Model name: model_name=EAM_Dynamo_OnatDurukanoglu_2014_CuNi__MO_592013496703_005
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=3.519999995827675
cohesive_energy=4.450349977830043
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: 0.018152681327875963
Energy: 1.0862247873959827
Energy: 0.018152681328206726
Energy: 1.0862247873959827
Energy: 0.01815268132758195
Energy: 1.0862247873953212
Energy: 1.086224787396277
Energy: 0.5625257589118536
Energy: 1.0862247873959827
Energy: 1.23124599495956
Energy: 1.0862247873969384
Energy: 1.2049777637053563
Energy: 0.018152681327875963
Energy: 1.0862247873966075
Energy: 0.018152681328868256
Energy: 1.0862247873953212
Energy: 0.018152681327875963
Energy: 1.0862247873949904
Energy: 1.086224787395652
Energy: 1.2312459949588987
Energy: 1.086224787396277
Energy: 1.2883231621150415
Energy: 1.086224787395652
Energy: 1.2049777637001744
Energy: 0.01815268132758195
Energy: 1.0862247873969384
Energy: 0.01815268132853749
Energy: 1.086224787395652
Energy: 0.018152681327875963
Energy: 1.0862247873949904
Energy: 1.0862247873959827
Energy: 1.2049777636950292
Energy: 1.086224787395652
Energy: 1.2049777637296124
Energy: 1.086224787395652
Energy: 1.2049777636927503

minimum gb energy = 0.01815268132758195 eV
minimum distance =  2.28468971025703 Angstroms
sigma value = 1


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

Energy: 1.2767548665452497
Energy: 1.2286743594897425
Energy: 1.2767548665444537
Energy: 1.2286743594937233
Energy: 1.276754866546842
Energy: 1.228674359491335
Energy: 1.2547030838006414
Energy: 1.1525936179556064
Energy: 1.2547030837306492
Energy: 1.1525936179556064
Energy: 1.2547030837306492
Energy: 1.152593617957199
Energy: 1.244739710276141
Energy: 1.280364374911591
Energy: 1.2447397102801219
Energy: 1.2803643749147755
Energy: 1.2447397102777331
Energy: 1.2803643749099984
Energy: 1.368074108938628
Energy: 1.203447137959344
Energy: 1.3680741089290736
Energy: 1.2034471379609364
Energy: 1.368074108943405
Energy: 1.2034471379577516
Energy: 1.2210188043991024
Energy: 1.2883601913801368
Energy: 1.2210188044094528
Energy: 1.2883601913737672
Energy: 1.2210188044086565
Energy: 1.2883601913666014
Energy: 1.2784815537900975
Energy: 1.166689476553953
Energy: 1.2784815537869127
Energy: 1.1666894765555456
Energy: 1.278481553788505
Energy: 1.1666894765507683
Energy: 1.195464635002395
Energy: 1.2499534942310757
Energy: 1.1954646349984142
Energy: 1.2499534942247064
Energy: 1.1954646350000064
Energy: 1.2499534942270947
Energy: 1.1984809124871452
Energy: 1.3501606609555716
Energy: 1.1984809124895337
Energy: 1.3501606609468135
Energy: 1.1984809124895337
Energy: 1.3501606609619412
Energy: 1.3133122217389694
Energy: 1.2600065411037809
Energy: 1.3133122217349886
Energy: 1.2600065411021883
Energy: 1.3133122217381732
Energy: 1.2600065411037809
Energy: 1.1388954983998474
Energy: 1.3311157795724362
Energy: 1.1388954983966626
Energy: 1.3311157795748247
Energy: 1.1388954983990514
Energy: 1.331115779583583
Energy: 1.2769008893264608
Energy: 1.1666832889945022
Energy: 1.2769008893272569
Energy: 1.1666832889960945
Energy: 1.2769008893296456
Energy: 1.1666832889937062
Energy: 1.1351414024746787
Energy: 1.2130730704011403
Energy: 1.1351414024730861
Energy: 1.2130730703939745
Energy: 1.1351414024730861
Energy: 1.2130730704114907
Energy: 1.3966262535600866
Energy: 1.120160793135703
Energy: 1.396626253561679
Energy: 1.120160793135703
Energy: 1.3966262535608827
Energy: 1.120160793135703
Energy: 1.1880199601865755
Energy: 1.21700523701856
Energy: 1.1880199601865755
Energy: 1.2170052370209485
Energy: 1.188019960188168
Energy: 1.217005237017764
Energy: 1.4196343009184598
Energy: 1.1467951189038879
Energy: 1.419634300927218
Energy: 1.1467951189062764
Energy: 1.4196343009383645
Energy: 1.146795118904684
Energy: 1.4203116743236852
Energy: 1.2899093544291333
Energy: 1.4203116743212965
Energy: 1.289909354438688
Energy: 1.420311674322889
Energy: 1.289909354431522
Energy: 1.2353930066369756
Energy: 1.2474068613412017
Energy: 1.2353930066377719
Energy: 1.2474068613404057
Energy: 1.2353930066321985
Energy: 1.2474068613396097
Energy: 1.2354160509326422
Energy: 1.2049470610074007
Energy: 1.2354160509390115
Energy: 1.2049470610105855
Energy: 1.2354160509350307
Energy: 1.2049470610137702
Energy: 1.2363893346987826
Energy: 1.2016627081618658
Energy: 1.236389334699579
Energy: 1.201662708162662
Energy: 1.236389334700375
Energy: 1.2016627081634583
Energy: 1.2934776231127936
Energy: 1.1667768557633
Energy: 1.2934776231191631
Energy: 1.1667768557633
Energy: 1.2934776231326983
Energy: 1.1667768557593188
Energy: 1.1677353139095352
Energy: 1.3625045079233964
Energy: 1.1677353139103315
Energy: 1.3625045079170268
Energy: 1.1677353139079427
Energy: 1.3625045079162306
Energy: 1.288725997559444
Energy: 1.2525037883315593
Energy: 1.28872599756024
Energy: 1.2525037883307633
Energy: 1.28872599756024
Energy: 1.2525037883323555
Energy: 1.1355834428915756
Energy: 1.3671071835853985
Energy: 1.1355834428891871
Energy: 1.367107183586195
Energy: 1.1355834428899831
Energy: 1.3671071835933606

