Energy: 0.7179136915464646
Energy: 0.38301819413904803
Energy: 0.6644148195773867
Energy: 0.6806055133229943
Energy: 0.6977717550422845
Energy: 0.3900517490484828
Energy: 0.6853108101371509
Energy: 0.6986035011162118
Energy: 0.3900517490481743
Energy: 0.6751789414703167
Energy: 0.6977717550435184
Energy: 0.3900517490481743
Energy: 0.6853108101377677
Energy: 0.6986035011165204
Energy: 0.6886267006928269
Energy: 0.4094330725507249
Energy: 0.6781962287384263
Energy: 0.6886267006885083
Energy: 0.4094330725510334
Energy: 0.6779936835856426
Energy: 0.68862670069221
Energy: 0.40943307255041644
Energy: 0.6781962287381178
Energy: 0.68862670069221
Energy: 0.39001865990140755
Energy: 1.0204421529387722
Energy: 0.706878560310106
Energy: 0.3900186598998652
Energy: 1.0204421529381555
Energy: 0.7060534239312503
Energy: 0.39001865990017365
Energy: 1.0204421529384637
Energy: 0.7068785603097975
Energy: 0.3900186599004821
Energy: 0.5906896909571419
Energy: 0.6555841394416098
Energy: 0.691888726669769
Energy: 0.5906896909568334
Energy: 0.7116480738427602
Energy: 0.6962720184696426
Energy: 0.5906896909574503
Energy: 0.6555841394456199
Energy: 0.691888726669769
Energy: 0.5906896909568334
Energy: 0.3908047152526085
Energy: 0.7547284400245989
Energy: 0.8573476568385193
Energy: 0.39080471525288896
Energy: 0.7332975305129771
Energy: 0.8573476568385193
Energy: 0.3908047152531974
Energy: 0.7547284400245989
Energy: 0.8573476568391364
Energy: 0.3908047152516831
Energy: 0.5885487829755772
Energy: 0.7432888760392338
Energy: 0.38321992690143575
Energy: 0.5885487829755772
Energy: 0.7220028364799315
Energy: 0.3832199269002019
Energy: 0.5885487829743434
Energy: 0.7432888760386169
Energy: 0.3832199269008188
Energy: 0.5885487829749604
Energy: 0.4737834584953368
Energy: 0.7609604778700102
Energy: 0.39003511134626606
Energy: 0.47403936206346764
Energy: 0.7569352499612301
Energy: 0.39003511134595764
Energy: 0.4737834584968792
Energy: 0.7609604778712441
Energy: 0.3900351113453407
Energy: 0.47403936206315916
Energy: 0.7290928591469913
Energy: 0.6772200318128775
Energy: 0.3834367021949042
Energy: 0.8016327171016789
Energy: 0.7443874930755723
Energy: 0.3834367021936703
Energy: 0.7290928591476081
Energy: 0.6772200318131859
Energy: 0.38343670219459575
Energy: 0.8016327171010619
Energy: 0.796304778746303
Energy: 0.8535981578201554
Energy: 0.4078464589742473
Energy: 0.7675835877634392
Energy: 0.8535981578204639
Energy: 0.40784645897486427
Energy: 0.7963047787493878
Energy: 0.8535981578213891
Energy: 0.40784645897363037
Energy: 0.7675835877618967
Energy: 0.9067031254536467
Energy: 0.46945418569877495
Energy: 1.0189522266487312
Energy: 0.7291319969744771
Energy: 0.4694541856984664
Energy: 1.0189522266487312
Energy: 0.9067031254527215
Energy: 0.469454185698158
Energy: 1.0189522266487312
Energy: 0.7291319969741686
Energy: 0.79748071052664
Energy: 0.3830181941415158
Energy: 0.5129714890088183
Energy: 0.7662378211664413
Energy: 0.3830181941408989
Energy: 0.8967777797297791
Energy: 0.797480710527874
Energy: 0.38301819413935645
Energy: 0.5129714890088183
Energy: 0.7662378211670583
Energy: 0.7291436877483559
Energy: 0.3900517490484828
Energy: 0.7468089461304401
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Energy: 0.6773155350275791
Energy: 0.7291436877486643
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Energy: 0.7468089461288977
Energy: 0.8016708948317989
Energy: 0.6886267006869661
Energy: 0.4094330725510334
Energy: 0.7146026264555491
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Energy: 0.7546309525075371
Energy: 0.6886267006891252
Energy: 0.40943307255041644
Energy: 0.7146026264549321
Energy: 0.6886267006909762
Energy: 0.3900186599010991
Energy: 1.020442152937847
Energy: 0.721968381517119
Energy: 0.3900186599004821
Energy: 1.0204421529375385
Energy: 0.7433400112744531
Energy: 0.3900186598998652
Energy: 1.0204421529381555
Energy: 0.7219683815174274
Energy: 0.39001865990017365
Energy: 0.5906896909574503
Energy: 0.5470441100799809
Energy: 0.723059466478227
Energy: 0.5906896909571419
Energy: 0.8422425015478734
Energy: 0.6935292380114454
Energy: 0.5906896909577588
Energy: 0.5470441128883037
Energy: 0.7230594664785356
Energy: 0.5906896909571419
Energy: 0.39080471525230004
Energy: 0.6655084543896236
Energy: 0.8573476568391364
Energy: 0.39080471525230004
Energy: 0.6967123738283161
Energy: 0.8573476568388279
Energy: 0.3908047152531974
Energy: 0.6655084543886982
Energy: 0.8573476568394448
Energy: 0.3908047152516831
Energy: 0.5885487829755772
Energy: 0.7061136960300174
Energy: 0.38321992690236123
Energy: 0.588548782974035
Energy: 0.706707258881035
Energy: 0.3832199269020527
Energy: 0.588548782973418
Energy: 0.7061136960287835
Energy: 0.3832199269011273
Energy: 0.5885487829758858
Energy: 0.5373828427317736
Energy: 0.6883920915720587
Energy: 0.39003511134657454
Energy: 0.5692007204113056
Energy: 0.6483496118444873
Energy: 0.39003511134626606
Energy: 0.5373828427326989
Energy: 0.6883920915720587
Energy: 0.39003511134595764
Energy: 0.5692007204119224
Energy: 0.6976054530139228
Energy: 0.675158193577742
Energy: 0.3834367021952127
Energy: 0.6983774607223172
Energy: 0.6844634258872312
Energy: 0.38343670219428727
Energy: 0.6976054530129975
Energy: 0.675158193577742
Energy: 0.3834367021939788
Energy: 0.6983774607223172
Energy: 0.697504301572923
Energy: 0.8535981578207724
Energy: 0.4078464589742473
Energy: 0.6718287232355017
Energy: 0.8535981578204639
Energy: 0.4078464589745558
Energy: 0.6975043015707637
Energy: 0.8535981578216977
Energy: 0.4078464589742473
Energy: 0.6718287232358101

