Model name: model_name=EAM_Dynamo_HoytGarvinWebb_2003_PbCu__MO_119135752160_005
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=3.615034341812134
cohesive_energy=3.5403314649062034
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: 0.015485904900721922
Energy: 0.31011532781378137
Energy: 0.31011532781378137
Energy: 0.015485904900721922
Energy: 0.31011532781378137
Energy: 0.31011532781378137
Energy: 0.015485904900721922
Energy: 0.31011532781378137
Energy: 0.31011532781378137
Energy: 0.015485904900721922
Energy: 0.30781888412289976
Energy: 0.018513634291253855
Energy: 0.30770548475344817
Energy: 0.30781888412289976
Energy: 0.018513634289808373
Energy: 0.30770548475200266
Energy: 0.30781888412289976
Energy: 0.018513634289808373
Energy: 0.3077054847548936
Energy: 0.30781888412289976
Energy: 0.939576750811977
Energy: 0.01628708929788013
Energy: 0.01628708929788013
Energy: 0.682614693613166
Energy: 0.01628708929788013
Energy: 0.01628708929788013
Energy: 0.3659107962614031
Energy: 0.20177313307036843
Energy: 0.01628708929788013
Energy: 0.5372465007434613
Energy: 0.3078188841257906
Energy: 0.30770548475200266
Energy: 0.018513634291253855
Energy: 0.30781888412434516
Energy: 0.30770548475200266
Energy: 0.018513634291253855
Energy: 0.30781888412434516
Energy: 0.30770548475200266
Energy: 0.018513634291253855
Energy: 0.30781888412434516
Energy: 0.015485904900721922
Energy: 0.31011532781378137
Energy: 0.3101153278152269
Energy: 0.015485904902167405
Energy: 0.31011532781378137
Energy: 0.3101153278152269
Energy: 0.015485904900721922
Energy: 0.31011532781378137
Energy: 0.31011532781378137
Energy: 0.015485904900721922
Energy: 0.30781888412434516
Energy: 0.018513634291253855
Energy: 0.30770548475344817
Energy: 0.30781888412434516
Energy: 0.018513634292699338
Energy: 0.30770548475200266
Energy: 0.30781888412434516
Energy: 0.018513634291253855
Energy: 0.30770548475200266
Energy: 0.30781888412289976
Energy: 1.0718570629483992
Energy: 0.01628708929788013
Energy: 0.20177313307181394
Energy: 0.373065586816297
Energy: 0.01628708929788013
Energy: 0.01628708929788013
Energy: 1.045130477186076
Energy: 0.01628708929788013
Energy: 0.01628708929788013
Energy: 0.6176870110906548

minimum gb energy = 0.015485904900721922 eV
minimum distance =  2.33663646968545 Angstroms
sigma value = 3


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

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Energy: 0.8428512502124389
Energy: 0.8425536660774534
Energy: 0.7149697947679043
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Energy: 0.7867472274527342
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Energy: 0.7867472274509317
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Energy: 0.8431596700343551
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Energy: 0.6467258655341116
Energy: 0.869788736958675
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Energy: 0.7301784566609719
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Energy: 0.8123930278960979
Energy: 0.6775468195241956
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Energy: 0.6773824025496537
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Energy: 0.7187745457386862
Energy: 0.8428512502110227
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Energy: 0.7192703719744986
Energy: 0.8428512502114088
Energy: 0.8425536660777754
Energy: 0.7187745457570978
Energy: 0.8428512502170097
Energy: 0.8425536660806078
Energy: 0.7192703719766231
Energy: 0.7247413122442827
Energy: 0.677498211591001
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Energy: 0.7247413122390038
Energy: 0.6774982115928035
Energy: 0.8124681309879045
Energy: 0.7247413122361713
Energy: 0.6774982115902929
Energy: 0.8124681309857801
Energy: 0.7247413122485316
Energy: 0.7125486531552402
Energy: 0.7878830343047191
Energy: 0.8126758357977665
Energy: 0.71094825276427
Energy: 0.7878830343694815
Energy: 0.812675835794934
Energy: 0.7125486560509505
Energy: 0.7878830343949746
Energy: 0.8126758357970584
Energy: 0.7109482527770165
Energy: 0.8422232427897196
Energy: 0.8428932890967881
Energy: 0.6476376441451849
Energy: 0.8422232427996335
Energy: 0.8428932890964662
Energy: 0.6476376441420306
Energy: 0.8422232427935821
Energy: 0.8428932890982045
Energy: 0.6476376441462794
Energy: 0.8422232427942903

minimum gb energy = 0.6158325735206269 eV
minimum distance =  2.38349220833782 Angstroms
sigma value = 75


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

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Energy: 0.7294206186210919
Energy: 0.7294507997986668
Energy: 0.9802560968648648
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minimum gb energy = 0.7294176996272481 eV
minimum distance =  2.23632572769439 Angstroms
sigma value = 105


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

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Energy: 0.8404963766799135
Energy: 0.9349371383607997
Energy: 0.8585971163803118
Energy: 0.8404963766740663
Energy: 0.9425052659657708
Energy: 0.8585971163797093
Energy: 0.8680413313963488
Energy: 0.9241697591775211
Energy: 0.84052456329279
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Energy: 0.9241697591808169
Energy: 0.8763132321942003
Energy: 0.8680413313932303
Energy: 0.9241697591773086
Energy: 0.8405245632929673
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Energy: 0.8233247713195293
Energy: 0.8236388556819981
Energy: 0.8527565128277644
Energy: 0.8233247713173676
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Energy: 0.8527565128221298
Energy: 0.8575050158249268
Energy: 0.9328904651073264
Energy: 0.8792596311264241
Energy: 0.8415871898626555
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Energy: 0.8792596311277708
Energy: 0.8415871898620885
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Energy: 0.8415871898624783
Energy: 0.9520815171888628
Energy: 0.8468631582580427
Energy: 0.8305862120338993
Energy: 0.8888957296100817
Energy: 0.8660134430109981
Energy: 0.8305862120344664
Energy: 0.8758609690292795
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Energy: 0.8888957296057937
Energy: 0.8660134430141168
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Energy: 0.8273259749788096
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Energy: 0.8821036710452553
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Energy: 0.8268012335650445
Energy: 0.8761712044324746
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Energy: 0.8761712044315177
Energy: 0.8848340888399909
Energy: 0.9455104084743563
Energy: 0.9453628213700245
Energy: 0.8848363421530021
Energy: 0.9455104084772623
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Energy: 0.8848340888431094
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Energy: 0.9453628213653466
Energy: 0.8848363421479346
Energy: 0.9180401551380946
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Energy: 0.8715952226702537
Energy: 0.9180401551404336
Energy: 0.8455480604898024
Energy: 0.8715952226743291
Energy: 0.9180401551466707
Energy: 0.8455480604933107
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Energy: 0.9180401551443317
Energy: 0.8725942015623466
Energy: 0.9243671564785348
Energy: 0.8518345770081093
Energy: 0.8725942015650754
Energy: 0.9243671564798815
Energy: 0.8518345770061602
Energy: 0.872594201559618
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Energy: 0.8518345770061602
Energy: 0.8725942015598305
Energy: 0.8777478162883828
Energy: 0.8773277380353237
Energy: 0.8252401250221998
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Energy: 0.8773530420383553
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Energy: 0.8777478162834924
Energy: 0.8773277380341896
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Energy: 0.8777022734779734
Energy: 0.9337752805631766
Energy: 0.8900649062631302
Energy: 0.8263230844227268
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Energy: 0.8900649062604016
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Energy: 0.9337752805649485
Energy: 0.8900649062588423
Energy: 0.8263230844213448
Energy: 0.933775280563779
Energy: 0.8073437906946552
Energy: 0.8758170100171155
Energy: 0.9002494623601023
Energy: 0.8073437906915367
Energy: 0.8758170100184977
Energy: 0.9002494623538652
Energy: 0.8073437906956121
Energy: 0.8758170100229627
Energy: 0.9002494623587203
Energy: 0.8073437906919265
Energy: 0.8806613157668998
Energy: 1.0190924407146276
Energy: 0.9223276326491746
Energy: 0.8914225705725992
Energy: 1.0191765927728926
Energy: 0.9238393371144047
Energy: 0.8597751833346605
Energy: 1.019092440715974
Energy: 0.9238393371142276
Energy: 0.8755478298364793
Energy: 0.9111289698071173
Energy: 0.868643599159717
Energy: 0.8235061565271196
Energy: 0.9111289698071173
Energy: 0.8686435991659541
Energy: 0.8235061565265169
Energy: 0.9111289698047785
Energy: 0.8686435991612763
Energy: 0.823506156528289
Energy: 0.9111289698082868
Energy: 0.8984943120896666
Energy: 0.8603900013899743
Energy: 0.8313243878265546
Energy: 0.8984943120873278
Energy: 0.8603900013985504
Energy: 0.8313243878308426
Energy: 0.8984943120923953
Energy: 0.8603900013946522
Energy: 0.8313243878243929
Energy: 0.8984943120852015
Energy: 0.8420529545271852
Energy: 0.878597296118714
Energy: 0.8771053752424655
Energy: 0.8420529545267953
Energy: 0.8785972961210529
Energy: 0.8771053752356613
Energy: 0.842052954528142
Energy: 0.8785972961179344
Energy: 0.8771053752331098
Energy: 0.8420529545283546
Energy: 0.8230680852707388
Energy: 0.8364647464311582
Energy: 0.8453221706768502
Energy: 0.8230680852691796
Energy: 0.836451196355143
Energy: 0.845322170679579
Energy: 0.8230680852707388
Energy: 0.8364647464274727
Energy: 0.8453221706830875
Energy: 0.8230680852752394
Energy: 0.8600669557259885
Energy: 0.8459143512120235
Energy: 0.8876155527133317
Energy: 0.8600669557236494
Energy: 0.8457944183856067
Energy: 0.8876155527133317
Energy: 0.860066955726201
Energy: 0.8459143512120235
Energy: 0.8876155527152808
Energy: 0.8600669557250314
Energy: 0.8591181616905649
Energy: 0.8575211198950194
Energy: 0.8852241423460571
Energy: 0.8591181616905649
Energy: 0.8575211198925033
Energy: 0.8852241423474035
Energy: 0.8591181616878362
Energy: 0.8575211198930703
Energy: 0.8852241423489629
Energy: 0.859118161688226
Energy: 0.8401246972522473
Energy: 0.935079507143395
Energy: 0.8593182045737834
Energy: 0.8401246972524243
Energy: 0.9350666176306168
Energy: 0.8593182045730037
Energy: 0.8401246972524243
Energy: 0.9350795071482854
Energy: 0.8593182045706649
Energy: 0.8401246972524243
Energy: 0.924295003305983
Energy: 0.8503348812182651
Energy: 0.8673563228065557
Energy: 0.9242950033104482
Energy: 0.8501318261818576
Energy: 0.8673563228048193
Energy: 0.9242950033098812
Energy: 0.8503348812190445
Energy: 0.8673563228063785
Energy: 0.9242950033003483
Energy: 0.8485503848648394
Energy: 0.852621379545562
Energy: 0.8781153951609691
Energy: 0.8485503848640596
Energy: 0.8526197421113584
Energy: 0.8781153951672062
Energy: 0.8485503848634928
Energy: 0.8526213795434358
Energy: 0.8781153951588428
Energy: 0.8485503848648394

