Model name: model_name=EAM_Dynamo_Foiles_1985_Ni__MO_010059867259_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.519999977946282
cohesive_energy=4.450349978791505
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.018160145411972625
Energy: 1.2247226730021612
Energy: 0.018160145412597403
Energy: 1.2247226730014997
Energy: 0.0181601454113111
Energy: 1.2247226730021612
Energy: 1.2247226730018306
Energy: 0.9939437036498351
Energy: 1.224722673002786
Energy: 1.4597505724081816
Energy: 1.224722673002786
Energy: 1.2294637696337911
Energy: 0.018160145412597403
Energy: 1.224722673002786
Energy: 0.018160145412266637
Energy: 1.224722673002786
Energy: 0.018160145412266637
Energy: 1.2247226730018306
Energy: 1.224722673002492
Energy: 1.4597505724085127
Energy: 1.2247226730021612
Energy: 1.2294637696276536
Energy: 1.224722673002492
Energy: 1.2294637696331663
Energy: 0.018160145411972625
Energy: 1.2247226730031169
Energy: 0.018160145412266637
Energy: 1.224722673002492
Energy: 0.018160145410980336
Energy: 1.224722673002492
Energy: 1.2247226730011689
Energy: 1.2294637696360697
Energy: 1.224722673002492
Energy: 1.2294637696383113
Energy: 1.2247226730021612
Energy: 1.2294637696318431

minimum gb energy = 0.018160145410980336 eV
minimum distance =  2.3411856904338 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.4608785985120343
Energy: 1.374478303685884
Energy: 1.4608785985128308
Energy: 1.3744783036842918
Energy: 1.4608785985120343
Energy: 1.374478303685088
Energy: 1.5796445074794294
Energy: 1.2702223359165252
Energy: 1.5796445074762444
Energy: 1.2702223359149327
Energy: 1.5796445074873913
Energy: 1.2702223359141365
Energy: 1.432300158844534
Energy: 1.4468474765960249
Energy: 1.4323001588453301
Energy: 1.446847476600006
Energy: 1.4323001588453301
Energy: 1.4468474765992096
Energy: 1.5424056796651067
Energy: 1.340412289305025
Energy: 1.5424056796555523
Energy: 1.3404122893042285
Energy: 1.5424056796515713
Energy: 1.340412289305025
Energy: 1.3907042029258319
Energy: 1.4613324782913675
Energy: 1.3907042029258319
Energy: 1.4613324782826094
Energy: 1.3907042029369783
Energy: 1.4613324782913675
Energy: 1.4599306119490483
Energy: 1.3025046626612733
Energy: 1.4599306119490483
Energy: 1.302504662668439
Energy: 1.4599306119506406
Energy: 1.3025046626668466
Energy: 1.332307001326948
Energy: 1.435564884169329
Energy: 1.332307001330929
Energy: 1.4355648841733097
Energy: 1.3323070013285405
Energy: 1.4355648841749022
Energy: 1.3358322786631762
Energy: 1.546215026592698
Energy: 1.3358322786655645
Energy: 1.546215026597475
Energy: 1.3358322786703416
Energy: 1.5462150265839398
Energy: 1.4846408780800204
Energy: 1.4458261268916226
Energy: 1.484640878081613
Energy: 1.4458261268908263
Energy: 1.4846408780832054
Energy: 1.4458261268908263
Energy: 1.2573122768746154
Energy: 1.5289227126444362
Energy: 1.2573122768706348
Energy: 1.5289227126516018
Energy: 1.2573122768714309
Energy: 1.5289227126587677
Energy: 1.4524141399364985
Energy: 1.3018788075164927
Energy: 1.452414139934906
Energy: 1.3018788075180852
Energy: 1.452414139934906
Energy: 1.3018788075164927
Energy: 1.223051420347088
Energy: 1.486218728620618
Energy: 1.2230514203462917
Energy: 1.4862187286309685
Energy: 1.2230514203454954
Energy: 1.4862187286134525
Energy: 1.5956667091452672
Energy: 1.2157314699005244
Energy: 1.595666709149248
Energy: 1.2157314698989319
Energy: 1.5956667091468595
Energy: 1.2157314698981359
Energy: 1.322299931448385
Energy: 1.354777842232814
Energy: 1.3222999314452002
Energy: 1.3547778422383874
Energy: 1.3222999314459967
Energy: 1.354777842232814
Energy: 1.6275636690810014
Energy: 1.2666561726869607
Energy: 1.6275636690857784
Energy: 1.2666561726813874
Energy: 1.6275636690833895
Energy: 1.2666561726821834
Energy: 1.626220607063917
Energy: 1.4606767564273433
Energy: 1.626220607063917
Energy: 1.4606767564122158
Energy: 1.626220607063917
Energy: 1.4606767564161969
Energy: 1.422600845096952
Energy: 1.4106392565409704
Energy: 1.422600845100933
Energy: 1.410639256538582
Energy: 1.4226008450929712
Energy: 1.4106392565369896
Energy: 1.4227851081557514
Energy: 1.3510170159464148
Energy: 1.4227851081477894
Energy: 1.3510170159440262
Energy: 1.4227851081533631
Energy: 1.3510170159495996
Energy: 1.4035814453229198
Energy: 1.339763992774306
Energy: 1.403581445320531
Energy: 1.3397639927735099
Energy: 1.4035814453245121
Energy: 1.339763992774306
Energy: 1.4617509746125223
Energy: 1.3024109372056603
Energy: 1.4617509746172996
Energy: 1.3024109371992907
Energy: 1.4617509746149109
Energy: 1.3024109371992907
Energy: 1.2847866324590724
Energy: 1.549903934223681
Energy: 1.2847866324574801
Energy: 1.5499039342197
Energy: 1.2847866324582762
Energy: 1.549903934223681
Energy: 1.470330666531159
Energy: 1.4388090706663477
Energy: 1.470330666526382
Energy: 1.4388090706695325
Energy: 1.470330666531955
Energy: 1.4388090706687364
Energy: 1.249442728006412
Energy: 1.5566765774818976
Energy: 1.2494427280103928
Energy: 1.5566765774747318
Energy: 1.2494427280056157
Energy: 1.5566765774779165

minimum gb energy = 1.2157314698981359 eV
minimum distance =  2.24993302212312 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.6791462896980662
Energy: 1.5080593678415937
Energy: 1.6203083932952684
Energy: 1.5080593678415937
Energy: 1.6791462896989722
Energy: 1.5080593678352534
Energy: 1.5951012761066208
Energy: 1.3538163174015683
Energy: 1.5951012761043566
Energy: 1.3538163174006623
Energy: 1.5951012761048093
Energy: 1.3538163174083615
Energy: 1.3470788464845866
Energy: 1.3537505529581673
Energy: 1.347078846473265
Energy: 1.3537505529654135
Energy: 1.3470788464814167
Energy: 1.3537505529559033
Energy: 1.5710571646181233
Energy: 1.4921080868047503
Energy: 1.5710571646108773
Energy: 1.492108086802033
Energy: 1.5710571646176703
Energy: 1.492108086785318
Energy: 1.4687821675306205
Energy: 1.419996473937667
Energy: 1.4687821675197517
Energy: 1.419996473937667
Energy: 1.468782167525639
Energy: 1.4199964739412898
Energy: 1.3139905601523652
Energy: 1.3469413155058223
Energy: 1.3139905601541766
Energy: 1.3469413155049168
Energy: 1.3139905601510067
Energy: 1.3469413155175558
Energy: 1.5244198276816332
Energy: 1.6064287691789887
Energy: 1.524419827685709
Energy: 1.6064287691839703
Energy: 1.524419827685256
Energy: 1.6064287691839703
Energy: 1.229301461513326
Energy: 1.6742394376256275
Energy: 1.2293014615237419
Energy: 1.6742394376165706
Energy: 1.2293014615142317
Energy: 1.6742394376047955
Energy: 1.29442058345175
Energy: 1.350234364797275
Energy: 1.2944205834567317
Energy: 1.3502343647981807
Energy: 1.294420583452203
Energy: 1.3502343648095023
Energy: 1.3175784874599772
Energy: 1.6528831045491714
Energy: 1.3175839864183532
Energy: 1.6528831045455485
Energy: 1.3175784874617886
Energy: 1.6528831045319623
Energy: 1.6255721452012564
Energy: 1.3200950737461372
Energy: 1.6255721451980865
Energy: 1.3200950737434198
Energy: 1.6255721451998977
Energy: 1.320095073753836
Energy: 1.3480249157903925
Energy: 1.4123184867042546
Energy: 1.348042092653862
Energy: 1.4123184866988614
Energy: 1.3480249157903925
Energy: 1.4123184866852754
Energy: 1.5854161734263548
Energy: 1.2803038467643362
Energy: 1.5854149053687812
Energy: 1.2803038467584489
Energy: 1.585416173429525
Energy: 1.2803038467679593
Energy: 1.5980083314962896
Energy: 1.2419407048657014
Energy: 1.5980124961892361
Energy: 1.2419406902394754
Energy: 1.5980083314958369
Energy: 1.2419407164064815
Energy: 1.495920223844696
Energy: 1.3538774570780778
Energy: 1.4959202238618639
Energy: 1.3538774570753607
Energy: 1.495920223847866
Energy: 1.3538774570826064
Energy: 1.3478592843710007
Energy: 1.353736829221197
Energy: 1.3478592843646604
Energy: 1.3537368292221028
Energy: 1.3478592843678303
Energy: 1.353736829218027
Energy: 1.5803920999780894
Energy: 1.494343594952956
Energy: 1.580392099972655
Energy: 1.4943435949511445
Energy: 1.580392099976278
Energy: 1.4943435949683537
Energy: 1.4690893313602795
Energy: 1.3466957864056552
Energy: 1.469089331365261
Energy: 1.346695786413807
Energy: 1.4690893313593738
Energy: 1.346695786409731
Energy: 1.3165254649068812
Energy: 1.354498138802852
Energy: 1.3165254649086926
Energy: 1.3544981387978705
Energy: 1.3165254649055225
Energy: 1.3544981387978705
Energy: 1.5536952568318705
Energy: 1.6058214442359204
Energy: 1.5536760577155828
Energy: 1.6058214442363732
Energy: 1.5536952568332292
Energy: 1.6058214442354675
Energy: 1.2665246227908757
Energy: 1.638744193126155
Energy: 1.2665411688064572
Energy: 1.6387441931247966
Energy: 1.2665246227922344
Energy: 1.6387441931234379
Energy: 1.2915525032207693
Energy: 1.3507273699212712
Energy: 1.2915525032207693
Energy: 1.3507273699208182
Energy: 1.2915525032207693
Energy: 1.350727369938933
Energy: 1.3183779826341824
Energy: 1.646422291238871
Energy: 1.3183776572098758
Energy: 1.6464222912257376
Energy: 1.3183779826368995
Energy: 1.6464222912411355
Energy: 1.6199293306222762
Energy: 1.4689903499327701
Energy: 1.6199293306154832
Energy: 1.4689903499327701
Energy: 1.6199293306231821
Energy: 1.4689903499440917
Energy: 1.3468540155743793
Energy: 1.3142135919086113
Energy: 1.3467738024407585
Energy: 1.3142135919040825
Energy: 1.3468540155748323
Energy: 1.3142135919240088
Energy: 1.6663243376437622
Energy: 1.4899562570337836
Energy: 1.6092182164778097
Energy: 1.4899562570337836
Energy: 1.6663243376428565
Energy: 1.4899562570455582
Energy: 1.6669755392135213
Energy: 1.494526662903039
Energy: 1.6095352600422348
Energy: 1.4945266629107377
Energy: 1.66697553920854
Energy: 1.4945266629148135
Energy: 1.346758234476642
Energy: 1.2919365417336353
Energy: 1.3467582344780005
Energy: 1.2919365417368052
Energy: 1.3467582344752835
Energy: 1.2919365417472213
Energy: 1.6482989490903968
Energy: 1.3535436597762993
Energy: 1.6482989490876796
Energy: 1.3535436597767523
Energy: 1.648298949092208
Energy: 1.3535436597830925
Energy: 1.3184797059819817
Energy: 1.6125575893810533
Energy: 1.318479705988775
Energy: 1.6125575893796948
Energy: 1.3184797059819817
Energy: 1.6125575893792417
Energy: 1.5616927090917423
Energy: 1.351845864649243
Energy: 1.5616927090976296
Energy: 1.3518458646478844
Energy: 1.561692709099894
Energy: 1.3518458646370568
Energy: 1.2841438440341457
Energy: 1.442874846869593
Energy: 1.2841438440323343
Energy: 1.4422582488512303
Energy: 1.2841438440345987
Energy: 1.4125875840190179
Energy: 1.520729422033308
Energy: 1.6055717001689014
Energy: 1.5207294220364782
Energy: 1.6055717001689014
Energy: 1.5207294220346668
Energy: 1.60557170016709
Energy: 1.3559111685233167
Energy: 1.4955173333344325
Energy: 1.3559111685255811
Energy: 1.495517333331715
Energy: 1.3559111685205993
Energy: 1.4955173333348852
Energy: 1.3533373910542967
Energy: 1.3471854625490836
Energy: 1.3533373910420694
Energy: 1.3471854625486306
Energy: 1.3533373910493154
Energy: 1.3471854625382147
Energy: 1.4963553197642556
Energy: 1.5697256962434236
Energy: 1.4963553197696902
Energy: 1.5697256962438766
Energy: 1.49635531976335
Energy: 1.5697256962293846
Energy: 1.3472685806286568
Energy: 1.4686147158108216
Energy: 1.3472209592959223
Energy: 1.4686147158176146
Energy: 1.3472685806300155
Energy: 1.4686147158225962
Energy: 1.347258608209842
Energy: 1.3143955549526813
Energy: 1.3472203513358894
Energy: 1.3143955549476998
Energy: 1.3472586082102949
Energy: 1.3143955549649087
Energy: 1.598272076810916
Energy: 1.2438961054352151
Energy: 1.5982729925415926
Energy: 1.2438961614172614
Energy: 1.598272076810916
Energy: 1.2438960855395147
Energy: 1.6708607828099113
Energy: 1.2710442719939699
Energy: 1.6708607828053825
Energy: 1.2710442719962343
Energy: 1.6708607828112698
Energy: 1.2710442719863122
Energy: 1.348236681665589
Energy: 1.290575501591459
Energy: 1.3482366816664948
Energy: 1.2905755015919118
Energy: 1.348236681665589
Energy: 1.2905755016000635

minimum gb energy = 1.229301461513326 eV
minimum distance =  2.34297243695488 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.4285100543033227
Energy: 1.4524115002186258
Energy: 1.4285100543033227
Energy: 1.4524115002165272
Energy: 1.4285100543043718
Energy: 1.4524115002175766
Energy: 1.5378655067707034
Energy: 1.3554786815529813
Energy: 1.5378655067707034
Energy: 1.35547868155508
Energy: 1.5378655067717528
Energy: 1.3554786815540307
Energy: 1.3715507101701085
Energy: 1.438114566010511
Energy: 1.3715507101711577
Energy: 1.4381145660126098
Energy: 1.3715507101743059
Energy: 1.4381145660073633
Energy: 1.4230920558566913
Energy: 1.2447666141715392
Energy: 1.4230920558577407
Energy: 1.2447666141725884
Energy: 1.423092055855642
Energy: 1.2447666141715392
Energy: 1.4430196434911693
Energy: 1.3867537068680804
Energy: 1.4430196434932678
Energy: 1.386753706870179
Energy: 1.4430196434911693
Energy: 1.386753706867031
Energy: 1.4427093798582953
Energy: 1.3864398503203077
Energy: 1.4427093798530488
Energy: 1.386439850318209
Energy: 1.4427093798561967
Energy: 1.3864398503192583
Energy: 1.4224625852614659
Energy: 1.386520912923697
Energy: 1.4224625852646136
Energy: 1.3865209129215983
Energy: 1.4224625852688106
Energy: 1.3865209129215983
Energy: 1.3172892851689142
Energy: 1.3882174919199213
Energy: 1.3172892851657665
Energy: 1.3882174919167733
Energy: 1.317289285167865
Energy: 1.3882174919157242
Energy: 1.6207151004092681
Energy: 1.2392097495498502
Energy: 1.6207151004029725
Energy: 1.2392097495498502
Energy: 1.620715100408219
Energy: 1.2392097495498502
Energy: 1.2659222062231712
Energy: 1.4602403734395326
Energy: 1.2659222062210724
Energy: 1.4602403734258917
Energy: 1.2659222062252697
Energy: 1.460240373422744
Energy: 1.5045172518203993
Energy: 1.2479938106549247
Energy: 1.5045172518214485
Energy: 1.2479938106549247
Energy: 1.5045172518203993
Energy: 1.247993810657023
Energy: 1.4257059926900335
Energy: 1.4558449510874223
Energy: 1.4257059926900335
Energy: 1.4558449510874223
Energy: 1.4257059926889843
Energy: 1.4558449510874223
Energy: 1.5341468210719238
Energy: 1.3527279131908096
Energy: 1.534146821067727
Energy: 1.3527279131908096
Energy: 1.5341468210740226
Energy: 1.3527279131908096
Energy: 1.3715588851839216
Energy: 1.3364150072833538
Energy: 1.3715588851713778
Energy: 1.3364150072833538
Energy: 1.37155888518707
Energy: 1.3364150072823047
Energy: 1.4309515965979924
Energy: 1.4356750476376685
Energy: 1.430951596600091
Energy: 1.435675047639767
Energy: 1.4309515966032391
Energy: 1.435675047639767
Energy: 1.4422954457696036
Energy: 1.3866347963192194
Energy: 1.4422954457675048
Energy: 1.38663479631817
Energy: 1.4422954457664556
Energy: 1.3866347963202688
Energy: 1.4423555148720737
Energy: 1.5030585704181236
Energy: 1.4423555148720737
Energy: 1.5030585704139265
Energy: 1.4423555148762708
Energy: 1.5030585704170745
Energy: 1.4235705204152298
Energy: 1.3919250074484535
Energy: 1.4235705204141804
Energy: 1.3919250074495029
Energy: 1.423570520416279
Energy: 1.3919250074474043

