Model name: model_name=EAM_Dynamo_FoilesBaskesDaw_1986Universal3_Ni__MO_580571659842_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5199998259544394
cohesive_energy=4.45034998140762
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.0181588380185121
Energy: 0.018595712972313865
Energy: 1.4092762146929732
Energy: 0.018595712972938647
Energy: 0.018595712972938647
Energy: 1.1335626692691767
Energy: 0.018595712972938647
Energy: 1.1335626692698384
Energy: 1.4092762146923117
Energy: 0.018595712972938647
Energy: 0.0181588380185121
Energy: 0.018595712972313865
Energy: 0.018595712972313865
Energy: 1.1335626692698384
Energy: 0.018595712972313865
Energy: 1.1335626692691767

minimum gb energy = 0.0181588380185121 eV
minimum distance =  2.42577596355759 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.37371347220041
Energy: 1.3961468398020747
Energy: 1.2862778922896732
Energy: 1.3961468398028771
Energy: 1.3021521092369888
Energy: 1.370031125584721
Energy: 1.3062399426187115
Energy: 1.3700311255871278
Energy: 1.228822248333644
Energy: 1.3797389620409446
Energy: 1.2845080991976972
Energy: 1.37973896203934
Energy: 1.2739966070975959
Energy: 1.4103852555881522
Energy: 1.2597950781992033
Energy: 1.4103852555905592
Energy: 1.2774116023276152
Energy: 1.3987461658479474
Energy: 1.2891387492012722
Energy: 1.398746165847145
Energy: 1.2323585471936245
Energy: 1.3625568438242577
Energy: 1.2207082861032204
Energy: 1.3625568438234552
Energy: 1.306400812475858
Energy: 1.3799510814077809
Energy: 1.2342050921375873
Energy: 1.3799510814069786
Energy: 1.1635392416308716
Energy: 1.3978528380562378
Energy: 1.218795083367463
Energy: 1.3978528380562378
Energy: 1.2612245103907158
Energy: 1.2886327072471606
Energy: 1.3016117928092112
Energy: 1.2886327072447539
Energy: 1.2150666545854956
Energy: 1.3796831881274263
Energy: 1.1558364924792386
Energy: 1.3796831881258218
Energy: 1.2872071419421103
Energy: 1.3695903645652021
Energy: 1.2614784909848038
Energy: 1.3695903645660041
Energy: 1.2636269166176275
Energy: 1.3982183193764308
Energy: 1.228526800559977
Energy: 1.3982183193772335
Energy: 1.2844522162980534
Energy: 1.3791024574859823
Energy: 1.306222193558078
Energy: 1.37910245748518
Energy: 1.290238268168413
Energy: 1.3886422782846104
Energy: 1.2502574037105665
Energy: 1.3886422782838082
Energy: 1.287910777150888
Energy: 1.3958983957350353
Energy: 1.283253262241512
Energy: 1.3958983957334308
Energy: 1.2872520405988497
Energy: 1.3962725216133463
Energy: 1.2841859532214992
Energy: 1.396272521614951
Energy: 1.2845250606833083
Energy: 1.3798789695503577
Energy: 1.1903020741183983
Energy: 1.3798789695519622
Energy: 1.3063165180659004
Energy: 1.3628300299744833
Energy: 1.3032668907801008
Energy: 1.3628300299744833
Energy: 1.1967416224734502
Energy: 1.3971115407974426
Energy: 1.228458478887101
Energy: 1.3971115407974426
Energy: 1.3228028422623375
Energy: 1.2881337454926727
Energy: 1.2655437498934419
Energy: 1.2881337454942774
Energy: 1.2166477769990796
Energy: 1.3798481376060003
Energy: 1.1705892192622962
Energy: 1.3798481376060003
Energy: 1.2598674373166037
Energy: 1.2967485950361128
Energy: 1.288176029557974
Energy: 1.2967485950345083
Energy: 1.2875388461952353
Energy: 1.398856859410061
Energy: 1.2200656289007006
Energy: 1.398856859407654
Energy: 1.260696044713661
Energy: 1.3798886780625728
Energy: 1.2326378467554862
Energy: 1.3798886780625728
Energy: 1.2343427424800624
Energy: 1.358739211833858
Energy: 1.306312884378235
Energy: 1.3587392118298462
Energy: 1.2815376139122252
Energy: 1.3980985542255928
Energy: 1.2182397255716801
Energy: 1.3980985542215811
Energy: 1.2804917011675419
Energy: 1.3670868159014768
Energy: 1.261299442624291
Energy: 1.367086815902279
Energy: 1.2176336247701358
Energy: 1.379119766608889
Energy: 1.284141291163741
Energy: 1.379119766606482
Energy: 1.3011542355948074
Energy: 1.3587868335759183
Energy: 1.2866900480858077
Energy: 1.358786833575116
Energy: 1.3029292610772931
Energy: 1.3964818876739982
Energy: 1.2677964824424321
Energy: 1.3964818876788119
Energy: 1.2951002132645233
Energy: 1.3901705901699493
Energy: 1.2841978448037554
Energy: 1.3901705901683445
Energy: 1.263873015127179
Energy: 1.3807971367974066
Energy: 1.291276101119056
Energy: 1.3807971367974066
Energy: 1.2773670619844109
Energy: 1.4090556786591697
Energy: 1.2608389028409484
Energy: 1.4090556786583672

minimum gb energy = 1.1558364924792386 eV
minimum distance =  2.24910930355702 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.466863876978449
Energy: 1.4890651783341857
Energy: 1.3074037780840926
Energy: 1.4890651783378448
Energy: 1.3410749365080705
Energy: 1.443456349786132
Energy: 1.3448701094268956
Energy: 1.4434563497843025
Energy: 1.2964880637370932
Energy: 1.4875574811555177
Energy: 1.3445391727892329
Energy: 1.4875574811564323
Energy: 1.2887404833787235
Energy: 1.3268503194838852
Energy: 1.2811182140738564
Energy: 1.3268503194838852
Energy: 1.2886061239718978
Energy: 1.4638579462621901
Energy: 1.3622070133883208
Energy: 1.463857946266764
Energy: 1.3523327586683835
Energy: 1.4636804478150385
Energy: 1.2860949079453738
Energy: 1.4636804478177827
Energy: 1.340484642176591
Energy: 1.3258079599058983
Energy: 1.3259205700918124
Energy: 1.3258079599022397
Energy: 1.2090199165460775
Energy: 1.4883201516628561
Energy: 1.2495524497476425
Energy: 1.4883201516646858
Energy: 1.298901585578433
Energy: 1.3654568960263909
Energy: 1.3450823806086432
Energy: 1.3654568960373683
Energy: 1.2875383957726687
Energy: 1.4881818780519034
Energy: 1.2967149178938557
Energy: 1.4881818780656246
Energy: 1.3403667881249577
Energy: 1.4182659830325677
Energy: 1.334814153086344
Energy: 1.4182659830325677
Energy: 1.2552096207028185
Energy: 1.4761747947318478
Energy: 1.3448594274414853
Energy: 1.476174794734592
Energy: 1.3660184411481
Energy: 1.4629558685046204
Energy: 1.33753597756918
Energy: 1.4629558685009616
Energy: 1.3659780780578183
Energy: 1.4629373683882065
Energy: 1.3588748490691553
Energy: 1.462937368393695
Energy: 1.2550953049123765
Energy: 1.4760274206723014
Energy: 1.335245341114621
Energy: 1.4760274206796193
Energy: 1.3404298850835654
Energy: 1.418422214550355
Energy: 1.3259455594062801
Energy: 1.418422214554929
Energy: 1.2875125776584337
Energy: 1.4884576676650754
Energy: 1.298061384454157
Energy: 1.488457667669649
Energy: 1.2987994885245724
Energy: 1.3655289462283655
Energy: 1.3450823448101141
Energy: 1.3655289462256213
Energy: 1.2090215880171349
Energy: 1.4879831289470984
Energy: 1.2729722766852027
Energy: 1.4879831289599053
Energy: 1.3403944876954796
Energy: 1.3255957653455324
Energy: 1.2862740406111781
Energy: 1.3255957653528503
Energy: 1.352505903831008
Energy: 1.463660579893201
Energy: 1.314738665810889
Energy: 1.4636605798986895
Energy: 1.2887099051879336
Energy: 1.4633212055383202
Energy: 1.3334692674118462
Energy: 1.4633212055511264
Energy: 1.2886979897987354
Energy: 1.326619384629202
Energy: 1.3259081716046697
Energy: 1.3266193846346905
Energy: 1.2962555715164055
Energy: 1.487535485651641
Energy: 1.3352430524282646
Energy: 1.4875354856461525
Energy: 1.3412063103800758
Energy: 1.4437794565772986
Energy: 1.3447470225054154
Energy: 1.4437794565672362
Energy: 1.4668638769793636
Energy: 1.489065178333271
Energy: 1.3879013178110562
Energy: 1.4890651783369298
Energy: 1.3410749365080705
Energy: 1.4434563497852169
Energy: 1.3448701094268956
Energy: 1.4434563497879611
Energy: 1.296488063738008
Energy: 1.4875574811546028
Energy: 1.3445391727928917
Energy: 1.4875574811564323
Energy: 1.2887404833796379
Energy: 1.3268503194838852
Energy: 1.2858707556075648
Energy: 1.3268503194847998