minimum gb energy = 0.38301819413904803 eV
minimum distance =  2.39214100983163 Angstroms
sigma value = 33


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

Energy: 0.7583867824103943
Energy: 0.8547303235995872
Energy: 0.832733527817654
Energy: 0.7254915397723577
Energy: 0.8547303235995872
Energy: 0.8327335278210409
Energy: 0.7583867824120876
Energy: 0.8547303236012805
Energy: 0.8327335278193475
Energy: 0.7254915397723577
Energy: 0.9423821515397632
Energy: 0.7584974349357808
Energy: 0.8211929180046394
Energy: 0.9423821515363765
Energy: 0.7584974349357808
Energy: 0.8211929180046394
Energy: 0.9423821515380698
Energy: 0.7584974349340875
Energy: 0.8211929180046394
Energy: 0.9423821515397632
Energy: 0.8471463764787484
Energy: 0.6924267049533116
Energy: 0.84858418021315
Energy: 0.8657440629294391
Energy: 0.6924267049516183
Energy: 0.8115631931181418
Energy: 0.8981693570867917
Energy: 0.6924267049533116
Energy: 0.8115631931181418
Energy: 0.8981693570850983
Energy: 0.9934976921027888
Energy: 0.7584812170167149
Energy: 0.9530926855172264
Energy: 0.9934976921027888
Energy: 0.7584812170184083
Energy: 0.9530926855189197
Energy: 0.9934976921027888
Energy: 0.7584812170167149
Energy: 0.9530926855189197
Energy: 0.9934976921027888
Energy: 0.953164223695581
Energy: 0.8017579200381119
Energy: 0.7187924080205788
Energy: 0.9531642236972744
Energy: 0.8017579200381119
Energy: 0.7187924080188853
Energy: 0.9531642236989677
Energy: 0.8017579200364183
Energy: 0.7187924080188853
Energy: 0.9531642236972744
Energy: 0.8597487594525991
Energy: 0.8378330122533344
Energy: 0.9208005576808228
Energy: 0.8597487594509057
Energy: 0.8378330122499476
Energy: 0.9208005576825162
Energy: 0.8597487594492124
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Energy: 0.8597487594509057
Energy: 0.7458039426396523
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Energy: 0.9376832247757741
Energy: 0.7458300216981154
Energy: 0.8136599487805926
Energy: 0.9376832247757741
Energy: 0.7458039426396523
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Energy: 0.9376832247757741
Energy: 0.7458300216981154
Energy: 0.8574341774494556
Energy: 0.7550797863915324
Energy: 0.8817479918893223
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Energy: 0.8574341774494556
Energy: 0.755079786389839
Energy: 0.8817479918893223
Energy: 0.8574341774477622
Energy: 0.8312996211233069
Energy: 0.719056454775701
Energy: 0.962811152268478
Energy: 0.8312996211216135
Energy: 0.7190564547773945
Energy: 0.9628111522752516
Energy: 0.8312996211216135
Energy: 0.7190564547773945
Energy: 0.9628111522617044
Energy: 0.8312996211216135
Energy: 0.8285600946665111
Energy: 0.7636282675151257
Energy: 1.0285126191674663
Energy: 0.8285600946665111
Energy: 0.763628267516819
Energy: 1.0285126191708225
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Energy: 0.763628267516819
Energy: 1.0285126191708225
Energy: 0.8285600946682045
Energy: 0.8373740273140524
Energy: 0.9230361684656625
Energy: 0.7725457234869995
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Energy: 0.9230361684656625
Energy: 0.7725495388067309
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Energy: 0.9230361684656625
Energy: 0.7725457234886929
Energy: 0.8373740273157458
Energy: 0.7554491284011008
Energy: 0.8791550495021506
Energy: 0.9397022149425905
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Energy: 0.8775812574631581
Energy: 0.9360659558940286
Energy: 0.7554491284027942
Energy: 0.8791550495004572
Energy: 0.9397022149408972
Energy: 0.7554491284027942
Energy: 0.7270738789503413
Energy: 0.8110954453977964
Energy: 0.8122111992536779
Energy: 0.7270738789520347
Energy: 0.8118707824852167
Energy: 0.8154460281370637
Energy: 0.7270738789503413
Energy: 0.8110954454299714
Energy: 0.8122111992502912
Energy: 0.7270738789486478
Energy: 0.7596559533044699
Energy: 0.950438703496691
Energy: 0.803842930021209
Energy: 0.7596559533044699
Energy: 0.9413424394348677
Energy: 0.803842930021209
Energy: 0.7596559533044699
Energy: 0.950438703496691
Energy: 0.8038429300229023
Energy: 0.7596559533061633
Energy: 0.8443503490667407
Energy: 0.7360665879668427
Energy: 1.0095309523608613
Energy: 0.8443503490650472
Energy: 0.7202498485513494
Energy: 1.0095309523625549
Energy: 0.8443503490650472
Energy: 0.7360665879668427
Energy: 1.0095309523625549
Energy: 0.8443503490650472
Energy: 0.8208778064541397
Energy: 0.9420354448081975
Energy: 0.7587678026824499
Energy: 0.820877806455833
Energy: 0.9420354448098909
Energy: 0.7587678026841432
Energy: 0.820877806455833
Energy: 0.9420354448081975
Energy: 0.7587678026807565
Energy: 0.8208778064541397
Energy: 0.8157674562307116
Energy: 1.0209097503447275
Energy: 0.6933388152016448
Energy: 0.8157674562290181
Energy: 1.0209097503447275
Energy: 0.6933388152016448
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Energy: 0.8179095780711756
Energy: 0.8918701995401391
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Energy: 0.8179095780711756
Energy: 0.910368237138682
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Energy: 0.8179095780694822
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Energy: 0.9338679737173805
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Energy: 0.8693144753016604
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Energy: 0.814285933603031
Energy: 0.9088511058891481
Energy: 0.8228674534936125
Energy: 0.8142859336047243
Energy: 0.9088511058891481
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Energy: 0.9934990712228596
Energy: 0.9088517922040366
Energy: 0.719272421967084