minimum gb energy = 1.2392097495498502 eV
minimum distance =  2.2441428888457 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 1.1847591049058857
Energy: 1.2098343367399707
Energy: 1.184759104901529
Energy: 1.2098343367412154
Energy: 1.1847591049046409
Energy: 1.2098343367399707
Energy: 1.3249277651258133
Energy: 1.4393639521334762
Energy: 1.3249277651320377
Energy: 1.4393639521334762
Energy: 1.3249277651376392
Energy: 1.4393639521334762
Energy: 1.1404596358188548
Energy: 1.4368478627732668
Energy: 1.1404596358206935
Energy: 1.4368478627732668
Energy: 1.1404596358182322
Energy: 1.4368478627713996
Energy: 1.245747931071654
Energy: 1.1406107730958912
Energy: 1.2457479310722763
Energy: 1.1406107730946462
Energy: 1.2457479310710313
Energy: 1.1406107730958912
Energy: 1.1716158591074366
Energy: 1.1812946246441856
Energy: 1.1716158591080585
Energy: 1.1812946246460525
Energy: 1.1716158591086812
Energy: 1.1812946246441856
Energy: 1.1716740507611658
Energy: 1.1814122967761673
Energy: 1.1716740507636554
Energy: 1.1814122967743
Energy: 1.1716740507667673
Energy: 1.181412296775545
Energy: 1.2457404614142924
Energy: 1.1406036473512153
Energy: 1.24574046141367
Energy: 1.1406036473487258
Energy: 1.2457404614186491
Energy: 1.1406036473487258
Energy: 1.1406022289896396
Energy: 1.4367655449331145
Energy: 1.1406022289877722
Energy: 1.4367655449331145
Energy: 1.1406022289871496
Energy: 1.4367655449324919
Energy: 1.3249276974214328
Energy: 1.439403443968304
Energy: 1.3249276974176984
Energy: 1.439403443966437
Energy: 1.3249276974145863
Energy: 1.4394034439658145
Energy: 1.184759104902151
Energy: 1.2098343367399707
Energy: 1.1847591049046409
Energy: 1.2098343367393485
Energy: 1.1847591049052633
Energy: 1.2098343367399707
Energy: 1.3249277651363944
Energy: 1.439363952134721
Energy: 1.324927765129548
Energy: 1.4393639521328538
Energy: 1.3249277651314153
Energy: 1.439363952131609
Energy: 1.1404596358194485
Energy: 1.4368478627732668
Energy: 1.1404596358206935
Energy: 1.4368478627720218
Energy: 1.1404596358194485
Energy: 1.4368478627745114
Energy: 1.2457479310697868
Energy: 1.1406107730940238
Energy: 1.245747931071654
Energy: 1.1406107730958912
Energy: 1.2457479310685418
Energy: 1.1406107730940238
Energy: 1.1716158591086812
Energy: 1.1812946246454303
Energy: 1.1716158591099262
Energy: 1.1812946246454303
Energy: 1.1716158591093035
Energy: 1.1812946246460525
Energy: 1.1716740507680123
Energy: 1.181412296775545
Energy: 1.1716740507642778
Energy: 1.181412296775545
Energy: 1.1716740507680123
Energy: 1.1814122967749225
Energy: 1.2457404614180267
Energy: 1.1406036473493482
Energy: 1.2457404614174046
Energy: 1.1406036473493482
Energy: 1.2457404614155372
Energy: 1.1406036473487258
Energy: 1.140602228989017
Energy: 1.4367655449343593
Energy: 1.1406022289883946
Energy: 1.4367655449349814
Energy: 1.1406022289877722
Energy: 1.4367655449343593
Energy: 1.3249276974226778
Energy: 1.4394034439689265
Energy: 1.3249276974201882
Energy: 1.4394034439658145
Energy: 1.3249276974195658
Energy: 1.4394034439658145
Energy: 1.1847591049040185
Energy: 1.2098343367387259
Energy: 1.184759104906508
Energy: 1.209834336741838
Energy: 1.1847591049058857
Energy: 1.2098343367387259
Energy: 1.3249277651307927
Energy: 1.4393639521340988
Energy: 1.3249277651289253
Energy: 1.4393639521322315
Energy: 1.3249277651289253
Energy: 1.4393639521322315
Energy: 1.1404596358182322
Energy: 1.436847862770777
Energy: 1.1404596358206935
Energy: 1.4368478627720218
Energy: 1.140459635821316
Energy: 1.436847862770777
Energy: 1.245747931071654
Energy: 1.1406107730934014
Energy: 1.2457479310704092
Energy: 1.1406107730940238
Energy: 1.2457479310697868
Energy: 1.1406107730958912
Energy: 1.1716158591093035
Energy: 1.1812946246429405
Energy: 1.1716158591074366
Energy: 1.1812946246435632
Energy: 1.1716158591093035
Energy: 1.1812946246435632
Energy: 1.1716740507649002
Energy: 1.181412296775545
Energy: 1.1716740507599208
Energy: 1.181412296775545
Energy: 1.1716740507655226
Energy: 1.1814122967743
Energy: 1.2457404614198941
Energy: 1.1406036473493482
Energy: 1.2457404614130476
Energy: 1.1406036473487258
Energy: 1.2457404614180267
Energy: 1.1406036473481034
Energy: 1.1406022289871496
Energy: 1.4367655449331145
Energy: 1.140602228989017
Energy: 1.4367655449362264
Energy: 1.1406022289877722
Energy: 1.4367655449362264
Energy: 1.324927697424545
Energy: 1.439403443968304
Energy: 1.3249276974201882
Energy: 1.4394034439658145
Energy: 1.3249276974152089
Energy: 1.4394034439645695
Energy: 1.1847591049046409
Energy: 1.2098343367393485
Energy: 1.1847591049058857
Energy: 1.2098343367399707
Energy: 1.184759104901529
Energy: 1.2098343367412154
Energy: 1.3249277651307927
Energy: 1.4393639521322315
Energy: 1.3249277651370168
Energy: 1.4393639521334762
Energy: 1.3249277651276807
Energy: 1.4393639521340988
Energy: 1.140459635821316
Energy: 1.4368478627701546
Energy: 1.1404596358200711
Energy: 1.4368478627720218
Energy: 1.1404596358200711
Energy: 1.4368478627720218

minimum gb energy = 1.1404596358182322 eV
minimum distance =  2.25780227229549 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 1.1642022060495307
Energy: 1.133381388470002
Energy: 1.1642022060464814
Energy: 1.1333813884715265
Energy: 1.1642022060480057
Energy: 1.1333813884715265
Energy: 1.3336868965634283
Energy: 1.1743441708449944
Energy: 1.3336868965741004
Energy: 1.17434417084347
Energy: 1.3336868965664774
Energy: 1.1743441708465192
Energy: 1.1833044982469278
Energy: 1.3042912252450884
Energy: 1.1833044983170244
Energy: 1.3042912252435637
Energy: 1.183304498318549
Energy: 1.3042912252450884
Energy: 1.3173385905901953
Energy: 1.0998294726653444
Energy: 1.3173385906039168
Energy: 1.0998294726638542
Energy: 1.3173385906039168
Energy: 1.0998294726638542
Energy: 1.3156638830980822
Energy: 1.1000757611589707
Energy: 1.315663883099607
Energy: 1.1000757611604954
Energy: 1.315663883099607
Energy: 1.1000757611604954
Energy: 1.337295522015426
Energy: 1.3895571866880723
Energy: 1.3372955220169505
Energy: 1.3895571866895624
Energy: 1.3372955220215241
Energy: 1.389557186691087
Energy: 1.2430134002880058
Energy: 1.178392693176114
Energy: 1.243013400286481
Energy: 1.178392693176114
Energy: 1.2430134002895301
Energy: 1.1783926931745892
Energy: 1.1576332818773685
Energy: 1.135041548579847
Energy: 1.1576332818743191
Energy: 1.1350415485813716
Energy: 1.1576332818743191
Energy: 1.135041548579847
Energy: 1.333052054059472
Energy: 1.182247095918015
Energy: 1.3330520540564228
Energy: 1.1822471137630097
Energy: 1.3330520540579476
Energy: 1.182247092594343
Energy: 1.2875481015641548
Energy: 1.333926565479739
Energy: 1.2875481015656791
Energy: 1.3339265654812638
Energy: 1.2875481015641548
Energy: 1.3339265654812638
Energy: 1.3208507934211813
Energy: 1.1008880209650496
Energy: 1.320850793550702
Energy: 1.1008880209650496
Energy: 1.320850793584243
Energy: 1.100888020963525
Energy: 1.387298453926947
Energy: 1.2623873537902277
Energy: 1.387298453926947
Energy: 1.262387353793277
Energy: 1.387298453926947
Energy: 1.262387353793277

minimum gb energy = 1.0998294726638542 eV
minimum distance =  2.23763597903856 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.1648334653009889
Energy: 1.1159826381888789
Energy: 1.16483346529799
Energy: 1.115982638186737
Energy: 1.164833465302274
Energy: 1.1159826381880222
Energy: 1.1084180428660804
Energy: 1.0922752078912203
Energy: 1.10841804296114
Energy: 1.1211756892004654
Energy: 1.1084180427761612
Energy: 1.081669983906159
Energy: 1.025388851993454
Energy: 1.1373478099933818
Energy: 1.025388851990027
Energy: 1.1373478099955237
Energy: 1.0253888519930257
Energy: 1.1373478099963803
Energy: 1.0500221304597077
Energy: 1.006785925773089
Energy: 1.0500221304614212
Energy: 1.0067859257718037
Energy: 1.050022130460136
Energy: 1.006785925770519
Energy: 1.1293062408114178
Energy: 1.0911741593490156
Energy: 1.1293062408169865
Energy: 1.0911741593498723
Energy: 1.1293062408144163
Energy: 1.091174159347302
Energy: 1.1429307862468905
Energy: 1.1276758638871667
Energy: 1.1429307862473188
Energy: 1.1276758638828828
Energy: 1.1429307862366096
Energy: 1.1276758638798843
Energy: 1.070245511956975
Energy: 1.173985402197999
Energy: 1.0702455119578316
Energy: 1.1739854021967138
Energy: 1.0702455119492642
Energy: 1.1739854021962854
Energy: 0.9858427973490805
Energy: 1.1345272063267917
Energy: 0.9858427973473671
Energy: 1.1345272063276484
Energy: 0.9858427973477953
Energy: 1.134527206328077
Energy: 1.1373036016968563
Energy: 1.0905394351338713
Energy: 1.137303601687004
Energy: 1.0905394351385835
Energy: 1.1373036016912876
Energy: 1.0905394351338713
Energy: 1.1273726743592722
Energy: 1.2816278086658004
Energy: 1.1273726743669832
Energy: 1.2816278086606598
Energy: 1.127372674365698
Energy: 1.2816278086649435
Energy: 1.0464530354879855
Energy: 1.0153503590866333
Energy: 1.0464530354875574
Energy: 1.01535035908749
Energy: 1.046453035485844
Energy: 1.0153503590862047
Energy: 1.079200298511205
Energy: 1.1548634556303898
Energy: 1.0792002985107767
Energy: 1.1548634556051158
Energy: 1.0792002985129185
Energy: 1.1548634556098278
Energy: 1.1027245193558868
Energy: 1.1049497429368338
Energy: 1.102724519353745
Energy: 1.1049497429376904
Energy: 1.1027245193563153
Energy: 1.1049497429385475
Energy: 1.1593648287847598
Energy: 1.0423308390015278
Energy: 1.1593648287877583
Energy: 1.0423308389968156
Energy: 1.1593648287753355
Energy: 1.0423308389976724
Energy: 1.0258374338664422
Energy: 1.124953232199546
Energy: 1.0258374338638718
Energy: 1.124953232199546
Energy: 1.0258374338638718
Energy: 1.1249532322012594
Energy: 1.0356533731276198
Energy: 1.071667450873925
Energy: 1.0356533731280482
Energy: 1.0716674508687847
Energy: 1.0356533731254778
Energy: 1.0716674508709265
Energy: 1.3372402869594284
Energy: 1.0072310122082118
Energy: 1.3372402869581432
Energy: 1.007231012209925
Energy: 1.3372402869525746
Energy: 1.0072310122107822
Energy: 1.038618947403694
Energy: 1.0889883650895742
Energy: 1.0386189474032657
Energy: 1.0889883650895742
Energy: 1.0386189474066927
Energy: 1.0889883650921446
Energy: 0.9812331147541348
Energy: 1.3502019843655317
Energy: 0.9812331147596646
Energy: 1.3502019844104718
Energy: 0.9812331147609497
Energy: 1.350201984300458
Energy: 1.2158751585690348
Energy: 1.0344935391365935
Energy: 1.21587515857032
Energy: 1.034493539104037
Energy: 1.2158751585720335
Energy: 1.0344935391310244
Energy: 0.9812318505086125
Energy: 1.3503830463784106
Energy: 0.9812318505077559
Energy: 1.3503830463771254
Energy: 0.9812318505081841
Energy: 1.3503830463741266
Energy: 1.038617064615262
Energy: 1.088994878750259
Energy: 1.038617064613977
Energy: 1.0889948787515442
Energy: 1.0386170646161186
Energy: 1.0889948787524009
Energy: 1.3371865416271707
Energy: 1.007492451352699
Energy: 1.3371865416309867
Energy: 1.0074924513604095
Energy: 1.3371865416258855
Energy: 1.007492451359553
Energy: 1.0356772168278379
Energy: 1.1393511999029617
Energy: 1.0356772168329784
Energy: 1.139351199910244
Energy: 1.035677216833835
Energy: 1.1393511999111008
Energy: 1.0258601077455793
Energy: 1.125574967648545
Energy: 1.0258601077434375
Energy: 1.125574967648545
Energy: 1.0258601077455793
Energy: 1.125574967643833
Energy: 1.1595181394321363
Energy: 1.1301798095170403
Energy: 1.1595181394252825
Energy: 1.1301798095178972
Energy: 1.159518139428281
Energy: 1.1301798095191822
Energy: 1.1026078683040073
Energy: 1.105241764937893
Energy: 1.1026078683100042
Energy: 1.105241764944747
Energy: 1.1026078683160014
Energy: 1.1052417649408914
Energy: 1.0766593631610775
Energy: 1.0936474953000557
Energy: 1.0766593631606491
Energy: 1.0936474952970572
Energy: 1.0766593631623624
Energy: 1.0936474952983422
Energy: 1.0461307918096534
Energy: 1.0153091448631246
Energy: 1.0461307918143654
Energy: 1.0153091448635532
Energy: 1.0461307918182208
Energy: 1.015309144862268
Energy: 1.1278145550173126
Energy: 1.061636825293896
Energy: 1.127814555024595
Energy: 1.061636825293039
Energy: 1.127814555033591
Energy: 1.0616368252887556
Energy: 1.1375737897854445
Energy: 1.0905408850485847
Energy: 1.1375737897888714
Energy: 1.090540885047728
Energy: 1.1375737897875862
Energy: 1.0905408850472995
Energy: 0.9858746861244433
Energy: 1.1343800452007484
Energy: 0.9858746861278704
Energy: 1.1343800452020336
Energy: 0.9858746861248717
Energy: 1.1343800451998916
Energy: 1.070396392439792
Energy: 1.1737199759295978
Energy: 1.0703963924436475
Energy: 1.173719975930883
Energy: 1.0703963924367934
Energy: 1.1737199759304546
Energy: 1.142841480604855
Energy: 1.1143322540918843
Energy: 1.142841480609567
Energy: 1.1143322540918843
Energy: 1.1428414806189915
Energy: 1.1143322540983098
Energy: 1.1302129685123956
Energy: 1.0911120570562882
Energy: 1.1302129685111104
Energy: 1.09111205705843
Energy: 1.130212968512824
Energy: 1.0911120570588586
Energy: 1.0500353529734527
Energy: 1.0067760802780368
Energy: 1.0500353529760231
Energy: 1.006776080279322
Energy: 1.050035352971311
Energy: 1.0067760802767516
Energy: 1.0252684517568058
Energy: 1.1375609511920783
Energy: 1.0252684517631925
Energy: 1.1375609511907931
Energy: 1.0252684517631925
Energy: 1.1375609511882228
Energy: 1.108624117937772
Energy: 1.0139064922276524
Energy: 1.108624117937772
Energy: 1.0139064922263672
Energy: 1.1086241179373437
Energy: 1.0139064922302226
Energy: 1.1648334653027022
Energy: 1.1159826381871656
Energy: 1.164833465304844
Energy: 1.1159826381884508
Energy: 1.1648334653052725
Energy: 1.115982638186309
Energy: 1.1084180429410067
Energy: 1.0816699839095858
Energy: 1.1084180429153434
Energy: 1.081669983910871
Energy: 1.108418042866509
Energy: 1.081669983910871
Energy: 1.025388851998166
Energy: 1.137347809994667
Energy: 1.0253888519960241
Energy: 1.137347809997237
Energy: 1.0253888519994512
Energy: 1.1373478099929533
Energy: 1.050022130445143
Energy: 1.006785925769662
Energy: 1.05002213044857
Energy: 1.0067859257765162
Energy: 1.0500221304447148
Energy: 1.0067859257692338
Energy: 1.1293062408276568
Energy: 1.0911741593481588
Energy: 1.129306240832369
Energy: 1.0911741593485873
Energy: 1.1293062408293704
Energy: 1.0911741593481588

minimum gb energy = 0.9812318505077559 eV
minimum distance =  2.29496295378858 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.517255335514292
Energy: 0.5294380877707341
Energy: 0.5172553355152671
Energy: 0.5294380877726844
Energy: 0.5172553355162424
Energy: 0.529438087769759
Energy: 0.643030753422869
Energy: 0.5186039088666716
Energy: 0.6430307534209186
Energy: 0.5186039088666716
Energy: 0.6430307534218939
Energy: 0.5186039088656964
Energy: 0.5743500890454537
Energy: 0.6362809300699457
Energy: 0.5743500890483791
Energy: 0.6362809300709209
Energy: 0.5743500890454537
Energy: 0.6362809300689706
Energy: 0.5319635990586619
Energy: 0.5165895321767305
Energy: 0.531963599059637
Energy: 0.5165895321777056
Energy: 0.5319635990625624
Energy: 0.5165895321767305
Energy: 0.6443295199958742
Energy: 0.6478208909884782
Energy: 0.6443295199861229
Energy: 0.647820890986528
Energy: 0.644329519993924
Energy: 0.647820890986528
Energy: 0.5167805153416551
Energy: 0.5771511900218845
Energy: 0.5167805153426303
Energy: 0.5771511900199343
Energy: 0.5167805153436053
Energy: 0.5771511900189592
Energy: 0.5167857372011767
Energy: 0.5753472660528793
Energy: 0.5167857372011767
Energy: 0.5753472660519041
Energy: 0.5167857372002016
Energy: 0.5753472660519041
Energy: 0.644239436870837
Energy: 0.6479005001232903
Energy: 0.6442394368669365
Energy: 0.6479005001252406
Energy: 0.6442394368669365
Energy: 0.6479005001242655
Energy: 0.5319671017806485
Energy: 0.5166152910180314
Energy: 0.5319671017816237
Energy: 0.516615291023882
Energy: 0.5319671017825989
Energy: 0.5166152910258324
Energy: 0.5743372859357718
Energy: 0.6363903802147913
Energy: 0.5743372859406475
Energy: 0.6363903802167415
Energy: 0.5743372859250453
Energy: 0.6363903802177167
Energy: 0.6429939612244295
Energy: 0.5180456494052984
Energy: 0.6429939612244295
Energy: 0.5180456494043233
Energy: 0.6429939612234543
Energy: 0.5180456494043233
Energy: 0.517255335514292
Energy: 0.5294380877678088
Energy: 0.517255335514292
Energy: 0.5294380877707341
Energy: 0.517255335514292
Energy: 0.529438087769759
Energy: 0.6430307534218939
Energy: 0.5186039088627712
Energy: 0.6430307534218939
Energy: 0.518603908860821
Energy: 0.643030753422869
Energy: 0.5186039088637463
Energy: 0.5743500890483791
Energy: 0.6362809300679955
Energy: 0.5743500890483791
Energy: 0.6362809300699457
Energy: 0.5743500890435034
Energy: 0.6362809300699457
Energy: 0.5319635990606122
Energy: 0.5165895321786808
Energy: 0.5319635990586619
Energy: 0.516589532179656
Energy: 0.5319635990625624
Energy: 0.516589532179656
Energy: 0.6443295199909985
Energy: 0.6478208909855528
Energy: 0.6443295199900234
Energy: 0.6478208909875031
Energy: 0.6443295199919736
Energy: 0.6478208909875031
Energy: 0.5167805153465307
Energy: 0.5771511900218845
Energy: 0.5167805153445804
Energy: 0.5771511900218845
Energy: 0.5167805153455555
Energy: 0.5771511900199343
Energy: 0.5167857372002016
Energy: 0.5753472660499539
Energy: 0.5167857371992265
Energy: 0.5753472660519041
Energy: 0.5167857372041021
Energy: 0.5753472660470285
Energy: 0.6442394368649862
Energy: 0.6479005001252406
Energy: 0.6442394368679116
Energy: 0.6479005001291411
Energy: 0.6442394368698618
Energy: 0.6479005001262157