minimum gb energy = 0.8073437906915367 eV
minimum distance =  2.33696416500387 Angstroms
sigma value = 165


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

Energy: 0.8216503287038694
Energy: 0.8850422896165798
Energy: 0.8846090228315292
Energy: 0.8216503287038694
Energy: 0.8850422896219328
Energy: 0.8846090228315292
Energy: 0.8216503287052077
Energy: 0.8850422896165798
Energy: 0.8846090228308601
Energy: 0.8216503287038694
Energy: 0.8778468317019449
Energy: 0.8269469887426198
Energy: 0.9144479018183761
Energy: 0.8778468316965918
Energy: 0.8269469887419507
Energy: 0.9144479018183761
Energy: 0.8778468316999375
Energy: 0.8269469887426198
Energy: 0.9144479018190451
Energy: 0.8778468316979302
Energy: 0.8613633422229616
Energy: 0.9237573134111992
Energy: 0.7908900458150627
Energy: 0.8613633422289838
Energy: 0.9237573134058461
Energy: 0.7908900349171153
Energy: 0.8613633424523814
Energy: 0.9237573134098609
Energy: 0.7908900427377701
Energy: 0.8613633421734764
Energy: 0.9274310790976746
Energy: 0.9414767074449367
Energy: 0.8266494936684535
Energy: 0.9274310790936598
Energy: 0.9414767074456059
Energy: 0.8266494936637695
Energy: 0.9274310790970055
Energy: 0.9414767074456059
Energy: 0.8266494936691225
Energy: 0.9274310790936598
Energy: 0.8551810553456914
Energy: 0.8958211008893789
Energy: 0.8555648265083293
Energy: 0.8551810553410074
Energy: 0.8958211008833569
Energy: 0.8555648265197043
Energy: 0.8551810553463605
Energy: 0.8958211008880408
Energy: 0.8555648265103366
Energy: 0.8551810553403384
Energy: 0.8267737303884545
Energy: 0.9681591554922875
Energy: 0.9275600994306714
Energy: 0.8267737303897927
Energy: 0.9681591554916184
Energy: 0.9275600994273563
Energy: 0.8267737303877855
Energy: 0.9681591554942949
Energy: 0.9275600994286946
Energy: 0.8267737303904619
Energy: 0.8775915139539076
Energy: 0.9003604795951899
Energy: 0.8840071839040127
Energy: 0.877591513754568
Energy: 0.9003604795958591
Energy: 0.8840071839020053
Energy: 0.8775915137840097
Energy: 0.9003604795951899
Energy: 0.8840071839026743
Energy: 0.8775915137278334
Energy: 0.9342240529876524
Energy: 0.8228596863915928
Energy: 0.8220564295593865
Energy: 0.934224052985645
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Energy: 0.8220564295593865
Energy: 0.9342240529883216
Energy: 0.8228596863915928
Energy: 0.8220564295567099
Energy: 0.9342240529849759
Energy: 0.8775801285839778
Energy: 0.8839683642090809
Energy: 0.9003618446317714
Energy: 0.8775801324391019
Energy: 0.8839683642177492
Energy: 0.9003618446324405
Energy: 0.8775801382084515
Energy: 0.8839683642097501
Energy: 0.9003618446311021
Energy: 0.877580153244443
Energy: 0.8268606959794911
Energy: 0.9276064452399762
Energy: 0.9691514846149815
Energy: 0.8268606959841749
Energy: 0.9276064452399762
Energy: 0.9691514846223418
Energy: 0.8268606959794911
Energy: 0.9276064452399762
Energy: 0.9691514846163196
Energy: 0.8268606959835058
Energy: 0.8549890977168042
Energy: 0.855527199399053
Energy: 0.8959450919976839
Energy: 0.854989097720819
Energy: 0.8555271993930309
Energy: 0.8959450919970148
Energy: 0.8549890977194808
Energy: 0.8555271993936999
Energy: 0.8959450919983529
Energy: 0.8549890977161352
Energy: 0.9276491951829539
Energy: 0.8266684785723882
Energy: 0.942768235856929
Energy: 0.9276491951822847
Energy: 0.8266684785730574
Energy: 0.9427682358602746
Energy: 0.9276491951809465
Energy: 0.82666847857105
Energy: 0.9427682358575981
Energy: 0.9276491951836229
Energy: 0.8613084236252665
Energy: 0.7909643738896935
Energy: 0.9233499057416027
Energy: 0.8613084172794018
Energy: 0.7909643738743036
Energy: 0.923349905742941
Energy: 0.8613084139519464
Energy: 0.7909643738749726
Energy: 0.9233499057409337
Energy: 0.861308417592402
Energy: 0.8776434568988619
Energy: 0.914456204288435
Energy: 0.8269036812609099
Energy: 0.8776434568988619
Energy: 0.9144562042877659
Energy: 0.8269036812622481
Energy: 0.8776434569015384
Energy: 0.9144562042924498
Energy: 0.826903681261579
Energy: 0.8776434568968545
Energy: 0.821650328705877
Energy: 0.8850422896132342
Energy: 0.8846090228321983
Energy: 0.8216503287045386
Energy: 0.8850422896165798
Energy: 0.8846090228288528
Energy: 0.8216503287052077
Energy: 0.885042289612565
Energy: 0.8846090228301909
Energy: 0.8216503287052077

minimum gb energy = 0.7908900349171153 eV
minimum distance =  2.33844389775131 Angstroms
sigma value = 41