minimum gb energy = 0.6924267049516183 eV
minimum distance =  2.26541086643953 Angstroms
sigma value = 219


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

Energy: 0.8658836097133646
Energy: 1.1139585063418658
Energy: 1.1139681171391635
Energy: 0.8658836097133646
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Energy: 0.9530004727084335
Energy: 0.8754092892022783
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Energy: 1.0759259977567088
Energy: 0.8633929865118538
Energy: 1.1326743575200577
Energy: 1.1138976367211304
Energy: 0.8633929865107332
Energy: 1.1326743575200577
Energy: 1.1138976367211304
Energy: 0.8633929865107332
Energy: 1.1326743575200577
Energy: 1.1138976367211304
Energy: 0.8633929865107332
Energy: 1.1183851456628409
Energy: 1.0565116102315883
Energy: 1.2143097792739381
Energy: 1.1183851456628409
Energy: 1.0565116102315883
Energy: 1.2143097792739381
Energy: 1.1183851456628409
Energy: 1.056511610232709
Energy: 1.2143097792739381
Energy: 1.1183851456628409

minimum gb energy = 0.8633929865107332 eV
minimum distance =  2.32420979318067 Angstroms
sigma value = 15


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

Energy: 0.9997211812738876
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Energy: 1.3221079149044983
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Energy: 1.301013138818349
Energy: 1.1364625391887382
Energy: 1.0771841682520855
Energy: 1.0996744108098548
Energy: 1.1717276173350322
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minimum gb energy = 0.9994551036603698 eV
minimum distance =  2.26694323528622 Angstroms
sigma value = 293


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

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Energy: 1.0850225762830508
Energy: 1.0630938124301446
Energy: 1.0184802551250665
Energy: 1.0521203046599197
Energy: 1.0844668453657784
Energy: 1.018480255125573
Energy: 1.0521203046599197
Energy: 1.0844668453657784
Energy: 1.0184802551248362
Energy: 1.052120304660702
Energy: 1.0844668453660316
Energy: 1.018480255125849
Energy: 1.0745316364302204
Energy: 1.1012271109667184
Energy: 1.127442728561364
Energy: 1.0745316364449027
Energy: 1.1012271109629213
Energy: 1.1274427285611108
Energy: 1.0745316364365491
Energy: 1.1012271109527954
Energy: 1.1274427285611108
Energy: 1.0745316364266762
Energy: 1.145142457266515
Energy: 1.2787409041854787
Energy: 1.2783914735227926
Energy: 1.145142457266515
Energy: 1.2787409041847195
Energy: 1.2783914735230457
Energy: 1.145142457266745
Energy: 1.2787409041844662
Energy: 1.278391473523552
Energy: 1.145142457266745
Energy: 1.0749183772675064
Energy: 1.1274068752095163
Energy: 1.1010558875142873
Energy: 1.0749183772672533
Energy: 1.1274068752095163
Energy: 1.1010558875145404
Energy: 1.0749183772675064
Energy: 1.1274068752097695
Energy: 1.1010558875135281
Energy: 1.0749183772672533
Energy: 1.0183981696156612
Energy: 1.0844743246208015
Energy: 1.0521495730097532
Energy: 1.0183981696156612
Energy: 1.0844743246208015
Energy: 1.052149573009523
Energy: 1.0183981696161675
Energy: 1.0844743246210546
Energy: 1.0521495730097532
Energy: 1.0183981696161675
Energy: 1.0633768283188134
Energy: 1.0853660008069157
Energy: 1.2539397037024893
Energy: 1.0633768283193197
Energy: 1.0853660008069157
Energy: 1.2539397037024893
Energy: 1.0633768283188134
Energy: 1.0853660008069157
Energy: 1.2539397037024893
Energy: 1.0633768283190437
Energy: 1.15540759278479
Energy: 1.1290504150860723
Energy: 1.3059934534901503
Energy: 1.1554075927845369
Energy: 1.1290504150858194
Energy: 1.3059934534901503
Energy: 1.1554075927855496
Energy: 1.129050415085313
Energy: 1.305993453489897
Energy: 1.1554075927842837
Energy: 1.2896029363953736
Energy: 1.1024397332144564
Energy: 1.138298210198736
Energy: 1.289602936394361
Energy: 1.1024397332149627
Energy: 1.13829821019823
Energy: 1.2896029363953736
Energy: 1.1024397332144564
Energy: 1.138298210198736
Energy: 1.2896029363938548
Energy: 1.1259843165504557
Energy: 1.2753073976661307
Energy: 1.3847797453540858
Energy: 1.1259843165504557
Energy: 1.2753073976658775
Energy: 1.384779745354845
Energy: 1.1259843165504557
Energy: 1.2753073976653713
Energy: 1.384779745354592
Energy: 1.1259843165502028
Energy: 1.0802712695287364
Energy: 0.9952333396521923
Energy: 0.9938511221205837
Energy: 1.0802712695305086
Energy: 0.9952333396524453
Energy: 0.9938511221221026
Energy: 1.0802712695302554
Energy: 0.9952333396529517
Energy: 0.9938511221200774
Energy: 1.0802712695317744
Energy: 1.1258284484830643
Energy: 1.3846407414140325
Energy: 1.2754878082846546
Energy: 1.125828448482558
Energy: 1.3846407414142856
Energy: 1.2754878082846546
Energy: 1.1258284484833174
Energy: 1.3846407414142856
Energy: 1.2754878082844012
Energy: 1.1258284484835706
Energy: 1.289755201933595
Energy: 1.1387218718474827
Energy: 1.1023503897985498
Energy: 1.2897552019338483
Energy: 1.1387218718464704
Energy: 1.1023503897985498
Energy: 1.2897552019338483
Energy: 1.1387218718457108
Energy: 1.1023503897985498
Energy: 1.2897552019341014
Energy: 1.155184991325082
Energy: 1.306051468895918
Energy: 1.1298199579627168
Energy: 1.1551849913253351
Energy: 1.306051468895918
Energy: 1.1298199579622106
Energy: 1.1551849913255885
Energy: 1.3060514688964242
Energy: 1.1298199579624635
Energy: 1.1551849913248289
Energy: 1.0630938124299145
Energy: 1.254128034158539
Energy: 1.0850225762830508
Energy: 1.0630938124301446
Energy: 1.2541280341582859
Energy: 1.0850225762827974
Energy: 1.0630938124299145
Energy: 1.2541280341587921
Energy: 1.0850225762830508
Energy: 1.0630938124301446