minimum gb energy = 1.2090199165460775 eV
minimum distance =  2.23970897397814 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.404730843848808
Energy: 1.5614129317702985
Energy: 1.4030006621593314
Energy: 1.5614129317713619
Energy: 1.4330573370903867
Energy: 1.4867989039531664
Energy: 1.37435294426036
Energy: 1.48679890395423
Energy: 1.3693881208675387
Energy: 1.602057564026368
Energy: 1.3753427093821362
Energy: 1.602057564026368
Energy: 1.3757013177556925
Energy: 1.3903216440316764
Energy: 1.3394770476844482
Energy: 1.3903216440306128
Energy: 1.3405433090676282
Energy: 1.5642272635097385
Energy: 1.3343262890734564
Energy: 1.5642272635108019
Energy: 1.4370888626300486
Energy: 1.6005380560002758
Energy: 1.3383184903190821
Energy: 1.6005380560013394
Energy: 1.377350254423974
Energy: 1.380472541988939
Energy: 1.3709667745106824
Energy: 1.3804725419878756
Energy: 1.4794114236371074
Energy: 1.5634289822333653
Energy: 1.2872554127324227
Energy: 1.5634289822333653
Energy: 1.3710542036459181
Energy: 1.4894152699069412
Energy: 1.376891842970472
Energy: 1.4894152699090681
Energy: 1.374140363795013
Energy: 1.6010437841868628
Energy: 1.3248824194771176
Energy: 1.6010437841879264
Energy: 1.3336321032177434
Energy: 1.5613928851534569
Energy: 1.3749385531214025
Energy: 1.5613928851523933
Energy: 1.3416408633406447
Energy: 1.5618399297482506
Energy: 1.3747213576222947
Energy: 1.561839929749314
Energy: 1.3753650038703336
Energy: 1.5033862250612595
Energy: 1.3275005292399804
Energy: 1.503386225060196
Energy: 1.3714354982046775
Energy: 1.4523353970586985
Energy: 1.433024202232071
Energy: 1.4523353970586985
Energy: 1.3696872531603559
Energy: 1.5621254975594254
Energy: 1.2842194714653516
Energy: 1.5621254975594254
Energy: 1.3745699770954185
Energy: 1.383699125796901
Energy: 1.3393521405869406
Energy: 1.3836991257958375
Energy: 1.2670693635241537
Energy: 1.6014722856251455
Energy: 1.2663990557930764
Energy: 1.6014722856272723
Energy: 1.3394950517059914
Energy: 1.5012999925284556
Energy: 1.420594196805987
Energy: 1.5012999925263286
Energy: 1.370912732202302
Energy: 1.5036445340994946
Energy: 1.3395065366345063
Energy: 1.5036445340973679
Energy: 1.3392396367364172
Energy: 1.6004854429676298
Energy: 1.379246275716263
Energy: 1.6004854429676298
Energy: 1.3897422813750764
Energy: 1.4827670540898152
Energy: 1.375827162222102
Energy: 1.4827670540898152
Energy: 1.4028462429920727
Energy: 1.5620301190158297
Energy: 1.4325849271168105
Energy: 1.5620301190147663
Energy: 1.4344152452237975
Energy: 1.498459856326649
Energy: 1.3749140535789444
Energy: 1.4984598563255853
Energy: 1.3294998851257998
Energy: 1.6043979037808782
Energy: 1.3741848151993292
Energy: 1.6043979037808782
Energy: 1.3742584219264162
Energy: 1.3964450074326689
Energy: 1.3380500726773095
Energy: 1.3964450074337325

minimum gb energy = 1.2663990557930764 eV
minimum distance =  2.24303093458421 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.4844529660351886
Energy: 1.4834943480125282
Energy: 1.506326311819934
Energy: 1.4834943480125282
Energy: 1.4341265084136996
Energy: 1.5774162559095675
Energy: 1.4638958408748426
Energy: 1.5774162559146414
Energy: 1.3384729747257975
Energy: 1.474396841939232
Energy: 1.471430664839385
Energy: 1.4743968419443063
Energy: 1.4703929991948779
Energy: 1.6003990141860276
Energy: 1.3631784892162442
Energy: 1.6003990141923703
Energy: 1.5378342783125676
Energy: 1.5767683170350633
Energy: 1.4485693504531651
Energy: 1.5767683170312574
Energy: 1.3236599424064404
Energy: 1.472927698643762
Energy: 1.3645551393929054
Energy: 1.4729276986462991
Energy: 1.4656020088709039
Energy: 1.362711457439009
Energy: 1.3644060164674479
Energy: 1.3627114574377404
Energy: 1.447706843653214
Energy: 1.4725563727083462
Energy: 1.3527438089169825
Energy: 1.4725563727045403
Energy: 1.4673169061328493
Energy: 1.577247888420036
Energy: 1.4676551120167165
Energy: 1.577247888412425
Energy: 1.4747953615181355
Energy: 1.4808595050372941
Energy: 1.3641315198152353
Energy: 1.4808595050347573
Energy: 1.3953641413036306
Energy: 1.5766657138501905
Energy: 1.4712810754565424
Energy: 1.5766657138489217
Energy: 1.4696327810439547
Energy: 1.5260812693931716
Energy: 1.363964123966895
Energy: 1.5260812693944403
Energy: 1.3233879976665321
Energy: 1.4815141212656355
Energy: 1.372268694709304
Energy: 1.481514121266904
Energy: 1.4290475339852209
Energy: 1.4721620650656693
Energy: 1.4652514282701607
Energy: 1.4721620650669374
Energy: 1.3234020851854484
Energy: 1.4813948898089822
Energy: 1.3959213116075617
Energy: 1.4813948898152962
Energy: 1.4698669459334543
Energy: 1.5263857215632053
Energy: 1.363850358306295
Energy: 1.526385721569548
Energy: 1.394763293090203
Energy: 1.576725325107049
Energy: 1.403943371505287
Energy: 1.5767253251083175
Energy: 1.4749521675952328
Energy: 1.4808598021533377
Energy: 1.3643873113185774
Energy: 1.4808598021558748
Energy: 1.4673501946014396
Energy: 1.5772708533520265
Energy: 1.4057430422130108
Energy: 1.5772708533545636
Energy: 1.4476131350649228
Energy: 1.4724782238117626
Energy: 1.352720686234191
Energy: 1.4724782238181053
Energy: 1.4656182291324396
Energy: 1.3626920008017185
Energy: 1.3644139204730414
Energy: 1.36269200080045

minimum gb energy = 1.3233879976665321 eV
minimum distance =  2.32857136927938 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.41141122134223
Energy: 1.7263638902528817
Energy: 1.6306771969075726
Energy: 1.7263638902528817
Energy: 1.3898765185066257
Energy: 1.594353010590261
Energy: 1.3766188415120346
Energy: 1.594353010590261
Energy: 1.3770314415972142
Energy: 1.5120843390431662
Energy: 1.3762255933737095
Energy: 1.5120843390463035
Energy: 1.4107097337388663
Energy: 1.4863579736342396
Energy: 1.5486281753170588
Energy: 1.4863579736342396
Energy: 1.5451923223306423
Energy: 1.390383235651909
Energy: 1.376865859641472
Energy: 1.390383235653478
Energy: 1.3812393826671368
Energy: 1.6113063179807292
Energy: 1.3779194157401318
Energy: 1.6113063179807292
Energy: 1.3765016567258117
Energy: 1.4838183122487862
Energy: 1.376434788395778
Energy: 1.483818312251924
Energy: 1.528545022485609
Energy: 1.3789265123528411
Energy: 1.4132618655774545
Energy: 1.378926512127007
Energy: 1.3762730816927227
Energy: 1.5926614804279593
Energy: 1.3927659967921673
Energy: 1.5926614804263908
Energy: 1.585588970928089
Energy: 1.5137997858276633
Energy: 1.3784376858776057
Energy: 1.5137997858245256
Energy: 1.471978437758366
Energy: 1.4837625797404612
Energy: 1.6932723213348941
Energy: 1.4837625797420302
Energy: 1.3770680306553245
Energy: 1.424883114363922
Energy: 1.5850818612830935
Energy: 1.424883114362353
Energy: 1.5337289952578974
Energy: 1.6160544414985178
Energy: 1.3759720753096398
Energy: 1.6160544414954159
Energy: 1.3762027227912637
Energy: 1.484650825078652
Energy: 1.411839509171135
Energy: 1.484650825078652
Energy: 1.3759346208685546
Energy: 1.5900016087472817
Energy: 1.5292817905851794
Energy: 1.5900016087488507
Energy: 1.3920389232588783
Energy: 1.5222845164575594
Energy: 1.3811501853187724
Energy: 1.522284516455991
Energy: 1.3766851603888366
Energy: 1.5046588185071523
Energy: 1.5835443911921023
Energy: 1.5046588185087213