minimum gb energy = 1.120160793135703 eV
minimum distance =  2.22619500205959 Angstroms
sigma value = 33


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

Energy: 1.458204903156761
Energy: 1.3194412625169616
Energy: 1.4098347146756207
Energy: 1.3194412625142442
Energy: 1.4582049031576667
Energy: 1.3194412625201317
Energy: 1.3839033503901088
Energy: 1.1968518641492414
Energy: 1.3839033503787872
Energy: 1.196851864146977
Energy: 1.383903350386033
Energy: 1.1968518641510528
Energy: 1.204214463126036
Energy: 1.2023353932079976
Energy: 1.204214463130112
Energy: 1.2023353932048275
Energy: 1.2042144631255831
Energy: 1.2023353931948644
Energy: 1.3548771746666362
Energy: 1.2853922280438383
Energy: 1.3548771746602961
Energy: 1.2853922280365926
Energy: 1.3548771746652777
Energy: 1.2853922280501786
Energy: 1.266856151738751
Energy: 1.261960279655011
Energy: 1.2668561517256178
Energy: 1.2619602796522935
Energy: 1.2668561517414685
Energy: 1.2619602796559164
Energy: 1.1874338239703246
Energy: 1.2033907821069514
Energy: 1.187433823965796
Energy: 1.2033907821110272
Energy: 1.1874338239734947
Energy: 1.203390782107857
Energy: 1.3225860752622367
Energy: 1.3797534372953102
Energy: 1.3225860752640481
Energy: 1.3797534372944043
Energy: 1.322586075246839
Energy: 1.3797534372898754
Energy: 1.1223500175790362
Energy: 1.4437811938363683
Energy: 1.1223500175817533
Energy: 1.443781193833651
Energy: 1.1223500175781305
Energy: 1.4437811938408969
Energy: 1.1748119796869598
Energy: 1.2044362981481558
Energy: 1.1748119796869598
Energy: 1.2044362981472498
Energy: 1.1748119796856014
Energy: 1.204436298144574
Energy: 1.174480161901332
Energy: 1.4371516571358625
Energy: 1.1744770661345496
Energy: 1.4371516571385796
Energy: 1.1744801619004261
Energy: 1.437151657168469
Energy: 1.3975902804550622
Energy: 1.1738291043956284
Energy: 1.397590280441476
Energy: 1.1738291043965343
Energy: 1.3975902804559677
Energy: 1.1738291043974398
Energy: 1.205706970074398
Energy: 1.247130835507684
Energy: 1.2057114711081656
Energy: 1.2471308355239463
Energy: 1.2057069700739451
Energy: 1.2471308355104014
Energy: 1.3530051269712138
Energy: 1.163094999907076
Energy: 1.3530082852488663
Energy: 1.163094999907982
Energy: 1.3530051269684966
Energy: 1.1630949999274554
Energy: 1.3635650958154508
Energy: 1.3507445556456843
Energy: 1.363566192970949
Energy: 1.3507445556438729
Energy: 1.363565095813639
Energy: 1.3507445556570064
Energy: 1.2986805987935488
Energy: 1.2051888011591074
Energy: 1.2986805987971717
Energy: 1.205188801157296
Energy: 1.2986805987844912
Energy: 1.2051888011672591
Energy: 1.2032339683144713
Energy: 1.2028195190459048
Energy: 1.2032339683221702
Energy: 1.2028195190477162
Energy: 1.203233968319
Energy: 1.2028195190581323
Energy: 1.3565539448036152
Energy: 1.286328049157569
Energy: 1.3565539448135784
Energy: 1.286328049157569
Energy: 1.3565539448036152
Energy: 1.2863280491525875
Energy: 1.2683941156071064
Energy: 1.2034896156437047
Energy: 1.2683941156030305
Energy: 1.2034896156446104
Energy: 1.268394115615711
Energy: 1.2034896156536679
Energy: 1.187926646786324
Energy: 1.2007410568597223
Energy: 1.1879266467790783
Energy: 1.2007410568601753
Energy: 1.187926646787683
Energy: 1.2007410568619867
Energy: 1.3542959602672435
Energy: 1.3828816992997592
Energy: 1.3544355035215419
Energy: 1.3828816993015707
Energy: 1.3542959602676965
Energy: 1.3828816992956834