minimum gb energy = 0.9938511221132653 eV
minimum distance =  2.26715543194881 Angstroms
sigma value = 293


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

Energy: 0.9455303680328722
Energy: 0.9459746599266319
Energy: 0.9459407031224086
Energy: 0.9455303680319571
Energy: 0.9459746599270895
Energy: 0.9459407031214937
Energy: 0.9455303680324147
Energy: 0.9459746599266319
Energy: 0.9459407031219511
Energy: 0.9455303680314996
Energy: 1.1269843737667329
Energy: 0.9464210542316257
Energy: 1.1292890177570696
Energy: 1.1269843737667329
Energy: 0.9464210542311683
Energy: 1.1292890177570696
Energy: 1.1269843737667329
Energy: 0.9464210542311683
Energy: 1.1292890177575272
Energy: 1.1269843737667329
Energy: 0.9442636308351309
Energy: 0.9440299570424172
Energy: 1.1612179820694701
Energy: 0.9442636308355884
Energy: 0.9440299570447048
Energy: 1.1612179820699278
Energy: 0.9442636308355884
Energy: 0.9440299570447048
Energy: 1.1612179820694701
Energy: 0.9442636308355884
Energy: 1.1617552411130911
Energy: 0.943928124569663
Energy: 0.9435402152157092
Energy: 1.1617552411135486
Energy: 0.943928124568748
Energy: 0.9435402152161666
Energy: 1.1617552411130911
Energy: 0.943928124569663
Energy: 0.9435402152157092
Energy: 1.1617552411140064
Energy: 1.1299660112068584
Energy: 0.9459348835531485
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835540635
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835536062
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Energy: 1.1299660112068584
Energy: 0.9459746599261744
Energy: 0.9459407031219511
Energy: 0.9455303680328722
Energy: 0.9459746599266319
Energy: 0.9459407031214937
Energy: 0.9455303680319571
Energy: 0.9459746599266319
Energy: 0.9459407031233237
Energy: 0.9455303680324147
Energy: 0.9459746599270895
Energy: 0.9464210542311683
Energy: 1.1292890177570696
Energy: 1.1269843737671903
Energy: 0.9464210542297956
Energy: 1.1292890177575272
Energy: 1.1269843737667329
Energy: 0.9464210542311683
Energy: 1.1292890177570696
Energy: 1.1269843737653604
Energy: 0.9464210542307107
Energy: 0.9440299570447048
Energy: 1.1612179820694701
Energy: 0.9442636308351309
Energy: 0.9440299570451625
Energy: 1.1612179820699278
Energy: 0.9442636308355884
Energy: 0.9440299570447048
Energy: 1.1612179820694701
Energy: 0.9442636308351309
Energy: 0.9440299570456199
Energy: 0.9439281245692054
Energy: 0.9435402152161666
Energy: 1.1617552411135486
Energy: 0.9439281245692054
Energy: 0.9435402152157092
Energy: 1.1617552411135486
Energy: 0.9439281245692054
Energy: 0.9435402152152516
Energy: 1.1617552411135486
Energy: 0.943928124569663
Energy: 0.9459348835536062
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835531485
Energy: 1.1271520259210968
Energy: 1.1299660112068584
Energy: 0.9459348835531485
Energy: 1.1271520259220118
Energy: 1.1299660112068584
Energy: 0.9459348835536062
Energy: 0.9459407031214937
Energy: 0.9455303680324147
Energy: 0.9459746599266319
Energy: 0.9459407031224086
Energy: 0.9455303680324147
Energy: 0.9459746599266319
Energy: 0.9459407031237813
Energy: 0.9455303680324147
Energy: 0.9459746599266319
Energy: 0.9459407031219511
Energy: 1.1292890177570696
Energy: 1.1269843737667329
Energy: 0.9464210542316257
Energy: 1.1292890177575272
Energy: 1.1269843737658178
Energy: 0.9464210542311683
Energy: 1.1292890177575272
Energy: 1.1269843737662752
Energy: 0.9464210542320833
Energy: 1.1292890177570696
Energy: 1.1612179820699278
Energy: 0.9442636308360458
Energy: 0.9440299570451625
Energy: 1.1612179820699278
Energy: 0.9442636308355884
Energy: 0.9440299570460775
Energy: 1.1612179820708428
Energy: 0.9442636308360458
Energy: 0.9440299570456199
Energy: 1.1612179820713004
Energy: 0.9435402152161666
Energy: 1.1617552411135486
Energy: 0.9439281245692054
Energy: 0.9435402152157092
Energy: 1.1617552411130911
Energy: 0.943928124569663
Energy: 0.9435402152166242
Energy: 1.1617552411130911
Energy: 0.943928124569663
Energy: 0.9435402152152516
Energy: 1.1271520259210968
Energy: 1.1299660112068584
Energy: 0.9459348835531485
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835531485
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835536062
Energy: 1.1271520259215544
Energy: 0.9455303680328722
Energy: 0.9459746599261744
Energy: 0.9459407031228664
Energy: 0.9455303680319571
Energy: 0.9459746599266319
Energy: 0.945940703121036
Energy: 0.9455303680324147
Energy: 0.9459746599261744
Energy: 0.9459407031224086
Energy: 0.9455303680319571
Energy: 1.1269843737667329
Energy: 0.9464210542316257
Energy: 1.1292890177575272
Energy: 1.1269843737667329
Energy: 0.9464210542320833
Energy: 1.1292890177570696
Energy: 1.1269843737667329
Energy: 0.9464210542311683
Energy: 1.1292890177575272
Energy: 1.1269843737667329
Energy: 0.9442636308355884
Energy: 0.9440299570447048
Energy: 1.1612179820703852
Energy: 0.9442636308360458
Energy: 0.9440299570447048
Energy: 1.1612179820703852
Energy: 0.9442636308355884
Energy: 0.9440299570442472
Energy: 1.1612179820699278
Energy: 0.9442636308360458
Energy: 1.1617552411130911
Energy: 0.9439281245692054
Energy: 0.9435402152157092
Energy: 1.1617552411130911
Energy: 0.943928124568748
Energy: 0.9435402152161666
Energy: 1.1617552411130911
Energy: 0.943928124568332
Energy: 0.9435402152157092
Energy: 1.1617552411135486
Energy: 1.1299660112068584
Energy: 0.9459348835536062
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835536062
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459348835531485
Energy: 1.1271520259215544
Energy: 1.1299660112068584
Energy: 0.9459746599266319
Energy: 0.9459407031228664
Energy: 0.9455303680324147
Energy: 0.9459746599266319
Energy: 0.9459407031214937
Energy: 0.9455303680319571
Energy: 0.9459746599266319
Energy: 0.9459407031242388
Energy: 0.9455303680324147
Energy: 0.9459746599266319
Energy: 0.9464210542302534
Energy: 1.1292890177570696
Energy: 1.1269843737658178
Energy: 0.9464210542311683
Energy: 1.1292890177575272
Energy: 1.1269843737662752
Energy: 0.9464210542307107
Energy: 1.1292890177570696
Energy: 1.1269843737653604
Energy: 0.9464210542302534