minimum gb energy = 0.5165895321767305 eV
minimum distance =  2.38836479547902 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.9085831665739464
Energy: 0.8940624070341204
Energy: 0.9085831665818038
Energy: 0.8940624070312633
Energy: 0.9085831665868038
Energy: 0.8940624070284061
Energy: 1.1239709483284925
Energy: 0.9583481207213799
Energy: 1.1239709483284925
Energy: 0.9583481207192367
Energy: 1.1239709483257003
Energy: 0.9583481207170939
Energy: 1.1322153820162852
Energy: 1.263614142002362
Energy: 1.1322153820148566
Energy: 1.2636141420045048
Energy: 1.1322153820148566
Energy: 1.2636141420009337
Energy: 1.1614279561065572
Energy: 0.8542420191934692
Energy: 1.1614279561044143
Energy: 0.8542420191941835
Energy: 1.161427956112986
Energy: 0.8542420191948977
Energy: 0.8558535905056776
Energy: 0.8276055382784344
Energy: 0.8558535905128206
Energy: 0.8276055382805775
Energy: 0.8558535905121063
Energy: 0.8276055382777201
Energy: 1.0221718713415782
Energy: 0.8450205287488353
Energy: 1.0221718713444352
Energy: 0.8450205287524067
Energy: 1.022171871343721
Energy: 0.8450205287509782
Energy: 0.8135053083746994
Energy: 0.8961603678384717
Energy: 0.8135053083725565
Energy: 0.8961603678384717
Energy: 0.813505308416129
Energy: 0.8961603678356146
Energy: 1.121179853688335
Energy: 0.7908398054406359
Energy: 1.121179853688335
Energy: 0.7908398054406359
Energy: 1.121179853688335
Energy: 0.7908398054406359
Energy: 1.1186647369323186
Energy: 0.7963232950902386
Energy: 1.1186647369351757
Energy: 0.7963232950895243
Energy: 1.1186647369366043
Energy: 0.7963232950873814
Energy: 0.8071363695363705
Energy: 1.1849074554170151
Energy: 0.8071363695413706
Energy: 1.1849074554191579
Energy: 0.8071363695363705
Energy: 1.1849074554177292
Energy: 1.0523648813755153
Energy: 1.037074768871522
Energy: 1.0523648813776585
Energy: 1.0370747688608726
Energy: 1.0523648813798012
Energy: 1.0370747688743793
Energy: 0.8551483855355875
Energy: 0.8314035415640589
Energy: 0.855148385537016
Energy: 0.8314035415662019
Energy: 0.855148385520652
Energy: 0.8314035415662019
Energy: 1.0025341352557942
Energy: 0.8614105978644989
Energy: 1.0025341352543657
Energy: 0.8614105978644989
Energy: 1.0025341352565085
Energy: 0.8614105978652131
Energy: 1.1098571721379522
Energy: 1.228815782265621
Energy: 1.1098571721358093
Energy: 1.2288157822649064
Energy: 1.1098571721322377
Energy: 1.228815782265621
Energy: 1.144136719134323
Energy: 0.9718841504329268
Energy: 1.1441367191386087
Energy: 0.9718841504364983
Energy: 1.1441367191321803
Energy: 0.9718841504386413
Energy: 0.8779750911519226
Energy: 1.120196977096376
Energy: 0.8779750911562084
Energy: 1.1201969770949474
Energy: 0.8779750911547798
Energy: 1.12019697709709
Energy: 0.9123730237087806
Energy: 0.9563986797493038
Energy: 0.9123730237094949
Energy: 0.9563986797507323
Energy: 0.9123730237066375
Energy: 0.9563986797507323
Energy: 1.3861102838506587
Energy: 0.94138000156288
Energy: 1.3861102838492303
Energy: 0.9413800015685945
Energy: 1.3861102838449444
Energy: 0.9413800015664515
Energy: 1.028210726414388
Energy: 0.8492770614935136
Energy: 1.028210726414388
Energy: 0.8492770614977994
Energy: 1.028210726411531
Energy: 0.8492770614949422
Energy: 0.8565344732668412
Energy: 0.9908985941151756
Energy: 0.8565344732696983
Energy: 0.9908985941123184
Energy: 0.8565344732682697
Energy: 0.9908985941130327
Energy: 0.8094139082678482
Energy: 0.8490929942599557
Energy: 0.8094139082692768
Energy: 0.84909299426067
Energy: 0.809413908269991
Energy: 0.849092994258527
Energy: 0.8599971240471261
Energy: 0.8953586873844408
Energy: 0.8599971240492691
Energy: 0.895358687387298
Energy: 0.8599971240471261
Energy: 0.8953586873837265
Energy: 0.9812679531128031
Energy: 0.9943760451184172
Energy: 0.9812679531135173
Energy: 0.9943760451177028
Energy: 0.9812679531120888
Energy: 0.9943760451162741
Energy: 1.0068411207424464
Energy: 0.8419459437806128
Energy: 1.0068411207431607
Energy: 0.8419459437820415
Energy: 1.0068411207367318
Energy: 0.8419459437841843
Energy: 0.8092413301095797
Energy: 1.1937667162484182
Energy: 0.8092413301067225
Energy: 1.1937667162627044
Energy: 0.8092413301052939
Energy: 1.193766716252704
Energy: 1.550135037260527
Energy: 1.0363522438208985
Energy: 1.550135037263384
Energy: 1.0363522438258987
Energy: 1.550135037261241
Energy: 1.036352243826613

minimum gb energy = 0.7908398054406359 eV
minimum distance =  2.30087688251099 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 1.0252613352586797
Energy: 0.9236913504255357
Energy: 1.0252613352569908
Energy: 0.9236913504266616
Energy: 1.0252613352558646
Energy: 0.9236913504266616
Energy: 0.976333841906327
Energy: 0.9797412207848982
Energy: 0.976333841904075
Energy: 0.9797412207809573
Energy: 0.9763338419052009
Energy: 0.979741220742162
Energy: 1.0776656130444324
Energy: 1.0576276075156097
Energy: 1.0776656130523141
Energy: 1.0576276075111055
Energy: 1.0776656130506252
Energy: 1.0576276075156097
Energy: 0.9609209641671438
Energy: 0.9010633115270492
Energy: 0.9609209641598251
Energy: 0.9010633115270492
Energy: 0.960920964162077
Energy: 0.9010633115253603
Energy: 0.8882344852952602
Energy: 0.9641297393831949
Energy: 0.888234485296949
Energy: 0.9641297393843209
Energy: 0.8882344852958232
Energy: 0.9641297393831949
Energy: 1.1823769822640693
Energy: 0.9857728038865025
Energy: 1.1823769822629435
Energy: 0.9857728038966364
Energy: 1.1823769822629435
Energy: 0.9857728038966364
Energy: 0.8950771963660236
Energy: 1.3123141323127123
Energy: 0.8950771963677127
Energy: 1.3123141323155272
Energy: 0.8950771963620827
Energy: 1.3123141323188539
Energy: 0.871184893878751
Energy: 0.9014205364149358
Energy: 0.871184893876499
Energy: 0.9014205364143728
Energy: 0.8711848938736841
Energy: 0.9014205364143728
Energy: 0.9032631478724227
Energy: 0.9531153425750892
Energy: 0.9032631478718597
Energy: 0.9531153425767781
Energy: 0.9032631478701708
Energy: 0.9531153425750892
Energy: 0.9634617242848067
Energy: 0.9797425348526411
Energy: 0.9634617242859328
Energy: 0.9797425348509521
Energy: 0.9634617242853697
Energy: 0.9797425348515151
Energy: 0.9546488271865669
Energy: 0.9873794749868502
Energy: 0.9546488271893817
Energy: 0.9873794749434999
Energy: 0.9546488271888187
Energy: 0.9873794749806573
Energy: 0.8620076689917395
Energy: 1.2624527694731573
Energy: 0.8620076689900505
Energy: 1.2624527694720316
Energy: 0.8620076689939914
Energy: 1.1283151067012454
Energy: 0.8707586346073101
Energy: 0.8987454082883731
Energy: 0.8707586346067469
Energy: 0.8987454082900622
Energy: 0.870758634605621
Energy: 0.8987454082889361
Energy: 0.8468201375095709
Energy: 0.9782614827459796
Energy: 0.8468201375101339
Energy: 0.9782614827403497
Energy: 0.8468201375095709
Energy: 0.9782614827403497
Energy: 0.9548993595478572
Energy: 1.161872286965778
Energy: 0.9548993595422274
Energy: 1.16187228696803
Energy: 0.9548993595467312
Energy: 1.1618722869669038
Energy: 0.8407474596695195
Energy: 0.918240470597606
Energy: 0.8407474596689566
Energy: 0.9182404705739604
Energy: 0.8407474596695195
Energy: 0.9182404706122437
Energy: 0.8820520582540873
Energy: 0.8989020513622938
Energy: 0.8820520582512723
Energy: 0.8989020513634199
Energy: 0.8820520582540873
Energy: 0.8989020513651088
Energy: 0.9071914357673747
Energy: 1.0580388984664961
Energy: 0.9071914357353354
Energy: 1.0580388984445397
Energy: 0.9071914357381503
Energy: 1.0580388984541103
Energy: 0.9800980117190461
Energy: 1.1471280963808512
Energy: 0.980098011726928
Energy: 1.1471280963802881
Energy: 0.9800980117274912
Energy: 1.1471280963808512
Energy: 0.9521741394625697
Energy: 1.1507832937391047
Energy: 0.9521741394580658
Energy: 1.2316021590055035
Energy: 0.9521741394642589
Energy: 0.9031399916995823
Energy: 0.8850676257124722
Energy: 0.9784428784680709
Energy: 0.8850676257096571
Energy: 0.9784428784641299
Energy: 0.8850676257107831
Energy: 0.9784428784624408
Energy: 0.9278594903709099
Energy: 1.2301519558877299
Energy: 0.9278594903698351
Energy: 1.2301519558815368
Energy: 0.9278594903771027
Energy: 1.2301519558843519
Energy: 0.9630003176089674
Energy: 0.902253666636254
Energy: 0.9630003176044636
Energy: 0.902253666635128
Energy: 0.9630003176494517
Energy: 0.9022536666373799
Energy: 0.8402094601012605
Energy: 1.1939351415145987
Energy: 0.8402094601029495
Energy: 1.1927163766521511
Energy: 0.8402094601046384
Energy: 1.088153492557939
Energy: 0.8414525946165528
Energy: 1.1854116377770267
Energy: 0.8414525946171157
Energy: 1.1854116377697077
Energy: 0.8414525946176787
Energy: 1.1854116377674555
Energy: 0.8943324786732398
Energy: 0.9750195206496082
Energy: 0.8943324786692989
Energy: 1.0669913332459116
Energy: 0.894332478670988
Energy: 0.8946978548732828
Energy: 0.882727362000909
Energy: 0.9021688643393942
Energy: 0.882727361998094
Energy: 0.9021688643404688
Energy: 0.8827273619986569
Energy: 0.902168864338831
Energy: 0.9017680344882232
Energy: 1.0318303841973973
Energy: 0.9017680344887861
Energy: 1.079777696761896
Energy: 0.9017680344882232
Energy: 0.9644874792875178
Energy: 0.9519476241486737
Energy: 1.1570343241876022
Energy: 0.9519476241481107
Energy: 1.1570343241892913
Energy: 0.9519476241458587
Energy: 1.1570343241904173
Energy: 1.0423251517617738
Energy: 0.8840339672743939
Energy: 1.0423251517713445
Energy: 0.9756776609458456
Energy: 1.0423251517651517
Energy: 0.884033967263134
Energy: 0.8725580810342215
Energy: 1.125032208973266
Energy: 0.8725580810308435
Energy: 1.125032208968762
Energy: 0.8725580810359105
Energy: 1.125032208976081
Energy: 0.91136708272969
Energy: 0.9422516548229876
Energy: 0.9113670827302531
Energy: 0.9422516548241137
Energy: 0.9113670827280012
Energy: 0.9422516548229876
Energy: 0.8553897591573796
Energy: 0.9179341764674153
Energy: 0.8553897591556908
Energy: 0.9179341764691041
Energy: 0.8553897591556908
Energy: 0.9179341764662893

minimum gb energy = 0.8402094601012605 eV
minimum distance =  2.32542448066923 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 1.0511682003529483
Energy: 0.9503912879219242
Energy: 1.0511682003517273
Energy: 0.9503912879196253
Energy: 1.0511682003572589
Energy: 0.9503912879160333
Energy: 1.049488150004383
Energy: 0.9068033686571549
Energy: 1.0494881500114948
Energy: 0.9068033686555745
Energy: 1.049488150004742
Energy: 0.9068033686587353
Energy: 0.965346449784757
Energy: 1.0806598164302796
Energy: 0.9653464497906477
Energy: 1.0806598164187855
Energy: 0.965346449791869
Energy: 1.0806598164121046
Energy: 0.9608523020419081
Energy: 0.9317098272147564
Energy: 0.9608523020498104
Energy: 0.9317098272143972
Energy: 0.9608523020506006
Energy: 0.9317098272155466
Energy: 0.9647333817163929
Energy: 1.0249280538611465
Energy: 0.9647333817183327
Energy: 1.0249280538709882
Energy: 0.9647333817171831
Energy: 1.024928053870198
Energy: 1.345266289836107
Energy: 0.9576770311505154
Energy: 1.3452662898305754
Energy: 0.957677031148935
Energy: 1.3452662898412073
Energy: 0.9576770311497251
Energy: 0.9417555900254884
Energy: 1.0315505150506723
Energy: 0.941755590023908
Energy: 1.0315505150503128
Energy: 0.9417555900227585
Energy: 1.0315505150506723
Energy: 0.9954418799036784
Energy: 0.9935010086949403
Energy: 0.9954418799008768
Energy: 0.993501008693791
Energy: 0.9954418798945548
Energy: 0.9935010086945812
Energy: 1.0949895288102485
Energy: 0.9872150504158425
Energy: 1.0949895288034956
Energy: 0.9872150504134718
Energy: 1.094989528808668
Energy: 0.9872150504162734
Energy: 1.4115747046211657
Energy: 0.9355940314595957
Energy: 1.4115747046160652
Energy: 0.9355940314623257
Energy: 1.411574704615275
Energy: 0.9355940314623257
Energy: 0.9956919638623094
Energy: 0.992266894382449
Energy: 0.995691963861088
Energy: 0.9922668943820181
Energy: 0.9956919638583582
Energy: 0.9922668943828084
Energy: 0.9717985387562239
Energy: 0.9321912627157128
Energy: 0.9717985381152786
Energy: 0.932191262715282
Energy: 0.9717985395422117
Energy: 0.9321912627176526
Energy: 0.9865704057601872
Energy: 1.096709877670808
Energy: 0.9865704057586068
Energy: 1.0967098776771298
Energy: 0.986570405762989
Energy: 1.0967098776711672
Energy: 1.0185609083150224
Energy: 1.0055777315094052
Energy: 1.0185609083153815
Energy: 1.005577731507825
Energy: 1.018560908313011
Energy: 1.0055777315086152
Energy: 1.0027203989476396
Energy: 0.937933024680321
Energy: 1.0027203989460594
Energy: 0.9379330246772318
Energy: 1.00272039895116
Energy: 0.9379330246799619
Energy: 0.9663417204378362
Energy: 1.350558221745609
Energy: 0.9663417204350345
Energy: 1.350558221749129
Energy: 0.9663417204374053
Energy: 1.3505582217448187
Energy: 1.024599991477366
Energy: 0.916919449563364
Energy: 1.0245999919426656
Energy: 0.9169194495519417
Energy: 1.0245999919157978
Energy: 0.9169194495617835
Energy: 0.9244920601049472
Energy: 0.9626357559516254
Energy: 0.9244920601045881
Energy: 0.962635755950045
Energy: 0.9244920601073179
Energy: 0.9626357559516254
Energy: 1.0856775135624734
Energy: 0.964842279492929
Energy: 1.085677513557301
Energy: 0.9648422794866072
Energy: 1.0856775135588814
Energy: 0.9648422794960899
Energy: 1.0987479009071117
Energy: 0.9704096561444158
Energy: 1.0987479009291663
Energy: 0.9704096561444158
Energy: 1.0987479009185341
Energy: 0.970409656145206
Energy: 0.918743062666106
Energy: 1.006396163746026
Energy: 0.9187430626621548
Energy: 1.0063961637464567
Energy: 0.9187430626550427
Energy: 1.0063961637448764
Energy: 0.900646880912264
Energy: 1.0505900574208664
Energy: 0.900646880912264
Energy: 1.0505900574105933
Energy: 0.9006468809083129
Energy: 1.0505900574117428
Energy: 1.0033533122750913
Energy: 0.8894460387662122
Energy: 1.003353312277462
Energy: 0.8894460387618299
Energy: 1.003353312277893
Energy: 0.8894460387634104
Energy: 0.9163506016080821
Energy: 1.0107238195026265
Energy: 0.9163506016037718
Energy: 1.0107238194998966
Energy: 0.9163506016069327
Energy: 1.0107238195049972
Energy: 1.024413294479236
Energy: 0.9167959592717532
Energy: 1.0244132944642215
Energy: 0.9167959592591096
Energy: 1.0244132944784456
Energy: 0.9167959592654313
Energy: 0.9518653650839943
Energy: 0.996811222337822
Energy: 0.9518653650824139
Energy: 0.9968112223283391
Energy: 0.9518653650832042
Energy: 0.9968112223397615
Energy: 1.0463064592280977
Energy: 0.9470084083949003
Energy: 1.0463064592308993
Energy: 0.9470084083941102
Energy: 1.0463064592316895
Energy: 0.9470084083905899
Energy: 1.0065327051832422
Energy: 0.9414716635780233
Energy: 1.0065327051844637
Energy: 0.9414716635831956
Energy: 1.0065327051840325
Energy: 0.9414716635800346
Energy: 0.9890789838227909
Energy: 1.0967577777030473
Energy: 0.9890789838204203
Energy: 1.0967577777030473
Energy: 0.9890789838224318
Energy: 1.096757777701467
Energy: 0.9291712719196955
Energy: 1.4056218597523291
Energy: 0.9291712719157444
Energy: 1.4056218597471566
Energy: 0.9291712719122243
Energy: 1.4056218597511076
Energy: 0.9582524188854671
Energy: 0.9193881796281308
Energy: 0.9582524188858982
Energy: 0.9193881796340216
Energy: 0.9582524188815159
Energy: 0.919388179631651
Energy: 0.9164607239264542
Energy: 1.0245316781063325
Energy: 0.9164607239240835
Energy: 1.0245316780897376
Energy: 0.9164607239288248
Energy: 1.0245316781161744
Energy: 1.0996857587556048
Energy: 0.9476840864246918
Energy: 1.0996857587603461
Energy: 0.9476840864298641
Energy: 1.0996857587512943
Energy: 0.9476840864278527
Energy: 0.9992451950801159
Energy: 1.0097509287205042
Energy: 0.9992451950761648
Energy: 1.009750928722444
Energy: 0.9992451950773862
Energy: 1.0097509287248148
Energy: 0.999037144921019
Energy: 1.009836876787333
Energy: 0.9990371449115363
Energy: 1.0098368767889134
Energy: 0.9990371449178581
Energy: 1.0098368767853216
Energy: 1.1043237415490028
Energy: 0.9476256619709652
Energy: 1.1043237415399512
Energy: 0.9476256619736951
Energy: 1.1043237415423217
Energy: 0.9476256619721147
Energy: 0.9163897023557744
Energy: 1.024281559709067
Energy: 0.916389702360947
Energy: 1.0242815597110786
Energy: 0.916389702357786
Energy: 1.0242815596644554
Energy: 0.9583713179607602
Energy: 0.919770586433743
Energy: 0.9583713179591798
Energy: 0.9197705864353235
Energy: 0.9583713179588205
Energy: 0.9197705864420763
Energy: 0.9292798332135885
Energy: 1.4056856658072323
Energy: 0.9292798332163903
Energy: 1.4056856658005514
Energy: 0.9292798332132294
Energy: 1.4056856658001202
Energy: 0.9890554882732886
Energy: 1.0967532328564151
Energy: 0.989055488268619
Energy: 1.096753232824806
Energy: 0.9890554882705587
Energy: 1.0967532328500933
Energy: 1.0064665717178123
Energy: 0.9185677144085048
Energy: 1.0064665717007863
Energy: 0.9185677144045538
Energy: 1.0064665717023669
Energy: 0.9185677144049128
Energy: 1.046448260169928
Energy: 0.9467261505541765
Energy: 1.0464482601738792
Energy: 0.9467261505541765
Energy: 1.046448260173448
Energy: 0.9467261505502255
Energy: 0.9518198936685677
Energy: 0.9967951554202822
Energy: 0.9518198936753204
Energy: 0.9967951554258138
Energy: 0.9518198936753204
Energy: 0.9967951553962161
Energy: 1.0245823793839093
Energy: 0.9167101927186705
Energy: 1.0245823793815385
Energy: 0.9167101927194606
Energy: 1.0245823793922426
Energy: 0.9167101927159405
Energy: 0.9165665575511789
Energy: 1.0101420461250812
Energy: 0.9165665575456473
Energy: 1.010142046127883
Energy: 0.916566557548018
Energy: 1.0101420461152393
Energy: 1.003356891202904
Energy: 0.8895237747804827
Energy: 1.003356891216338
Energy: 0.8895237747800517
Energy: 1.003356891202904
Energy: 0.8895237747796926
Energy: 0.9004742888040159
Energy: 1.050729373088387
Energy: 0.9004742888004957
Energy: 1.0507293730896083
Energy: 0.9004742887981251
Energy: 1.0507293730935594