Energy: 1.1477521158745014
Energy: 1.3899678349251054
Energy: 1.1477628676129095
Energy: 1.3899678349219353
Energy: 1.1477521158749544
Energy: 1.389967834936427
Energy: 1.2717950292271014
Energy: 1.2121224152511714
Energy: 1.271795029232083
Energy: 1.2121224152511714
Energy: 1.2717950292271014
Energy: 1.2121224152267163
Energy: 1.1757284945396218
Energy: 1.431470852759721
Energy: 1.174352164553227
Energy: 1.4314708527778357
Energy: 1.1757284945396218
Energy: 1.4314708527624382
Energy: 1.3982837383156161
Energy: 1.2669638948781805
Energy: 1.3982837383178806
Energy: 1.266963894880898
Energy: 1.3982837383147102
Energy: 1.2669638948908608
Energy: 1.2044334239149845
Energy: 1.1869255605619673
Energy: 1.204058668352968
Energy: 1.1869255605542686
Energy: 1.2044334239113617
Energy: 1.1869255605406828
Energy: 1.4533520719837667
Energy: 1.3166089684729212
Energy: 1.3893501896665654
Energy: 1.3166089684751856
Energy: 1.4533520719887483
Energy: 1.3166089684860132
Energy: 1.4554607566485536
Energy: 1.2828573209783902
Energy: 1.3903476896512448
Energy: 1.2828573209792957
Energy: 1.4554607566494595
Energy: 1.282857320971144
Energy: 1.2047750443887568
Energy: 1.2721029468962963
Energy: 1.2047750443905683
Energy: 1.272102946894032
Energy: 1.2047750443892096
Energy: 1.2721029468813514
Energy: 1.433955797104291
Energy: 1.1954082519357945
Energy: 1.4339557971020267
Energy: 1.1954082519385114
Energy: 1.433955797101615
Energy: 1.1954082519453046
Energy: 1.176209141712437
Energy: 1.3954450221768846
Energy: 1.1762091417119842
Energy: 1.395445022178696
Energy: 1.1762091417147014
Energy: 1.3954450221832244
Energy: 1.3248810176587915
Energy: 1.2043659268516542
Energy: 1.3248810176578856
Energy: 1.2043659268507485
Energy: 1.3248810176696602
Energy: 1.2043659268724864
Energy: 1.1613436508653516
Energy: 1.3003046910100062
Energy: 1.161343650853124
Energy: 1.300304694528149
Energy: 1.1613436508658042
Energy: 1.3003046967416962
Energy: 1.323176790753031
Energy: 1.382873425992376
Energy: 1.3231767907548424
Energy: 1.3828734259937348
Energy: 1.3231767907412564
Energy: 1.3828734260195483
Energy: 1.1926346681203777
Energy: 1.2986689873408968
Energy: 1.192634668119019
Energy: 1.2986689873386323
Energy: 1.1926346681271707
Energy: 1.2986689873264048
Energy: 1.202136839782915
Energy: 1.2037439059880521
Energy: 1.2021368397847265
Energy: 1.203743905985788
Energy: 1.202136839783368
Energy: 1.2037439059934867
Energy: 1.291532367530222
Energy: 1.3550611487653448
Energy: 1.291532367532939
Energy: 1.3550611487630804
Energy: 1.291532367532939
Energy: 1.3550611487703264
Energy: 1.203730371908698
Energy: 1.2664337909893892
Energy: 1.2037165448451632
Energy: 1.2664337909821433
Energy: 1.2037303719082453
Energy: 1.2664337909875776
Energy: 1.2032252725455015
Energy: 1.1900997280489658
Energy: 1.2030044908450777
Energy: 1.190099728040814
Energy: 1.2032252725441426
Energy: 1.1900997280254577
Energy: 1.3641665658996702
Energy: 1.3539958244864914
Energy: 1.3641680383907924
Energy: 1.3539958244873969
Energy: 1.3641665659010287
Energy: 1.3539958244887558
Energy: 1.4452551609649207
Energy: 1.15325113059563
Energy: 1.4452551609694495
Energy: 1.1532511305965356
Energy: 1.4452551609694495
Energy: 1.1532511306028757
Energy: 1.2056029342061463
Energy: 1.1709318331797154
Energy: 1.2056029342129393
Energy: 1.1709318331806213
Energy: 1.205602934206599
Energy: 1.1709318331674878