minimum gb energy = 1.3759346208685546 eV
minimum distance =  2.31214504550802 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.5490825215756368
Energy: 1.5484048654581568
Energy: 1.8065155849567103
Energy: 1.5484048654572682
Energy: 1.6095545367683635
Energy: 1.5127076379315305
Energy: 1.4131145270040362
Energy: 1.5127076379306421
Energy: 1.5805897575181675
Energy: 1.5431092889692628
Energy: 1.4129678240023098
Energy: 1.5431092889692628
Energy: 1.4148120050553727
Energy: 1.556004533270336
Energy: 1.5182078023312289
Energy: 1.5560045332676704
Energy: 1.6145813825920832
Energy: 1.5360591753308195
Energy: 1.4130503443445366
Energy: 1.5360591753272654
Energy: 1.427545755325321
Energy: 1.4639995514079478
Energy: 1.5794068236622487
Energy: 1.4639995514079478
Energy: 1.4189730937630756
Energy: 1.5721560187679509
Energy: 1.4133323395568183
Energy: 1.5721560187706165
Energy: 1.5804322992074935
Energy: 1.5912212757808828
Energy: 1.4248573672631726
Energy: 1.5912212757808828
Energy: 1.4317936522268329
Energy: 1.6243518072454648
Energy: 1.6093572985338744
Energy: 1.6243518072410223
Energy: 1.7064768396574315
Energy: 1.5113510300911133
Energy: 1.412957522703866
Energy: 1.5113510300928903
Energy: 1.4185634682906454
Energy: 1.5885128637148713
Energy: 1.5861217393736786
Energy: 1.5885128637139827
Energy: 1.4260390798084106
Energy: 1.5665996713113814
Energy: 1.4250836328495924
Energy: 1.566599671308716
Energy: 1.6087538439384175
Energy: 1.5437704146611202
Energy: 1.542582972628535
Energy: 1.5437704146637858
Energy: 1.4128622529658068
Energy: 1.5717704557258017
Energy: 1.5939551721347003
Energy: 1.571770455735575
Energy: 1.5304222653829453
Energy: 1.5743115571044723
Energy: 1.429750442917365
Energy: 1.5743115571062494
Energy: 1.5815096643217093
Energy: 1.5448263960213922
Energy: 1.5804506080796243
Energy: 1.5448263960231687
Energy: 1.4130043947354058
Energy: 1.5619522477744312
Energy: 1.7001740774422698
Energy: 1.5619522477726544
Energy: 1.5726279773189424
Energy: 1.5424882709409988
Energy: 1.4276624385524315
Energy: 1.5424882709480665
Energy: 1.4468723354026631
Energy: 1.5771687537352992
Energy: 1.5076525152169313
Energy: 1.5771687537326333
Energy: 1.4134445347128288
Energy: 1.5480463268578957
Energy: 1.4153533618479184
Energy: 1.5480463268578957
Energy: 1.4966663826090187
Energy: 1.54329081546426
Energy: 1.5801669311597955
Energy: 1.543290815466037
Energy: 1.412992471580628
Energy: 1.656284198042982
Energy: 1.7071420975280998
Energy: 1.656284198042982
Energy: 1.5977917005527094
Energy: 1.5914408476826358
Energy: 1.4124335275903954
Energy: 1.5914408476799704
Energy: 1.4250062909085517
Energy: 1.5730553431964416
Energy: 1.602071857074748
Energy: 1.5730553431946646
Energy: 1.4245542165402245
Energy: 1.5431346712885554
Energy: 1.601078084984996
Energy: 1.5431346712921095
Energy: 1.6040990268236488
Energy: 1.5924892104021497
Energy: 1.4138799555002863
Energy: 1.5924892104074808
Energy: 1.412941911216654
Energy: 1.6244791983268003
Energy: 1.7382706451516505
Energy: 1.6244791983285771
Energy: 1.5790395997851454
Energy: 1.4709015364647033
Energy: 1.5820129473560887
Energy: 1.470901536467369
Energy: 1.7002621083437843
Energy: 1.628343122875836
Energy: 1.4193321553102347
Energy: 1.628343122875836
Energy: 1.424670569925437
Energy: 1.6203406786276788
Energy: 1.5748993045248763
Energy: 1.6203406786312327

minimum gb energy = 1.4124335275903954 eV
minimum distance =  2.22199648542363 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.347400161192642
Energy: 1.3469894654777999
Energy: 1.7426328934942088
Energy: 1.3469894654757544
Energy: 1.6027212746389476
Energy: 1.4709837963926355
Energy: 1.4870383308660748
Energy: 1.4709837963926355
Energy: 1.3481037713364563
Energy: 1.346293814964774
Energy: 1.580651561002848
Energy: 1.3462938149668198
Energy: 1.3483865513123978
Energy: 1.34626270193701
Energy: 1.372265386261883
Energy: 1.3462627019308735
Energy: 1.6027893425478366
Energy: 1.4709889551543205
Energy: 1.513456610673051
Energy: 1.4709889551563657
Energy: 1.3474001611905968
Energy: 1.3469894654757544
Energy: 1.7138257684962872
Energy: 1.3469894654757544
Energy: 1.6027212746369022
Energy: 1.4709837963926355
Energy: 1.4870383308640294
Energy: 1.4709837963926355
Energy: 1.3481037713385016
Energy: 1.3462938149627288
Energy: 1.5806515610048937
Energy: 1.346293814964774
Energy: 1.3483865513123978
Energy: 1.3462627019349644
Energy: 1.4907073281005665
Energy: 1.3462627019308735
Energy: 1.6027893425478366
Energy: 1.4709889551543205
Energy: 1.5126806305667002
Energy: 1.4709889551563657
Energy: 1.347400161192642
Energy: 1.3469894654757544
Energy: 1.8128468462208762
Energy: 1.3469894654757544
Energy: 1.6027212746389476
Energy: 1.4709837963926355
Energy: 1.5715448211130052
Energy: 1.4709837963926355
Energy: 1.3481037713364563
Energy: 1.346293814964774
Energy: 1.580651561002848
Energy: 1.3462938149668198

minimum gb energy = 1.3462627019308735 eV
minimum distance =  2.29069405146223 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.478927062915143
Energy: 1.6799936175749843
Energy: 1.874009528426766
Energy: 1.6799936175719559
Energy: 1.673748479591942
Energy: 1.5536933660974275
Energy: 1.4809793302658725
Energy: 1.5536933660959134
Energy: 1.4700717835400159
Energy: 1.465874848032738
Energy: 1.4823140405187238
Energy: 1.4658748480289527
Energy: 1.6332499397598492
Energy: 1.735598891415225
Energy: 1.48283311679837
Energy: 1.7355988914129539
Energy: 1.6599236576518164
Energy: 1.5484631316355635
Energy: 1.4805924312387913
Energy: 1.5484631316378346
Energy: 1.465185899458582
Energy: 1.4651878528467517
Energy: 1.6455246314556844
Energy: 1.4651878528467517
Energy: 1.8786033891809368
Energy: 1.5438065085590504
Energy: 1.4812836929761082
Energy: 1.5438065085635928
Energy: 1.4767209387685847
Energy: 1.5762257044856967
Energy: 1.6514216469206857
Energy: 1.5762257044872108
Energy: 1.4721844685118395
Energy: 1.7525684252140834
Energy: 1.4761226841117456
Energy: 1.7525684252125695
Energy: 1.4714372684880856
Energy: 1.546253362099614
Energy: 1.4811484120778524
Energy: 1.546253362099614
Energy: 1.4775121024320517
Energy: 1.578709247102966
Energy: 1.8690193992492017
Energy: 1.5787092471037232
Energy: 1.6696941655840447
Energy: 1.673681144384275
Energy: 1.47487701345885
Energy: 1.6736811443895743
Energy: 1.4728397823386947
Energy: 1.5730128825080127
Energy: 1.7588799625266078
Energy: 1.5730128825050531
Energy: 1.6378147218924284
Energy: 1.6451453747938622
Energy: 1.4849287276190277
Energy: 1.6451453748014329
Energy: 1.4805438148670893
Energy: 1.651130777530438
Energy: 1.6409951837919365
Energy: 1.651130777533466
Energy: 1.4735438206631564
Energy: 1.749044713530714
Energy: 1.6415186300193572
Energy: 1.749044713530714
Energy: 1.558259683139004
Energy: 1.6519137818396123
Energy: 1.480710706318288
Energy: 1.6519137818403693
Energy: 1.4776934002709414
Energy: 1.544534631328628
Energy: 1.6572623041345296
Energy: 1.544534631328628
Energy: 1.6468708009680864
Energy: 1.5737729767567301
Energy: 1.4675730269101843
Energy: 1.5737729767567301
Energy: 1.4763879218692737
Energy: 1.5607252910341467
Energy: 1.571106646662639
Energy: 1.560725291038689
Energy: 1.644913731689587
Energy: 1.7377278929315567
Energy: 1.6362733913250884
Energy: 1.7377278929323139
Energy: 1.579612353840811
Energy: 1.6390993037691437
Energy: 1.4721553196730488
Energy: 1.6390993037706576
Energy: 1.4762897184670625
Energy: 1.6571215512699744
Energy: 1.4729676416843431
Energy: 1.6571215512722457
Energy: 1.8852540459729124
Energy: 1.5764745733511822
Energy: 1.4752221185048477
Energy: 1.5764745733496681
Energy: 1.4817816125784722
Energy: 1.688094356668041
Energy: 1.8010060450865373
Energy: 1.6880943566650128
Energy: 1.5674214784866978
Energy: 1.4652355174134133
Energy: 1.4702285565066968
Energy: 1.4652355174065999
Energy: 1.6463713356451537
Energy: 1.6547013131943844
Energy: 1.6329078194577162
Energy: 1.6547013131958987
Energy: 1.4936870058828902
Energy: 1.735839504947118
Energy: 1.632860109913245
Energy: 1.7358395049524173
Energy: 1.566956203477421
Energy: 1.4652149541502142
Energy: 1.469463394534846
Energy: 1.4652149541532422
Energy: 1.4815005480785899
Energy: 1.6871040170975649
Energy: 1.7959823093146907
Energy: 1.6871040170968081
Energy: 1.7847468724104376
Energy: 1.575971140035958
Energy: 1.474588414130073
Energy: 1.5759711400382288
Energy: 1.4805541517482903
Energy: 1.5465141315401132
Energy: 1.4711180403584383
Energy: 1.5465141315355708
Energy: 1.4831202756264232
Energy: 1.64163087933062
Energy: 1.4703546447872549
Energy: 1.6416308793283487
Energy: 1.64634667526725
Energy: 1.7394863780008862
Energy: 1.633264727523239
Energy: 1.7394863779993721
Energy: 1.4785002235160505
Energy: 1.6951605732093522
Energy: 1.8779924471377205
Energy: 1.6951605732063242