minimum gb energy = 0.8894460387618299 eV
minimum distance =  2.31869216260547 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 1.1189946572141174
Energy: 1.0113906453806238
Energy: 1.1189946572193987
Energy: 1.0113906453832646
Energy: 1.1189946572193987
Energy: 1.0113906453806238
Energy: 1.060680775153071
Energy: 0.9308835697028216
Energy: 1.060680775153071
Energy: 0.930883569700181
Energy: 1.060680775153071
Energy: 0.930883569700181
Energy: 1.506234419349446
Energy: 1.1936096373365792
Energy: 1.012390383767856
Energy: 1.19360963733922
Energy: 1.012390383767856
Energy: 1.1936096373365792
Energy: 1.060738626453124
Energy: 0.9312747742909164
Energy: 1.0607386264557646
Energy: 0.9312747742909164
Energy: 1.060738626453124
Energy: 0.9312747742909164
Energy: 1.118994657216758
Energy: 1.0113906453779833
Energy: 1.118994657216758
Energy: 1.0113906453779833
Energy: 1.1189946572193987
Energy: 1.0113906453806238
Energy: 1.0606807751583525
Energy: 0.930883569700181
Energy: 1.0606807751583525
Energy: 0.9308835697028216
Energy: 1.0606807751583525
Energy: 0.930883569700181
Energy: 1.0123903837652155
Energy: 1.19360963733922
Energy: 1.012390383767856
Energy: 1.19360963733922
Energy: 1.0123903837652155
Energy: 1.19360963733922

minimum gb energy = 0.930883569700181 eV
minimum distance =  2.32851772763574 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.3488336486808292
Energy: 1.2366822271886089
Energy: 1.294068573794609
Energy: 1.2366822272065765
Energy: 1.3488336486628618
Energy: 1.2366822272065765
Energy: 1.2235891275513835
Energy: 1.1294439393564741
Energy: 1.2235891275441964
Energy: 1.1294439393600677
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Energy: 1.2831139028234575
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Energy: 1.2831139027947094
Energy: 1.189814957687471
Energy: 1.2831139026977505
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Energy: 1.1667844247201438
Energy: 1.182931854952165
Energy: 1.1669302932682208
Energy: 1.1829319979490562
Energy: 1.1667844247021764
Energy: 1.1829311278451056
Energy: 1.3285902420591984
Energy: 1.173580832060071
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Energy: 1.173580832074445
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Energy: 1.1735808320852252
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Energy: 1.1646811609430794
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Energy: 1.1646811609071446
Energy: 1.1546386529785118
Energy: 1.164681160917925
Energy: 1.2399647998185324
Energy: 1.1329478246091664
Energy: 1.2399647998220606
Energy: 1.1329478246199467
Energy: 1.2399647998256542
Energy: 1.1329478246163533
Energy: 1.1793988971885105
Energy: 1.2566056539549353
Energy: 1.179398897199291
Energy: 1.2566056539513417
Energy: 1.1793988971813238
Energy: 1.2566056539369679
Energy: 1.2969405981767346
Energy: 1.1487949257613226
Energy: 1.296940598173141
Energy: 1.1487949257649162
Energy: 1.2969405981803281
Energy: 1.1487949257649162
Energy: 1.2721678180073117
Energy: 1.1330781587719516
Energy: 1.2721878041340227
Energy: 1.1330781587899192
Energy: 1.272167818010905
Energy: 1.133078158782732
Energy: 1.2532218400150166
Energy: 1.174960292144171
Energy: 1.253221840032984
Energy: 1.174960292144171
Energy: 1.2532218400365776
Energy: 1.1749602921405777
Energy: 1.1670443857508672
Energy: 1.2538685978549533
Energy: 1.1670443857472736
Energy: 1.2538685978765143
Energy: 1.1670443857400867
Energy: 1.2538685978765143
Energy: 1.2210946136232113
Energy: 1.1892098264161033
Energy: 1.221094613619618
Energy: 1.1892098264232902
Energy: 1.2210946136053096
Energy: 1.1892098264232902
Energy: 1.2372038646259018
Energy: 1.1890490491526506
Energy: 1.2365908484832515
Energy: 1.189049049156244
Energy: 1.2372038646294954
Energy: 1.1890490491598376

minimum gb energy = 1.0988481699822439 eV
minimum distance =  2.29543181382062 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.2662576817553692
Energy: 1.195485933867519
Energy: 1.266257681749451
Energy: 1.1954859338689985
Energy: 1.2662576817479714
Energy: 1.1954859338680122
Energy: 1.1535446364486426
Energy: 1.109503646045191
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Energy: 1.1095036460442047
Energy: 1.1535446364491357
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Energy: 1.2253377853066005
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Energy: 1.3559067686753579
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Energy: 1.0378492782002506
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Energy: 1.2175988908260342
Energy: 1.3180136446968311
Energy: 1.217598890815677
Energy: 1.318013644699297
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Energy: 1.318433689174974
Energy: 1.2708426152418169
Energy: 1.3184336891818789
Energy: 1.2708426152423102
Energy: 1.318433689174974
Energy: 1.037811873999535
Energy: 1.1627446915082391
Energy: 1.037811873995096
Energy: 1.1627446915092257
Energy: 1.0378118740089057
Energy: 1.1627446915102122
Energy: 1.0944973484675422
Energy: 1.0564827216197266
Energy: 1.0944973484655693
Energy: 1.0564827216147943
Energy: 1.094497348467049
Energy: 1.0564827216221926
Energy: 1.1121846393418393
Energy: 1.1546904490491683
Energy: 1.1121846393403596
Energy: 1.1546904490511412
Energy: 1.1121846393433188
Energy: 1.1546904490501546
Energy: 1.0580530111250508
Energy: 1.04225591562038
Energy: 1.0580530111215987
Energy: 1.0422559156193933
Energy: 1.058053011120119
Energy: 1.042255915620873
Energy: 1.1821350675478424
Energy: 1.255926486663455
Energy: 1.1821350675384716
Energy: 1.255926486663455
Energy: 1.1821350675458695
Energy: 1.2559264866619755
Energy: 1.054259659984564
Energy: 1.1169927888252833
Energy: 1.0542596599914686
Energy: 1.1169927888242968
Energy: 1.0542596599880163
Energy: 1.1169927888233104
Energy: 1.05644722749763
Energy: 1.0886563032509862
Energy: 1.0564472275045347
Energy: 1.0886563032687415
Energy: 1.0564472275005892
Energy: 1.088656303252959
Energy: 1.068563624983037
Energy: 1.0550110322897994
Energy: 1.0685636249835302
Energy: 1.0550110322893065
Energy: 1.0685636249840234
Energy: 1.055011032290786
Energy: 1.1180661891991164
Energy: 1.451800724911887
Energy: 1.1180661892089359
Energy: 1.451800724909421
Energy: 1.1180661892035553
Energy: 1.451800724916819
Energy: 1.367036361864659
Energy: 1.1803270725133665
Energy: 1.3670363618676182
Energy: 1.1803270724971358
Energy: 1.3670363618661387
Energy: 1.1803270725153394
Energy: 1.1110776238303992
Energy: 1.05955666869822
Energy: 1.1110776238289197
Energy: 1.05955666869822
Energy: 1.111077623832372
Energy: 1.0595566686992064
Energy: 1.1011777213399645
Energy: 1.0572790118960602
Energy: 1.1011777213419371
Energy: 1.057279011895567
Energy: 1.1011777213399645
Energy: 1.057279011892608

minimum gb energy = 1.037811873995096 eV
minimum distance =  2.35030524233716 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.4086738795679365
Energy: 1.0829941829168979
Energy: 1.4086738795685425
Energy: 1.0829941829114456
Energy: 1.4086738795667249
Energy: 1.0829941829156862
Energy: 1.2172333909179036
Energy: 1.0928771128430894
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Energy: 1.217233390920327
Energy: 1.0928771128424835
Energy: 1.25664200847111
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Energy: 1.1544449180925702
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Energy: 1.1636778053230485
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Energy: 1.1636778053206251
Energy: 1.1932468584469909
Energy: 1.1636778053072971
Energy: 1.2419423130886598
Energy: 1.0893675784382673
Energy: 1.241942313088054
Energy: 1.0893675784382673
Energy: 1.2419423130898715
Energy: 1.0893675784364496
Energy: 1.295942084275174
Energy: 1.163250927318212
Energy: 1.2959420842763858
Energy: 1.1632509273170002
Energy: 1.2959420842733567
Energy: 1.163250927318212
Energy: 1.277224540352622
Energy: 1.1465066651628923
Energy: 1.2772245403514102
Energy: 1.1465066651604692
Energy: 1.2772245403508042
Energy: 1.146506665161681
Energy: 1.2395214071380976
Energy: 1.0885041796208748
Energy: 1.239521407147185
Energy: 1.0885041796184514
Energy: 1.23952140710599
Energy: 1.088504179616634
Energy: 1.1926273579608213
Energy: 1.2032041267487283
Energy: 1.1926273579553692
Energy: 1.203204126749334
Energy: 1.1926273579608213
Energy: 1.2032041267487283
Energy: 1.2560622323821318
Energy: 1.1875268407861794
Energy: 1.2560622323815258
Energy: 1.187526840792843
Energy: 1.2560622323863726
Energy: 1.1875268407946606
Energy: 1.0505889871667087
Energy: 1.2407994387950085
Energy: 1.0505889871673144
Energy: 1.2407994387919794
Energy: 1.0505889871648912
Energy: 1.24079943879622
Energy: 1.2766744960308154
Energy: 1.178777029839682
Energy: 1.2766744960332386
Energy: 1.1787770298390763
Energy: 1.276674496031421
Energy: 1.1787770298384705
Energy: 1.149281167305885
Energy: 1.1444754948406164
Energy: 1.1492811673077024
Energy: 1.1444754948418279
Energy: 1.1492811673064907
Energy: 1.1444754948424336
Energy: 1.2520907108649908
Energy: 1.1867259128666459
Energy: 1.252090710857721
Energy: 1.1867259128696752
Energy: 1.2520907108643848
Energy: 1.1867259128690693
Energy: 1.2197586265877611
Energy: 1.0897400851323154
Energy: 1.1511619357044514
Energy: 1.0897400851281023
Energy: 1.2197586265962426
Energy: 1.0897400851347385
Energy: 1.2529186830713235
Energy: 1.0994839287431926
Energy: 1.2529186830422723
Energy: 1.0994839287444045
Energy: 1.252918683002289
Energy: 1.0994839287431926
Energy: 1.1495696891285523
Energy: 1.2112661039222705
Energy: 1.1495696891309755
Energy: 1.2112661039198471
Energy: 1.1495696891297638
Energy: 1.2112661039216646
Energy: 1.2076482001978521
Energy: 1.236245984419481
Energy: 1.2076482001948232
Energy: 1.236245984420693
Energy: 1.207648200198458
Energy: 1.236245984419481
Energy: 1.153729823024825
Energy: 1.1777520100433523
Energy: 1.1537298230230075
Energy: 1.1777520100457755
Energy: 1.15372982302119
Energy: 1.1777520100463814

minimum gb energy = 1.0486225464154917 eV
minimum distance =  2.30701656076384 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.1907914838597515
Energy: 1.030768925101919
Energy: 1.1907914838589673
Energy: 1.030768925095644
Energy: 1.1907914838621052
Energy: 1.0307689250948593
Energy: 1.147517962596179
Energy: 1.0522955002864578
Energy: 1.147517962596179
Energy: 1.052295500284889
Energy: 1.1475179625946104
Energy: 1.0522955002841046
Energy: 1.1462482211208689
Energy: 1.297931432585086
Energy: 1.1462482211208689
Energy: 1.2979314325843014
Energy: 1.1462482211067855
Energy: 1.2979314325804152
Energy: 1.188498466565598
Energy: 1.2240612516469227
Energy: 1.1884984665640292
Energy: 1.2240612516524136
Energy: 1.188498466563245
Energy: 1.2240612516563356
Energy: 1.084270980842922
Energy: 1.2184552161475133
Energy: 1.0842709808523348
Energy: 1.2184552161428066
Energy: 1.0842709808413533
Energy: 1.2184552161435913
Energy: 1.1465813035493622
Energy: 1.164654781134596
Energy: 1.1465813035297525
Energy: 1.1646547811369132
Energy: 1.1465813035493622
Energy: 1.164654781134596
Energy: 1.175565570679358
Energy: 1.2998855199767596
Energy: 1.175565570680142
Energy: 1.2998855199767596
Energy: 1.175565570679358
Energy: 1.299885519979113
Energy: 1.1874646605860302
Energy: 1.0582827799808165
Energy: 1.1874646605828927
Energy: 1.0582827799784633
Energy: 1.1874646605821082
Energy: 1.058282779981601
Energy: 1.1063403175628692
Energy: 1.0473196372871891
Energy: 1.1063403175613002
Energy: 1.0473196372887579
Energy: 1.106340317562085
Energy: 1.0473196372864049
Energy: 1.019317698611277
Energy: 1.1643045740011335
Energy: 1.0193176986120613
Energy: 1.1643045740065885
Energy: 1.01931769861363
Energy: 1.1643045740019178
Energy: 1.1759783461333255
Energy: 1.2300619521182201
Energy: 1.175978346134894
Energy: 1.2300619521166511
Energy: 1.1759783461356785
Energy: 1.2300619521182201
Energy: 1.0903381077713095
Energy: 1.219378990022916
Energy: 1.0903381077728784
Energy: 1.2193789900088325
Energy: 1.0903381077689565
Energy: 1.2193789899774568
Energy: 1.1221934947726302
Energy: 1.0476561006317018
Energy: 1.1221934947656063
Energy: 1.0476561006301328
Energy: 1.1221934947726302
Energy: 1.0476561006293483
Energy: 1.119652559210176
Energy: 1.0595762963287318
Energy: 1.1196525591850754
Energy: 1.0595762963255944
Energy: 1.1196525592376299
Energy: 1.0595762963248099
Energy: 1.1200134159359076
Energy: 1.0445784684926784
Energy: 1.1200134159382609
Energy: 1.044578468495816
Energy: 1.120013415936692
Energy: 1.0445784684934625
Energy: 1.0916903440896042
Energy: 1.0331558965060132
Energy: 1.0916903440880352
Energy: 1.0331558965044445
Energy: 1.0916903440888197
Energy: 1.0331558965052292
Energy: 1.021324216914949
Energy: 1.1545188321376887
Energy: 1.021324216908674
Energy: 1.1545188321369044
Energy: 1.021324216911027
Energy: 1.1545188321353357
Energy: 1.1725955358539997
Energy: 1.1714296338650667
Energy: 1.1725955358547842
Energy: 1.1714296338697732
Energy: 1.1725955358563527
Energy: 1.1714296338674197
Energy: 1.021395382943332
Energy: 1.1543720910744306
Energy: 1.0213953829496074
Energy: 1.1543720910744306
Energy: 1.0213953829456854
Energy: 1.1543720910752147
Energy: 1.0919401655846854
Energy: 1.0331509557336422
Energy: 1.0919401655823324
Energy: 1.0331509557336422
Energy: 1.0919401655800145
Energy: 1.0331509557336422
Energy: 1.1192853105582148
Energy: 1.0445758303378836
Energy: 1.1192853105550775
Energy: 1.044575830337099
Energy: 1.1192853105582148
Energy: 1.0445758303386679
Energy: 1.1220194013384328
Energy: 1.0478209293759113
Energy: 1.1220194204205698
Energy: 1.0478209293806178
Energy: 1.1220193929083697
Energy: 1.0478209293876772
Energy: 1.121448206903396
Energy: 1.0474252283824332
Energy: 1.1214482069065335
Energy: 1.0474252283792957
Energy: 1.121448206915162
Energy: 1.047425228376978
Energy: 1.090206352521517
Energy: 1.2193012398743528
Energy: 1.0902063525246546
Energy: 1.21930123985239
Energy: 1.0902063525223014
Energy: 1.2193012398500367

minimum gb energy = 1.019317698611277 eV
minimum distance =  2.34138739390109 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.089356688884724
Energy: 1.0673236062621672
Energy: 1.0893566888869426
Energy: 1.0673236062621672
Energy: 1.089356688884724
Energy: 1.0673236062621672
Energy: 1.034509501984921
Energy: 1.038599830817901
Energy: 1.0345095019882489
Energy: 1.038599830817901
Energy: 1.034509501984921
Energy: 1.0385998308156823
Energy: 1.243707506175667
Energy: 1.2178550821345615
Energy: 1.243707506178995
Energy: 1.2178550821345615
Energy: 1.2437075061767766
Energy: 1.2178550821356706
Energy: 0.9406452168328484
Energy: 1.194996497491701
Energy: 0.940645216835067
Energy: 1.1949964974861544
Energy: 0.9406452168306297
Energy: 1.194996497491701
Energy: 1.0713886866604405
Energy: 1.1460099912960855
Energy: 1.0713886866615496
Energy: 1.1460099912927577
Energy: 1.0713886866836853
Energy: 1.1460099912960855
Energy: 1.0940787969187291
Energy: 1.1720171671628883
Energy: 1.0940787969187291
Energy: 1.1720171671595605
Energy: 1.09407879691762
Energy: 1.1720171671606698
Energy: 1.1146384488100534
Energy: 1.022909476141906
Energy: 1.1146384488111627
Energy: 1.022909476141906
Energy: 1.114638448808944
Energy: 1.0229094761364097
Energy: 0.9405398433875671
Energy: 1.134644705947178
Energy: 0.9405398433853486
Energy: 1.1346447059460687
Energy: 0.9405398433886764
Energy: 1.1346447059505058
Energy: 1.1527488617183936
Energy: 1.0288631325540485
Energy: 1.1527488617161752
Energy: 1.0288631325607043
Energy: 1.1527488617172843
Energy: 1.0288631325562674
Energy: 1.1003372504293099
Energy: 1.031922287030132
Energy: 1.1003372504282005
Energy: 1.0319222870312412
Energy: 1.1003372504270914
Energy: 1.031922287027913
Energy: 1.083421222511348
Energy: 0.9946724029664951
Energy: 1.083421222512457
Energy: 0.9946724029687137
Energy: 1.083421222512457
Energy: 0.9946724029653857
Energy: 1.0645028185574499
Energy: 1.028632804950982
Energy: 1.0645028185574499
Energy: 1.028632804950982
Energy: 1.0645028185596686
Energy: 1.028632804950982
Energy: 0.9734584013903826
Energy: 1.1742482735295225
Energy: 0.973458401391492
Energy: 1.1742482735284134
Energy: 0.9734584013903826
Energy: 1.1742482735295225
Energy: 1.1003384539222756
Energy: 1.167310806607899
Energy: 1.1003384539256034
Energy: 1.167310806607899
Energy: 1.1003384539256034
Energy: 1.1673108066056803
Energy: 1.1045656527950392
Energy: 0.974329661747661
Energy: 1.1045656527950392
Energy: 0.9743296617354588
Energy: 1.10456565279393
Energy: 0.9743296617465517
Energy: 1.1005580808933866
Energy: 1.1766635743413032
Energy: 1.1005580808911677
Energy: 1.1766635743413032
Energy: 1.1005580808911677
Energy: 1.1766635743424125
Energy: 1.0977154650399321
Energy: 1.1624327020211527
Energy: 1.0977154650399321
Energy: 1.1624327020222618
Energy: 1.0977154650388228
Energy: 1.1624327020233711