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

Energy: 0.9563911417940486
Energy: 0.8081581998288794
Energy: 0.8075129333367356
Energy: 0.899345721482715
Energy: 0.8081581998262832
Energy: 0.8075129333419279
Energy: 0.9563911417888562
Energy: 0.8081581998340717
Energy: 0.8075129333367356
Energy: 0.899345721482715
Energy: 0.8124007965051274
Energy: 0.7158942531097877
Energy: 0.8136012838082807
Energy: 0.8124007965025313
Energy: 0.7158942531097877
Energy: 0.8136012838030885
Energy: 0.8124007965025313
Energy: 0.7158942530994031
Energy: 0.8136012838108769
Energy: 0.8124007965051274
Energy: 0.7740311541843522
Energy: 0.7167748391386247
Energy: 0.7426053369487825
Energy: 0.7547738418567107
Energy: 0.716774839143817
Energy: 0.7426547501095219
Energy: 0.7732373953802875
Energy: 0.716774839143817
Energy: 0.7426053369409941
Energy: 0.7618749500632167
Energy: 0.73915478433786
Energy: 0.7391112130393956
Energy: 0.7430277182152616
Energy: 0.7391547843404561
Energy: 0.7391112130367995
Energy: 0.7429852621465286
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Energy: 0.7391112130419918
Energy: 0.7430277182178577
Energy: 0.7391547843352638
Energy: 0.7557062465975537
Energy: 0.8048482890829234
Energy: 0.7417595203635305
Energy: 0.7557062465897652
Energy: 0.8048482890751348
Energy: 0.7418130275759264
Energy: 0.7557062465897652
Energy: 0.8048482890673464
Energy: 0.7417595203583383
Energy: 0.7557062465949574
Energy: 0.7453041219221075
Energy: 0.7794267432676011
Energy: 0.7843939103014667
Energy: 0.7453041219221075
Energy: 0.7794267432624089
Energy: 0.7843939102988704
Energy: 0.7453041219195111
Energy: 0.7794267432624089
Energy: 0.7843939103040627
Energy: 0.7453041219221075
Energy: 0.7417839163585991
Energy: 0.7157391974291774
Energy: 0.8126777081525431
Energy: 0.7417839163637914
Energy: 0.7157391974213888
Energy: 0.8126777081448019
Energy: 0.7417839163663875
Energy: 0.715739197423985
Energy: 0.8126777081396096
Energy: 0.7417839163637914
Energy: 0.8068970756656423
Energy: 0.7324830988564546
Energy: 0.7624479995055329
Energy: 0.8068970756682385
Energy: 0.7326882080688846
Energy: 0.7624479995081291
Energy: 0.8068970756682385
Energy: 0.732483098861647
Energy: 0.7624479994977443
Energy: 0.8068970756656423
Energy: 0.7838062187029046
Energy: 0.8291028900169204
Energy: 0.7537234772806516
Energy: 0.7838062187055007
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Energy: 0.7377003006902616
Energy: 0.783806218708097
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Energy: 0.7537234772806516
Energy: 0.7838062187003083
Energy: 0.7189855474252286
Energy: 0.7839421393347834
Energy: 0.7770479027299225
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Energy: 0.7843680023496346
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Energy: 0.7839421393218025
Energy: 0.7770479027273265
Energy: 0.7189855474148439
Energy: 0.7166013964855059
Energy: 0.7626459760108601
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Energy: 0.7166013964906981
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Energy: 0.7166013964932942
Energy: 0.7626459760108601
Energy: 0.7625446552679093
Energy: 0.7166013964855059
Energy: 0.716804851671071
Energy: 0.7543694886639968
Energy: 0.7922215202695544
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Energy: 0.754955754448848
Energy: 0.7922215202721505
Energy: 0.7168048516658785
Energy: 0.7543694886068811
Energy: 0.7922215202773429
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Energy: 0.8167352517271587
Energy: 0.7448554063242224
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Energy: 0.7448733366135442
Energy: 0.8361165214280415
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Energy: 0.7448554063086456
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Energy: 0.8084000086807452
Energy: 0.8028299324520582
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Energy: 0.8084000086807452
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Energy: 0.7457642130298227
Energy: 0.8084000086833414
Energy: 0.8028299324598467
Energy: 0.7457642130220341
Energy: 0.8084000086833414
Energy: 0.716784786512168
Energy: 0.8158350881884762
Energy: 0.7396716009070649
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Energy: 0.7396716009018725
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Energy: 0.7163056765102471
Energy: 0.78311950502205
Energy: 0.7845614911980431
Energy: 0.7163056765128433
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Energy: 0.7845614912032355
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Energy: 0.7831195050142614
Energy: 0.7845614911980431
Energy: 0.7163056764998624
Energy: 0.7546799939084583
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Energy: 0.7573690295362134
Energy: 0.7300781068025277
Energy: 0.7696558495175564
Energy: 0.7742620383534295
Energy: 0.7300781067999316
Energy: 0.7879488457379142
Energy: 0.757369029531021
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Energy: 0.7696558495149602
Energy: 0.7636276179386035
Energy: 0.8090830190243528
Energy: 0.715636639908744
Energy: 0.7636276179360072
Energy: 0.8082862248476683
Energy: 0.7156366399113402
Energy: 0.7636276179360072
Energy: 0.786022484674668
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Energy: 0.739420086529016
Energy: 0.8358181912837217
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Energy: 0.7395382138795784
Energy: 0.835818191288914
Energy: 0.7162135369143108
Energy: 0.7394200865316122
Energy: 0.835818191288914
Energy: 0.7162135369168597
Energy: 0.7395382138951553
Energy: 0.745809140598255
Energy: 0.8082734114214688
Energy: 0.806381309625689
Energy: 0.7457986745181626
Energy: 0.8082734114162766
Energy: 0.8063813096179004
Energy: 0.745809140600851
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Energy: 0.806381309625689
Energy: 0.745798674507778
Energy: 0.8234848592834417
Energy: 0.7444113072369446
Energy: 0.7801020455175736
Energy: 0.8234848592834417
Energy: 0.7444113072421371
Energy: 0.7801020436024537
Energy: 0.8234848592886342
Energy: 0.7444113072525217
Energy: 0.780102045185406
Energy: 0.8234848592912303
Energy: 0.7652339490344293
Energy: 0.7544143106310288
Energy: 0.7167082722900269
Energy: 0.7548297665598508
Energy: 0.7544143106388173
Energy: 0.7167082723055566
Energy: 0.7548337087773727
Energy: 0.7544143106336249
Energy: 0.7167082723029603
Energy: 0.7205806146985062
Energy: 0.7625340103603684
Energy: 0.7621537385935836
Energy: 0.716749214615599
Energy: 0.7625340103603684
Energy: 0.7621537385935836
Energy: 0.716749214615599
Energy: 0.7625340103603684
Energy: 0.7621537385961797
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Energy: 0.7625340103629645
Energy: 0.7824985711433935
Energy: 0.7970875664328523
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Energy: 0.7824985711433935
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Energy: 0.7824985711459896
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Energy: 0.7797163333505251
Energy: 0.7764538912333425
Energy: 0.7847850246093376
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Energy: 0.7764538912281501
Energy: 0.7847850246067415
Energy: 0.7797163339422147
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Energy: 0.7847850246041453
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Energy: 0.8046406416443145
Energy: 0.7154943003651907
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Energy: 0.7767785476476939
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Energy: 0.8256163104001315
Energy: 0.7447628873712469
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Energy: 0.7364265108146105
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Energy: 0.7435316372680725
Energy: 0.8016076188939129
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Energy: 0.7435316372680725
Energy: 0.8016076188939129
Energy: 0.7767593631346169
Energy: 0.7435316372784571
Energy: 0.8137006018167021
Energy: 0.7156601618674915
Energy: 0.791320763975385
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Energy: 0.7156601618700876
Energy: 0.791320763975385
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Energy: 0.7156601618752327
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Energy: 0.8137006018348752
Energy: 0.8087272458101047
Energy: 0.7636199673270723
Energy: 0.9261748720919052
Energy: 0.8087272458075085
Energy: 0.7636199673166877
Energy: 0.8983474348944998
Energy: 0.8087272458101047
Energy: 0.76361996732188
Energy: 0.9261748720919052
Energy: 0.8087272458075085
Energy: 0.7166899461342306
Energy: 0.8127732055116326
Energy: 0.7741111519860113
Energy: 0.7166899461342306
Energy: 0.8293848642841404
Energy: 0.7557472140049075
Energy: 0.7166899461290384
Energy: 0.8127732055116326
Energy: 0.7741111519834152
Energy: 0.7166899461342306
Energy: 0.717786490051179
Energy: 0.7619241613459647
Energy: 0.762636801501908
Energy: 0.7177864900485827
Energy: 0.7618694601789712
Energy: 0.7625121756420685
Energy: 0.7177864900537752
Energy: 0.761924161348561
Energy: 0.762636801501908
Energy: 0.7177864900563713
Energy: 0.7321267550837377
Energy: 0.7403497160046523
Energy: 0.7396062640101135
Energy: 0.7321267550759964
Energy: 0.7405315460139281
Energy: 0.7396062640101135
Energy: 0.7321267550811417
Energy: 0.740349716015037
Energy: 0.7396062640075173
Energy: 0.7321267550837377
Energy: 0.8059610241356036
Energy: 0.7422156431556618
Energy: 0.7818957703516588
Energy: 0.8059610241304113
Energy: 0.7421933250255758
Energy: 0.7818957703594474
Energy: 0.8059610241433921
Energy: 0.7422156431582579
Energy: 0.7818957703516588
Energy: 0.8059610241459882
Energy: 0.8087693637434159
Energy: 0.80471888167137
Energy: 0.7455951101137488
Energy: 0.7632070905253023
Energy: 0.8035573137360346
Energy: 0.7455951101033642
Energy: 0.7632070905330909
Energy: 0.8008547659122138
Energy: 0.7455951101059604
Energy: 0.763207090535687

minimum gb energy = 0.7154943003625945 eV
minimum distance =  2.29270650457385 Angstroms
sigma value = 185