minimum gb energy = 1.1223500175781305 eV
minimum distance =  2.32005106008848 Angstroms
sigma value = 51


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

Energy: 1.264490118101847
Energy: 1.2795694868296401
Energy: 1.264490118101847
Energy: 1.2795694868275418
Energy: 1.2644901181007977
Energy: 1.2795694868296401
Energy: 1.3581593426215788
Energy: 1.2108214241504625
Energy: 1.3581593426236773
Energy: 1.2108214241504625
Energy: 1.358159342625776
Energy: 1.2108214241504625
Energy: 1.201859776231231
Energy: 1.264223132156763
Energy: 1.2018597762280834
Energy: 1.2642231321672557
Energy: 1.201859776230182
Energy: 1.26422313216096
Energy: 1.2473062439709774
Energy: 1.1453496859518526
Energy: 1.2473062439730762
Energy: 1.1453496859508034
Energy: 1.2473062439741254
Energy: 1.1453496859518526
Energy: 1.2862489542409157
Energy: 1.2189238208493645
Energy: 1.2862489542535072
Energy: 1.2189238208504136
Energy: 1.2862489542545565
Energy: 1.2189238208577586
Energy: 1.2867290423642737
Energy: 1.218605663807759
Energy: 1.2867290423569284
Energy: 1.2186056638056602
Energy: 1.2867290423590272
Energy: 1.2186056638067095
Energy: 1.2502845083600493
Energy: 1.2184507295191844
Energy: 1.2502845083663452
Energy: 1.2184507295160367
Energy: 1.2502845083663452
Energy: 1.2184507295170859
Energy: 1.1682986973570497
Energy: 1.2197384598985423
Energy: 1.1682986973570497
Energy: 1.2197384599048382
Energy: 1.1682986973560006
Energy: 1.219738459903789
Energy: 1.353928030754847
Energy: 1.140660057710501
Energy: 1.3539280307611425
Energy: 1.1406600577094517
Energy: 1.353928030748551
Energy: 1.140660057710501
Energy: 1.173998161699225
Energy: 1.3129494236966157
Energy: 1.1739981617002742
Energy: 1.3129494236934676
Energy: 1.1739981616971265
Energy: 1.3129494236903199
Energy: 1.3487092219623185
Energy: 1.1342883313723051
Energy: 1.3487092219665155
Energy: 1.1342883313723051
Energy: 1.348709221964417
Energy: 1.1342883313723051
Energy: 1.2618929178825415
Energy: 1.282566265669114
Energy: 1.2618929178856897
Energy: 1.2825662656712125
Energy: 1.2618929178825415
Energy: 1.282566265669114
Energy: 1.355043361420212
Energy: 1.2170606485120845
Energy: 1.3550433614307051
Energy: 1.2170606485120845
Energy: 1.3550433614191626
Energy: 1.2170606485110351
Energy: 1.2019812403211199
Energy: 1.1882835316459532
Energy: 1.2019812403211199
Energy: 1.1882835316417562
Energy: 1.2019812403211199
Energy: 1.1882835316511997
Energy: 1.2463929436256043
Energy: 1.260863972432993
Energy: 1.246392943628752
Energy: 1.260863972432993
Energy: 1.2463929436266534
Energy: 1.2608639724308945
Energy: 1.286134169468201
Energy: 1.2187140713477869
Energy: 1.2861341694640038
Energy: 1.2187140713467377
Energy: 1.2861341694661024
Energy: 1.2187140713477869
Energy: 1.2867583634023654
Energy: 1.3142649823688866
Energy: 1.2867583634044641
Energy: 1.3142649823625905
Energy: 1.2867583634065627
Energy: 1.3142649823688866
Energy: 1.251904030509799
Energy: 1.2242625991553466
Energy: 1.2519040305108484
Energy: 1.2242625991542972
Energy: 1.2519040305108484
Energy: 1.2242625991542972

minimum gb energy = 1.1342883313723051 eV
minimum distance =  2.22296572077805 Angstroms
sigma value = 19