minimum gb energy = 0.9435402152152516 eV
minimum distance =  2.3363761970926 Angstroms
sigma value = 15


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

Energy: 1.0637924000785381
Energy: 1.2383885551117517
Energy: 1.3568727877925695
Energy: 1.052085631173882
Energy: 1.2383885551179736
Energy: 1.3568727877925695
Energy: 1.063792400076464
Energy: 1.2383885551179736
Energy: 1.3568727877925695
Energy: 1.052085631173882
Energy: 1.0117332904787564
Energy: 1.058418106813327
Energy: 1.185871352175774
Energy: 1.0117332904787564
Energy: 1.058418106813327
Energy: 1.1858713521737
Energy: 1.0117332904808303
Energy: 1.058418106813327
Energy: 1.185871352175774
Energy: 1.0117332904787564
Energy: 1.203796532813593
Energy: 1.048761831159257
Energy: 1.2696808916235927
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Energy: 1.0487618311613311
Energy: 1.2696808916215185
Energy: 1.203796532813593
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Energy: 1.2696808916277404
Energy: 1.203796532813593
Energy: 1.0638894596729527
Energy: 1.050130254000776
Energy: 0.990435781193849
Energy: 1.0638894596750266
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Energy: 0.990435781195923
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Energy: 1.0501302539987019
Energy: 0.9904357811979971
Energy: 1.0638894596729527
Energy: 1.1687544360582902
Energy: 1.0677228062035076
Energy: 1.177645502209161
Energy: 1.168754436056216
Energy: 1.0677228062035076
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Energy: 1.0677228062035076
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Energy: 1.1687544360582902
Energy: 1.0739892558711135
Energy: 1.2223327285213343
Energy: 0.996711718493002
Energy: 1.0739892558690396
Energy: 1.2223327285213343
Energy: 0.9967117184971501
Energy: 1.0739892558711135
Energy: 1.222332728517224
Energy: 0.996711718495076
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Energy: 1.05030527078318
Energy: 1.0827595967506234
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Energy: 1.0503052707811058
Energy: 1.0827595967506234
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Energy: 1.0506971597122667
Energy: 1.0124708965736497
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Energy: 1.1793437793207038
Energy: 1.0124708965736497
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Energy: 1.1793437793227777
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Energy: 1.0124708965715756
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Energy: 1.0423199959560774
Energy: 1.0419585051276405
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Energy: 1.0423199959560774
Energy: 1.0419585050923823
Energy: 1.305776293369917
Energy: 1.0423199959560774
Energy: 1.041958505044718
Energy: 1.3057762933719907
Energy: 1.010143286206364
Energy: 1.1132654216982483
Energy: 1.1525839433556913
Energy: 1.0101424400179992
Energy: 1.1132654216961742
Energy: 1.1525839433556913
Energy: 1.01014328620429
Energy: 1.1132654216961742
Energy: 1.1525839433556913
Energy: 1.0101424400179992
Energy: 1.096633913778489
Energy: 1.0103964978695126
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Energy: 1.0677653172486496
Energy: 1.096633913780563
Energy: 1.1076249110501484
Energy: 0.9945564448051399
Energy: 1.1946602848328165
Energy: 1.1076249110480743
Energy: 0.9942983459451809
Energy: 1.1946602848328165
Energy: 1.1076249110501484
Energy: 0.9945564448051399
Energy: 1.1946602848369645
Energy: 1.1076249110501484
Energy: 1.2135318366130663
Energy: 0.9917637453406254
Energy: 1.0488229576323669
Energy: 1.2135318366130663
Energy: 0.9917637453406254
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Energy: 1.2135318366130663
Energy: 1.011203003022979
Energy: 1.0601007489922585
Energy: 1.2577932002551866
Energy: 1.0112030030188308
Energy: 1.0601007489922585
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Energy: 1.0112030030188308
Energy: 1.0601007489943326
Energy: 1.2577932002531127
Energy: 1.011203003020905
Energy: 1.1990889306285328
Energy: 1.2869935877773853
Energy: 1.0104209169870961
Energy: 1.199088930630607
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Energy: 1.199088930630607
Energy: 1.2869935877773853
Energy: 1.0104209169850598
Energy: 1.199088930630607
Energy: 1.002059671982689
Energy: 1.1388333270664321
Energy: 1.146643607651029