minimum gb energy = 0.9405398433853486 eV
minimum distance =  2.28178028836454 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.082948221390141
Energy: 0.9682653527606668
Energy: 1.082948221390141
Energy: 0.968265352761095
Energy: 1.0829482213897126
Energy: 0.9682653527585249
Energy: 0.9776485486233448
Energy: 0.9345922274237249
Energy: 0.9776485486229163
Energy: 0.9345922274232965
Energy: 0.9776485486199177
Energy: 0.93459222742501
Energy: 1.0178321986655896
Energy: 1.032192907136734
Energy: 1.017832198659203
Energy: 1.0321929071375906
Energy: 1.0178321986711585
Energy: 1.0321929071375906
Energy: 0.9071124107577891
Energy: 1.0901245034189324
Energy: 0.907112410763358
Energy: 1.0900913377388657
Energy: 0.907112410753077
Energy: 1.090124503420646
Energy: 0.9808563685211633
Energy: 0.9338339057139302
Energy: 0.9808563685224485
Energy: 0.9338339057165004
Energy: 0.9808563685198782
Energy: 0.9338339057165004
Energy: 1.036742507438707
Energy: 0.9828217999160983
Energy: 1.0367425074369936
Energy: 0.9828217999148132
Energy: 1.03674250743528
Energy: 0.9828217999156701
Energy: 0.9817735338950707
Energy: 0.9861047358666021
Energy: 0.9817735338963559
Energy: 0.9861047358670303
Energy: 0.9817735338950707
Energy: 0.9861047358678872
Energy: 1.000547878100319
Energy: 1.08902329935977
Energy: 1.0005478781033177
Energy: 1.0890232993601983
Energy: 1.0005478781028891
Energy: 1.0890232993580564
Energy: 1.0129536705907434
Energy: 1.0355669897011266
Energy: 1.012953670590315
Energy: 1.035566989704125
Energy: 1.0129536705907434
Energy: 1.035566989704125
Energy: 0.9810947398299935
Energy: 0.8880808310766015
Energy: 0.9810947398368476
Energy: 0.8880808310787434
Energy: 0.9810947398342773
Energy: 0.8880808310791719
Energy: 0.9068695307848325
Energy: 1.0538738799406882
Energy: 0.9068695307758367
Energy: 1.0538738799501124
Energy: 0.9068695307822622
Energy: 1.0538738799445433
Energy: 1.0927590956744384
Energy: 0.962244489911495
Energy: 1.0927590956808642
Energy: 0.9622444899123519
Energy: 1.0927590956860047
Energy: 0.9622444899081071
Energy: 1.005149764976596
Energy: 0.9611326707672837
Energy: 1.005149764973597
Energy: 0.9611326707698539
Energy: 1.0051497649714551
Energy: 0.9611326707715673
Energy: 0.988039350669905
Energy: 0.9748142963135848
Energy: 0.9880393506673346
Energy: 0.9748142963140133
Energy: 0.9880393506677629
Energy: 0.9748142963191537
Energy: 1.017489459687188
Energy: 0.9624304374510942
Energy: 1.0174894596829043
Energy: 0.9624304374699426
Energy: 1.017489459679049
Energy: 0.9624304374763683
Energy: 0.9069696589928932
Energy: 1.056780860484893
Energy: 0.9069696589920754
Energy: 1.0711184140109422
Energy: 0.9069696589924648
Energy: 1.0199576973883833
Energy: 1.0027742112024363
Energy: 1.0231957526101332
Energy: 1.0027742112032931
Energy: 1.0231957526092765
Energy: 1.002774211205435
Energy: 1.023195752608848
Energy: 1.0420813484092724
Energy: 1.0257840798481141
Energy: 1.0420813484045601
Energy: 1.0257840798481141
Energy: 1.0420813484114142
Energy: 1.0257840798476856
Energy: 1.0000047712586946
Energy: 1.0222043861932526
Energy: 1.0000047712634066
Energy: 1.0222043861911108
Energy: 1.0000047712698323
Energy: 1.0222043861936811
Energy: 1.0016263368488276
Energy: 0.8846346995642229
Energy: 1.0016263368535396
Energy: 0.8846346995672213
Energy: 1.0016263368475424
Energy: 0.8846346995667931
Energy: 0.9998621067778959
Energy: 1.021682406808553
Energy: 0.9998621067680434
Energy: 1.0216824068444974
Energy: 0.9998621067727553
Energy: 1.0216824068205086
Energy: 1.0422283744014824
Energy: 1.0259064027729627
Energy: 1.0422283744074798
Energy: 1.025906402774248
Energy: 1.0422283744049095
Energy: 1.025906402777675
Energy: 1.002725714746682
Energy: 1.0230093349796312
Energy: 1.0027257147471105
Energy: 1.0230093349796312
Energy: 1.002725714746682
Energy: 1.0230093349796312
Energy: 0.9071251132152035
Energy: 1.0985108704123683
Energy: 0.9071251132088168
Energy: 1.0985108704076563
Energy: 0.907125113209245
Energy: 1.098510870408513
Energy: 1.0176157926385274
Energy: 0.9621627127197694
Energy: 1.0176157926372422
Energy: 0.9621627127176277
Energy: 1.0176157926355287
Energy: 0.9621627127201979
Energy: 0.9878884034771301
Energy: 0.9742525708623654
Energy: 0.9878884034784151
Energy: 0.9742525708619371
Energy: 0.987888403482699
Energy: 0.9742525708615087
Energy: 1.0061056676037763
Energy: 0.9606420049778451
Energy: 1.0061056676042048
Energy: 0.9606420049868021
Energy: 1.0061056676054898
Energy: 0.9606420049795587
Energy: 1.0928248888575456
Energy: 0.9623962835506127
Energy: 1.0928248888571175
Energy: 0.9623962835493276
Energy: 1.0928248888545473
Energy: 0.9623962835471858
Energy: 0.9067929098058577
Energy: 1.0536520858036098
Energy: 0.906792909809713
Energy: 1.0536520858006113
Energy: 0.9067929098054295
Energy: 1.0536520857976517
Energy: 0.9810001100100221
Energy: 0.8876429098463726
Energy: 0.9810001100138772
Energy: 0.8876429098459443
Energy: 0.9810001100138772
Energy: 0.8876429098480861
Energy: 1.0128092965550155
Energy: 1.0355534952505818
Energy: 1.0128092965558722
Energy: 1.0355534952484398
Energy: 1.012809296554587
Energy: 1.0355534952510101
Energy: 1.0006857352730063
Energy: 1.0890575714445203
Energy: 1.0006857352670089
Energy: 1.089057571448804
Energy: 1.0006857352730063
Energy: 1.0890575714492323
Energy: 0.9816865399430065
Energy: 0.985337547531113
Energy: 0.9816865399348672
Energy: 0.9853375475131603
Energy: 0.9816865399400078
Energy: 0.985337547520832
Energy: 1.0371205509713455
Energy: 0.9489595699961381
Energy: 1.0371205509696317
Energy: 0.9489595699948529
Energy: 1.0371205509679184
Energy: 0.9489595699957096
Energy: 0.9824343993936746
Energy: 0.9339888926636382
Energy: 0.9824343993885342
Energy: 0.9339888926674936
Energy: 0.982434399394103
Energy: 0.9339888926713488
Energy: 0.9071037883958855
Energy: 1.04340508963549
Energy: 0.9071037884001693
Energy: 1.0434050896375928
Energy: 0.9071037883963139
Energy: 1.0434050896440183
Energy: 1.0178401597900748
Energy: 1.0319172060358923
Energy: 1.0178401597887898
Energy: 1.0319172060346071
Energy: 1.0178401598016407
Energy: 1.031917206034179
Energy: 0.9791680307279725
Energy: 0.9347573157433081
Energy: 0.9791680307292576
Energy: 0.9347573157411662
Energy: 0.9791680307275443
Energy: 0.9347573157420229
Energy: 1.0829482213884276
Energy: 0.9682653527645221
Energy: 1.0829482213909978
Energy: 0.9682653527636653
Energy: 1.0829482213918544
Energy: 0.9682653527649504
Energy: 0.9776485486190609
Energy: 0.9449059271698478
Energy: 0.9776485486216312
Energy: 0.9449059271702762
Energy: 0.9776485486297704
Energy: 0.9449059271694195
Energy: 1.0178321986652001
Energy: 1.0321929071405895
Energy: 1.0178321986574894
Energy: 1.0321929071393043
Energy: 1.0178321986698735
Energy: 1.0321929071414462
Energy: 0.9071124107590742
Energy: 1.0227656526995061
Energy: 0.9071124107522204
Energy: 1.02276565270379
Energy: 0.9071124107577891
Energy: 1.0227656526999347
Energy: 0.980856368525447
Energy: 0.9338339057079328
Energy: 0.9808563685185931
Energy: 0.9338339057015074
Energy: 0.9808563685288739
Energy: 0.9338339057006505

minimum gb energy = 0.8846346995642229 eV
minimum distance =  2.31303219030934 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.9903464729313576
Energy: 0.8936386453912215
Energy: 0.99034647292787
Energy: 0.8936386453940114
Energy: 0.9903464729243826
Energy: 0.8936386453919191
Energy: 0.9112357675775743
Energy: 0.8795800159831928
Energy: 0.9112357675705993
Energy: 0.8795800159831928
Energy: 0.9112357675719943
Energy: 0.8795800159783103
Energy: 1.0625722693994484
Energy: 0.9551872314310587
Energy: 1.0625722693868935
Energy: 0.9551872314282688
Energy: 1.0625722693896833
Energy: 0.9551872314317562
Energy: 0.855125718338917
Energy: 0.980061599231934
Energy: 0.8551257183270595
Energy: 0.9800615992340266
Energy: 0.855125718340312
Energy: 0.9800615992368166
Energy: 0.8922005396755939
Energy: 0.8266599651639995
Energy: 0.8922005396282278
Energy: 0.826659965153537
Energy: 0.8922005396191605
Energy: 0.826659965164697
Energy: 0.9750312351199095
Energy: 0.8794257613776252
Energy: 0.9750312351254895
Energy: 0.8794257613762302
Energy: 0.9750312351192121
Energy: 0.8794257613769277
Energy: 0.8357182543783621
Energy: 0.9408793893649082
Energy: 0.8357182543804547
Energy: 0.9408793893593282
Energy: 0.8357182543748747
Energy: 0.9408793893635132
Energy: 1.1096426641701906
Energy: 0.9182417117093633
Energy: 1.1096426641750732
Energy: 0.9182417117086659
Energy: 1.1096426641757706
Energy: 0.9182417117079683
Energy: 0.8891146912206752
Energy: 0.8816538718441864
Energy: 0.8891146912185827
Energy: 0.8816538718434891
Energy: 0.8891146912185827
Energy: 0.8816538718400015
Energy: 0.8997416922008885
Energy: 0.9049667549807194
Energy: 0.8997416921980986
Energy: 0.9049667549814169
Energy: 0.8997416921980986
Energy: 0.9049667549800219
Energy: 0.8367734059836194
Energy: 1.0193101253102967
Energy: 0.8367734059745521
Energy: 1.0193101253137842
Energy: 0.8367734059905945
Energy: 1.0193101253116916
Energy: 0.9290082706721604
Energy: 0.8457593962533915
Energy: 0.9290082706644879
Energy: 0.845759396254089
Energy: 0.9290082706658829
Energy: 0.8457593962436266
Energy: 0.8983394487579918
Energy: 0.9597729155985406
Energy: 0.8983394487510168
Energy: 0.9597729155985406
Energy: 0.8983394487538068
Energy: 0.9597729156020279
Energy: 0.8506398876313563
Energy: 0.9345512130803476
Energy: 0.8506398876313563
Energy: 0.9345512130705825
Energy: 0.8506398876313563
Energy: 0.93455121307128
Energy: 1.0005464418058563
Energy: 0.894959053725231
Energy: 1.0005464418100414
Energy: 0.8949590537294158
Energy: 1.000546441809344
Energy: 0.8949590537273234
Energy: 0.8972215761133161
Energy: 0.8915798089603456
Energy: 0.8972215761216862
Energy: 0.8915798089569215
Energy: 0.8972215761223836
Energy: 0.8915798089631356
Energy: 0.9257028223576956
Energy: 1.011742901408168
Energy: 0.9257028223611831
Energy: 1.0117429014060755
Energy: 0.9257028223632756
Energy: 1.0117429014060755
Energy: 0.9538142014632676
Energy: 0.9795896974707817
Energy: 0.9538142014646623
Energy: 0.9795896974658992
Energy: 0.953814201458385
Energy: 0.9795896974707817
Energy: 0.8656656096668082
Energy: 1.0570705840602286
Energy: 0.8656656096654132
Energy: 1.0570705840623211
Energy: 0.8656656096605306
Energy: 1.057070584060926
Energy: 0.8544602660872578
Energy: 0.9730731141267677
Energy: 0.8544602661060267
Energy: 0.9730731141274649
Energy: 0.8544602660913794
Energy: 0.9730731141260701
Energy: 0.9505814647543176
Energy: 0.9459067722561605
Energy: 0.9505814647410652
Energy: 0.9459067722526731
Energy: 0.9505814647361829
Energy: 0.945906772256858
Energy: 0.8358533215181988
Energy: 1.0634258047398186
Energy: 0.8358533215188964
Energy: 1.0634258047412137
Energy: 0.8358533215084339
Energy: 1.0634258047509786
Energy: 0.9240490042408189
Energy: 0.9280676618252477
Energy: 0.9240490042429114
Energy: 0.9280676618245502
Energy: 0.9240490042387264
Energy: 0.9280676618245502
Energy: 0.9146644576971537
Energy: 1.0618237929019816
Energy: 0.9146644577111035
Energy: 1.061823792885939
Energy: 0.9146644577027336
Energy: 1.0618237928880316
Energy: 0.9147355713183333
Energy: 1.136439904339468
Energy: 0.9147355713218207
Energy: 1.1364399043401654
Energy: 0.9147355713190307
Energy: 1.1364399043380728
Energy: 0.8959310017457565
Energy: 0.9272011259290371
Energy: 0.8959310017380842
Energy: 0.9272011259290371
Energy: 0.8959310017457565
Energy: 0.9272011259290371
Energy: 0.8495717356391155
Energy: 1.0570956888704839
Energy: 0.8495717356405103
Energy: 1.0570956888683913
Energy: 0.8495717356405103
Energy: 1.0570956888697862

minimum gb energy = 0.826659965153537 eV
minimum distance =  2.27799462516488 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.8530522691749767
Energy: 0.8026545883981484
Energy: 0.8530522691744686
Energy: 0.8026545884011975
Energy: 0.8530522691765012
Energy: 0.8026545884006894
Energy: 0.8776676746184852
Energy: 0.814209583287989
Energy: 0.8776676746215342
Energy: 0.8142095832874806
Energy: 0.8776676746189932
Energy: 0.814209583287989
Energy: 0.9160267937763796
Energy: 0.8671628983148952
Energy: 0.9160267937773959
Energy: 0.8671628983148952
Energy: 0.9160267937763796
Energy: 0.8671628983143871
Energy: 0.839513089078461
Energy: 0.8420658228302615
Energy: 0.8395130890799856
Energy: 0.8420658228307698
Energy: 0.8395130890738873
Energy: 0.8420658228322944
Energy: 0.8700736050282153
Energy: 0.7752965139132276
Energy: 0.8700736050231335
Energy: 0.775296513914244
Energy: 0.8700736050241498
Energy: 0.775296513914244
Energy: 0.8272162336056378
Energy: 0.7880978434429579
Energy: 0.8272162336041132
Energy: 0.788097843446007
Energy: 0.827216233601064
Energy: 0.7880978434454987
Energy: 0.7487756079751444
Energy: 0.8169850605988149
Energy: 0.7487756079736199
Energy: 0.816985060601356
Energy: 0.7487756079797182
Energy: 0.8169850606049133
Energy: 0.8690079515157184
Energy: 0.7615879493368595
Energy: 0.8690079515131774
Energy: 0.7615879493353348
Energy: 0.8690079515162267
Energy: 0.7615879493353348
Energy: 0.7926459684502657
Energy: 0.7776149096027328
Energy: 0.7926459684522985
Energy: 0.7776149096037493
Energy: 0.7926459684497574
Energy: 0.7776149096027328
Energy: 0.8809186699872186
Energy: 0.7766927388226224
Energy: 0.8809186699862022
Energy: 0.7766927388281663
Energy: 0.8809186699831529
Energy: 0.7766927388276581
Energy: 0.9515973205558239
Energy: 0.8518501035270701
Energy: 0.9515973205548075
Energy: 0.8518501035255457
Energy: 0.9515973205553157
Energy: 0.8518501035255457
Energy: 0.7501224848094965
Energy: 0.7801951765643557
Energy: 0.7501224848105129
Energy: 0.7801951765724867
Energy: 0.7501224848100048
Energy: 0.7801951765719787
Energy: 0.8798676998813392
Energy: 0.739388950204796
Energy: 0.8798676998813392
Energy: 0.7393889502063206
Energy: 0.8798676998818472
Energy: 0.7393889502063206
Energy: 0.9495087445558968
Energy: 0.9414150253808466
Energy: 0.9495087445574214
Energy: 0.9414150253849121
Energy: 0.9495087445569133
Energy: 0.9414150253838959
Energy: 0.7767108831791283
Energy: 0.7757020171041061
Energy: 0.7767108831791283
Energy: 0.775702017103598
Energy: 0.776710883175571
Energy: 0.7757020170969914
Energy: 0.825235471199308
Energy: 0.8216572631864354
Energy: 0.8252354711947342
Energy: 0.8216572631859274
Energy: 0.825235471196767
Energy: 0.821657263185419
Energy: 0.7994116030238737
Energy: 0.940286376035763
Energy: 0.7994116030248901
Energy: 0.940286376035763
Energy: 0.7994116030213327
Energy: 0.9402863760352549
Energy: 0.7990066207705564
Energy: 0.7765141068091376
Energy: 0.7990066207700482
Energy: 0.7765141068111704
Energy: 0.7990066207715728
Energy: 0.7765141068086295
Energy: 0.7489800544733245
Energy: 0.8660448100068489
Energy: 0.7489800544763737
Energy: 0.8660448100068489
Energy: 0.7489800544758656
Energy: 0.8660448100053243
Energy: 0.8226147043505476
Energy: 0.8544210088769063
Energy: 0.8226147043474984
Energy: 0.8544210088794472
Energy: 0.8226147043495312
Energy: 0.8544210088774146
Energy: 0.862608020517598
Energy: 0.7924664792639654
Energy: 0.8626080205186144
Energy: 0.79246647926549
Energy: 0.862608020517598
Energy: 0.7924664792619326
Energy: 0.8132178246391445
Energy: 0.8693566815429652
Energy: 0.8132178246396526
Energy: 0.8693566815439816
Energy: 0.8132178246421936
Energy: 0.8693566815424568
Energy: 0.8211193983816673
Energy: 0.8677169924869971
Energy: 0.8211193983821753
Energy: 0.8677169924864889
Energy: 0.8211193983821753
Energy: 0.8677169924875051
Energy: 0.9094748824527652
Energy: 0.7943867893868891
Energy: 0.9094748824563227
Energy: 0.794386789386381
Energy: 0.9094748824563227
Energy: 0.7943867893853646
Energy: 0.7477268915118276
Energy: 0.8514852871981046
Energy: 0.747726891515893
Energy: 0.8514852872006456
Energy: 0.7477268915148767
Energy: 0.8514852872021702
Energy: 0.768859326719584
Energy: 0.8395272317116527
Energy: 0.7688593267190758
Energy: 0.8395272317106361
Energy: 0.7688593267165347
Energy: 0.839527231712669
Energy: 0.8346596502884592
Energy: 0.7666526256774399
Energy: 0.8243902568949112
Energy: 0.7666526256718497
Energy: 0.8346596502884592
Energy: 0.7666526256713415
Energy: 0.7419185959192927
Energy: 0.8465300997932091
Energy: 0.741918595920309
Energy: 0.846530099792701
Energy: 0.7419185959192927
Energy: 0.8465300997907143
Energy: 0.7689117706006172
Energy: 0.7907666447140387
Energy: 0.7689117706016336
Energy: 0.7907666447135305
Energy: 0.7689117705996009
Energy: 0.7907666447145468
Energy: 0.7706645423935397
Energy: 0.8878245890141419
Energy: 0.7706645423904905
Energy: 0.8878245890151583
Energy: 0.7706645423925234
Energy: 0.8878245890100762
Energy: 0.8005559076409077
Energy: 0.8442102572651152
Energy: 0.7595983500150613
Energy: 0.8442102572681646
Energy: 0.800555907631252
Energy: 0.8442102572635908
Energy: 0.7693705383415255
Energy: 0.7624430467973442
Energy: 0.7693705383379681
Energy: 0.7624430467978524
Energy: 0.7693705383440664
Energy: 0.7624430467958196
Energy: 0.7456008664992408
Energy: 0.8509938574480106
Energy: 0.745600866494159
Energy: 0.8509938574546171
Energy: 0.7456008664972081
Energy: 0.8509938574551252
Energy: 0.8811062195275792
Energy: 0.9564835151652885
Energy: 0.8811062195245299
Energy: 0.9564835151683376
Energy: 0.8811062195275792
Energy: 0.9564835151663049
Energy: 0.800301708478621
Energy: 0.7394828687238836
Energy: 0.8003017084776047
Energy: 0.7394828687238836
Energy: 0.8003017084781128
Energy: 0.7394828687243917
Energy: 0.6904853541284969
Energy: 0.8493536268237517
Energy: 0.6904853541279887
Energy: 0.8493536268323909
Energy: 0.6904853541290051
Energy: 0.8493536268252763