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

Energy: 1.077515687706643
Energy: 1.0940882158500362
Energy: 1.077515687707888
Energy: 1.0940882158506586
Energy: 1.077515687707888
Energy: 1.0940882158531482
Energy: 1.200911654135376
Energy: 1.2808014823428568
Energy: 1.2009116541359985
Energy: 1.2808014823441016
Energy: 1.2009116541335088
Energy: 1.2808014823441016
Energy: 1.0287134381833891
Energy: 1.1344359946286966
Energy: 1.0287134381840115
Energy: 1.1344359946280742
Energy: 1.0287134381840115
Energy: 1.1344359946280742
Energy: 1.1344710911214115
Energy: 1.0287247798984445
Energy: 1.1344710911239013
Energy: 1.0287247799003116
Energy: 1.1344710911232787
Energy: 1.0287247798996892
Energy: 1.0582885433698224
Energy: 1.0751927292616694
Energy: 1.0582885433679554
Energy: 1.0751927292622916
Energy: 1.0582885433685778
Energy: 1.0751927292622916
Energy: 1.0582763665527444
Energy: 1.0752688312314735
Energy: 1.058276366552122
Energy: 1.0752688312308512
Energy: 1.0582763665533668
Energy: 1.0752688312314735
Energy: 1.1344441043669387
Energy: 1.028831452309437
Energy: 1.1344441043663165
Energy: 1.028831452308815
Energy: 1.1344441043675613
Energy: 1.028831452308815
Energy: 1.0288144914890773
Energy: 1.1345631919259223
Energy: 1.0288144914890773
Energy: 1.1345631919265446
Energy: 1.028814491488455
Energy: 1.1345631919203205
Energy: 1.2009175603786542
Energy: 1.2806328960675764
Energy: 1.2009175603860949
Energy: 1.2806328960694435
Energy: 1.2009175603910742
Energy: 1.280632896066954
Energy: 1.0775156877085101
Energy: 1.0940882158519036
Energy: 1.0775156877072656
Energy: 1.0940882158519036
Energy: 1.0775156877091325
Energy: 1.0940882158506586
Energy: 1.200911654137243
Energy: 1.2808014823422345
Energy: 1.2009116541366207
Energy: 1.2808014823446958
Energy: 1.2009116541359985
Energy: 1.2808014823446958
Energy: 1.028713438181522
Energy: 1.1344359946293192
Energy: 1.0287134381821443
Energy: 1.1344359946286966
Energy: 1.028713438181522
Energy: 1.1344359946274518
Energy: 1.1344710911214115
Energy: 1.0287247798984445
Energy: 1.1344710911232787
Energy: 1.0287247798996892
Energy: 1.1344710911226565
Energy: 1.0287247798996892
Energy: 1.0582885433698224
Energy: 1.0751927292660262
Energy: 1.0582885433685778
Energy: 1.0751927292654038
Energy: 1.0582885433679554
Energy: 1.0751927292647814
Energy: 1.0582763665533668
Energy: 1.0752688312426768
Energy: 1.0582763665533668
Energy: 1.0752688312445442
Energy: 1.0582763665527444
Energy: 1.0752688312432994
Energy: 1.1344441043650717