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

Energy: 0.7673105723184935
Energy: 0.39888391571445025
Energy: 0.40553311144352294
Energy: 0.41268839736711904
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Energy: 0.767310572314179
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Energy: 0.4055331114450638
Energy: 0.41268839736711904
Energy: 0.6823114030054571
Energy: 0.399251542574632
Energy: 0.5346799159187323
Energy: 0.6061948339546227
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Energy: 0.6823114030054571
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Energy: 0.6061948339577045
Energy: 0.48467204105930134
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Energy: 0.5201019461417419
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Energy: 0.4252276455825271
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Energy: 0.48464861311863444
Energy: 0.473264723561817
Energy: 0.3997529957283684
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Energy: 0.6643826917246071
Energy: 0.6751160805746277
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Energy: 0.6751160805835649
Energy: 0.3988761788459275
Energy: 0.5694281730261775
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Energy: 0.4055331114444474
Energy: 0.4121932894951198
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Energy: 0.40553311144383103
Energy: 0.6505827625098343
Energy: 0.39888391571999743
Energy: 0.40553311144352294
Energy: 0.4121932894951198
Energy: 0.6623263875928257
Energy: 0.3992515425783301
Energy: 0.48889429097499926
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Energy: 0.41417060157842556
Energy: 0.4993917956454394
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Energy: 0.45617621075096665
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Energy: 0.41417060158181546
Energy: 0.4993917956500621
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Energy: 0.7061505297945002
Energy: 0.4056511259167899
Energy: 0.5973616143397955
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Energy: 0.6314016843803161
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Energy: 0.4068774311851558
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Energy: 0.5202303480527047
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Energy: 0.48582803185436024
Energy: 0.40687743118638847
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Energy: 0.6503981637879952
Energy: 0.4053471504697517
Energy: 0.6335455544955992
Energy: 0.6923410648153067
Energy: 0.40534715046543723
Energy: 0.6313499175358326
Energy: 0.6923410648146904
Energy: 0.40534715046358816
Energy: 0.6335455544980647
Energy: 0.6923410648116085
Energy: 0.4053471504675944
Energy: 0.6534469600941052
Energy: 0.5142891501807966
Energy: 0.4132875621295195
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Energy: 0.6534469601018096
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Energy: 0.4055435148938988
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Energy: 0.4055435148988016
Energy: 0.6453519035513974
Energy: 0.40506423463942276
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Energy: 0.39975299572898476
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Energy: 0.6751160805792504
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Energy: 0.7673105723175689
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Energy: 0.4068774311879294
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Energy: 0.40687743118854575
Energy: 0.39945197071142896
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Energy: 0.6503981637901524
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Energy: 0.6351472622110129
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Energy: 0.4765100661452876
Energy: 0.6350297811241009
Energy: 0.6503981637873788
Energy: 0.5407399488252622
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Energy: 0.650398163787687
Energy: 0.40534715047067627
Energy: 0.597171669982144
Energy: 0.6923410648128412
Energy: 0.40534715047005987
Energy: 0.6313499175355244
Energy: 0.6923410648146904
Energy: 0.4053471504675944
Energy: 0.5971716699861503
Energy: 0.6923410648103758
Energy: 0.4053471504743744
Energy: 0.6534469601015014
Energy: 0.5201019461429746
Energy: 0.4132875621335258
Energy: 0.6534469601061241
Energy: 0.4859136148371456
Energy: 0.4132875621335258
Energy: 0.6534469601104386
Energy: 0.5201019461426665
Energy: 0.41328756213968937
Energy: 0.6534469601055076
Energy: 0.4252276455812944
Energy: 0.6460303869337484
Energy: 0.4050642346428127
Energy: 0.5005403813665922
Energy: 0.6117704429955086
Energy: 0.4050642346431209
Energy: 0.4252276455862253
Energy: 0.6460303869318992
Energy: 0.405064234639731
Energy: 0.5005403813604566
Energy: 0.4846486131170936
Energy: 0.4732647235658233
Energy: 0.3997529957274439
Energy: 0.5369754061501055
Energy: 0.515976289952347
Energy: 0.3997529957274439
Energy: 0.4846486131210999
Energy: 0.47326472357198685
Energy: 0.39975299572377376
Energy: 0.5369754061541119
Energy: 0.664382691722758
Energy: 0.6751160805820241
Energy: 0.39887617885147475
Energy: 0.569428173006174
Energy: 0.6751160805841813
Energy: 0.3988761788496256
Energy: 0.6643826917239907
Energy: 0.6751160805798667
Energy: 0.3988761788474684
Energy: 0.5694281730058657

minimum gb energy = 0.3988761788459275 eV
minimum distance =  2.37962845439443 Angstroms
sigma value = 33


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

Energy: 0.6866367312132619
Energy: 0.7113835600340147
Energy: 0.7116508352619568
Energy: 0.6837931270985474
Energy: 0.7113835600407821
Energy: 0.7116508352653405
Energy: 0.6866367312217209
Energy: 0.7113835600458575
Energy: 0.7116508352619568
Energy: 0.6837931271002392
Energy: 0.6952510642446417
Energy: 0.687120205527401
Energy: 0.691422057990902
Energy: 0.6952510642463335
Energy: 0.6871202055257093
Energy: 0.6914220579858266
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Energy: 0.6871202055257093
Energy: 0.6914220579892101
Energy: 0.6952510642446417
Energy: 0.6993285890432862
Energy: 0.68697513114626
Energy: 0.6920800082459887
Energy: 0.6993285890382416
Energy: 0.6869751311496436
Energy: 0.6920800082459887
Energy: 0.7116559100719168
Energy: 0.6869751311411846
Energy: 0.6920800082476805
Energy: 0.7071883821074416
Energy: 0.6823556641458953
Energy: 0.6843096718242803
Energy: 0.6902628985570388
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Energy: 0.6843096718158213
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Energy: 0.6843096718208967
Energy: 0.6902628985553471
Energy: 0.6823556641509707
Energy: 0.6896299058013872
Energy: 0.703367078342402
Energy: 0.6720349091326248
Energy: 0.6896299058098462
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Energy: 0.6896299058098462
Energy: 0.703367078333943
Energy: 0.6720349091241656
Energy: 0.6896299058081544
Energy: 0.705638873797659
Energy: 0.7344546555785342
Energy: 0.7003701030080454
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Energy: 0.7141494191091684
Energy: 0.7044010474982757
Energy: 0.6877005693094351
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Energy: 0.7044010474999675
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Energy: 0.6877005693060514
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Energy: 0.6646054215218511
Energy: 0.7749586110518702
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Energy: 0.7115690925553054
Energy: 0.6871699666056589
Energy: 0.6795084699843112
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Energy: 0.6871699666056589
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Energy: 0.7132766643615834
Energy: 0.7146749234509262
Energy: 0.7142740696556334
Energy: 0.7132766643649672
Energy: 0.7146749234492343
Energy: 0.7142751300900009
Energy: 0.7132766643700426
Energy: 0.7146749234509262
Energy: 0.7142740696573253
Energy: 0.7132766643683508
Energy: 0.686721948667951
Energy: 0.7410946819233752
Energy: 0.6921012085195637
Energy: 0.6867219486628756
Energy: 0.7062863774403491
Energy: 0.6919292618703206
Energy: 0.6867219486696429
Energy: 0.7410946819216835
Energy: 0.6921012085178719
Energy: 0.686721948667951
Energy: 0.6845143795993937
Energy: 0.6895061287949276
Energy: 0.6902295139097928
Energy: 0.6845143795993937
Energy: 0.6895029096272681
Energy: 0.6902261290538738
Energy: 0.684514379604469
Energy: 0.6895061287966193
Energy: 0.6902295138979501
Energy: 0.6845143796027772
Energy: 0.687043929460005
Energy: 0.6950168918038185
Energy: 0.7082518684590235
Energy: 0.6870439294616969
Energy: 0.6950168918055103
Energy: 0.7082518684590235
Energy: 0.687043929451546
Energy: 0.6950168918021575
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Energy: 0.687043929451546
Energy: 0.7124398279618986
Energy: 0.6843171432220772
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minimum gb energy = 0.65837480348835 eV
minimum distance =  2.28556027906399 Angstroms
sigma value = 219