minimum gb energy = 1.465185899458582 eV
minimum distance =  2.23733828070269 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.4715731049611687
Energy: 1.470194169099483
Energy: 1.8583943449268037
Energy: 1.470194169099483
Energy: 1.500333768524639
Energy: 1.5980636860312216
Energy: 1.482952626493192
Energy: 1.5980636860312216
Energy: 1.4919356984761472
Energy: 1.650070875721123
Energy: 1.475460048946017
Energy: 1.6500708756875189
Energy: 1.480336703106544
Energy: 1.6012994603447768
Energy: 1.4833393936411148
Energy: 1.6012994603435757
Energy: 1.4796320601039772
Energy: 1.582266963344016
Energy: 1.4798276933404233
Energy: 1.5822669633428148
Energy: 1.4936653154834933
Energy: 1.4844566332767644
Energy: 1.8389092186632963
Energy: 1.4844566332779654
Energy: 1.8616933651762577
Energy: 1.7807115269135723
Energy: 1.4845475057031905
Energy: 1.780711526912371
Energy: 1.4805169560407134
Energy: 1.4698398646608293
Energy: 1.8311970899131256
Energy: 1.4698398646632043
Energy: 1.8177244957584304
Energy: 1.472210433138731
Energy: 1.4761382578148696
Energy: 1.472210433138731
Energy: 1.4926798083699817
Energy: 1.5841440312031145
Energy: 1.486537828948785
Energy: 1.5841440312019135
Energy: 1.479203352351221
Energy: 1.471468599672863
Energy: 1.8192007509909212
Energy: 1.4714685996740642
Energy: 1.6505809570507342
Energy: 1.6067021491404023
Energy: 1.4799561313840777
Energy: 1.6067021491392286
Energy: 1.486539917380171
Energy: 1.5801175142165582
Energy: 1.6520153567881177
Energy: 1.5801175142153567
Energy: 1.885990495432433
Energy: 1.5817005765039156
Energy: 1.4936961043801105
Energy: 1.5817005765051166
Energy: 1.4733555510009892
Energy: 1.5271314791177846
Energy: 1.651133483691884
Energy: 1.5271314791189858
Energy: 1.820197017078361
Energy: 1.4706443213632194
Energy: 1.4805562657546945
Energy: 1.4706443213608176
Energy: 1.4856242110585536
Energy: 1.4787187591831237
Energy: 1.4919921345485283
Energy: 1.4787187591819226
Energy: 1.48112019904462
Energy: 1.4738306330799225
Energy: 1.4921779731072722
Energy: 1.4738306330811235
Energy: 1.4779919650094084
Energy: 1.4697667330976365
Energy: 1.4792693126489755
Energy: 1.4697667330976365
Energy: 1.4829576870537144
Energy: 1.528192641001421
Energy: 1.8602341013023198
Energy: 1.528192641002622
Energy: 1.8850864870903652
Energy: 1.4836685207790425
Energy: 1.4929484419192092
Energy: 1.4836685207778413
Energy: 1.4829830463336897
Energy: 1.5856841586579449
Energy: 1.6575051573701312
Energy: 1.585684158656744

minimum gb energy = 1.4697667330976365 eV
minimum distance =  2.2496769103864 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.5071597579339848
Energy: 1.5068209283592875
Energy: 1.8869661519332133
Energy: 1.5068209283584384
Energy: 1.6505078723751407
Energy: 1.5140000129376732
Energy: 1.4848095310396807
Energy: 1.5140000129351252
Energy: 1.4838400605042654
Energy: 1.5061857853810294
Energy: 1.5108335207322627
Energy: 1.506185785374235
Energy: 1.534366502841871
Energy: 1.6005020280140962
Energy: 1.4855173379852822
Energy: 1.6005020280140962
Energy: 1.4839396845971164
Energy: 1.5772036216168233
Energy: 1.5008320323831783
Energy: 1.5772036216125764
Energy: 1.4784912338217782
Energy: 1.5076070871699714
Energy: 1.7856324728704989
Energy: 1.50760708717167
Energy: 1.6523182981809084
Energy: 1.6477840031834254
Energy: 1.5203582543905398
Energy: 1.647784003182576
Energy: 1.4785929515293386
Energy: 1.5079541073396732
Energy: 1.8265501495223682
Energy: 1.5079541073456184
Energy: 1.6710721681403082
Energy: 1.5868294618841838
Energy: 1.4928831749407734
Energy: 1.5868294618714824
Energy: 1.4785284079700514
Energy: 1.6122839619558673
Energy: 1.632413400820912
Energy: 1.6122839619584155
Energy: 1.519981948269816
Energy: 1.5073509467289354
Energy: 1.5281036253536635
Energy: 1.5073509467246888
Energy: 1.5273168671190032
Energy: 1.5779799110647306
Energy: 1.5336288177509732
Energy: 1.5779799110604837
Energy: 1.5164960398453
Energy: 1.5106346828856196
Energy: 1.5324704604889814
Energy: 1.5106346828711814
Energy: 1.5106468703042686
Energy: 1.501926104326666
Energy: 1.5335165094706305
Energy: 1.50192610434705
Energy: 1.47633954677982
Energy: 1.730313495261086
Energy: 1.6672057269966047
Energy: 1.7303134952644832
Energy: 1.9076373248163752
Energy: 1.500383413421297
Energy: 1.4945858613937129
Energy: 1.5003834134289409
Energy: 1.4755930678124138
Energy: 1.57742169644007
Energy: 1.5675579655350993
Energy: 1.577421696434125
Energy: 1.5002856171161847
Energy: 1.724267393240331
Energy: 1.5317198610926057
Energy: 1.7242673932309882
Energy: 1.4758607450878343
Energy: 1.5088080616391069
Energy: 1.5323339251956491
Energy: 1.5088080616416548
Energy: 1.4776517365480537
Energy: 1.5806139394661598
Energy: 1.5310764228055957
Energy: 1.5806139394585157
Energy: 1.5211588630429784
Energy: 1.7164819881715645
Energy: 1.4880177616037171
Energy: 1.7164819881656195
Energy: 1.4779936957745783
Energy: 1.5058053852635094
Energy: 1.6394409704931094
Energy: 1.5058053852618105
Energy: 1.7972353163189512
Energy: 1.5868200122167668
Energy: 1.5279525966486456
Energy: 1.5868200122167668
Energy: 1.509408939323562
Energy: 1.5075156715790639
Energy: 1.786773609216471
Energy: 1.5075156715841596
Energy: 1.514101770108669
Energy: 1.5815760892261248
Energy: 1.5272612663973557
Energy: 1.5815760892227275
Energy: 1.531291248231803
Energy: 1.5069817505742735
Energy: 1.5125106026135606
Energy: 1.506981750582767
Energy: 1.4839444484986275
Energy: 1.6046796345235848
Energy: 1.6461086427198541
Energy: 1.6046796345286807
Energy: 1.5405801442319442
Energy: 1.577487191212806
Energy: 1.4850430661223941
Energy: 1.57748719122045
Energy: 1.4845192167477788
Energy: 1.5072470161912008
Energy: 1.684452646683048
Energy: 1.5072470161979956
Energy: 1.508470829808401
Energy: 1.5061887870434987
Energy: 1.4843205868310354
Energy: 1.506188787046896
Energy: 1.4846364165404617
Energy: 1.5078960386461082
Energy: 1.7399208989774504
Energy: 1.507896038638464

minimum gb energy = 1.4755930678124138 eV
minimum distance =  2.23147888142384 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.446765663725983
Energy: 1.436934063234028
Energy: 1.9188650024357043
Energy: 1.4369340632348826
Energy: 1.4012289473579587
Energy: 1.4510125285833155
Energy: 1.4477013172196733
Energy: 1.4510125285838744
Energy: 1.4064125795057751
Energy: 1.5175421798267579
Energy: 1.5795487081093291
Energy: 1.5175421798270539
Energy: 1.4467392896884506
Energy: 1.4037932067508916
Energy: 1.4480135828063718
Energy: 1.4037932067514831
Energy: 1.447089252273591
Energy: 1.4927269304268453
Energy: 1.4714723221413963
Energy: 1.4927269304271413
Energy: 1.4457281060723566
Energy: 1.5185799003018075
Energy: 1.446092308826202
Energy: 1.5185799003021034
Energy: 1.4381606932450663
Energy: 1.4927412305323287
Energy: 1.4469777446121077
Energy: 1.4927412305329202
Energy: 1.447921781638284
Energy: 1.4040189882741285
Energy: 1.447705413432466
Energy: 1.4040189882761667
Energy: 1.579702957311383
Energy: 1.5176114375753742
Energy: 1.4046191820720502
Energy: 1.5176114375756702

minimum gb energy = 1.4012289473579587 eV
minimum distance =  2.2861351522418 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.400838714279366
Energy: 1.4220800108972185
Energy: 1.6344330859488427
Energy: 1.4220800108972185
Energy: 1.6213428117651476
Energy: 1.4481204028317267
Energy: 1.3591137371309645
Energy: 1.4481204028333312
Energy: 1.3662644460589275
Energy: 1.4128764952362445
Energy: 1.6238446542600986
Energy: 1.4128764952378492
Energy: 1.3603800612526984
Energy: 1.483910581889826
Energy: 1.370012118830006
Energy: 1.483910581886617
Energy: 1.3818141716425705
Energy: 1.491983589193309
Energy: 1.6223638699277216
Energy: 1.491983589193309
Energy: 1.421147719096725
Energy: 1.4252143436843105
Energy: 1.3579715346080303
Energy: 1.4252143436875195
Energy: 1.366277926099422
Energy: 1.4894769766145566
Energy: 1.3569988688037742
Energy: 1.489476976618568
Energy: 1.364638350217003
Energy: 1.4260605516748905
Energy: 1.3694277381132893
Energy: 1.4260605516740883
Energy: 1.3814086580041467
Energy: 1.4893270421112212
Energy: 1.3878361750962371
Energy: 1.4893270421088145
Energy: 1.376042243685864
Energy: 1.4899317238690326
Energy: 1.3805164020191458
Energy: 1.4899317238690326
Energy: 1.3984667821656724
Energy: 1.4267931797882503
Energy: 1.3684236437817892
Energy: 1.4267931797866455
Energy: 1.3787043316085568
Energy: 1.5060435909152974
Energy: 1.428274778484966
Energy: 1.5060435909104835
Energy: 1.419034740348133
Energy: 1.42347088041724
Energy: 1.426658745321966
Energy: 1.423470880414833
Energy: 1.3802430727086032
Energy: 1.4236364969945106
Energy: 1.414349366413814
Energy: 1.423636496992906
Energy: 1.408410423606848
Energy: 1.4858782472280958
Energy: 1.3676857663505164
Energy: 1.4858782472240843
Energy: 1.3746247141994317
Energy: 1.4125296171365074
Energy: 1.4043944318701054
Energy: 1.4125296171365074
Energy: 1.6102039240304544
Energy: 1.5088831015064985
Energy: 1.3598632041532823
Energy: 1.5088831015097077
Energy: 1.3780374958144213
Energy: 1.4235000986607875
Energy: 1.5116556873363969
Energy: 1.4235000986607875
Energy: 1.3739203865215304
Energy: 1.4920419045930229
Energy: 1.3599723184320178
Energy: 1.492041904596232
Energy: 1.3677757078712294
Energy: 1.480183762951834
Energy: 1.3902785014711772
Energy: 1.4801837629486247
Energy: 1.360553328557697
Energy: 1.4246595214618851
Energy: 1.3725028261602212
Energy: 1.4246595214618851
Energy: 1.3783148022349772
Energy: 1.4900595954432794
Energy: 1.36827630215186
Energy: 1.4900595954408726
Energy: 1.358040442143647
Energy: 1.4251495508805143
Energy: 1.3598411497737046
Energy: 1.4251495508765026
Energy: 1.4219445309246548
Energy: 1.425190273774023
Energy: 1.3684928667273069
Energy: 1.4251902737764297
Energy: 1.4317161335321738
Energy: 1.409644805456948
Energy: 1.381329368145429
Energy: 1.4096448054585526
Energy: 1.4063095329363677
Energy: 1.4237786835603186
Energy: 1.3819999966390042
Energy: 1.423778683556307
Energy: 1.3635374083538894
Energy: 1.4741831618416348
Energy: 1.3910897363522625
Energy: 1.4741831618416348
Energy: 1.4376185015410359
Energy: 1.4589899250269913
Energy: 1.374934585108744
Energy: 1.4589899250277936
Energy: 1.3680391798743816
Energy: 1.4484228824859153
Energy: 1.6175804176886732
Energy: 1.44842288248752
Energy: 1.5242232406364324
Energy: 1.422707530584825
Energy: 1.377980490855664
Energy: 1.4227075305856272
Energy: 1.3639307143617503
Energy: 1.390658750294171
Energy: 1.5233813311306585
Energy: 1.390658750294171
Energy: 1.6070018488516646
Energy: 1.4569269897564037
Energy: 1.368975450078547
Energy: 1.4569269897588104
Energy: 1.3780644711411374
Energy: 1.4581818564816886
Energy: 1.3626145985730238
Energy: 1.4581818564808864