minimum gb energy = 0.6904853541279887 eV
minimum distance =  2.2670836562076 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.03445553690838312
Energy: 0.083881937664909
Energy: 0.034455536906515885
Energy: 0.08388193766304176
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.644454328072578
Energy: 0.03719836902380945
Energy: 0.6444543280707108
Energy: 0.03719836902194221
Energy: 0.6444543280707108
Energy: 0.03719836902567668
Energy: 0.6444590838608906
Energy: 0.03589839645576305
Energy: 0.6444590838627579
Energy: 0.035898396438957966
Energy: 0.6444590838608906
Energy: 0.03589839644829412
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.034455536904648656
Energy: 0.08388193766304176
Energy: 0.6444543280707108
Energy: 0.03719836898837448
Energy: 0.644454328072578
Energy: 0.03719836897903832
Energy: 0.6444543280707108
Energy: 0.03719836898837448
Energy: 0.6444590838608906
Energy: 0.035898396472568136
Energy: 0.6444590838608906
Energy: 0.03589839648190429
Energy: 0.6444590838608906
Energy: 0.03589839647816983
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.6444543280707108
Energy: 0.037198368986507246
Energy: 0.6444543280707108
Energy: 0.03719836898464002
Energy: 0.6444543280707108
Energy: 0.037198368980905554
Energy: 0.6444590838608906
Energy: 0.03589839648190429
Energy: 0.6444590838627579
Energy: 0.03589839648190429
Energy: 0.6444590838608906
Energy: 0.03589839648750599
Energy: 0.03445553690838312
Energy: 0.083881937664909
Energy: 0.034455536906515885
Energy: 0.083881937664909
Energy: 0.034455536906515885
Energy: 0.083881937664909

minimum gb energy = 0.034455536904648656 eV
minimum distance =  2.46303715923517 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.752804925575227
Energy: 0.7247081277344432
Energy: 0.7528049255757858
Energy: 0.7247081277310906
Energy: 0.7528049255780209
Energy: 0.7247081277333256
Energy: 0.6350220002290855
Energy: 0.7169316705955894
Energy: 0.6350220002302029
Energy: 0.716931670593913
Energy: 0.6350220002279678
Energy: 0.7169316705978245
Energy: 0.7253408045445414
Energy: 0.7164843713317745
Energy: 0.7908401162782193
Energy: 0.716484371330098
Energy: 0.7253408045434238
Energy: 0.7164843713273042
Energy: 0.7596052454482191
Energy: 0.6956892035278577
Energy: 0.7596052454510129
Energy: 0.6956892035317691
Energy: 0.7596052454498953
Energy: 0.6956892035284165
Energy: 0.6204223383951103
Energy: 0.7185697311377771
Energy: 0.6204223383967867
Energy: 0.7185697311321892
Energy: 0.6204223383956692
Energy: 0.7185697311372183
Energy: 0.728451878891504
Energy: 0.7196114703640771
Energy: 0.7284518788903864
Energy: 0.7196114703640771
Energy: 0.7284518788920626
Energy: 0.7196114703657535
Energy: 0.7124299068702534
Energy: 0.7026978039982588
Energy: 0.7124299068713709
Energy: 0.7026978039965825
Energy: 0.7124299068747236
Energy: 0.7026978039977001
Energy: 0.616428564264699
Energy: 0.6980560605661147
Energy: 0.6164285642630228
Energy: 0.698056060570585
Energy: 0.6164285642602289
Energy: 0.69805606056835
Energy: 0.7413873315495171
Energy: 0.7276519513497696
Energy: 0.7413873315495171
Energy: 0.7276519513475344
Energy: 0.7413873315489583
Energy: 0.7276519513492108
Energy: 0.7125852460102166
Energy: 0.6703241799604257
Energy: 0.7125852460102166
Energy: 0.6703241799587494
Energy: 0.712585246009099
Energy: 0.6703241799609845
Energy: 0.6590800655186956
Energy: 0.7067504765321642
Energy: 0.6590800655192544
Energy: 0.7067504765321642
Energy: 0.6590800655203718
Energy: 0.7067504765310466
Energy: 0.7587204269490093
Energy: 0.7669053472436874
Energy: 0.7587204269462154
Energy: 0.7669053472470402
Energy: 0.7587204269473331
Energy: 0.7669053472431286
Energy: 0.7114583202689554
Energy: 0.6321204424509175
Energy: 0.7114583202706317
Energy: 0.6321204424531527
Energy: 0.711458320267838
Energy: 0.6321204424537115
Energy: 0.6872260320498959
Energy: 0.745153059774202
Energy: 0.6872260320504546
Energy: 0.7451530597730845
Energy: 0.6872260320515723
Energy: 0.7451530597714081
Energy: 0.719178164705874
Energy: 0.7445594346911212
Energy: 0.7191781647075504
Energy: 0.7445594346911212
Energy: 0.7191781647053154
Energy: 0.7445594346911212
Energy: 0.7160680932906169
Energy: 0.6218930284545315
Energy: 0.7160680932894995
Energy: 0.6218930284556491
Energy: 0.7160680932911757
Energy: 0.6218930284567666
Energy: 0.7246870402304256
Energy: 0.7669167488245021
Energy: 0.7246870402287493
Energy: 0.7669167488233846
Energy: 0.7246870402309844
Energy: 0.7669167488217082
Energy: 0.7180496703022917
Energy: 0.7055663195789161
Energy: 0.7180496703011742
Energy: 0.705566319576681
Energy: 0.7180496703011742
Energy: 0.7055663195750047
Energy: 0.7182825066753618
Energy: 0.6857452774396506
Energy: 0.7182825066775969
Energy: 0.6857452774379743
Energy: 0.7182825066770381
Energy: 0.6857452774385331
Energy: 0.7042802684062917
Energy: 0.7936509826334501
Energy: 0.7042802684074092
Energy: 0.7936509826351266
Energy: 0.7042802684051741
Energy: 0.793650982631215
Energy: 0.7385319930924011
Energy: 0.6997482642422577
Energy: 0.7385319930924011
Energy: 0.6997482642422577
Energy: 0.7385319930918424
Energy: 0.6997482642405815
Energy: 0.6893039939122252
Energy: 0.6945792152769997
Energy: 0.6893039939166953
Energy: 0.6945792152775584
Energy: 0.6893039939127839
Energy: 0.6945792152781173
Energy: 0.717576970516619
Energy: 0.6895259091383468
Energy: 0.7175769705171778
Energy: 0.689525909134994
Energy: 0.7175769705132663
Energy: 0.6895259091389054
Energy: 0.7287885705280721
Energy: 0.6939434104595165
Energy: 0.7287885705275133
Energy: 0.6939434104600752
Energy: 0.7287885705263958
Energy: 0.6939434104595165
Energy: 0.7075399896577524
Energy: 0.7261157326533448
Energy: 0.7075399896594287
Energy: 0.7261157326539036
Energy: 0.70753998965887
Energy: 0.7261157326544624
Energy: 0.7107285550746932
Energy: 0.7081935930731038
Energy: 0.7107285550746932
Energy: 0.7081935930719864
Energy: 0.7107285550735757
Energy: 0.7081935930719864
Energy: 0.8081190752638304
Energy: 0.612148196460482
Energy: 0.8081190752638304
Energy: 0.6121481964638347
Energy: 0.8081190752638304
Energy: 0.6121481964610408
Energy: 0.7210646993150658
Energy: 0.7478682499660163
Energy: 0.7210646993167421
Energy: 0.7478682499660163
Energy: 0.7210646993161833
Energy: 0.747868249967134
Energy: 0.6970381909735124
Energy: 0.7182810631407991
Energy: 0.6970381909729536
Energy: 0.7182810631380053
Energy: 0.697038190974071
Energy: 0.7182810631391229
Energy: 0.8157085598985663
Energy: 0.6567743741835286
Energy: 0.8157085598913022
Energy: 0.6567743741857637
Energy: 0.8157085598940961
Energy: 0.6567743741846461
Energy: 0.7364545379479718
Energy: 0.7411403205347583
Energy: 0.7364545379462955
Energy: 0.741140320535876
Energy: 0.7364545379468542
Energy: 0.7411403205353172
Energy: 0.6666604717999866
Energy: 0.7149969782737321
Energy: 0.666660471801104
Energy: 0.7149969782737321
Energy: 0.666660471801104
Energy: 0.7149969782731733
Energy: 0.7434254085721104
Energy: 0.7290541418774131
Energy: 0.7434254085726691
Energy: 0.7290541418774131
Energy: 0.7434254085737867
Energy: 0.7290541418779719

minimum gb energy = 0.612148196460482 eV
minimum distance =  2.32848336670119 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.9685155408463286
Energy: 0.90115241600508
Energy: 0.968515540847921
Energy: 0.9011524160026915
Energy: 0.9685155408463286
Energy: 0.9011524160058763
Energy: 0.893981248358539
Energy: 0.895570525100402
Energy: 0.89398124836252
Energy: 0.895570525100402
Energy: 0.8939812483665007
Energy: 0.8955705250988097
Energy: 1.0105324146053085
Energy: 0.9229851637637739
Energy: 0.9505419661440229
Energy: 0.9229851637637739
Energy: 1.010532414614863
Energy: 0.9229851637629777
Energy: 0.9396758306055812
Energy: 0.9131514214656582
Energy: 0.9396758306016002
Energy: 0.9131514214624733
Energy: 0.9396758306039888
Energy: 0.9131514214648618
Energy: 0.8167689058965463
Energy: 0.873745803280294
Energy: 0.8167689059005272
Energy: 0.8737458032810903
Energy: 0.8167689058989348
Energy: 0.8737458032818864
Energy: 0.9406152678141918
Energy: 0.9200892171632213
Energy: 0.9406152678149879
Energy: 0.9200892171632213
Energy: 0.9406152678149879
Energy: 0.9200892171648137
Energy: 0.8778487362487726
Energy: 0.8858468006967307
Energy: 0.8778487362439955
Energy: 0.8858468006991193
Energy: 0.877848736242403
Energy: 0.8858468006983229
Energy: 0.8760778602822484
Energy: 0.8603064924925334
Energy: 0.876077860280656
Energy: 0.8603064924901448
Energy: 0.876077860280656
Energy: 0.8603064924909412
Energy: 0.966431514267442
Energy: 0.9790593445707511
Energy: 0.9664315142690344
Energy: 0.9790593445675664
Energy: 0.9664315142690344
Energy: 0.9790593445675664
Energy: 0.9097092859928361
Energy: 0.8335108324470075
Energy: 0.9097092859904474
Energy: 0.8335108324486
Energy: 0.9097092859920398
Energy: 0.8335108324501925
Energy: 0.9454153171329288
Energy: 0.926542413082535
Energy: 0.9454153171345212
Energy: 0.9265424130817389
Energy: 0.9454153171353172
Energy: 0.926542413082535
Energy: 0.8831747600973313
Energy: 0.9273330662628912
Energy: 0.8831747600981275
Energy: 0.9273330662636874
Energy: 0.8831747600981275
Energy: 0.9273330662652799
Energy: 0.9093622170409156
Energy: 0.8840777089657328
Energy: 0.9093622170409156
Energy: 0.8840777089593633
Energy: 0.9093622170417117
Energy: 0.8840777089760833
Energy: 0.8973626723130503
Energy: 0.92339070349691
Energy: 0.8973626723130503
Energy: 0.9233907034977061
Energy: 0.8973626723098655
Energy: 0.9233907034985024
Energy: 0.887818397983004
Energy: 0.8865054199702721
Energy: 0.8878183979798193
Energy: 0.8865054199726606
Energy: 0.8878183979766344
Energy: 0.8865054199726606
Energy: 0.9358727728884936
Energy: 0.9000755557216134
Energy: 0.9358727728869011
Energy: 0.900075555720817
Energy: 0.9358727728853089
Energy: 0.900075555724798
Energy: 0.9294844227577139
Energy: 0.9279474813926494
Energy: 0.9294844227561214
Energy: 0.927947481391057
Energy: 0.9294844227569178
Energy: 0.927947481391057
Energy: 0.8937044287891488
Energy: 0.8723233598476093
Energy: 0.8937044287907412
Energy: 0.872323359846017
Energy: 0.8937044287891488
Energy: 0.8723233598484057
Energy: 0.9218454462347234
Energy: 0.9435001232394982
Energy: 0.9218454462363159
Energy: 0.9435001232394982
Energy: 0.9218454462371121
Energy: 0.9435001232410906
Energy: 0.8186789376149923
Energy: 0.9248907725509611
Energy: 0.8186789376078267
Energy: 0.9248907725525535
Energy: 0.8186789376126038
Energy: 0.9248907725509611
Energy: 0.9605450261610772
Energy: 0.8861096552872412
Energy: 0.9605450261984981
Energy: 0.8861096552832601
Energy: 0.960545026164262
Energy: 0.8861096552872412
Energy: 0.9500170888029351
Energy: 0.9805795177502656
Energy: 0.9500170887998228
Energy: 0.9805795177486734
Energy: 0.95001708880612
Energy: 0.9805795177478771
Energy: 0.8802412987673206
Energy: 0.924040906341638
Energy: 0.880241298768913
Energy: 0.9240409063400455
Energy: 0.8802412987673206
Energy: 0.9240409063400455