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

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Energy: 0.93348875292528
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Energy: 0.910668343964018
Energy: 0.9334887529230405
Energy: 0.8976574450518212

minimum gb energy = 0.8529916582144483 eV
minimum distance =  2.31671971246521 Angstroms
sigma value = 15


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

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Energy: 1.0349577721281702
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minimum gb energy = 0.9675383515271923 eV
minimum distance =  2.30799762963182 Angstroms
sigma value = 293


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

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Energy: 0.9641856313909115
Energy: 1.0106666300193248
Energy: 0.9804081156086217
Energy: 0.9641856313871179
Energy: 0.9634881955400877
Energy: 1.0117286768655709
Energy: 1.0517570904348506
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Energy: 1.0117286768663294
Energy: 1.0517570904272635
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Energy: 1.0517570904351037
Energy: 0.9634881955380644
Energy: 1.0256000707495605
Energy: 0.9829519062238341
Energy: 0.9752110886241855
Energy: 1.0256000707429849
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Energy: 1.0256000707495605
Energy: 0.9829519062248456
Energy: 0.9752110886236796
Energy: 1.0256000707434907
Energy: 1.0085390842447017
Energy: 1.0084528755955258
Energy: 0.9718212536776354
Energy: 1.0085390842434605
Energy: 1.0084528755972961
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Energy: 0.9828180705053474
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Energy: 0.9726175493072587
Energy: 0.9828180705018068
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Energy: 0.9726175493052356
Energy: 0.9828180705046119
Energy: 0.9873583524428594
Energy: 0.9726175493077646
Energy: 0.9828180705013009
Energy: 1.0414895671951399
Energy: 1.0328654818600815
Energy: 0.9649910970030943
Energy: 1.0414895671908404
Energy: 1.0328654818532532
Energy: 0.9649910970048646
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Energy: 1.0328654818600815
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Energy: 1.041489567190082
Energy: 0.999828436878966
Energy: 0.994523307170937
Energy: 1.0077731644059258
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Energy: 0.994523307168155
Energy: 1.0077731644066612
Energy: 0.9998284368787131
Energy: 1.027113277994863
Energy: 0.9648893944461192
Energy: 1.0163732077657137
Energy: 1.027113277992081
Energy: 0.9648893944433372
Energy: 1.016373207762702
Energy: 1.0271132779941043
Energy: 0.9648893944456134
Energy: 1.016373207765461
Energy: 1.0271132779938514
Energy: 0.9902375656698496
Energy: 0.9723273335647513
Energy: 0.9963177156628573
Energy: 0.990237565670631
Energy: 0.9723273335672804
Energy: 0.9963177156673636
Energy: 0.9902375656701253
Energy: 0.9723273335650042
Energy: 0.9963177156635928
Energy: 0.9902375656696195
Energy: 1.0077492414076414
Energy: 0.9717727842900371
Energy: 1.0395007972064676
Energy: 1.0077492414101705
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Energy: 1.0395007972049504
Energy: 1.007749241408653
Energy: 0.9717727842897843
Energy: 1.039500797206215
Energy: 1.0077492414106763
Energy: 1.025858230030248
Energy: 0.9779340420304629
Energy: 0.9819890918633087
Energy: 1.025858230038065
Energy: 0.9779340420269222
Energy: 0.981989091865332
Energy: 1.0258582300305008
Energy: 0.97793404203021
Energy: 0.9819890918633087
Energy: 1.0258582300385708
Energy: 0.9726873300899292
Energy: 1.055314211216014
Energy: 1.0120623740022887
Energy: 0.972687330085124
Energy: 1.055314211213738
Energy: 1.012062373999001
Energy: 0.9726873300914467
Energy: 1.0553142112101974
Energy: 1.0120623740033001
Energy: 0.972687330085124
Energy: 0.9636641318037047
Energy: 0.9638898404171864
Energy: 1.0195301496047124
Energy: 0.9636641318034518
Energy: 0.9638898404217388
Energy: 1.019530149605977
Energy: 0.9636641318042105
Energy: 0.9638898404164277
Energy: 1.019530149603448
Energy: 0.9636641318034518
Energy: 1.0706197704557718
Energy: 1.0080755727049944
Energy: 1.008203111507915
Energy: 1.0706197704540015
Energy: 1.0080755727024886
Energy: 1.008203111508421
Energy: 1.0706197704560247
Energy: 1.0080755727044886
Energy: 1.008203111507915
Energy: 1.0706197704534957
Energy: 0.9641856313893941
Energy: 1.0106666300208422
Energy: 0.9804081156043223
Energy: 0.964185631384083
Energy: 1.0106666300218539
Energy: 0.980408115607863
Energy: 0.9641856313893941
Energy: 1.0106666300218539
Energy: 0.980408115605081
Energy: 0.9641856313843359
Energy: 0.963488195539329
Energy: 1.0117286768638005
Energy: 1.051757090434092
Energy: 0.9634881955378116
Energy: 1.0117286768655709
Energy: 1.0517570904252402
Energy: 0.9634881955385702
Energy: 1.0117286768640532
Energy: 1.051757090433839
Energy: 0.9634881955362941
Energy: 1.0256000707500663
Energy: 0.9829519062245697
Energy: 0.9751810684711372
Energy: 1.0256000707450081
Energy: 0.9829519062250756
Energy: 0.9751810684767012
Energy: 1.0256000707488018
Energy: 0.9829519062240638
Energy: 0.9751810684701256
Energy: 1.0256000707447552
Energy: 1.0085390842507715
Energy: 1.0084528755932496
Energy: 0.9718212536788999
Energy: 1.0085390842485187
Energy: 1.0084528755945144
Energy: 0.9718212536859813
Energy: 1.0085390842500361
Energy: 1.0084528755937554
Energy: 0.9718212536781412
Energy: 1.0085390842480126

minimum gb energy = 0.9634881955362941 eV
minimum distance =  2.30224161285508 Angstroms
sigma value = 293