minimum gb energy = 1.3569988688037742 eV
minimum distance =  2.23628092626454 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.3622903074041717
Energy: 1.3613253543707173
Energy: 1.6238094289088643
Energy: 1.3613253543707173
Energy: 1.3952001217577799
Energy: 1.38425582947664
Energy: 1.3244043975859725
Energy: 1.3842558294799678
Energy: 1.294447689046737
Energy: 1.361196224173017
Energy: 1.7854080513054191
Energy: 1.361196224173017
Energy: 1.378235527086598
Energy: 1.4478054230194388
Energy: 1.3128531564423507
Energy: 1.4478054230216575
Energy: 1.2948828650595279
Energy: 1.4902071664992802
Energy: 1.3260471941234533
Energy: 1.4902071664970618
Energy: 1.2914088205968943
Energy: 1.3668070564953836
Energy: 1.312948214937929
Energy: 1.3668070564998205
Energy: 1.2948469312753246
Energy: 1.4904609259447221
Energy: 1.361149245650545
Energy: 1.4904609259447221
Energy: 1.294370300522067
Energy: 1.366476393563629
Energy: 1.3962273753992125
Energy: 1.3664763935614104
Energy: 1.3606381536811927
Energy: 1.35678160473619
Energy: 1.3598769492130227
Energy: 1.356781604737299
Energy: 1.3608080746559355
Energy: 1.3567334228575456
Energy: 1.3963157634145174
Energy: 1.3567334228586552
Energy: 1.2949075083850927
Energy: 1.3664233017442988
Energy: 1.3358020321902235
Energy: 1.3664233017442988
Energy: 1.2948834403670568
Energy: 1.4904256055977505
Energy: 1.3506413245591384
Energy: 1.49042560559886
Energy: 1.2904740427193933
Energy: 1.3665830353530544
Energy: 1.3128186204710126
Energy: 1.366583035355273
Energy: 1.294884281483742
Energy: 1.4904062885105651
Energy: 1.5275000777100405
Energy: 1.4904062885105651
Energy: 1.3798474346736882
Energy: 1.4478204454471812
Energy: 1.313069588585131
Energy: 1.4478204454493495
Energy: 1.2947370277569754
Energy: 1.3612245802775345
Energy: 1.424503270089097
Energy: 1.361224580276425
Energy: 1.3950979155584962
Energy: 1.3845146906810395
Energy: 1.3245754516111505
Energy: 1.3845146906865862
Energy: 1.3622903074030621
Energy: 1.3613253543707173
Energy: 1.3778483681785867
Energy: 1.3613253543707173
Energy: 1.3952001217566705
Energy: 1.384255829475531
Energy: 1.324404397584863
Energy: 1.3842558294799678
Energy: 1.2944476890456273
Energy: 1.361196224173017
Energy: 1.7854080513054191
Energy: 1.3611962241752356
Energy: 1.3782355270877074
Energy: 1.447805423020548
Energy: 1.3128531564423507
Energy: 1.447805423020548
Energy: 1.2948828650584185
Energy: 1.490207166498171
Energy: 1.3260471941589007
Energy: 1.490207166498171
Energy: 1.2914088205935663
Energy: 1.3668070564931647
Energy: 1.312948214937929
Energy: 1.3668070564998205
Energy: 1.2948469312753246
Energy: 1.4904609259458317
Energy: 1.3611492456494354
Energy: 1.4904609259447221

minimum gb energy = 1.2904740427193933 eV
minimum distance =  2.25327846770525 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.3463734401701932
Energy: 1.3459596997047962
Energy: 1.6141449764879667
Energy: 1.3459596996986256
Energy: 1.5299174648492793
Energy: 1.3289995312368044
Energy: 1.3059098396429871
Energy: 1.328999531232753
Energy: 1.3020103351904777
Energy: 1.3304775346212203
Energy: 1.6122777555955228
Energy: 1.3304775346164206
Energy: 1.350494867551432
Energy: 1.2952286964141875
Energy: 1.3000334683771488
Energy: 1.2952286964080169
Energy: 1.293661103258638
Energy: 1.4322441530317085
Energy: 1.3429492732566142
Energy: 1.4322441530317085
Energy: 1.2902698419626708
Energy: 1.31132093141665
Energy: 1.3177397048085664
Energy: 1.3113209314152787
Energy: 1.3109103034977203
Energy: 1.4113630280245182
Energy: 1.3300791713134916
Energy: 1.4113630280265752
Energy: 1.2890294539999394
Energy: 1.5766385883943186
Energy: 1.300676719104921
Energy: 1.5766385883929475
Energy: 1.343746412100251
Energy: 1.5741892732014473
Energy: 1.3643898115892514
Energy: 1.5741892732035043
Energy: 1.3477136950225588
Energy: 1.3939497848100808
Energy: 1.3063662299674932
Energy: 1.393949784811452
Energy: 1.3014553965736109
Energy: 1.3668843255075438
Energy: 1.296963383985335
Energy: 1.366884325508915
Energy: 1.3067803418705641
Energy: 1.4025907218036344
Energy: 1.312237442322553
Energy: 1.4025907218022633
Energy: 1.2878959837900645
Energy: 1.564149536569621
Energy: 1.3110267253765258
Energy: 1.5641495365716775
Energy: 1.3060479660431086
Energy: 1.430878837056158
Energy: 1.3450702328393396
Energy: 1.4308788370527297
Energy: 1.3067757504859248
Energy: 1.3027587466560249
Energy: 1.3568775198464809
Energy: 1.3027587466484827
Energy: 1.3014758892373448
Energy: 1.3324210076463583
Energy: 1.342127828213456
Energy: 1.3324210076470437
Energy: 1.318657216808037
Energy: 1.3012506884636208
Energy: 1.3110001577906902
Energy: 1.3012506884588215
Energy: 1.2948992204462617
Energy: 1.3458222005547953
Energy: 1.3147026312630379
Energy: 1.3458222005589093
Energy: 1.5315071864694196
Energy: 1.5976204523442585
Energy: 1.2999453116118236
Energy: 1.597620452354543
Energy: 1.3124194904743136
Energy: 1.3312260453273415
Energy: 1.3664203039051457
Energy: 1.3312260453348839
Energy: 1.3201718831016003
Energy: 1.3191207663980005
Energy: 1.3149387844078482
Energy: 1.319120766398686
Energy: 1.2950004956534327
Energy: 1.3463748385764813
Energy: 1.4702181562939238
Energy: 1.3463748385709962
Energy: 1.3365968739460306
Energy: 1.3120918653071827
Energy: 1.314567912481309
Energy: 1.312091865309925
Energy: 1.3009779419875491
Energy: 1.4134951127880053
Energy: 1.570170343949388
Energy: 1.413495112785948
Energy: 1.3285754583790796
Energy: 1.3469931247291491
Energy: 1.2969592595674073
Energy: 1.3469931247271547
Energy: 1.312278395360597
Energy: 1.4341794413126632
Energy: 1.3236996271135713
Energy: 1.4341794413099207
Energy: 1.5091549470011296
Energy: 1.3877209218301891
Energy: 1.303640707603172
Energy: 1.3877209218274464
Energy: 1.3622655040714753
Energy: 1.5509630924786195
Energy: 1.2999760357501196
Energy: 1.5509630924793054
Energy: 1.3676780234165298
Energy: 1.4302200001183643
Energy: 1.2940824000331936
Energy: 1.4302200001156213
Energy: 1.312931350384252
Energy: 1.3828921326067385
Energy: 1.3719565287824989
Energy: 1.3828921326087953
Energy: 1.298510111570843
Energy: 1.4305270502571925
Energy: 1.3057100315929007
Energy: 1.4305270502558212
Energy: 1.3004650767306036
Energy: 1.548998411966902
Energy: 1.2972248837014133
Energy: 1.5489984119614169
Energy: 1.303478012024749
Energy: 1.3982385777497581
Energy: 1.53694945604076
Energy: 1.3982385777463298
Energy: 1.3677694727492713
Energy: 1.5696946140973356
Energy: 1.3144394398421133
Energy: 1.5696946140980212
Energy: 1.2955450521495102
Energy: 1.347857886885118
Energy: 1.3435325243887473
Energy: 1.3478578868830613
Energy: 1.3464348301018056
Energy: 1.4130734042865325
Energy: 1.3096380634588283
Energy: 1.4130734042906463
Energy: 1.3143630668832023
Energy: 1.3154548450348942
Energy: 1.2941190693665046
Energy: 1.3154548451075092
Energy: 1.3410275437227455
Energy: 1.4343902664237578
Energy: 1.3146530530161906
Energy: 1.4343902664237578