minimum gb energy = 0.8167689058965463 eV
minimum distance =  2.32901771110489 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.1036297875962662
Energy: 1.0397891007711426
Energy: 1.1036297875952559
Energy: 1.0397891007711426
Energy: 1.1036297875972763
Energy: 1.0397891007726576
Energy: 1.0317283708955103
Energy: 1.0498196095812384
Energy: 1.0317283708970255
Energy: 1.049819609579723
Energy: 1.0317283708950051
Energy: 1.0498196095817434
Energy: 1.0607419327863248
Energy: 1.044883716573327
Energy: 1.060741932787794
Energy: 1.0448837165728218
Energy: 1.060741932786784
Energy: 1.044883716573327
Energy: 1.0712561298645216
Energy: 1.061346918760613
Energy: 1.0712561298645216
Energy: 1.0613469187601081
Energy: 1.071256129866037
Energy: 1.0613469187621285
Energy: 1.0194108147649936
Energy: 1.033760230385992
Energy: 1.0194108147654986
Energy: 1.0337602303854871
Energy: 1.0194108147649936
Energy: 1.033760230384477
Energy: 1.1275670913258602
Energy: 1.0564223750583293
Energy: 1.1275670913248501
Energy: 1.0564223750583293
Energy: 1.1275670913253553
Energy: 1.0564223750573192
Energy: 1.0341113359728844
Energy: 1.004409246873641
Energy: 1.0341113359794505
Energy: 1.004409246872631
Energy: 1.034111335970864
Energy: 1.004409246873641
Energy: 1.0536428665870547
Energy: 1.0657538065855041
Energy: 1.0536428665855393
Energy: 1.0657538065834835
Energy: 1.053642866584024
Energy: 1.0657538065855041
Energy: 1.044040410526023
Energy: 1.0726557158359298
Energy: 1.044040410525013
Energy: 1.072655715836435
Energy: 1.044040410525013
Energy: 1.0726557158359298
Energy: 1.0831259795499946
Energy: 1.0520412269901775
Energy: 1.0831259795510046
Energy: 1.0520412269911876
Energy: 1.0831259795494894
Energy: 1.0520412269932082
Energy: 1.0890461600028454
Energy: 1.0437462479750501
Energy: 1.0890461599988046
Energy: 1.043746247974545
Energy: 1.0890461599982997
Energy: 1.0437462479735349
Energy: 1.015594177059044
Energy: 1.0563713012372458
Energy: 1.0155941770580337
Energy: 1.0563713012372458
Energy: 1.0155941770580337
Energy: 1.0563713012367406
Energy: 1.0814149227883492
Energy: 1.047731643658479
Energy: 1.081414922787844
Energy: 1.0477316436579738
Energy: 1.0814149227913794
Energy: 1.0477316436599942
Energy: 1.0380429756707432
Energy: 1.0564409515650635
Energy: 1.0380429756707432
Energy: 1.056440951563548
Energy: 1.0380429756722585
Energy: 1.0564409515650635
Energy: 1.0417732495989072
Energy: 1.0348394023062935
Energy: 1.0417732495958767
Energy: 1.034839402304273
Energy: 1.041773249597392
Energy: 1.0348394023057885
Energy: 1.0711993956153905
Energy: 1.0716783548425863
Energy: 1.071199395612865
Energy: 1.0716783548430913
Energy: 1.0711993956158956
Energy: 1.0716783548435964
Energy: 1.0216593088449946
Energy: 1.0428714776954324
Energy: 1.021659308842469
Energy: 1.0428714776964425
Energy: 1.0216593088394845
Energy: 1.0428714776964425
Energy: 1.0954999873695395
Energy: 1.0809581135599882
Energy: 1.0954999873720648
Energy: 1.0809581135604933
Energy: 1.095499987369034
Energy: 1.0809581135615034
Energy: 1.0377126535786136
Energy: 1.0843322752920346
Energy: 1.0377126535770982
Energy: 1.0843322752920346
Energy: 1.037712653575583
Energy: 1.0843322752920346
Energy: 1.0091228187266077
Energy: 1.0440930783089069
Energy: 1.0091228187261028
Energy: 1.0440930783078968
Energy: 1.0091228187255976
Energy: 1.0440930783078968
Energy: 1.0635007359806958
Energy: 1.0934282667748976
Energy: 1.06350073597817
Energy: 1.0934282667754027
Energy: 1.063500735981201
Energy: 1.0934282667754027
Energy: 1.014709691386854
Energy: 0.9882221945367452
Energy: 1.0147096913893794
Energy: 0.9882221945377554
Energy: 1.0147096913878642
Energy: 0.9882221945382607
Energy: 1.0619518167165016
Energy: 1.0468113263479824
Energy: 1.0619518167170068
Energy: 1.0468113263494974
Energy: 1.0619518167210475
Energy: 1.0468113263505077
Energy: 1.08532498641723
Energy: 1.0414882866433226
Energy: 1.085324986417735
Energy: 1.0414882866433226
Energy: 1.0853249864187453
Energy: 1.0414882866428172
Energy: 1.023916033253673
Energy: 1.0258223048209698
Energy: 1.0239160332556936
Energy: 1.0258223048194546
Energy: 1.0239160332561985
Energy: 1.02582230482198
Energy: 1.0941748799288236
Energy: 1.0734069005342672
Energy: 1.0941748799252882
Energy: 1.073406900533762
Energy: 1.0941748799262982
Energy: 1.073406900533257
Energy: 1.0135039964514516
Energy: 1.020506140370089
Energy: 1.0135039964565027
Energy: 1.0205061403675635
Energy: 1.0135039964534722
Energy: 1.020506140370089
Energy: 1.0656237670821498
Energy: 1.1156452308294054
Energy: 1.0656237670836652
Energy: 1.115645230831426
Energy: 1.06562376708316
Energy: 1.1156452308289002
Energy: 1.0284247264306832
Energy: 1.036157056362236
Energy: 1.0284247264337136
Energy: 1.036157056362236
Energy: 1.0284247264316932
Energy: 1.036157056363246
Energy: 1.0013873426191235
Energy: 0.9676793437444833
Energy: 1.0013873426186184
Energy: 0.967679343742968
Energy: 1.0013873426181132
Energy: 0.9676793437449884
Energy: 1.0926824820480672
Energy: 1.1134323907200743
Energy: 1.0926824820490773
Energy: 1.1134323907205794
Energy: 1.0926824820450367
Energy: 1.1134323907195691
Energy: 1.0006267930248376
Energy: 1.0435773865826241
Energy: 1.000626793023827
Energy: 1.0435773865831293
Energy: 1.0006267930258477
Energy: 1.0435773865826241
Energy: 1.0694783530630338
Energy: 1.102664138706221
Energy: 1.0694783530620238
Energy: 1.1026641387072311
Energy: 1.0694783530625287
Energy: 1.102664138705211
Energy: 1.067808237946235
Energy: 1.0374223450185351
Energy: 1.0678082379472453
Energy: 1.0374223450215658
Energy: 1.0678082379477505
Energy: 1.0374223450200504
Energy: 1.0190975227956498
Energy: 1.044685576843274
Energy: 1.0190975227971653
Energy: 1.0446855768417587
Energy: 1.0190975227981756
Energy: 1.0446855768422638
Energy: 1.0935882516695634
Energy: 1.0484089796642009
Energy: 1.0935882516685531
Energy: 1.048408979663696
Energy: 1.0935882516695634
Energy: 1.0484089796626859
Energy: 1.0325668944871236
Energy: 1.0372400839372373
Energy: 1.0325668944876285
Energy: 1.0372400839387528
Energy: 1.0325668944861133
Energy: 1.0372400839387528

minimum gb energy = 0.967679343742968 eV
minimum distance =  2.3115886194428 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.2690278811228424
Energy: 1.2497635240976335
Energy: 1.2690278811269793
Energy: 1.2497635241031497
Energy: 1.269027881121463
Energy: 1.2497635240976335
Energy: 1.2122693226532442
Energy: 1.228264398844184
Energy: 1.2122693226573813
Energy: 1.2282643988469417
Energy: 1.2122693226532442
Energy: 1.2282643988469417
Energy: 1.361512781471447
Energy: 1.2228465816692764
Energy: 1.4094593668291724
Energy: 1.2228465816692764
Energy: 1.3257604068086164
Energy: 1.2228465816678975
Energy: 1.2571912439478545
Energy: 1.2927582200503864
Energy: 1.2571912439450963
Energy: 1.292758220046312
Energy: 1.2571912439464756
Energy: 1.2927582200490702
Energy: 1.209495390252912
Energy: 1.264201545095375
Energy: 1.209495390250154
Energy: 1.2642015450981332
Energy: 1.209495390248775
Energy: 1.264201545095375
Energy: 1.3508116531923238
Energy: 1.3178416082229176
Energy: 1.3508116531937029
Energy: 1.3178416082229176
Energy: 1.3508116531923238
Energy: 1.3178416082229176
Energy: 1.2575758146151859
Energy: 1.1844215177341342
Energy: 1.257575814616565
Energy: 1.184421517735513
Energy: 1.2575758146138067
Energy: 1.1844215177341342
Energy: 1.2750956713340948
Energy: 1.2292373609133116
Energy: 1.2750956713340948
Energy: 1.229237360914691
Energy: 1.2750956713327157
Energy: 1.229237360914691
Energy: 1.2140258606788525
Energy: 1.210055892524023
Energy: 1.2140258606788525
Energy: 1.210055892525402
Energy: 1.2140258606760945
Energy: 1.210055892525402
Energy: 1.2557962368098423
Energy: 1.233427608984265
Energy: 1.2557962368098423
Energy: 1.2334276089870233
Energy: 1.2557962368112217
Energy: 1.2334276089884022
Energy: 1.2086005638958233
Energy: 1.2235459820300658
Energy: 1.2086005638944446
Energy: 1.2235459820300658
Energy: 1.2086005638958233
Energy: 1.2235459820300658
Energy: 1.2599673573112657
Energy: 1.2280161816019861
Energy: 1.2599673573098864
Energy: 1.2280161816006072
Energy: 1.2599673573112657
Energy: 1.228016181599228
Energy: 1.2785237752370713
Energy: 1.292684540738476
Energy: 1.2785237752356924
Energy: 1.292684540739855
Energy: 1.2785237752370713
Energy: 1.292684540737097
Energy: 1.2113176069868068
Energy: 1.2300485186087469
Energy: 1.2113176069881857
Energy: 1.2300485186059888
Energy: 1.2113176069868068
Energy: 1.230048518607368

minimum gb energy = 1.1844215177341342 eV
minimum distance =  2.29423503908308 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.4605418299386885
Energy: 1.4692863772866067
Energy: 1.4605418299405057
Energy: 1.4692863772890026
Energy: 1.4605418299386885
Energy: 1.4692863772872127
Energy: 1.353651972392011
Energy: 1.3960366561426576
Energy: 1.3536519723950402
Energy: 1.3960366561414457
Energy: 1.3536519723926168
Energy: 1.3960366561414457
Energy: 1.4596516301629479
Energy: 1.413439947246805
Energy: 1.4964416251774613
Energy: 1.4134399472461994
Energy: 1.4964416251792787
Energy: 1.4134399472474108
Energy: 1.4169172310485842
Energy: 1.3685892672913604
Energy: 1.4169172310479783
Energy: 1.3685892672931779
Energy: 1.4169172310479783
Energy: 1.3685892672913604
Energy: 1.4375616846241182
Energy: 1.3790547967636777
Energy: 1.437561684621695
Energy: 1.3790547967654951
Energy: 1.4375616846204835
Energy: 1.3790547967648894
Energy: 1.4008396015779656
Energy: 1.4517977686975425
Energy: 1.4008396015779656
Energy: 1.4517977686987542
Energy: 1.400839601579177
Energy: 1.4517977686969368
Energy: 1.4043897600685975
Energy: 1.400099790968348
Energy: 1.4043897600655684
Energy: 1.4000997909689261
Energy: 1.4043897600692032
Energy: 1.400099790969532
Energy: 1.4071249516915214
Energy: 1.3952925424385805
Energy: 1.4071249516903097
Energy: 1.3952925424391864
Energy: 1.4071249516903097
Energy: 1.3952925424391864
Energy: 1.4264526056260105
Energy: 1.3917164334069223
Energy: 1.426452605627828
Energy: 1.3917164334057108
Energy: 1.426452605627828
Energy: 1.391716433405105
Energy: 1.3971564264703318
Energy: 1.4355513906270152
Energy: 1.3971564264679082
Energy: 1.4355513906258035
Energy: 1.3971564264685141
Energy: 1.4355513906270152
Energy: 1.3755528950634595
Energy: 1.403236298175643
Energy: 1.3755528950628537
Energy: 1.403236298175643
Energy: 1.3755528950634595
Energy: 1.403236298175643
Energy: 1.4081108914064977
Energy: 1.4255112964175929
Energy: 1.4081108914064977
Energy: 1.425511296416987
Energy: 1.4081108914083154
Energy: 1.4255112964157752
Energy: 1.4151217418337003
Energy: 1.3920046887335327
Energy: 1.4151217418385464
Energy: 1.3920046887347441
Energy: 1.4151217418343058
Energy: 1.39200468873535
Energy: 1.4221443117643247
Energy: 1.4165089628861967
Energy: 1.422144311760084
Energy: 1.4165089628868024
Energy: 1.422144311766142
Energy: 1.416508962885591
Energy: 1.395179430516574
Energy: 1.4071971765356663
Energy: 1.395179430516574
Energy: 1.4071971765326374
Energy: 1.3951794305171796
Energy: 1.4071971765332434
Energy: 1.4051559384061523
Energy: 1.3995099032640297
Energy: 1.405155938406758
Energy: 1.3995099032646356
Energy: 1.405155938406758
Energy: 1.3995099032591831
Energy: 1.3757734854838777
Energy: 1.4050569798210573
Energy: 1.3757734854838777
Energy: 1.4050569798210573
Energy: 1.3757734854863009
Energy: 1.405056979821663
Energy: 1.4565991125071363
Energy: 1.4577453198047352
Energy: 1.4565991125071363
Energy: 1.4577453198047352
Energy: 1.4565991125065305
Energy: 1.4577453198041292
Energy: 1.3850938076273807
Energy: 1.3363049808787584
Energy: 1.3850938076285646
Energy: 1.3363049808805758
Energy: 1.3850938076297763
Energy: 1.3363049808781524
Energy: 1.4030645037570804
Energy: 1.397462791609563
Energy: 1.403064503755263
Energy: 1.397462791609563
Energy: 1.4030645037534455
Energy: 1.397462791609563
Energy: 1.3718847293016025
Energy: 1.3871999242948652
Energy: 1.3718847293028142
Energy: 1.3871999242948652
Energy: 1.3718847293016025
Energy: 1.387199924296049
Energy: 1.4615209401416775
Energy: 1.4549548306509843
Energy: 1.4615209401404659
Energy: 1.4549548306491669
Energy: 1.46152094013986
Energy: 1.4549548306503783
Energy: 1.4160949650214223
Energy: 1.4133139584731829
Energy: 1.4160949650232397
Energy: 1.4133139584737886
Energy: 1.416094965022028
Energy: 1.413313958472577
Energy: 1.4580751205975429
Energy: 1.416218620202674
Energy: 1.4580751205993603
Energy: 1.4162186202032798
Energy: 1.4580751205981488
Energy: 1.416218620200251
Energy: 1.398268562760014
Energy: 1.4201909024922679
Energy: 1.3982685627606197
Energy: 1.420190902491662
Energy: 1.398268562759408
Energy: 1.4201909024910562
Energy: 1.391644748674673
Energy: 1.4069345971569074
Energy: 1.391644748674067
Energy: 1.4069345971587246
Energy: 1.3916447486758847
Energy: 1.406934597157513
Energy: 1.3808276718788761
Energy: 1.466484909201125
Energy: 1.380827671879482
Energy: 1.4664849091999135
Energy: 1.3808276718776646
Energy: 1.4664849092005192
Energy: 1.4258188585013356
Energy: 1.3968611095187526
Energy: 1.4258188585001241
Energy: 1.3968611095199641
Energy: 1.4258188584989124
Energy: 1.3968611095199641
Energy: 1.4238535991706947
Energy: 1.4181607112858878
Energy: 1.4238535991706947
Energy: 1.4181607112858878
Energy: 1.4238535991706947
Energy: 1.4181607112858878
Energy: 1.3972369969892986
Energy: 1.3453169823818159
Energy: 1.3972369969892986
Energy: 1.345316982376969
Energy: 1.3972369969899041
Energy: 1.345316982376969
Energy: 1.3995936037221381
Energy: 1.4610454555796135
Energy: 1.399593603724561
Energy: 1.461045455580219
Energy: 1.3995936037215322
Energy: 1.4610454555796135

minimum gb energy = 1.3363049808781524 eV
minimum distance =  2.26590085912332 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.3801304941890016
Energy: 1.3824784081488208
Energy: 1.3801304941879236
Energy: 1.3824784081488208
Energy: 1.3801304941900798
Energy: 1.3824784081477426
Energy: 1.4416573600923877
Energy: 1.6036870196340165
Energy: 1.4416573600923877
Energy: 1.6036870196329387
Energy: 1.4416573600923877
Energy: 1.6036870196318604
Energy: 1.4411130038715527
Energy: 1.4316363504670748
Energy: 1.4411130038855673
Energy: 1.431636350468153
Energy: 1.4411130038823332
Energy: 1.4316363504670748
Energy: 1.3878122095356118
Energy: 1.829063273009934
Energy: 1.3878122095366896
Energy: 1.6243795090040811
Energy: 1.3878122095345335
Energy: 1.482958111507712
Energy: 1.4491391784226153
Energy: 1.4317031643732152
Energy: 1.4491391784377081
Energy: 1.4317031643742932
Energy: 1.4491391784312397
Energy: 1.4317031643732152
Energy: 1.442053532888429
Energy: 1.6021312554991147
Energy: 1.4420535328895068
Energy: 1.4937503482773105
Energy: 1.4420535328862727
Energy: 1.4937503482762324
Energy: 1.3801304941857675
Energy: 1.3824784081477426
Energy: 1.3801304941857675
Energy: 1.3824784081488208
Energy: 1.3801304941868455
Energy: 1.3824784081466648
Energy: 1.4416573600902314
Energy: 1.6036870196329387
Energy: 1.4416573600913094
Energy: 1.6036870196329387
Energy: 1.4416573600913094
Energy: 1.6036870196350947
Energy: 1.4411130038844893
Energy: 1.4316363504703091
Energy: 1.4411130038812552
Energy: 1.4316363504692309
Energy: 1.441113003875865
Energy: 1.4316363504703091
Energy: 1.3878122095356118
Energy: 1.6243795090094713
Energy: 1.3878122095388459
Energy: 1.6243795090094713
Energy: 1.3878122095366896
Energy: 1.482958111509868
Energy: 1.4491391784333958
Energy: 1.431703164372137
Energy: 1.4491391784183032
Energy: 1.4317031643710592
Energy: 1.449139178412913
Energy: 1.431703164372137
Energy: 1.4420535328916628
Energy: 1.6021312555012708
Energy: 1.4420535328948971
Energy: 1.6021312555023488
Energy: 1.4420535328916628
Energy: 1.6021312555001928
Energy: 1.3801304941900798
Energy: 1.3824784081477426
Energy: 1.3801304941900798
Energy: 1.3824784081488208
Energy: 1.3801304941900798
Energy: 1.3824784081488208
Energy: 1.4416573600923877
Energy: 1.6036870196329387
Energy: 1.4416573600934652
Energy: 1.6036870196329387
Energy: 1.4416573600923877
Energy: 1.6036870196318604
Energy: 1.4411130038801772
Energy: 1.431636350468153
Energy: 1.4411130038877233
Energy: 1.431636350468153
Energy: 1.441113003875865
Energy: 1.431636350468153
Energy: 1.3878122095345335
Energy: 1.4829581115066337
Energy: 1.3878122095356118
Energy: 1.4829581115066337
Energy: 1.3878122095366896
Energy: 1.482958111507712
Energy: 1.4491391784215373
Energy: 1.4317031643742932
Energy: 1.449139178438786
Energy: 1.4317031643742932
Energy: 1.4491391784215373
Energy: 1.4317031643742932

minimum gb energy = 1.3801304941857675 eV
minimum distance =  2.29069837887398 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.5120227328443931
Energy: 1.4307483871031441
Energy: 1.5120227328461535
Energy: 1.430748387106665
Energy: 1.5120227328452733
Energy: 1.4307483871084257
Energy: 1.4764290396003803
Energy: 1.4272254185628512
Energy: 1.4764290396021404
Energy: 1.4272254185654918
Energy: 1.4764290395995
Energy: 1.4272254185637314
Energy: 1.5195555105029679
Energy: 1.4663907816615742
Energy: 1.5195555105056084
Energy: 1.466390781659814
Energy: 1.4740647565245555
Energy: 1.4663907816624546
Energy: 1.4361586354434384
Energy: 1.5521300834816125
Energy: 1.4361586354425584
Energy: 1.5521300834816125
Energy: 1.4361586354434384
Energy: 1.5521300834842533
Energy: 1.477765011266868
Energy: 1.473588446212303
Energy: 1.4777650112695087
Energy: 1.4735884462131832
Energy: 1.4777650112677483
Energy: 1.4735884462105424
Energy: 1.4791207201826102
Energy: 1.476138958506043
Energy: 1.4791207201834904
Energy: 1.4761389585069231
Energy: 1.4791207201799697
Energy: 1.4761389585078033
Energy: 1.4577133014094086
Energy: 1.4824736642340324
Energy: 1.4577133014085282
Energy: 1.482473664235793
Energy: 1.4577133014102885
Energy: 1.4824736642340324
Energy: 1.4496054001207743
Energy: 1.5078504081030204
Energy: 1.4496054001207743
Energy: 1.50785040810214
Energy: 1.4496054001198941
Energy: 1.5078504081039006
Energy: 1.5730382337527404
Energy: 1.4899367023507297
Energy: 1.5730382337492197
Energy: 1.4899367023516101
Energy: 1.5730382337518602
Energy: 1.4899367023498495
Energy: 1.4581722859317232
Energy: 1.453498593476811
Energy: 1.4581722859317232
Energy: 1.4534985934803317
Energy: 1.4581722859317232
Energy: 1.4534985934847329
Energy: 1.4333162532783303
Energy: 1.4736317570278659
Energy: 1.4333162532730492
Energy: 1.4736317570296265
Energy: 1.4333162532774504
Energy: 1.4736317570296265
Energy: 1.5400333523872118
Energy: 1.4783527002788808
Energy: 1.540033352394254
Energy: 1.4783527002762402
Energy: 1.5400333523872118
Energy: 1.4783527002762402
Energy: 1.4463308265259112
Energy: 1.5136526522408218
Energy: 1.4463308265259112
Energy: 1.5136526522408218
Energy: 1.4463308265267913
Energy: 1.5136526522381812
Energy: 1.4498405140957866
Energy: 1.4552772222496977
Energy: 1.4498405140913855
Energy: 1.4552772222488175
Energy: 1.4498405140913855
Energy: 1.455277222247057
Energy: 1.5176678044382654
Energy: 1.458663490212553
Energy: 1.5176678044417862
Energy: 1.4586634902099125
Energy: 1.5176678044356247
Energy: 1.458663490208152
Energy: 1.519000999898255
Energy: 1.47212408747743
Energy: 1.5190009998964946
Energy: 1.4721240874800705
Energy: 1.5190009998964946
Energy: 1.4721240874800705
Energy: 1.4889832965767373
Energy: 1.4724961141195683
Energy: 1.4889832965767373
Energy: 1.4724961141169273
Energy: 1.4889832965784975
Energy: 1.4724961141204485
Energy: 1.6195747441525876
Energy: 1.4550801950530812
Energy: 1.6195747441561081
Energy: 1.4550801950566024
Energy: 1.6195747441525876
Energy: 1.4550801950548418
Energy: 1.4479756628503342
Energy: 1.460676418480624
Energy: 1.4479756628529747
Energy: 1.4606764184823844
Energy: 1.447975662853855
Energy: 1.4606764184797438
Energy: 1.4584351756116307
Energy: 1.4290998125332246
Energy: 1.4584351756125111
Energy: 1.4290998125323442
Energy: 1.4584351756142715
Energy: 1.4290998125349847
Energy: 1.5443468057255674
Energy: 1.47809320083362
Energy: 1.5443468057246872
Energy: 1.4780932008353804
Energy: 1.5443468057246872
Energy: 1.478093200837141