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

Energy: 0.9844686536812749
Energy: 0.9878605737926854
Energy: 0.9855054985760585
Energy: 0.9844686536799037
Energy: 0.9878605737949708
Energy: 0.9855054985756013
Energy: 0.9844686536812749
Energy: 0.9878605737926854
Energy: 0.9855054985760585
Energy: 0.9844686536799037
Energy: 0.9836059928136399
Energy: 0.9849356118564706
Energy: 0.985244108519402
Energy: 0.9836059928136399
Energy: 0.9849356118564706
Energy: 0.9852441085184879
Energy: 0.983605992813183
Energy: 0.9849356118564706
Energy: 0.9852441085180306
Energy: 0.9836059928145541
Energy: 0.9843451304634954
Energy: 0.9844194910062183
Energy: 1.065485659518825
Energy: 0.9843451304671521
Energy: 0.9844194910094181
Energy: 1.0654856595201962
Energy: 0.9843451304607528
Energy: 0.9844194910062183
Energy: 1.065485659519739
Energy: 0.984345130465781
Energy: 1.0653785275465897
Energy: 0.984429192272241
Energy: 0.9842203115866596
Energy: 1.0653785275502465
Energy: 0.984429192271784
Energy: 0.984220311583917
Energy: 1.0653785275456757
Energy: 0.984429192272241
Energy: 0.9842203115871168
Energy: 1.0653785275529892
Energy: 0.9852263302340571
Energy: 0.9849940227172788
Energy: 0.9836429891598145
Energy: 0.9852263302326859
Energy: 0.9849940227159073
Energy: 0.9836429891580277
Energy: 0.9852263302349713
Energy: 0.9849940227172788
Energy: 0.9836429891602715
Energy: 0.9852263302317718
Energy: 0.9878605737940567
Energy: 0.9855054985733159
Energy: 0.9844686536808178
Energy: 0.9878605737917712
Energy: 0.9855054985742301
Energy: 0.9844686536799037
Energy: 0.9878605737945138
Energy: 0.9855054985733159
Energy: 0.9844686536812749
Energy: 0.9878605737922281
Energy: 0.9849356118564706
Energy: 0.9852441085184879
Energy: 0.9836059928122687
Energy: 0.9849356118560134
Energy: 0.9852441085184879
Energy: 0.9836059928113545
Energy: 0.9849356118569276
Energy: 0.9852441085207733
Energy: 0.9836059928113545
Energy: 0.9849356118564706
Energy: 0.9844194910098751
Energy: 1.0654856595192823
Energy: 0.9843451304616669
Energy: 0.9844194910066755
Energy: 1.0654856595160824
Energy: 0.9843451304630384
Energy: 0.9844194910103322
Energy: 1.065485659518825
Energy: 0.9843451304625811
Energy: 0.9844194910066755
Energy: 0.984429192271784
Energy: 0.9842203115834598
Energy: 1.0653785275470466
Energy: 0.9844291922726982
Energy: 0.9842203115871168
Energy: 1.0653785275497893
Energy: 0.9844291922713267
Energy: 0.984220311584374
Energy: 1.0653785275452183
Energy: 0.9844291922726982
Energy: 0.9849940227163645
Energy: 0.9836429891575704
Energy: 0.9852263302331429
Energy: 0.9849940227172788
Energy: 0.9836429891602715
Energy: 0.9852263302331429
Energy: 0.9849940227163645
Energy: 0.9836429891575704
Energy: 0.9852263302349713
Energy: 0.9849940227177356
Energy: 0.985505498574687
Energy: 0.9844686536808178
Energy: 0.9878605737949708
Energy: 0.9855054985742301
Energy: 0.9844686536803607
Energy: 0.9878605737926854
Energy: 0.9855054985751444
Energy: 0.9844686536803607
Energy: 0.9878605737954279
Energy: 0.9855054985742301
Energy: 0.9852441085198591
Energy: 0.9836059928150114
Energy: 0.9849356118564706
Energy: 0.9852441085189448
Energy: 0.9836059928127258
Energy: 0.9849356118564706
Energy: 0.9852441085212303
Energy: 0.9836059928099831
Energy: 0.9849356118569276
Energy: 0.9852441085212303
Energy: 1.065485659519739
Energy: 0.9843451304680664
Energy: 0.9844194910098751
Energy: 1.0654856595174536
Energy: 0.9843451304644095
Energy: 0.9844194910066755
Energy: 1.0654856595179107
Energy: 0.9843451304689805
Energy: 0.9844194910103322
Energy: 1.0654856595174536
Energy: 0.9842203115866596
Energy: 1.0653785275497893
Energy: 0.9844291922713267
Energy: 0.984220311584374
Energy: 1.0653785275461327
Energy: 0.984429192272241
Energy: 0.9842203115875737
Energy: 1.0653785275507037
Energy: 0.984429192271784
Energy: 0.984220311583917
Energy: 0.983642989159399
Energy: 0.9852263302322286
Energy: 0.9849940227168215
Energy: 0.9836429891575704
Energy: 0.9852263302322286
Energy: 0.9849940227172788
Energy: 0.9836429891607287
Energy: 0.9852263302336001
Energy: 0.9849940227159073
Energy: 0.9836429891571136
Energy: 0.9844686536812749
Energy: 0.9878605737935996
Energy: 0.9855054985751444
Energy: 0.9844686536794466
Energy: 0.987860573795885
Energy: 0.9855054985751444
Energy: 0.9844686536812749
Energy: 0.9878605737931424
Energy: 0.985505498574687
Energy: 0.9844686536799037
Energy: 0.9836059928113545
Energy: 0.9849356118560134
Energy: 0.9852441085203162
Energy: 0.9836059928118116
Energy: 0.9849356118564706
Energy: 0.9852441085198591
Energy: 0.9836059928122687
Energy: 0.9849356118569276
Energy: 0.9852441085198591
Energy: 0.9836059928113545
Energy: 0.9843451304630384
Energy: 0.9844194910057611
Energy: 1.0654856595174536
Energy: 0.9843451304680664
Energy: 0.9844194910094181
Energy: 1.0654856595201962
Energy: 0.9843451304634954
Energy: 0.9844194910057611
Energy: 1.0654856595192823
Energy: 0.9843451304666951
Energy: 1.0653785275443042
Energy: 0.984429192272241
Energy: 0.9842203115875737
Energy: 1.0653785275493324
Energy: 0.984429192271784
Energy: 0.9842203115848311
Energy: 1.0653785275461327
Energy: 0.984429192272241
Energy: 0.9842203115875737
Energy: 1.0653785275497893
Energy: 0.9852263302326859
Energy: 0.9849940227177356
Energy: 0.9836429891598145
Energy: 0.9852263302317718
Energy: 0.9849940227163645
Energy: 0.9836429891566563
Energy: 0.9852263302326859
Energy: 0.9849940227177356
Energy: 0.9836429891602715
Energy: 0.9852263302345142
Energy: 0.9878605737949708
Energy: 0.9855054985737729
Energy: 0.9844686536808178
Energy: 0.9878605737931424
Energy: 0.9855054985742301
Energy: 0.9844686536803607
Energy: 0.987860573795885
Energy: 0.9855054985742301
Energy: 0.9844686536803607
Energy: 0.9878605737931424
Energy: 0.9849356118564706
Energy: 0.9852441085189448
Energy: 0.9836059928127258
Energy: 0.9849356118560134
Energy: 0.9852441085189448
Energy: 0.9836059928118116
Energy: 0.9849356118560134
Energy: 0.9852441085203162
Energy: 0.9836059928127258
Energy: 0.9849356118560134

minimum gb energy = 0.9836059928099831 eV
minimum distance =  2.31446198815064 Angstroms
sigma value = 15