minimum gb energy = 1.2878959837900645 eV
minimum distance =  2.23944734266347 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.19245601780677
Energy: 1.192164795744493
Energy: 1.8186771943524143
Energy: 1.192164795744493
Energy: 1.2068967947531974
Energy: 1.230261190262849
Energy: 1.2088323829224976
Energy: 1.230261190264643
Energy: 1.2063660235343594
Energy: 1.4102910064472676
Energy: 1.965130596147394
Energy: 1.4102910064472676
Energy: 1.19220643566204
Energy: 1.2302148689472185
Energy: 1.2087108306607712
Energy: 1.2302148689472185
Energy: 1.206258647354792
Energy: 1.3158987648747578
Energy: 1.1964471859012897
Energy: 1.3158987648729639
Energy: 1.2058512436644038
Energy: 1.1942728617385805
Energy: 1.196353606240986
Energy: 1.1942728617403748
Energy: 1.20678383835645
Energy: 1.4101025874289528
Energy: 1.192214649275276
Energy: 1.4101025874307467
Energy: 1.2068357523895794
Energy: 1.4089449429354959
Energy: 1.2094186693624611
Energy: 1.4089449429354959
Energy: 1.208617520234181
Energy: 1.3192274475232413
Energy: 1.1893525543535388
Energy: 1.3192274475232413
Energy: 1.2320207500175073
Energy: 1.1928077720455543
Energy: 1.2058438902109272
Energy: 1.1928077720473482
Energy: 1.1917478416838378
Energy: 1.2316239946663912
Energy: 1.205885044341957
Energy: 1.2316239946645973
Energy: 1.1918340258978712
Energy: 1.411167966994341
Energy: 1.2088684096363722
Energy: 1.411167966994341
Energy: 1.206749196212147
Energy: 1.1965867928169283
Energy: 1.189112932539059
Energy: 1.1965867928169283
Energy: 1.1937075226723624
Energy: 1.3157832557651952
Energy: 1.1930394320337048
Energy: 1.315783255766989
Energy: 1.203935880189726
Energy: 1.1965521677688322
Energy: 1.2059104668324858
Energy: 1.196552167767038

minimum gb energy = 1.189112932539059 eV
minimum distance =  2.26704332911188 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.1815405173650058
Energy: 1.1402193102889242
Energy: 1.4596977104452433
Energy: 1.14021931029118
Energy: 1.3598041685769018
Energy: 1.3661604790843282
Energy: 1.1341686697272604
Energy: 1.3661604790858322
Energy: 1.142027083201677
Energy: 1.1410652386044948
Energy: 1.3484114323708523
Energy: 1.141065238612766
Energy: 1.1466638213256681
Energy: 1.3659703251341484
Energy: 1.1278322339540061
Energy: 1.3659703251400952
Energy: 1.1482274777760393
Energy: 1.2336056364484513
Energy: 1.196277391193732
Energy: 1.23360563645973
Energy: 1.126888738486579
Energy: 1.16850729036848
Energy: 1.1550462440827858
Energy: 1.1685072903647202
Energy: 1.1481660124216557
Energy: 1.2355189519154373
Energy: 1.3637059876401219
Energy: 1.2355189519184446
Energy: 1.1321359450651796
Energy: 1.3656019978073133
Energy: 1.1553344850402525
Energy: 1.365601997808817
Energy: 1.1551234283258802
Energy: 1.2357808725846908
Energy: 1.4442101903042217
Energy: 1.2357808725673967
Energy: 1.354804379303928
Energy: 1.448469326204008
Energy: 1.127779287281043
Energy: 1.448469326221986
Energy: 1.1483998963178548
Energy: 1.2591188799701964
Energy: 1.1537775705315692
Energy: 1.2591188799596693
Energy: 1.183553245367671
Energy: 1.4485259256544898
Energy: 1.1249791994251175
Energy: 1.448525925652986
Energy: 1.1924067492169153
Energy: 1.1596242189733228
Energy: 1.1332782095882756
Energy: 1.159624218979338
Energy: 1.562566667922554
Energy: 1.2580499318756517
Energy: 1.1256127641874334
Energy: 1.258049931872644
Energy: 1.1480348479758806
Energy: 1.1406848931029563
Energy: 1.1339295795342108
Energy: 1.1406848931022042
Energy: 1.1356009012279293
Energy: 1.25835141811381
Energy: 1.1292504651107995
Energy: 1.2583514181250888
Energy: 1.1498566764028335
Energy: 1.2263918913105798
Energy: 1.1305444651106678
Energy: 1.226391891316595
Energy: 1.1513701966446441
Energy: 1.2318140878229695
Energy: 1.1673501341664014
Energy: 1.2318140878146986
Energy: 1.1494261438165028
Energy: 1.160585142546767
Energy: 1.1675853644930005
Energy: 1.160585142547519
Energy: 1.1497836831551111
Energy: 1.1602713380967005
Energy: 1.1670555547551662
Energy: 1.1602713381057232
Energy: 1.1500659791559362
Energy: 1.2319436171652853
Energy: 1.1674162156215044
Energy: 1.2319436171772475
Energy: 1.1499181787639667
Energy: 1.2263736327635497
Energy: 1.1303056585903937
Energy: 1.2263736327643018
Energy: 1.1352867858568547
Energy: 1.2581921882745581
Energy: 1.1293086662612026
Energy: 1.258192188267039
Energy: 1.1480580339638686
Energy: 1.140695192703568
Energy: 1.1341872548337117
Energy: 1.1406951927013123
Energy: 1.5627436360878342
Energy: 1.257935525531061
Energy: 1.1255805458793522
Energy: 1.2579355255348204
Energy: 1.1920533248956116
Energy: 1.160114680491917
Energy: 1.1596426698993578
Energy: 1.1601146805092113
Energy: 1.1836080379015177
Energy: 1.4484211295452483
Energy: 1.1251479729540386
Energy: 1.4484211295475038
Energy: 1.1538566650525346
Energy: 1.2585221410898808
Energy: 1.1573924940516698
Energy: 1.2585221410913163
Energy: 1.354385846671649
Energy: 1.4487759602015158
Energy: 1.1277964142341397
Energy: 1.4487759601864774
Energy: 1.1482344305129526
Energy: 1.2359325906275953
Energy: 1.3422883758114759
Energy: 1.2359325906200762
Energy: 1.1321243350420913
Energy: 1.365172936493264
Energy: 1.1553367038507523
Energy: 1.3651729364984595
Energy: 1.1547492309323026
Energy: 1.2353994535102175
Energy: 1.5490253304220232
Energy: 1.2353994535072101
Energy: 1.1271116988779695
Energy: 1.1688024423586458
Energy: 1.1551442717761773
Energy: 1.1688024423789476
Energy: 1.1544260655615937
Energy: 1.2336746123816147
Energy: 1.5482724025828842
Energy: 1.233674612377855
Energy: 1.146276336841232
Energy: 1.3657630364932478
Energy: 1.1278540097942364
Energy: 1.3657630364939999

minimum gb energy = 1.1249791994251175 eV
minimum distance =  2.22512408071255 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.0826079952121739
Energy: 1.0818403342849707
Energy: 1.094577955927726
Energy: 1.081840334283677
Energy: 1.1431834622162518
Energy: 1.081354486456464
Energy: 1.0345957170819353
Energy: 1.081354486456464
Energy: 1.0459438524639135
Energy: 1.2341535399540968
Energy: 1.7557019018933997
Energy: 1.2341535399528032
Energy: 1.0263609301140242
Energy: 1.4017273941261033
Energy: 1.0344686146612878
Energy: 1.4017273941248096
Energy: 1.0335269302926093
Energy: 1.0813445615539694
Energy: 1.028902109114406
Energy: 1.0813445615526756
Energy: 1.0226697871836037
Energy: 1.081479782776644
Energy: 1.0290931792593423
Energy: 1.081479782776644
Energy: 1.0651538330545105
Energy: 1.2712604763133055
Energy: 1.3778229708468992
Energy: 1.2712604763145992
Energy: 1.033957258851978
Energy: 1.0828919726880755
Energy: 1.0860407535014653
Energy: 1.0828919726893689
Energy: 1.033518695519271
Energy: 1.082686294549415
Energy: 1.560998153736464
Energy: 1.082686294549415
Energy: 1.4295900875552747
Energy: 1.0822409693825523
Energy: 1.0294336038436411
Energy: 1.0822409693838462
Energy: 1.0591585881998384
Energy: 1.1320267234658163
Energy: 1.026316550812397
Energy: 1.1320267234645227
Energy: 1.4221041577222742
Energy: 1.0817190918643842
Energy: 1.0346031425864577
Energy: 1.0817190918630906
Energy: 1.0336578987759077
Energy: 1.0817853728435993
Energy: 1.0229628399231416
Energy: 1.0817853728423057
Energy: 1.3774822391453208
Energy: 1.2632788660960703
Energy: 1.0327762526224975
Energy: 1.2632788661193561
Energy: 1.0810223709576152
Energy: 1.132948135974105
Energy: 1.0328053000825863
Energy: 1.132948135974105
Energy: 1.0814353196742605
Energy: 1.2154310610841468
Energy: 1.0347006719286733
Energy: 1.2154310610854404
Energy: 1.0338149325414345
Energy: 1.2157647290570748
Energy: 1.0330699443178353
Energy: 1.2157647290557811
Energy: 1.0258648171421463
Energy: 1.2622966907345985
Energy: 1.0345871500912998
Energy: 1.262296690737186
Energy: 1.0365222965628151
Energy: 1.0837578894134368
Energy: 1.0328191642361269
Energy: 1.0837578894121431
Energy: 1.0264889179530916
Energy: 1.0820603962783906
Energy: 1.0256859742048008
Energy: 1.0820603962770967