Energy: 1.0288314523063251
Energy: 1.1344441043638267
Energy: 1.02883145230757
Energy: 1.1344441043650717
Energy: 1.0288314523081923
Energy: 1.028814491490322
Energy: 1.1345631919302792
Energy: 1.028814491488455
Energy: 1.1345631919321464
Energy: 1.0288144914890773
Energy: 1.1345631919277896
Energy: 1.2009175603805213
Energy: 1.2806328960706883
Energy: 1.200917560381144
Energy: 1.2806328960694435
Energy: 1.200917560389207
Energy: 1.2806328960688211
Energy: 1.077515687707888
Energy: 1.0940882158519036
Energy: 1.077515687707888
Energy: 1.0940882158506586
Energy: 1.0775156877091325
Energy: 1.094088215851281
Energy: 1.2009116541378657
Energy: 1.2808014823416118
Energy: 1.200911654137243
Energy: 1.2808014823434795
Energy: 1.2009116541378657
Energy: 1.2808014823428568
Energy: 1.0287134381852563
Energy: 1.1344359946311864
Energy: 1.0287134381877459
Energy: 1.1344359946318088
Energy: 1.0287134381852563
Energy: 1.1344359946243396
Energy: 1.1344710911232787
Energy: 1.028724779899067
Energy: 1.1344710911207891
Energy: 1.0287247799003116
Energy: 1.1344710911214115
Energy: 1.0287247798996892
Energy: 1.05828854337169
Energy: 1.0751927292641592
Energy: 1.0582885433723124
Energy: 1.0751927292635366
Energy: 1.05828854337169
Energy: 1.0751927292635366
Energy: 1.0582763665527444
Energy: 1.0752688312358305
Energy: 1.058276366552122
Energy: 1.0752688312352081
Energy: 1.0582763665514996
Energy: 1.0752688312358305
Energy: 1.1344441043675613
Energy: 1.028831452308815
Energy: 1.1344441043669387
Energy: 1.028831452308815
Energy: 1.1344441043669387
Energy: 1.0288314523100595
Energy: 1.028814491488455
Energy: 1.1345631919265446
Energy: 1.028814491488455
Energy: 1.1345631919203205
Energy: 1.0288144914878323
Energy: 1.1345631919259223
Energy: 1.2009175603792768
Energy: 1.2806328960663313
Energy: 1.2009175603860949
Energy: 1.2806328960657092
Energy: 1.2009175603854725
Energy: 1.2806328960663313
Energy: 1.077515687706643
Energy: 1.0940882158531482
Energy: 1.077515687706643
Energy: 1.0940882158525256
Energy: 1.0775156877072656
Energy: 1.0940882158519036
Energy: 1.2009116541409777
Energy: 1.2808014823409897
Energy: 1.200911654138488
Energy: 1.2808014823422345
Energy: 1.200911654138488
Energy: 1.2808014823459406
Energy: 1.0287134381852563
Energy: 1.1344359946293192
Energy: 1.0287134381852563
Energy: 1.1344359946293192
Energy: 1.0287134381865013
Energy: 1.134435994626207

minimum gb energy = 1.028713438181522 eV
minimum distance =  2.3448411837003 Angstroms
sigma value = 27