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

Energy: 1.021232401011447
Energy: 1.0115225760086606
Energy: 0.9998549125527902
Energy: 0.9863477240656711
Energy: 1.0115225760128048
Energy: 0.999854912548646
Energy: 1.0212324010073404
Energy: 1.0115225760148767
Energy: 0.9998549125507182
Energy: 0.9863477240656711
Energy: 1.0165474602462945
Energy: 0.9514177477205574
Energy: 0.9435290190935286
Energy: 1.0165474602442224
Energy: 0.9514177477205574
Energy: 0.9435290190873125
Energy: 1.0165474602462945
Energy: 0.9514177477226294
Energy: 0.9435290190852403
Energy: 1.0165474602442224
Energy: 1.0096721070273251
Energy: 1.0076162643867508
Energy: 1.1112757388809973
Energy: 1.0096721070190369
Energy: 1.0076162643805346
Energy: 1.1112757388809973
Energy: 1.0096721070190369
Energy: 1.0076162643763904
Energy: 1.1112757388664931
Energy: 1.0096721070148929
Energy: 0.937966257936905
Energy: 0.9919091616308582
Energy: 0.9372720081150353
Energy: 0.9379662579472652
Energy: 0.9919091616267142
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Energy: 0.937272008098459
Energy: 0.9379662579451931
Energy: 0.9435883595216163
Energy: 0.9517904402880343
Energy: 1.0128019262849193
Energy: 0.9435883595278325
Energy: 0.9517904402838901
Energy: 1.0128019262766312
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Energy: 0.9517904402859623
Energy: 1.0128019262787031
Energy: 0.9435883595257605
Energy: 0.9855059489728005
Energy: 1.029122153509138
Energy: 0.935007333881799
Energy: 0.9855059489748726
Energy: 1.0291221532315984
Energy: 0.935007333879727
Energy: 0.9855059489707285
Energy: 1.0291221537141941
Energy: 0.9350073338838713
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Energy: 0.9347958249850044
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Energy: 1.0076124746216115
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Energy: 1.0165489069642406
Energy: 1.0075783280322919
Energy: 0.9347958249932925
Energy: 1.0165489069642406
Energy: 1.0076124746153952
Energy: 0.9485674738618695
Energy: 1.0447449517698444
Energy: 1.0160024532260057
Energy: 0.9485674738556533
Energy: 1.0447449517781326
Energy: 1.0160024532322216
Energy: 0.9485674738577254
Energy: 1.0447449517760607
Energy: 1.0160024532280776
Energy: 0.9485674738577254
Energy: 0.9316930154408913
Energy: 0.9885723690926811
Energy: 0.9854929966988947
Energy: 0.9316930154346751
Energy: 0.9884162809796736
Energy: 0.9854487357073589
Energy: 0.931693015428459
Energy: 0.9885723690947532
Energy: 0.9854929966926786
Energy: 0.9316930154367472
Energy: 0.94864057490829
Energy: 1.0930265722869623
Energy: 0.9607983966866284
Energy: 0.9486430653795892
Energy: 1.0930265722931785
Energy: 0.9604730092037024
Energy: 0.9486405749206847
Energy: 1.0930265722848902
Energy: 0.9607983966804122
Energy: 0.9486430653858053
Energy: 0.9929074332103601
Energy: 0.9216138151991656
Energy: 1.0038649120369465
Energy: 0.9929074332207203
Energy: 0.9216138152033099
Energy: 1.0038649120369465
Energy: 0.9929074332145041
Energy: 0.9216138151970936
Energy: 1.0038649120348744
Energy: 0.9929074332145041
Energy: 1.0308516011377056
Energy: 0.9312181400661532
Energy: 1.114423609544698
Energy: 1.0308516011294175
Energy: 0.9314692779239581
Energy: 1.1144236095384819
Energy: 1.0308516011232014
Energy: 0.9312181400765133
Energy: 1.1144236095322657
Energy: 1.0308516011252735
Energy: 1.0233890397528436
Energy: 0.9351154826864589
Energy: 0.9812409334280088
Energy: 1.0233890397528436
Energy: 0.9351154826885311
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Energy: 1.0233890397528436
Energy: 0.9351154826885311
Energy: 0.9812409334259368
Energy: 1.0233890397549157
Energy: 0.9366454882323769
Energy: 0.936437555173608
Energy: 0.9502602137027966
Energy: 0.9366454882303049
Energy: 0.9364375551632479
Energy: 0.9502602137007244
Energy: 0.9366454882261608
Energy: 0.9364375551591038
Energy: 0.9502602137027966
Energy: 0.9366454882282328
Energy: 1.0103986801372862
Energy: 1.0108908068350986
Energy: 0.9473614273300668
Energy: 1.010398680135214
Energy: 1.0108908068330265
Energy: 0.9476426799420962
Energy: 1.010398680135214
Energy: 1.0108908068309546
Energy: 0.9473614273342108
Energy: 1.010398680135214
Energy: 0.9420438388410391
Energy: 0.9556578938172023
Energy: 1.0602514302905492
Energy: 0.9420438388410391
Energy: 0.9556578938047702
Energy: 1.0602514302967656
Energy: 0.9420438388368952
Energy: 0.9556578938172023
Energy: 1.0602514302926214
Energy: 0.9420438388472554
Energy: 0.9933955708019974
Energy: 1.0764674895906396
Energy: 1.0363235956912669
Energy: 0.9588641332604503
Energy: 1.0764674895823516
Energy: 1.0363235956912669
Energy: 0.9933955707999255
Energy: 1.0764674895885677
Energy: 1.0363235956954109
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Energy: 0.9562446356765173
Energy: 0.9512170388010396
Energy: 0.9407942455617126
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Energy: 0.9407942455637848
Energy: 0.9562446356703012
Energy: 0.9512170388051837
Energy: 0.9407942455658568
Energy: 0.9562446356765173
Energy: 0.9389333274433719
Energy: 0.9816454023526907
Energy: 0.9521628487367146
Energy: 0.9389333274412999
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Energy: 0.9521628487346426
Energy: 0.938933327445444
Energy: 0.9816454023609789
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Energy: 0.938933327453732
Energy: 1.019922669907339
Energy: 0.947354746384465
Energy: 0.9798939160844348
Energy: 1.0199226699135548
Energy: 0.947354746384465
Energy: 0.9798939160885789
Energy: 1.019922669917699
Energy: 0.947354746384465
Energy: 0.9798939160927229
Energy: 1.0199226699135548
Energy: 0.9846312761484234
Energy: 0.9507238197397628
Energy: 1.0788805430990618
Energy: 0.9846312761422075
Energy: 0.9507238197397628
Energy: 1.0788805430969897
Energy: 0.9846312761339192
Energy: 0.9507238197335468
Energy: 1.0788805430907737
Energy: 0.9846312761380633
Energy: 1.0009461903152121
Energy: 1.048002979666605
Energy: 0.9354935890830578
Energy: 1.0009461903110681
Energy: 1.048002979664533
Energy: 0.9354935890872019
Energy: 1.0009461903110681
Energy: 1.048002979670749
Energy: 0.9354935890892739
Energy: 1.000946190317284
Energy: 1.0121266325060982
Energy: 1.0064311566834463
Energy: 1.005519042912404
Energy: 1.0118851199999852
Energy: 1.0064445345098108
Energy: 1.005519042906188
Energy: 1.0121266325081701
Energy: 1.0064311566855184
Energy: 1.005519042906188
Energy: 1.011885119987553
Energy: 0.9379639082781848
Energy: 0.9614623738282609
Energy: 0.9196752593637898
Energy: 0.9379639082719688
Energy: 0.9614623738220825
Energy: 0.9196752593700059
Energy: 0.9379639082678246
Energy: 0.9614623738200104
Energy: 0.9196752593637898
Energy: 0.9379639082740406
Energy: 0.963834298305328
Energy: 0.9876320882667798
Energy: 1.020597223242498
Energy: 0.9638342983032558
Energy: 0.9876320882626359
Energy: 1.0205972232321379
Energy: 0.9638342983094719
Energy: 0.987632088272996
Energy: 1.0205972232362819
Energy: 0.9638342983094719
Energy: 0.9493169659202364
Energy: 1.0296679203705839
Energy: 0.9977052067364438
Energy: 0.9493202348101141
Energy: 1.0296679203623333
Energy: 0.9889545119854385
Energy: 0.9493169659160925
Energy: 1.0296679203664398
Energy: 0.9977052067322998
Energy: 0.9493202348101141
Energy: 1.0345644615717966
Energy: 0.9237147055709997
Energy: 1.000446278709567
Energy: 1.0345644615717966
Energy: 0.9237147055668555
Energy: 1.000446278705423
Energy: 1.0345644615697245
Energy: 0.9237147055647835
Energy: 1.0004462787012787
Energy: 1.0345644615697245
Energy: 0.9690205265687227
Energy: 0.9510467349088657
Energy: 1.132604745355516
Energy: 0.9690205265749388
Energy: 0.9510467349026498
Energy: 1.1326047453513715
Energy: 0.9690205265645786
Energy: 0.9510467349005778
Energy: 1.1326047453410115
Energy: 0.9690205265707947
Energy: 0.9804907322791219
Energy: 0.9305392226055467
Energy: 0.9685243124428674
Energy: 0.9785783861710539
Energy: 0.9305321166296769
Energy: 0.9685243124407956
Energy: 0.9804907322749777
Energy: 0.9305392225993305
Energy: 0.9685243124345795
Energy: 0.9785783861772699
Energy: 0.9541722971182114
Energy: 0.9384012800564838
Energy: 0.9769669726072896
Energy: 0.9541722971140674
Energy: 0.9384012800523397
Energy: 0.9769669726052176
Energy: 0.9541722971078512
Energy: 0.9384012800564838
Energy: 0.9769669726114337
Energy: 0.9541722971057791
Energy: 1.0303814843734465
Energy: 1.0053648626885496
Energy: 0.9516930841459876
Energy: 1.0303814843672303
Energy: 1.0053648626926934
Energy: 0.9516948058542823
Energy: 1.0303814843693022
Energy: 1.0053648626926934
Energy: 0.9516930841522039
Energy: 1.0303814843754806
Energy: 0.9245458119707084
Energy: 0.9529580880328289
Energy: 1.0612499325001468
Energy: 0.9245458119707084
Energy: 0.9529580880349009
Energy: 1.0612499325001468
Energy: 0.9245458119748522
Energy: 0.9529580880307568
Energy: 1.0612499325022189
Energy: 0.9245458119686363
Energy: 1.020271881611992
Energy: 1.0621298275526811
Energy: 1.0106983378905532
Energy: 0.9854763922976177
Energy: 1.062129827550609
Energy: 1.0106983378884813
Energy: 1.020271881611992
Energy: 1.062129827548537
Energy: 1.0106983378864092
Energy: 0.9854763922976177
Energy: 1.0194603035424739
Energy: 0.935783952467116
Energy: 1.039007768035515
Energy: 0.9853988698744204
Energy: 0.9357839524774763
Energy: 1.0478763721393298
Energy: 1.019460303536258
Energy: 0.9357839524754041
Energy: 1.039007768031371
Energy: 0.9853988698661323
Energy: 0.9239117396722819
Energy: 1.0203158755843769
Energy: 0.9529920212164349
Energy: 0.9239117396743539
Energy: 1.0203158755885209
Energy: 0.952992021222651
Energy: 0.9239117396681378
Energy: 1.0203158755926647
Energy: 0.952992021222651
Energy: 0.9239117396681378
Energy: 0.9775805803302036
Energy: 0.9530387940132898
Energy: 0.9402624166729243
Energy: 0.9775805803281316
Energy: 0.9530387940091458
Energy: 0.9402624166708523
Energy: 0.9775805803281316
Energy: 0.9530387940050017
Energy: 0.9402624166625642
Energy: 0.9775805803302036
Energy: 0.954581293723321
Energy: 1.0617694661374364
Energy: 0.9336428378438023
Energy: 0.9545812937212489
Energy: 1.0617694661291484
Energy: 0.9338820589418486
Energy: 0.954581293723321
Energy: 1.0617694661332922
Energy: 0.9336428378438023
Energy: 0.9545812937212489
Energy: 1.0614540098975744
Energy: 1.0028481724547085
Energy: 0.9313727260340299
Energy: 1.0614540098975744
Energy: 1.0028481724609246
Energy: 0.931372726040246
Energy: 1.0614540098955023
Energy: 1.0028481724588525
Energy: 0.93137272604439
Energy: 1.0614540098955023
Energy: 0.9376244587638262
Energy: 1.0672095270905724
Energy: 0.9504479488188639
Energy: 0.9376244587555378
Energy: 1.0672095270988602
Energy: 0.9504479488250799
Energy: 0.9376244587555378
Energy: 1.0672095271009323
Energy: 0.950447948823008
Energy: 0.9376244587679324
Energy: 1.0743022863200338
Energy: 0.9875696277522937
Energy: 0.9247704553020654
Energy: 1.074302286330394
Energy: 0.9875696277543657
Energy: 0.9247704552999934
Energy: 1.074302286324178
Energy: 0.9875696277522937
Energy: 0.9247704553041375
Energy: 1.0743022863179619
Energy: 0.9486542771708228
Energy: 1.0062366159178078
Energy: 0.9905904803143294
Energy: 0.948654277181183
Energy: 1.006236615921952
Energy: 0.9905904803184735
Energy: 0.948654277174967
Energy: 1.006236615921952
Energy: 0.9905904803288336
Energy: 0.9486542771708228
Energy: 1.0420396521584738
Energy: 0.9894592894749639
Energy: 0.9875733809666831
Energy: 1.0420396521543298
Energy: 0.9894837250388078
Energy: 0.9877121827324673
Energy: 1.042039652162618
Energy: 0.9894592894728917
Energy: 0.9875733809563231
Energy: 1.042039652166762
Energy: 0.9503146179202245
Energy: 0.9220043412074256
Energy: 1.0017174755264864
Energy: 0.9503146179202245
Energy: 0.9220043412115698
Energy: 1.0017174755306304
Energy: 0.9503146179243687
Energy: 0.9220043412177857
Energy: 1.0017174755327025
Energy: 0.9503146179202245
Energy: 1.0080817240538236
Energy: 1.0219681701111845
Energy: 1.0072787607618907
Energy: 1.0080817240476077
Energy: 1.0219681701070404
Energy: 1.007278760770179
Energy: 1.0080817240476077
Energy: 1.0219681701070404
Energy: 1.0072787607639628
Energy: 1.0080817240558957
Energy: 1.0082691358842677
Energy: 0.9315486089511701
Energy: 0.9853574183534052
Energy: 1.0082691358925557
Energy: 0.931542514526956
Energy: 0.9853574183596213
Energy: 1.0082691358821956
Energy: 0.931548608942882
Energy: 0.9853574183699814
Energy: 1.0082691358801235
Energy: 0.9541974031250758
Energy: 0.9567126879938707
Energy: 1.058674919380619
Energy: 0.9541974031168253
Energy: 0.9567126879938707
Energy: 1.058674919376475
Energy: 0.9541974031250758
Energy: 0.9567126879980146
Energy: 1.0586749193723313
Energy: 0.954197403127148
Energy: 1.014238600660738
Energy: 0.9725172561157124
Energy: 0.9485768787205054
Energy: 1.0142386006565942
Energy: 0.9725172561219286
Energy: 0.9486942494115097
Energy: 1.014238600654522
Energy: 0.9725172561219286
Energy: 0.9485768787163615
Energy: 1.0142386006628101
Energy: 0.925355378247292
Energy: 0.9700631422266643
Energy: 1.0500987238155703
Energy: 0.92535537824522
Energy: 0.9700631422245923
Energy: 1.0500987238134982
Energy: 0.9253553782535082
Energy: 0.9700631422328804
Energy: 1.0500987238155703
Energy: 0.92535537824522
Energy: 0.9860720483267422
Energy: 1.0601457058606392
Energy: 0.9375664593874294
Energy: 0.9502452923296519
Energy: 1.0601457058564954
Energy: 0.9375664593853573
Energy: 0.9860720483391745
Energy: 1.0601457058544232
Energy: 0.9375664593812132
Energy: 0.9502452923275799