minimum gb energy = 1.4272254185628512 eV
minimum distance =  2.26744421571097 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.4849640221191063
Energy: 1.4080057222757802
Energy: 1.4849640221191063
Energy: 1.4080057222772642
Energy: 1.484964022119848
Energy: 1.4080057222750382
Energy: 1.4438946377110045
Energy: 1.4065642011793056
Energy: 1.4438946377117465
Energy: 1.4065642011778214
Energy: 1.4438946377110045
Energy: 1.4065642011778214
Energy: 1.4194884124757727
Energy: 1.4153137364578532
Energy: 1.4194884124728049
Energy: 1.4153137364571111
Energy: 1.4194884124713212
Energy: 1.4153137364578532
Energy: 1.4103943731516688
Energy: 1.4116326698437556
Energy: 1.4103943731509268
Energy: 1.4116326698430135
Energy: 1.410394373152411
Energy: 1.4116326698430135
Energy: 1.4094846899129718
Energy: 1.3595152642152235
Energy: 1.4094846899070699
Energy: 1.3595152642137396
Energy: 1.4094846899144557
Energy: 1.3595152642159656
Energy: 1.3491474985460805
Energy: 1.4350382709608538
Energy: 1.3491474985445966
Energy: 1.4350382709645633
Energy: 1.3491474985445966
Energy: 1.4350382709615956
Energy: 1.430011730441011
Energy: 1.4291958620618843
Energy: 1.430011730443237
Energy: 1.4291958620618843
Energy: 1.430011730441753
Energy: 1.429195862063368
Energy: 1.4595593509026328
Energy: 1.4190421785133527
Energy: 1.4595593509048586
Energy: 1.4190421785148366
Energy: 1.4595593509011486
Energy: 1.4190421785126106
Energy: 1.409300380268798
Energy: 1.4346147741456416
Energy: 1.4093003802680562
Energy: 1.4346147741486095
Energy: 1.409300380267314
Energy: 1.4346147741463837
Energy: 1.4107109531531807
Energy: 1.41374016372057
Energy: 1.4107109531554067
Energy: 1.4137401637198281
Energy: 1.4107109531554067
Energy: 1.41374016372057
Energy: 1.4108882518048718
Energy: 1.4203507268681717
Energy: 1.4108882518041297
Energy: 1.4203507268689137
Energy: 1.4108882518033878
Energy: 1.4203507268689137
Energy: 1.4270366361862188
Energy: 1.4345725733321837
Energy: 1.4270366361869606
Energy: 1.4345725733314416
Energy: 1.4270366361877027
Energy: 1.4345725733314416
Energy: 1.474591381553924
Energy: 1.4553920960221836
Energy: 1.474591381553924
Energy: 1.4553920960362807
Energy: 1.4745913815516982
Energy: 1.4553920960281193
Energy: 1.430170779312444
Energy: 1.4081466982022215
Energy: 1.4301707793102183
Energy: 1.4081466982022215
Energy: 1.430170779311702
Energy: 1.4081466982022215
Energy: 1.3516233458175233
Energy: 1.434744902406958
Energy: 1.3516233458197493
Energy: 1.4347449024047323
Energy: 1.3516233458190074
Energy: 1.4347449024054741
Energy: 1.4085464767514113
Energy: 1.359849715059495
Energy: 1.4085464767514113
Energy: 1.3598497150624629
Energy: 1.4085464767506695
Energy: 1.3598497150624629
Energy: 1.4194456725787183
Energy: 1.4224417058856362
Energy: 1.4194456725757505
Energy: 1.4224417058841523
Energy: 1.4194456725742666
Energy: 1.4224417058841523
Energy: 1.4094893201155254
Energy: 1.4162473617196587
Energy: 1.4094893201147836
Energy: 1.4162473617204008
Energy: 1.4094893201170093
Energy: 1.4162473617189169
Energy: 1.4018164307154777
Energy: 1.407694306925816
Energy: 1.4018164307154777
Energy: 1.407694306926558
Energy: 1.4018164307139938
Energy: 1.407694306926558
Energy: 1.484964022123524
Energy: 1.4080057222676183
Energy: 1.4849640221279758
Energy: 1.4080057222676183
Energy: 1.484964022126492
Energy: 1.4080057222683604
Energy: 1.4438946377087785
Energy: 1.4065642011859834
Energy: 1.4438946377080366
Energy: 1.406564201188209
Energy: 1.4438946377080366
Energy: 1.4065642011867252
Energy: 1.4194884124787408
Energy: 1.4153137364489494
Energy: 1.4194884124787408
Energy: 1.4153137364511754
Energy: 1.4194884124809666
Energy: 1.4153137364504336
Energy: 1.4103943731457333
Energy: 1.4116326698482071
Energy: 1.4103943731435074
Energy: 1.411632669849691
Energy: 1.4103943731464752
Energy: 1.411632669849691
Energy: 1.4094846899070699
Energy: 1.3595152642152235
Energy: 1.409484689906328
Energy: 1.3595152642152235
Energy: 1.409484689906328
Energy: 1.3595152642174495
Energy: 1.3491474985542422
Energy: 1.4350382709608538
Energy: 1.3491474985527583
Energy: 1.4350382709638214
Energy: 1.3491474985527583
Energy: 1.4350382709586278

minimum gb energy = 1.3491474985445966 eV
minimum distance =  2.28901074589479 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.4147456493757875
Energy: 1.4285796823124461
Energy: 1.4147456493770687
Energy: 1.4285796823124461
Energy: 1.4147456493770687
Energy: 1.4285796823111652
Energy: 1.4084416526721437
Energy: 1.3864207074007149
Energy: 1.4084416526715033
Energy: 1.3864207073994341
Energy: 1.4084416526702224
Energy: 1.3864207074000745
Energy: 1.4216641494576312
Energy: 1.3526805873484296
Energy: 1.4216641494544293
Energy: 1.3526805873509622
Energy: 1.4216641494563507
Energy: 1.352680587349681
Energy: 1.3710193363101169
Energy: 1.3989504759137332
Energy: 1.3710193363107572
Energy: 1.3989504759137332
Energy: 1.3710193363101169
Energy: 1.3989504759130926
Energy: 1.4043847772899072
Energy: 1.4187059802118602
Energy: 1.4043847772899072
Energy: 1.4187059802099389
Energy: 1.4043847772899072
Energy: 1.4187059802048445
Energy: 1.3967669922600585
Energy: 1.3789407722345308
Energy: 1.39676699226198
Energy: 1.37894077223325
Energy: 1.3967669922613395
Energy: 1.3789407722338904
Energy: 1.3509825006205618
Energy: 1.4351325592542479
Energy: 1.3509825006212022
Energy: 1.4351325592555289
Energy: 1.3509825006212022
Energy: 1.4351325592542479
Energy: 1.385957639240949
Energy: 1.442465650092847
Energy: 1.3859576392390276
Energy: 1.4424656500922064
Energy: 1.3859576392403083
Energy: 1.4424656500922064
Energy: 1.489758097849642
Energy: 1.3512147541999506
Energy: 1.4897580978502825
Energy: 1.35121475419931
Energy: 1.4897580978522036
Energy: 1.35121475419931
Energy: 1.4200477582238784
Energy: 1.3980217537380455
Energy: 1.4200477582251592
Energy: 1.3980217537393262
Energy: 1.4200477582245188
Energy: 1.3980217537380455
Energy: 1.3610387940158866
Energy: 1.4416767184254309
Energy: 1.3610387940158866
Energy: 1.4416767184241501
Energy: 1.3610387940158866
Energy: 1.4416767184247907
Energy: 1.418314477291599
Energy: 1.3515005275419234
Energy: 1.4183144772877563
Energy: 1.3515005275387213
Energy: 1.4183144772903182
Energy: 1.3515005275419234
Energy: 1.400769993434914
Energy: 1.3921074743931403
Energy: 1.4007699934342737
Energy: 1.3921074743931403
Energy: 1.4007699934329927
Energy: 1.3921074743937805
Energy: 1.3733530027221392
Energy: 1.398485307434037
Energy: 1.3733530027221392
Energy: 1.3984853074346775
Energy: 1.3733530027227798
Energy: 1.3984853074353178
Energy: 1.430793756099814
Energy: 1.3585943775093092
Energy: 1.430793756101095
Energy: 1.35859437751059
Energy: 1.4307937561055781
Energy: 1.3585943775093092
Energy: 1.4259144677548197
Energy: 1.3517848216846466
Energy: 1.4259144677548197
Energy: 1.3517848216833654
Energy: 1.4259144677528983
Energy: 1.3517848216846466
Energy: 1.3700698588904456
Energy: 1.4117688216125728
Energy: 1.3700698588898053
Energy: 1.4117688216119324
Energy: 1.3700698588891647
Energy: 1.4117688216125728
Energy: 1.4226393990809594
Energy: 1.4208950249639003
Energy: 1.4226393990809594
Energy: 1.4208950249645407
Energy: 1.4226393990809594
Energy: 1.4208950249645407
Energy: 1.3994925235165208
Energy: 1.375561568520104
Energy: 1.3994925235158802
Energy: 1.375561568520104
Energy: 1.3994925235152396
Energy: 1.375561568521385
Energy: 1.373616187784165
Energy: 1.4195136393899026
Energy: 1.3736161877848054
Energy: 1.4195136393899026
Energy: 1.3736161877835245
Energy: 1.419513639389262
Energy: 1.3567174984536097
Energy: 1.441812789343213
Energy: 1.3567174984561714
Energy: 1.4418127893438246
Energy: 1.3567174984542503
Energy: 1.4418127893444652
Energy: 1.4586985539941646
Energy: 1.3649738781121652
Energy: 1.45869855398776
Energy: 1.3649738781115246
Energy: 1.4586985539916026
Energy: 1.3649738781115246
Energy: 1.4142415863708282
Energy: 1.4044801598187406
Energy: 1.414241586372109
Energy: 1.4044801598187406
Energy: 1.4142415863714686
Energy: 1.4044801598187406
Energy: 1.4124315528032647
Energy: 1.4353214712923223
Energy: 1.412431552804546
Energy: 1.4353214712884796
Energy: 1.4124315528026243
Energy: 1.4353214712923223
Energy: 1.4063793078229838
Energy: 1.36550424217501
Energy: 1.4063793078223434
Energy: 1.3655042421756507
Energy: 1.4063793078229838
Energy: 1.3655042421743697
Energy: 1.4154736009699462
Energy: 1.3778401867787622
Energy: 1.4154736009718674
Energy: 1.3778401867794026
Energy: 1.415473600972508
Energy: 1.3778401867640608
Energy: 1.3637356008405417
Energy: 1.4093129742880772
Energy: 1.3637356008411823
Energy: 1.4093129742880772
Energy: 1.363735600839901
Energy: 1.4093129742893582
Energy: 1.4379288767920262
Energy: 1.382276967351806
Energy: 1.4379288767933072
Energy: 1.3822769673498847
Energy: 1.4379288767920262
Energy: 1.3822769673505253
Energy: 1.4094000497859374
Energy: 1.3817424175880966
Energy: 1.409400049785297
Energy: 1.3817424175874562
Energy: 1.409400049785297
Energy: 1.3817424175880966

minimum gb energy = 1.3509825006205618 eV
minimum distance =  2.26164278612978 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.3315565220712309
Energy: 1.4012496356973123
Energy: 1.331556522073483
Energy: 1.4012496356956234
Energy: 1.3315565220723569
Energy: 1.4012496356950606
Energy: 1.40189780818632
Energy: 1.322974583397216
Energy: 1.401897808186883
Energy: 1.3229745833955269
Energy: 1.401897808184068
Energy: 1.322974583394964
Energy: 1.3710166481754171
Energy: 1.2887797623774893
Energy: 1.371016648176543
Energy: 1.288779762378615
Energy: 1.37101664817598
Energy: 1.2887797623780521
Energy: 1.281993075283109
Energy: 1.3874507862265146
Energy: 1.2819930752825461
Energy: 1.4212344014090836
Energy: 1.2819930752825461
Energy: 1.3749049529262
Energy: 1.3365294840567001
Energy: 1.365876056665807
Energy: 1.336529484055574
Energy: 1.365876056664118
Energy: 1.3365294840567001
Energy: 1.365876056662429
Energy: 1.3595434058140217
Energy: 1.2877957563164262
Energy: 1.3595434058112064
Energy: 1.2877957563164262
Energy: 1.3595434058123326
Energy: 1.2877957563175522
Energy: 1.3213777225146748
Energy: 1.3832187574306263
Energy: 1.3213777225152377
Energy: 1.3832187574272485
Energy: 1.3213777225146748
Energy: 1.3832187574306263
Energy: 1.2780253187715944
Energy: 1.3824855392386861
Energy: 1.2780253187710313
Energy: 1.5068360438834825
Energy: 1.2780253187699053
Energy: 1.3800354595721946
Energy: 1.3611508726943367
Energy: 1.2891603628852804
Energy: 1.3611508726887067
Energy: 1.2891603628841544
Energy: 1.3611508726982267
Energy: 1.2891603628864063
Energy: 1.3376346935690768
Energy: 1.3503272482763111
Energy: 1.337634693570766
Energy: 1.3766826163886212
Energy: 1.3376346935702028
Energy: 1.372325296782384
Energy: 1.2741904246032332
Energy: 1.5279676863576683
Energy: 1.2741904246037963
Energy: 1.5279676863559792
Energy: 1.2741904246077371
Energy: 1.5279676863559792
Energy: 1.4274469695017769
Energy: 1.3449002981378089
Energy: 1.427446969508533
Energy: 1.322169875146825
Energy: 1.427446969505155
Energy: 1.322169875145699
Energy: 1.3577235563099102
Energy: 1.2874280626857018
Energy: 1.357723556308221
Energy: 1.2874280626868275
Energy: 1.3577235563087842
Energy: 1.2874280626879535
Energy: 1.3377040375507476
Energy: 1.444974582746925
Energy: 1.3377040375518736
Energy: 1.4449745827497398
Energy: 1.3377040375518736
Energy: 1.40584071492492
Energy: 1.4024226453675304
Energy: 1.3314737200967315
Energy: 1.4024226453658413
Energy: 1.3314737200944795
Energy: 1.4024226453664044
Energy: 1.3314737200944795
Energy: 1.3711139208082492
Energy: 1.28690403429591
Energy: 1.3711139208099385
Energy: 1.2869040342947842
Energy: 1.3711139208071232
Energy: 1.2869040342942213
Energy: 1.2715055500272798
Energy: 1.3995982420111956
Energy: 1.2715055500278427
Energy: 1.3995982420100697
Energy: 1.271505550026154
Energy: 1.3995982420111956
Energy: 1.2695163228698099
Energy: 1.3654366488816296
Energy: 1.2695163228748767
Energy: 1.3654366488816296
Energy: 1.2695163228737507
Energy: 1.3654366488855707
Energy: 1.358575675761794
Energy: 1.2890520795950753
Energy: 1.3585756757572898
Energy: 1.2890520795967642
Energy: 1.358575675755038
Energy: 1.2890520795950753
Energy: 1.2999931542936878
Energy: 1.3877004990381294
Energy: 1.2999931542948138
Energy: 1.3877004990386923
Energy: 1.2999931542948138
Energy: 1.3877004990386923
Energy: 1.2745665852204444
Energy: 1.5211948455699214
Energy: 1.2745665852170665
Energy: 1.5211948455682325
Energy: 1.2745665852187555
Energy: 1.5211948455648545
Energy: 1.4133940153161888
Energy: 1.2821890913194334
Energy: 1.4133940153173148
Energy: 1.2821890913216851
Energy: 1.4133940153139366
Energy: 1.2821890913222482
Energy: 1.4130135934214612
Energy: 1.282346741854513
Energy: 1.4130135934214612
Energy: 1.28234674185395
Energy: 1.41301359342315
Energy: 1.2823467418550247
Energy: 1.2821003713444339
Energy: 1.4032448325863756
Energy: 1.282100371342745
Energy: 1.4032448325565883
Energy: 1.2821003713421821
Energy: 1.4032448325323796
Energy: 1.4194849612377156
Energy: 1.3325462915927373
Energy: 1.4194849612365896
Energy: 1.3325462915921742
Energy: 1.419484961238279
Energy: 1.3325462915921742
Energy: 1.361263301500656
Energy: 1.2876847761940444
Energy: 1.3612633015017819
Energy: 1.2876847761934815
Energy: 1.3612633015017819
Energy: 1.2876847761946075
Energy: 1.331288434396402
Energy: 1.3890371187321051
Energy: 1.3312884343969649
Energy: 1.389037118733231
Energy: 1.331288434399217
Energy: 1.389037118733231
Energy: 1.3316166858148166
Energy: 1.3683806204281472
Energy: 1.3316166858153797
Energy: 1.3683806204242064
Energy: 1.3316166858114389
Energy: 1.3683806204225175
Energy: 1.4042116647843768
Energy: 1.3031868389022492
Energy: 1.4042116647843768
Energy: 1.3031868389039378
Energy: 1.4042116647871916
Energy: 1.3031868389039378
Energy: 1.2696750633335125
Energy: 1.3995423329632435
Energy: 1.2696750633346385
Energy: 1.3995423329632435
Energy: 1.2696750633368903
Energy: 1.3995423329638064
Energy: 1.2718799641562404
Energy: 1.362564248807209
Energy: 1.2718799641568033
Energy: 1.362564248806646
Energy: 1.2718799641596186
Energy: 1.3625642488060832
Energy: 1.4128722405219232
Energy: 1.2821215031019133
Energy: 1.412872240522486
Energy: 1.2821215031024766
Energy: 1.412872240523049
Energy: 1.2821215031019133
Energy: 1.4095613068030166
Energy: 1.3183211332752534
Energy: 1.4095613068035795
Energy: 1.3183211332769422
Energy: 1.4095613068013275
Energy: 1.3183211332763791

minimum gb energy = 1.2695163228698099 eV
minimum distance =  2.27845967927874 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020539386092367294
Energy: 0.9983462110964062
Energy: 0.020539386092367294
Energy: 0.9983462110954707
Energy: 0.020539386092367294
Energy: 0.998346211096874
Energy: 0.021483649841167178
Energy: 0.37610800904691144
Energy: 0.021483649842050742
Energy: 0.37610800904509234
Energy: 0.021483649842050742
Energy: 0.37610800904509234
Energy: 2.3122949163732462
Energy: 0.3757565550699012
Energy: 2.312294916370024
Energy: 0.3757565517617697
Energy: 0.9993521802309568
Energy: 0.3757565517434746
Energy: 0.02148364984574094
Energy: 0.37610800904462455
Energy: 0.02148364984574094
Energy: 0.37610800904415675
Energy: 0.021483649846156735
Energy: 0.37610800904415675

minimum gb energy = 0.020539386092367294 eV
minimum distance =  2.47830828509756 Angstroms
sigma value = 1