minimum gb energy = 1.0226697871836037 eV
minimum distance =  2.28198035751689 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 0.9957937221717298
Energy: 0.9415184994385997
Energy: 0.9492294274622346
Energy: 0.9415184994355691
Energy: 1.2427437365651366
Energy: 0.9640777876890241
Energy: 0.9460381379397296
Energy: 0.964077787693065
Energy: 0.93793297918909
Energy: 0.9374962110507595
Energy: 1.2288805732465358
Energy: 0.9374962110548004
Energy: 0.9928478188049368
Energy: 1.2095052278256249
Energy: 0.9459006583102704
Energy: 1.2095052278276452
Energy: 0.9445294359083007
Energy: 1.210712705266703
Energy: 0.9158528101756777
Energy: 1.210712705265693
Energy: 0.911191929678045
Energy: 1.209465486606007
Energy: 0.9462302663915199
Energy: 1.209465486606007
Energy: 0.9458696513509178
Energy: 0.9374996748717812
Energy: 0.9937414819334475
Energy: 0.9374996748667302
Energy: 0.9086493197176457
Energy: 0.9947466842250355
Energy: 0.9396209297029857
Energy: 0.9947466842270559
Energy: 0.9447338204603655
Energy: 0.9644003253961766
Energy: 1.2391609907423633
Energy: 0.9644003253951664
Energy: 0.9103958028290312
Energy: 1.1923747964628453
Energy: 0.9976701597518259
Energy: 1.1923747964648657
Energy: 0.9455832160767923
Energy: 0.937715344896481
Energy: 1.4648388147938296
Energy: 0.9377153448944606
Energy: 1.2232131450849464
Energy: 1.3368510767166768
Energy: 0.9396288876798887
Energy: 1.3368510767156665
Energy: 0.9447467300894143
Energy: 0.9644497649839325
Energy: 1.1920189709673017
Energy: 0.9644497649819121
Energy: 1.231146265013973
Energy: 1.2913183636962215
Energy: 0.9466193027131001
Energy: 1.2913183636972316
Energy: 0.9456407882121797
Energy: 0.9377647998583318
Energy: 0.9147798264226744
Energy: 0.9377647998613164
Energy: 1.2269020560552446
Energy: 1.3368056818935456
Energy: 0.9440096400508821
Energy: 1.336805681894556
Energy: 0.9444705753205066
Energy: 0.9947106696301918
Energy: 0.9085763562797798
Energy: 0.994710669632212
Energy: 1.2116900133413993
Energy: 1.2100292618598747
Energy: 0.9461708771711116
Energy: 1.2100292618598747
Energy: 1.0021203328264756
Energy: 0.9377242539617439
Energy: 0.9159669162094926
Energy: 0.9377242539637641
Energy: 1.4618869237293695
Energy: 1.3361182011981276
Energy: 0.944010906856783
Energy: 1.3361182011971173
Energy: 0.9451234000828632
Energy: 1.3353780807619815
Energy: 0.9089843529909634
Energy: 1.3353780807650122
Energy: 0.9374107200312732
Energy: 0.9644888752946322
Energy: 0.9456628558406679
Energy: 0.9644888752956423
Energy: 0.9459256370077957
Energy: 1.046617135142563
Energy: 1.2412860220370177
Energy: 1.0466171351435731
Energy: 0.9096387218712099
Energy: 1.1069774960293246
Energy: 0.9440346102546198
Energy: 1.1069774960313448
Energy: 0.9431605119818556
Energy: 1.3354172700061187
Energy: 1.228245139951393
Energy: 1.3354172700505205
Energy: 0.9109871521067573
Energy: 0.995272331737865
Energy: 0.9468202836693087
Energy: 0.9952723317419057

minimum gb energy = 0.9085763562797798 eV
minimum distance =  2.28846704427847 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.2778562038470742
Energy: 0.8736905129593456
Energy: 1.2533336822523131
Energy: 0.8736905129585174
Energy: 1.310389970686317
Energy: 0.8536695673665502
Energy: 0.8433779237411555
Energy: 0.8536695673665502
Energy: 0.8717415127456829
Energy: 0.8403717560680555
Energy: 1.1114902250108676
Energy: 0.8403717560672272
Energy: 1.0998900045677897
Energy: 1.060110990882635
Energy: 0.8436556777239882
Energy: 1.0601109908801507
Energy: 0.8382957415053744
Energy: 1.0934971161168976
Energy: 1.2264001562703974
Energy: 1.0934971161119282
Energy: 0.8543873944840784
Energy: 1.0596043981982917
Energy: 0.8432160749587849
Energy: 1.0596043981982917
Energy: 0.8424305934150788
Energy: 1.060568682353549
Energy: 0.8697312718978785
Energy: 1.0605686823527207
Energy: 0.822986627687429
Energy: 0.8723294673466115
Energy: 0.8392486391407811
Energy: 0.8723294673466115
Energy: 0.8464998143490361
Energy: 0.8738086503881739
Energy: 1.0970221758383913
Energy: 0.8738086504195695
Energy: 0.8223437103047612
Energy: 1.0507474018970526
Energy: 0.8727921557321434
Energy: 1.0507474018978806
Energy: 0.8425916967786492
Energy: 0.8539318980786001
Energy: 1.4732771991116962
Energy: 0.8539318980827411
Energy: 0.8240414503404283
Energy: 1.0742481538480269
Energy: 1.2787515080077525
Energy: 1.0742481538455422
Energy: 0.8462131087607981
Energy: 1.3957365429173014
Energy: 1.5595804380763243
Energy: 1.3957365429189579
Energy: 1.077947790343354
Energy: 0.9735496136722207
Energy: 0.8728251994243472
Energy: 0.973549613669736
Energy: 0.8426280921452771
Energy: 0.8541159776150925
Energy: 1.2968396996263527
Energy: 0.8541159776142643
Energy: 1.0900305504362837
Energy: 1.0737828010225108
Energy: 0.8394743006232233
Energy: 1.0737828010225108
Energy: 0.8464241767700769
Energy: 1.1926378208535025
Energy: 1.0585825414107741
Energy: 1.1926378208584718
Energy: 1.0896059889543037
Energy: 0.963107744249755
Energy: 0.843542871121348
Energy: 0.9631077442522396
Energy: 0.8423586332814951
Energy: 0.8722936987023545
Energy: 0.8425885273475456
Energy: 0.8722936987015263
Energy: 1.100423765982795
Energy: 1.0740009952522092
Energy: 0.8491781386408468
Energy: 1.0740009952464118
Energy: 0.8760396345315831
Energy: 0.9605500734996056
Energy: 0.8221089553128142
Energy: 0.9605500735037465
Energy: 1.4779201622461418
Energy: 0.9843758804177754
Energy: 0.8434376315805917
Energy: 0.9843758804186035
Energy: 1.2809622609848617
Energy: 1.076051648473873
Energy: 0.831038884692753
Energy: 1.0760516484722167
Energy: 1.2783844121062455
Energy: 1.1578589606211005
Energy: 0.845922856041227
Energy: 1.1578589606045369
Energy: 0.8757387541024575
Energy: 0.9664927163900168
Energy: 0.8250774805177894
Energy: 0.9664927163867042
Energy: 1.2869174857996086
Energy: 1.4864008979466696
Energy: 0.8434662677470884
Energy: 1.4864008979474979
Energy: 0.8426847830189432
Energy: 1.073981933155145
Energy: 1.1065453563416898
Energy: 1.0739819331576295
Energy: 0.8385331569795159
Energy: 0.9616720744476526
Energy: 0.8488808060881141
Energy: 0.9616720744443399
Energy: 0.8465589462588929
Energy: 0.9648730258813852
Energy: 1.0911068045912686
Energy: 0.9648730258805571
Energy: 0.8261042432275733
Energy: 1.0108656021032827
Energy: 0.8476721532564605
Energy: 1.0108656020991418
Energy: 0.8499301281458556
Energy: 1.0742545482008306
Energy: 1.1049218915885197
Energy: 1.0742545482049712
Energy: 0.8233376184503856
Energy: 0.9614333983913761
Energy: 0.8808365445717787
Energy: 0.9614333983963452