Energy: 1.002059671982689
Energy: 1.138833327068506
Energy: 1.146643607653103
Energy: 1.002059671982689
Energy: 1.1388333270664321
Energy: 1.146643607653103
Energy: 1.002059671984763
Energy: 1.0368133339350842
Energy: 1.2285255618736173
Energy: 1.1395111899242936
Energy: 1.0368147877409994
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Energy: 1.1395111899263675
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Energy: 1.129698246534079
Energy: 1.0588180916246483
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Energy: 1.0588180916246483
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Energy: 1.005250343335836
Energy: 1.135929357826603
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Energy: 1.0052503433399842
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Energy: 1.0052503433399842
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Energy: 1.0104579679897432
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Energy: 1.1010476127172473
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Energy: 1.0496390894393812
Energy: 1.3147278039727623
Energy: 1.3462903974612381
Energy: 0.9954710442983812
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Energy: 1.3462903974612381
Energy: 0.9954710443004553
Energy: 1.3147278039686143
Energy: 1.3462903974612381
Energy: 0.9954710443004553
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Energy: 1.0494018316544234
Energy: 1.052714808479348
Energy: 1.087587905875722
Energy: 1.049993869436719
Energy: 1.050943863959309
Energy: 1.087587905873648
Energy: 1.0494018316523495
Energy: 1.052714808479348
Energy: 1.087587905875722
Energy: 1.0499938694346451
Energy: 0.9994287779761836
Energy: 1.1635932001625782
Energy: 1.0528304683042333
Energy: 0.9994287779761836
Energy: 1.1635932001646523
Energy: 1.0528304683021592
Energy: 0.9994287779741098
Energy: 1.1635932001646523
Energy: 1.0528304683021592
Energy: 0.9994287779761836
Energy: 1.0512014241186094
Energy: 1.06787471820716
Energy: 1.0721935443030917
Energy: 1.0512014241206833
Energy: 1.0678747182092339
Energy: 1.07219354430724
Energy: 1.0512014241186094
Energy: 1.0678747182133819
Energy: 1.0721935443030917
Energy: 1.0512014241186094
Energy: 1.010821818655042
Energy: 1.3711696636356123
Energy: 1.1505351898224878
Energy: 1.010839104347915
Energy: 1.3711696636356123
Energy: 1.1542019591412107
Energy: 1.0108218186508937
Energy: 1.3711696636335384
Energy: 1.1505351898224878
Energy: 1.0108391043520628
Energy: 1.139466047342751
Energy: 1.0026504367762425
Energy: 1.0654953266433045
Energy: 1.1394660473448248
Energy: 1.0026504367762425
Energy: 1.0654953266453786
Energy: 1.139466047342751
Energy: 1.0026504367741684
Energy: 1.0654953266433045
Energy: 1.1394660472722726
Energy: 1.2285957640106322
Energy: 1.180445361974845
Energy: 1.1347785877786682
Energy: 1.2285957640127063
Energy: 1.1804453619727708
Energy: 1.1347785877807424
Energy: 1.2285957640127063
Energy: 1.180445361974845
Energy: 1.1347785877807424
Energy: 1.2285957640127063
Energy: 1.1944024747608977
Energy: 0.9969183314024387
Energy: 1.0532647040991652
Energy: 1.1801208244796701
Energy: 0.9966252622471933
Energy: 1.0532647040991652
Energy: 1.1944024747588613
Energy: 0.9969183314045125
Energy: 1.0532647040991652
Energy: 1.1801208244796701
Energy: 1.0796027893337006
Energy: 0.9961229839233939
Energy: 1.1485872230172118
Energy: 1.0796027893316265
Energy: 0.9961229839213201
Energy: 1.1485872230172118
Energy: 1.0796027893337006
Energy: 0.9961229839213201
Energy: 1.1485872230172118
Energy: 1.0796027893316265
Energy: 1.1788740033903775
Energy: 1.16983087448832
Energy: 1.0127325320045268
Energy: 1.1788740033903775
Energy: 1.1698308744903938
Energy: 1.0126703339882661
Energy: 1.1788740033883034
Energy: 1.16983087448832
Energy: 1.0127325320045268
Energy: 1.1788740033883034
Energy: 1.056033224135479
Energy: 1.1395830806969436
Energy: 1.140159907520284
Energy: 1.0560332241375532
Energy: 1.1395830807052396
Energy: 1.140159907522358
Energy: 1.056033224135479
Energy: 1.1395830806990175
Energy: 1.140159907522358
Energy: 1.0560332241334052
Energy: 1.0632634581662792
Energy: 1.1051154150600084
Energy: 1.202015685690976
Energy: 1.0522707169422272
Energy: 1.1051154150371942
Energy: 1.2020156856868283
Energy: 1.0632634581662792
Energy: 1.1051154150434166
Energy: 1.202015685690976