minimum gb energy = 0.9196752593637898 eV
minimum distance =  2.27266470533516 Angstroms
sigma value = 437


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

Energy: 0.8846444759253104
Energy: 0.8843510031083817
Energy: 0.884196726194186
Energy: 0.884644475927575
Energy: 0.88435100311895
Energy: 0.8841967261949408
Energy: 0.8846444759245555
Energy: 0.8843510031181951
Energy: 0.8841967261851618
Energy: 0.8846444759283298
Energy: 0.9531835418002463
Energy: 0.8624217796168681
Energy: 0.8763213214495732
Energy: 0.9531835418002463
Energy: 0.8624217796176229
Energy: 0.8763213214541025
Energy: 0.9531835418002463
Energy: 0.8624217796168681
Energy: 0.8763213214495732
Energy: 0.9531835418002463
Energy: 0.8553655371782616
Energy: 0.8535805504185605
Energy: 0.9685531207171814
Energy: 0.8553655371737323
Energy: 0.8535805504200703
Energy: 0.9685537395638671
Energy: 0.855365537178982
Energy: 0.8535805504193155
Energy: 0.9685512095586774
Energy: 0.8553655371707127
Energy: 0.973916246555042
Energy: 0.980247359354384
Energy: 0.9084607408914622
Energy: 0.9739162465542872
Energy: 0.9802473593551388
Energy: 0.9084607408914622
Energy: 0.9739162465557969
Energy: 0.9802473593581584
Energy: 0.9084607408914622
Energy: 0.973916246555042
Energy: 0.910757611036415
Energy: 0.8727972440563309
Energy: 0.9587527446670387
Energy: 0.9107576110356602
Energy: 0.8727972440578406
Energy: 0.9587527446662839
Energy: 0.9107576110349053
Energy: 0.872797244055576
Energy: 0.9587527446647742
Energy: 0.9107576110356602
Energy: 0.9106897815042191
Energy: 0.915523190586825
Energy: 0.8623216107876689
Energy: 0.9106897815011995
Energy: 0.9155231905807857
Energy: 0.862321610786914
Energy: 0.9106897815042191
Energy: 0.9155231905830504
Energy: 0.8623216107876689
Energy: 0.9106897815019545
Energy: 0.9111569308131053
Energy: 0.9389709376237105
Energy: 0.8536424604478038
Energy: 0.9111569308191445
Energy: 0.8967147397469435
Energy: 0.853642460451578
Energy: 0.9111569308131053
Energy: 0.8967147397461885
Energy: 0.8536424604478038
Energy: 0.9111569308191445
Energy: 0.8951152030703448
Energy: 1.0322521755668068
Energy: 0.9123485318799782
Energy: 0.8951152030703448
Energy: 1.0322521755630327
Energy: 0.912348531882243
Energy: 0.8951152030688351
Energy: 1.032252175567562
Energy: 0.9123485318807332
Energy: 0.8951152030658156
Energy: 1.0094825388356
Energy: 0.8740457538999622
Energy: 0.8731946606257265
Energy: 1.0094825388386193
Energy: 0.8740457538984525
Energy: 0.8731946606272363
Energy: 1.009482538840884
Energy: 0.8740457538984525
Energy: 0.8731946606257265
Energy: 1.0094825388371096
Energy: 0.9739177322511461
Energy: 0.8913404066754161
Energy: 0.9717953498541618
Energy: 0.9739177322488813
Energy: 0.8913404066769259
Energy: 0.9717953498549167
Energy: 0.9739177322511461
Energy: 0.891340406676171
Energy: 0.9717953498511424
Energy: 0.9739177322488813
Energy: 0.9482685989844513
Energy: 0.9485205489065288
Energy: 0.8962258924641655
Energy: 0.9482685989844513
Energy: 0.9485205489095484
Energy: 0.9134553596732309
Energy: 0.9482685989852062
Energy: 0.9485205489065288
Energy: 0.9134553596747406
Energy: 0.948268598985961
Energy: 0.8962506451988624
Energy: 0.865876356090119
Energy: 0.8799537880757515
Energy: 0.8962506451920685
Energy: 0.8658763560908739
Energy: 0.8799537880765064
Energy: 0.8962506451973528
Energy: 0.8658763560908739
Energy: 0.8799537880749966
Energy: 0.8962506451950881
Energy: 0.8729409336162887
Energy: 1.008583648311444
Energy: 0.8729482444784937
Energy: 0.8729409336185532
Energy: 1.0085836483023858
Energy: 0.8729482444769838
Energy: 0.8729409336170435
Energy: 1.008583648282004
Energy: 0.8729482444784937
Energy: 0.8729409336177983
Energy: 0.8757663344840929
Energy: 0.8636992186206958
Energy: 0.8718968967531869
Energy: 0.8757663344840929
Energy: 0.8636992186199408
Energy: 0.8718968967539419
Energy: 0.8757663344810734
Energy: 0.8636992186206958
Energy: 0.8718968967524322
Energy: 0.8757663344795638

minimum gb energy = 0.8535805504185605 eV
minimum distance =  2.27901813987109 Angstroms
sigma value = 33