minimum gb energy = 0.8221089553128142 eV
minimum distance =  2.28008472690857 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.155516753401806
Energy: 0.7913228485611978
Energy: 1.3954694154129168
Energy: 0.7913228485640041
Energy: 1.3304218685255833
Energy: 0.7877742888403941
Energy: 0.7885852068621702
Energy: 0.7877742888354831
Energy: 0.8166668103911262
Energy: 0.7863618558689074
Energy: 1.0006630078770324
Energy: 0.7863618558717138
Energy: 1.1752231997249594
Energy: 0.7884775922109791
Energy: 0.7887931081487671
Energy: 0.7884775922032617
Energy: 0.7852743434796774
Energy: 0.8761049383858364
Energy: 1.177716915030351
Energy: 0.8761049383928522
Energy: 1.1678598131473155
Energy: 0.9605026683257183
Energy: 0.7884437586643895
Energy: 0.9605026683250167
Energy: 0.787850522947827
Energy: 0.9725920777508504
Energy: 0.7950191218044157
Energy: 0.9725920777508504
Energy: 0.9724771929536148
Energy: 0.971508490997974
Energy: 0.7886159961395971
Energy: 0.9715084909951676
Energy: 0.7906607915185712
Energy: 0.8029062846131458
Energy: 0.9893035481905196
Energy: 0.8029062846152505
Energy: 0.755607268454253
Energy: 0.7868538535889396
Energy: 0.7860102739128918
Energy: 0.7868538535868349
Energy: 0.7880890939982346
Energy: 0.7884617266042724
Energy: 1.1769524587465554
Energy: 0.7884617266049739
Energy: 0.7556369183584634
Energy: 0.9615208833892933
Energy: 0.8171522388591742
Energy: 0.9615208833864869
Energy: 0.790322816388686
Energy: 0.803550045534603
Energy: 1.464666554437453
Energy: 0.8035500455668759
Energy: 0.7568651075443672
Energy: 0.7912389348629632
Energy: 1.156168835720437
Energy: 0.7912389348636647
Energy: 0.7880449548948234
Energy: 0.7886278032469202
Energy: 1.4781802922606275
Energy: 0.7886278032160505
Energy: 0.9915604366859507
Energy: 0.9611613022390052
Energy: 0.8172520776474339
Energy: 0.9611613022326909
Energy: 0.7904523436598343
Energy: 0.8029289800042649
Energy: 1.397318040177381
Energy: 0.8029289800007571
Energy: 1.0047499235624466
Energy: 0.8703444528614147
Energy: 0.7858018166542742
Energy: 0.8703444528663258
Energy: 0.7879450143484334
Energy: 0.7869698979157609
Energy: 1.1672237233348333
Energy: 0.786969897920672
Energy: 0.9830915333069883
Energy: 0.9605281607925256
Energy: 0.788516367870359
Energy: 0.9605281608044525
Energy: 0.7907072639422436
Energy: 0.8189803512085193
Energy: 0.9568609379343954
Energy: 0.8189803512071162
Energy: 0.990623501731056
Energy: 0.8011733705901095
Energy: 0.7939215766274306
Energy: 0.8011733704049551
Energy: 0.787995480618393
Energy: 0.7861871070717324
Energy: 0.7813254200923082
Energy: 0.7861871070801515
Energy: 1.3672624178867834
Energy: 0.9601937120444832
Energy: 0.7886822464997125
Energy: 0.9601937120451849
Energy: 0.8193358496921652
Energy: 0.8173946583043248
Energy: 0.7555120888880343
Energy: 0.8173946583078328
Energy: 1.3287096368623226
Energy: 0.8012486867575642
Energy: 0.793740566682149
Energy: 0.8012486867610722
Energy: 1.158009726917319
Energy: 0.7863590257051343
Energy: 0.7760871402436432
Energy: 0.7863590257037311
Energy: 1.4741737292572292
Energy: 0.95939616534483
Energy: 0.7887134234403411
Energy: 0.9593961653476364
Energy: 0.8192463688407664
Energy: 0.8990576324636088
Energy: 0.779028320493901
Energy: 0.8990576324327392
Energy: 1.134689460343028
Energy: 0.8021566083925427
Energy: 0.7936349084343011
Energy: 0.8021566083820187
Energy: 0.7880068421254866
Energy: 0.8725618060665721
Energy: 1.0003736562142425
Energy: 0.8725618060749273
Energy: 1.160998260932099
Energy: 0.7860451450048558
Energy: 0.7887107774775945
Energy: 0.7860451449711798
Energy: 0.7906347762786792
Energy: 0.8974719323054225
Energy: 0.9982142152313496
Energy: 0.8974719323061242
Energy: 0.765572888478706
Energy: 0.8174895767353911
Energy: 0.7938808786473198
Energy: 0.8174895767332864
Energy: 0.7698641853796189
Energy: 0.8691460545219964
Energy: 0.9908353485512361
Energy: 0.8691460545304156
Energy: 0.7591940365508476
Energy: 0.7857941991330188
Energy: 0.7912555200891879
Energy: 0.785794199146349
Energy: 0.7906909984834685
Energy: 0.9011172732428521
Energy: 1.3612704822337205
Energy: 0.9011172732365379

minimum gb energy = 0.7555120888880343 eV
minimum distance =  2.28281388188568 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.163647395021596
Energy: 0.7813610367478565
Energy: 0.9457505192002439
Energy: 0.7813610367429886
Energy: 1.4102707801048031
Energy: 0.7676093268302282
Energy: 0.7214517106939019
Energy: 0.7676093268320537
Energy: 1.1222278662407352
Energy: 0.7750446612514155
Energy: 0.8779619590932425
Energy: 0.77504466124959
Energy: 1.3761721427016795
Energy: 0.8302262974175185
Energy: 0.7215381343113673
Energy: 0.8302262974150846
Energy: 0.8400103729030154
Energy: 0.7309136735925665
Energy: 0.7364838784108599
Energy: 0.7309136735974345
Energy: 1.2380683437446607
Energy: 0.842415861527621
Energy: 0.7213663490999114
Energy: 0.842415861526404
Energy: 0.7984122959511343
Energy: 0.9205471884636346
Energy: 0.8112544738396448
Energy: 0.9205471884636346
Energy: 1.094391107162486
Energy: 0.829683064755918
Energy: 0.7310894416525812
Energy: 0.8296830647540925
Energy: 0.7309141222098056
Energy: 0.8796420511461929
Energy: 0.9939096867810532
Energy: 0.8796420511492353
Energy: 0.9306719888616272
Energy: 0.9104840932606263
Energy: 0.7991862508072265
Energy: 0.9104840932648858
Energy: 0.7220499829994494
Energy: 0.760679206382182
Energy: 1.1379378178017046
Energy: 0.7606792063852243
Energy: 0.762591088557502
Energy: 0.7692463767282365
Energy: 0.8405694588994465
Energy: 0.7692463767245855
Energy: 0.7207553131383474
Energy: 0.7376227993329706
Energy: 1.333207615870215
Energy: 0.7376227993317536
Energy: 0.6804133581949798
Energy: 0.8459874451460244
Energy: 1.1227100346494008
Energy: 0.8459874451381142
Energy: 0.7226775840224209
Energy: 0.8306387944378075
Energy: 1.5108435260027957
Energy: 0.8306387944414584
Energy: 0.6770026963527083
Energy: 0.7656508731446554
Energy: 1.0815694616497147
Energy: 0.7656508731446554
Energy: 0.7207931647498249
Energy: 0.7396292272919762
Energy: 1.4433822443236863
Energy: 0.7396292272919762
Energy: 0.8649164317422808
Energy: 0.8458628996879475
Energy: 1.122969877435126
Energy: 0.8458628996836881
Energy: 0.723711263494822
Energy: 0.8295689846102267
Energy: 1.3762235495604183
Energy: 0.8295689846150945
Energy: 0.8777746749675551
Energy: 0.7659088207028304
Energy: 0.8404427615016747
Energy: 0.7659088207095238
Energy: 0.7220486004760746
Energy: 0.749351880574451
Energy: 1.3046596821612473
Energy: 0.7493518805708004
Energy: 0.9532586031364568
Energy: 0.8983571169845681
Energy: 0.7991979654640512
Energy: 0.8983571169815256
Energy: 0.73215281487271
Energy: 0.7593923673868106
Energy: 1.0939002345345898
Energy: 0.7593923673886361
Energy: 0.9664127276306009
Energy: 0.7874718417244573
Energy: 0.7318921607786508
Energy: 0.7874718417281082
Energy: 0.801195045479259
Energy: 0.829933920206457
Energy: 0.930275842251691
Energy: 0.8299339202101077
Energy: 1.2848387544596709
Energy: 0.8984696186426163
Energy: 0.7227719278766414
Energy: 0.8984696186468757
Energy: 0.8423765087015217
Energy: 0.759412198985489
Energy: 0.7624530471646525
Energy: 0.7594121989848804
Energy: 1.2982705362689089
Energy: 0.787738439896878
Energy: 0.7215645894534567
Energy: 0.7877384398999203
Energy: 1.124439668575395
Energy: 0.8449295983542428
Energy: 0.6824921980962748
Energy: 0.8449295983512004
Energy: 1.5107120745330842
Energy: 0.8986210247138653
Energy: 0.7227852051497813
Energy: 0.8986210247089973
Energy: 1.1658144574540994
Energy: 0.7727954274860356
Energy: 0.6770697192890482
Energy: 0.7727954274854272
Energy: 1.3998840675001862
Energy: 0.7923694271574879
Energy: 0.7213962958995548
Energy: 0.7923694271404504
Energy: 1.1243644034019595
Energy: 0.8449689316511915
Energy: 0.676423013450625
Energy: 0.8449689316548423
Energy: 1.3763090412125372
Energy: 0.8292259917533595
Energy: 0.7236526054395966
Energy: 0.8292259917533595
Energy: 0.8426119209636878
Energy: 0.7592955639287589
Energy: 0.8778989561448229
Energy: 0.7592955639330182
Energy: 1.1133906370885476
Energy: 0.7982178481178586
Energy: 0.7242859794136791
Energy: 0.7982178481184671
Energy: 0.801290783988297
Energy: 0.8984451896006345
Energy: 0.9543964107132528
Energy: 0.898445189598809
Energy: 1.094261646231211
Energy: 0.7592448723747359
Energy: 0.7339493710123228
Energy: 0.7592448723789953
Energy: 0.7328204535847536
Energy: 0.7592229071077201
Energy: 0.9673574310140514
Energy: 0.7592229071083287
Energy: 0.770022627509288
Energy: 0.81013731095203
Energy: 0.8042657020184755
Energy: 0.8101373109526384
Energy: 0.7205047953539471
Energy: 0.898469534289931
Energy: 1.285404511078998
Energy: 0.8984695342881057
Energy: 0.7629930714720127
Energy: 0.7591543577042837
Energy: 0.8455598891330817
Energy: 0.7591543577006329
Energy: 0.7235793389217832
Energy: 0.7592641163074089
Energy: 1.2987233405377394
Energy: 0.7592641163098427

minimum gb energy = 0.676423013450625 eV
minimum distance =  2.28977657563994 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.0205378745280938
Energy: 0.021386726475976104
Energy: 0.9648026802810548
Energy: 0.021386726476443872
Energy: 0.9651368018826624
Energy: 0.3700154053198421
Energy: 0.37105781553668854
Energy: 0.3700154053198421
Energy: 0.0205378745280938
Energy: 0.021386726475092533
Energy: 0.9650276995243957
Energy: 0.021386726475976104
Energy: 0.96513680188313
Energy: 0.3700154053198421
Energy: 0.371057815535753
Energy: 0.3700154053198421
Energy: 0.0205378745280938
Energy: 0.0213867264755603
Energy: 0.9647995234835423
Energy: 0.021386726475976104
Energy: 0.9651368018835979
Energy: 0.37001540531942634
Energy: 0.37105781553757206
Energy: 0.37001540531942634

minimum gb energy = 0.0205378745280938 eV
minimum distance =  2.47795776874665 Angstroms
sigma value = 1