Energy: 1.0522707169422272
Energy: 1.064834932545109
Energy: 1.1655575989283677
Energy: 1.169137199064087
Energy: 1.0516241916390447
Energy: 1.1655575989304419
Energy: 1.1442433783718007
Energy: 1.064834932547183
Energy: 1.1655575989304419
Energy: 1.1691371990661608
Energy: 1.0516241916369709
Energy: 1.0604519931952998
Energy: 1.2200603091818825
Energy: 1.1779576251970487
Energy: 1.0604519931973737
Energy: 1.2200603091818825
Energy: 1.1779576251970487
Energy: 1.0604519931932257
Energy: 1.2200603091839564
Energy: 1.1779576251970487
Energy: 1.0604519931932257
Energy: 1.3430667165240526
Energy: 1.0107494603449256
Energy: 1.3048577830858057
Energy: 1.3430667165219785
Energy: 1.0107494603449256
Energy: 1.3048577830858057
Energy: 1.3430667165219785
Energy: 1.0107494603428515
Energy: 1.3048577830837316
Energy: 1.3430667165219785
Energy: 1.192342029354869
Energy: 1.14015992944654
Energy: 1.0129445696394301
Energy: 1.192342029354869
Energy: 1.140159929444466
Energy: 1.0132397609035992
Energy: 1.192342029354869
Energy: 1.140159929444466
Energy: 1.0129445696373562
Energy: 1.192342029354869
Energy: 1.2603894520392769
Energy: 1.1716348613850194
Energy: 0.9944180453107553
Energy: 1.2603894520392769
Energy: 1.1716348613829453
Energy: 0.9944180453086812
Energy: 1.260389452041351
Energy: 1.1716348613829453
Energy: 0.9944180453086812
Energy: 1.2603894520372407
Energy: 1.0840011824482518
Energy: 1.0838292128026457
Energy: 1.0664318950403946
Energy: 1.0840011824482518
Energy: 1.0838292128026457
Energy: 1.0664318950403946
Energy: 1.0840011824482518
Energy: 1.0838292128005715
Energy: 1.0664318950403946
Energy: 1.0840011824482518
Energy: 1.1586544775929162
Energy: 1.1442724121708172
Energy: 1.0516656185989843
Energy: 1.1586544775929162
Energy: 1.144272412168743
Energy: 1.0516656185989843
Energy: 1.15865447759499
Energy: 1.1442724121708172
Energy: 1.0516656185989843
Energy: 1.1586544775929162
Energy: 1.0106618314833609
Energy: 1.1164927936102482
Energy: 1.0992040755234205
Energy: 1.0106618314833609
Energy: 1.1164927936123221
Energy: 1.0992040755275685
Energy: 1.0106618314833609
Energy: 1.1164927936143962
Energy: 1.0992040755254946
Energy: 1.0106618314812867
Energy: 1.1397484520934018
Energy: 1.0436307521527923
Energy: 1.0412466900523718
Energy: 1.1397484520934018
Energy: 1.0436307521527923
Energy: 1.0412466900503357
Energy: 1.1397484520934018
Energy: 1.0436307521527923
Energy: 1.041246690054446
Energy: 1.1397484520934018
Energy: 1.2930791403946582
Energy: 1.006718923760025
Energy: 1.2622880159878576
Energy: 1.2930791403946582
Energy: 1.006718923760025
Energy: 1.2622880159857834
Energy: 1.293079140392584
Energy: 1.006718923760025
Energy: 1.2622880159878576
Energy: 1.2930791403946582
Energy: 1.0573525011730496
Energy: 1.4112113638396044
Energy: 1.0502313818394264
Energy: 1.0573525011730496
Energy: 1.4112113638375305
Energy: 1.0502313818394264
Energy: 1.0573525011751237
Energy: 1.4112113638354564
Energy: 1.0502313818394264
Energy: 1.057352501170976
Energy: 1.319346648706362
Energy: 0.9961735671048183
Energy: 1.2238157519304789
Energy: 1.319346648708436
Energy: 0.9961730595904063
Energy: 1.223815751932553
Energy: 1.319346648708436
Energy: 0.9961735671048183
Energy: 1.223815751932553
Energy: 1.319346648708436
Energy: 1.2051154815771135
Energy: 1.006845043981119
Energy: 1.1407757317690035
Energy: 1.2051154815771135
Energy: 1.006845043981119
Energy: 1.1407757317690035
Energy: 1.2051154815771135
Energy: 1.006845043981119
Energy: 1.1407757317648555
Energy: 1.2051154815771135
Energy: 1.117872191826892
Energy: 1.1065823555640177
Energy: 1.0083696737265828
Energy: 1.1178721918248178
Energy: 1.1065823555640177
Energy: 1.0076007849880921
Energy: 1.1178721918248178
Energy: 1.1065823555640177
Energy: 1.0083696737265828
Energy: 1.117872191826892
Energy: 1.0517591277156952
Energy: 1.1057882260935126
Energy: 1.0777009417788541
Energy: 1.0517591277156952
Energy: 1.1057882260914387
Energy: 1.0777009417809282
Energy: 1.0517591277156952
Energy: 1.1057882260914387
Energy: 1.0777009417788541
Energy: 1.0517591277156952
Energy: 1.0318356768139183
Energy: 1.1047165976928868
Energy: 1.114919913504201
Energy: 1.0319149899764393
Energy: 1.104716597694961
Energy: 1.114919913506275
Energy: 1.0318356768097705
Energy: 1.1047165976928868
Energy: 1.114919913504201
Energy: 1.0319149899971793