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

Energy: 1.0839737165632704
Energy: 1.0454412658440455
Energy: 1.0839737165632704
Energy: 1.0454412658425207
Energy: 1.0839737165647954
Energy: 1.0454412658425207
Energy: 1.2186229140758547
Energy: 1.0734626291185536
Energy: 1.2186229140773794
Energy: 1.0734626291170635
Energy: 1.2186229140743303
Energy: 1.0734626291140146
Energy: 1.066551386242376
Energy: 1.198047164607786
Energy: 1.0665513862439004
Energy: 1.1980471646123596
Energy: 1.0665513862454252
Energy: 1.1980471646093107
Energy: 1.1745779941459766
Energy: 1.0157348016312489
Energy: 1.1745779941383538
Energy: 1.0157348016282
Energy: 1.1745779941383538
Energy: 1.0157348016297245
Energy: 1.1729375483757727
Energy: 1.015609170110785
Energy: 1.172937548359002
Energy: 1.0156091701123098
Energy: 1.1729375483574775
Energy: 1.0156091701092604
Energy: 1.1907255337788036
Energy: 1.2471817378419974
Energy: 1.1907255337772789
Energy: 1.2471817378404728
Energy: 1.1907255337818525
Energy: 1.2471817378435217
Energy: 1.125880199659873
Energy: 1.076302355336349
Energy: 1.1258801996659717
Energy: 1.076302355336349
Energy: 1.125880199664447
Energy: 1.076302355336349
Energy: 1.07986867333483
Energy: 1.0502609879573954
Energy: 1.079868673336355
Energy: 1.0502609879558706
Energy: 1.079868673331781
Energy: 1.05026098795892
Energy: 1.2181545815617143
Energy: 1.0660298326737276
Energy: 1.2181545815647634
Energy: 1.0660298326691537
Energy: 1.2181545815632389
Energy: 1.0660298326584814
Energy: 1.1431371047100158
Energy: 1.2050966204494409
Energy: 1.1431371047115404
Energy: 1.2050966204463918
Energy: 1.143137104713065
Energy: 1.2050966204494409
Energy: 1.0748060148220269
Energy: 1.0161396791629704
Energy: 1.0748060148205023
Energy: 1.0161396791614459
Energy: 1.1827990702735343
Energy: 1.0161396791614459
Energy: 1.2431092411211007
Energy: 1.1496860682057108
Energy: 1.2431092411180515
Energy: 1.1496860682041863
Energy: 1.2431092411195759
Energy: 1.149686068202662

minimum gb energy = 1.0156091701092604 eV
minimum distance =  2.21800544996681 Angstroms
sigma value = 9