minimum gb energy = 0.990435781193849 eV
minimum distance =  2.25389624443971 Angstroms
sigma value = 437


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

Energy: 1.0102807480511764
Energy: 1.06574299576505
Energy: 1.0659729403714047
Energy: 1.010280748050421
Energy: 1.06574299576505
Energy: 1.0659729403706488
Energy: 1.0102807480511764
Energy: 1.06574299576505
Energy: 1.0659729403714047
Energy: 1.0102807480511764
Energy: 1.2718902713353826
Energy: 0.990043178973831
Energy: 1.1459176914852025
Energy: 1.2718902713338713
Energy: 0.9900431789745867
Energy: 1.1459176914852025
Energy: 1.2718902713353826
Energy: 0.990043178973831
Energy: 1.1459176914852025
Energy: 1.271890271334627
Energy: 1.134312753567324
Energy: 0.9755652675536336
Energy: 1.3031206772207022
Energy: 1.1343127535688353
Energy: 0.975565267552878
Energy: 1.303120677219191
Energy: 1.1343127535680795
Energy: 0.9755652675536336
Energy: 1.3031206772207022
Energy: 1.1343127535688353
Energy: 1.0520279315352628
Energy: 1.1325035750203198
Energy: 1.1246679069669754
Energy: 1.052027931890222
Energy: 1.1325035750203198
Energy: 1.1246679069677312
Energy: 1.052027931622878
Energy: 1.1325035750210752
Energy: 1.1246679069662198
Energy: 1.0520279315813201
Energy: 1.091538351825216
Energy: 1.0081086246113602
Energy: 1.2592150788976222
Energy: 1.0915383520548143
Energy: 1.0081086246113602
Energy: 1.2592150788976222
Energy: 1.091538351891674
Energy: 1.0081086246113602
Energy: 1.259215078898378
Energy: 1.0915383525041888
Energy: 1.1152079928393286
Energy: 1.0886439005920543
Energy: 0.9921528002915918
Energy: 1.1152079928400842
Energy: 1.088643900591299
Energy: 0.9921528002931028
Energy: 1.1152079928408396
Energy: 1.08864390059281
Energy: 0.9921528002923472
Energy: 1.1152079928408396
Energy: 1.1896871519964949
Energy: 1.0341268290676704
Energy: 0.975396120600433
Energy: 1.1896871519730712
Energy: 1.0341268290684258
Energy: 0.9753961205989218
Energy: 1.189687152141501
Energy: 1.0341268290684258
Energy: 0.9753961205996774
Energy: 1.215631340365821
Energy: 1.0504740417207545
Energy: 1.135430474642783
Energy: 1.0543881191303868
Energy: 1.0504740417192435
Energy: 1.135430474642783
Energy: 1.0543881191243418
Energy: 1.0504740417199991
Energy: 1.135430474642783
Energy: 1.05438811912812
Energy: 1.0504740417199991
Energy: 1.3727431393068015
Energy: 1.1404910292078543
Energy: 1.0074576848583896
Energy: 1.3727431393052902
Energy: 1.14049102920861
Energy: 1.0074576848591452
Energy: 1.3727431393052902
Energy: 1.14049102920861
Energy: 1.0074576848591452
Energy: 1.3727431393060459
Energy: 1.0527131106945438
Energy: 1.135811466710446
Energy: 1.1657557044965992
Energy: 1.0527131106952994
Energy: 1.135811466710446
Energy: 1.1657557044965992
Energy: 1.0527131106952994
Energy: 1.135811466710446
Energy: 1.1657557044958435
Energy: 1.0527131106952994
Energy: 1.042234033260574
Energy: 1.04171429689775
Energy: 1.2475357944054917
Energy: 1.042234033260574
Energy: 1.04171429689775
Energy: 1.247535794407003
Energy: 1.0422340332598186
Energy: 1.0417142968969946
Energy: 1.2475357944107808
Energy: 1.042234033260574
Energy: 1.1336347358910073
Energy: 0.9911856269807514
Energy: 1.1858794264791164
Energy: 1.1336347358894963
Energy: 0.9911856269807514
Energy: 1.1858794264791164
Energy: 1.1336347358917631
Energy: 0.9911856269807514
Energy: 1.1858794264791164
Energy: 1.1336347358902519
Energy: 1.0078934738291188
Energy: 1.2209681836481925
Energy: 1.0084177239719834
Energy: 1.0078934738298744
Energy: 1.2209681836481925
Energy: 1.0084177239719834
Energy: 1.0078934738291188
Energy: 1.220968183648948
Energy: 1.0084177239727388
Energy: 1.0078934738291188
Energy: 1.2477368993205942
Energy: 1.064019955428758
Energy: 1.2362713219284145
Energy: 1.2477368993198388
Energy: 1.0640199554280025
Energy: 1.2362713219367263
Energy: 1.2477368993198388
Energy: 1.064019955428758
Energy: 1.2362713219405042
Energy: 1.247736899319083

minimum gb energy = 0.9753961205989218 eV
minimum distance =  2.28221117917731 Angstroms
sigma value = 33