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

Energy: 1.0707343229691906
Energy: 1.0305720730427494
Energy: 1.0707343229610515
Energy: 1.0305720730423213
Energy: 1.0707343229679054
Energy: 1.0305720730444632
Energy: 1.0317855741626676
Energy: 0.9399716145769078
Energy: 1.0317855740294826
Energy: 1.0635671711966306
Energy: 1.0317855741519584
Energy: 0.9961946272586181
Energy: 0.9497993596015489
Energy: 1.056994392032674
Energy: 0.949799359600264
Energy: 1.0569943920095421
Energy: 0.9497993595916965
Energy: 1.0569943920228217
Energy: 0.9723061707598646
Energy: 0.9474907196268731
Energy: 0.9723061707598646
Energy: 0.9474907196247312
Energy: 0.9723061707590078
Energy: 0.9474907196264447
Energy: 1.0280342020215503
Energy: 0.9936733309373329
Energy: 1.0280342020181232
Energy: 0.9936733309356193
Energy: 1.0280342020228355
Energy: 0.9936733309364763
Energy: 1.044646184376738
Energy: 1.0198845764844737
Energy: 1.0446461843703123
Energy: 1.0517958866518493
Energy: 1.044646184380165
Energy: 1.0620063306101435
Energy: 0.9927876733048625
Energy: 1.0353496986869468
Energy: 0.9927876733057192
Energy: 1.0353496986890887
Energy: 0.992787673306576
Energy: 1.0353496986818065
Energy: 0.9232605251357904
Energy: 1.036608654790091
Energy: 0.9232605251323635
Energy: 1.0366086547913762
Energy: 0.9232605251315067
Energy: 1.0366086547892341
Energy: 1.0518649419866954
Energy: 0.9935444193711257
Energy: 1.0518649419849817
Energy: 0.9935444193732677
Energy: 1.0518649419995465
Energy: 0.9935444193694123
Energy: 1.0274950774520422
Energy: 0.9831780426095
Energy: 1.0274950774447595
Energy: 0.983178042612927
Energy: 1.0274950774379057
Energy: 0.9831780426274914
Energy: 0.9718404989528643
Energy: 0.9543612159275134
Energy: 0.9718404989472954
Energy: 0.9543612159279417
Energy: 0.971840498950294
Energy: 0.9543612159292268
Energy: 0.9824797882064674
Energy: 1.0062448677303122
Energy: 0.9824797882051822
Energy: 1.0062448677298839
Energy: 0.9824797882068959
Energy: 1.0062448677397366
Energy: 1.028847332121167
Energy: 1.0165053957850247
Energy: 1.0288473321215952
Energy: 1.0165053957584658
Energy: 1.0288473321091725
Energy: 1.0165053957751722
Energy: 1.0665402103714996
Energy: 1.0338652898846634
Energy: 1.0665402103685007
Energy: 1.0338652898859486
Energy: 1.0665402103603614
Energy: 1.0338652898906606
Energy: 0.9545507937296643
Energy: 1.0373075526370388
Energy: 0.9545507937326629
Energy: 1.0373075526370388
Energy: 0.9545507937288076
Energy: 1.0373075526370388
Energy: 0.964680415411753
Energy: 1.0437263015971678
Energy: 0.9646804154070409
Energy: 1.0437263015911706
Energy: 0.964680415419853
Energy: 1.0437263015980247
Energy: 1.1688769697115657
Energy: 0.9490607652724277
Energy: 1.1688769697149928
Energy: 0.9490607652698575
Energy: 1.168876969712851
Energy: 0.9490607652711426
Energy: 0.967503658808862
Energy: 0.9940068866740044
Energy: 0.9675036588148591
Energy: 0.9940068866727193
Energy: 0.9675036588067203
Energy: 0.9940068866714341
Energy: 0.9192356429659253
Energy: 1.0469165198380128
Energy: 0.9192356429672105
Energy: 1.0469165198345856
Energy: 0.9192356429633551
Energy: 1.0469165198367276
Energy: 1.1186452669348281
Energy: 0.9728476485658295
Energy: 1.1186452669365416
Energy: 1.008054252822532
Energy: 1.1186452669245472
Energy: 0.9383604316128592
Energy: 0.919214596811598
Energy: 1.0475021470569652
Energy: 0.9192145968111697
Energy: 1.0475021470402976
Energy: 0.9192145968107412
Energy: 1.0475021470865233
Energy: 0.9678959116150142
Energy: 0.9938720761638995
Energy: 0.9678959116107305
Energy: 0.9938720761681833
Energy: 0.967895911615871
Energy: 0.9938720761647564
Energy: 1.1689275519337097
Energy: 0.9489215580274172
Energy: 1.1689275519349946
Energy: 0.9489215580265602
Energy: 1.1689275519341382
Energy: 0.9489215580257037
Energy: 0.9645020627793519
Energy: 0.9939754928214786
Energy: 0.9645020627844924
Energy: 0.9939754928283326
Energy: 0.9645020627823505
Energy: 0.9939754927799265
Energy: 0.9545183383998456
Energy: 1.0373465079037893
Energy: 0.9545183384037009
Energy: 1.0373465079042177
Energy: 0.9545183384032725
Energy: 1.0373465079042177
Energy: 1.0665032340555864
Energy: 1.033609531648247
Energy: 1.0665032340508744
Energy: 1.0336095316499605
Energy: 1.0665032340581566
Energy: 1.0336095316512457
Energy: 1.029146463585946
Energy: 1.0165090985899596
Energy: 1.0291464635940462
Energy: 1.0165090985955285
Energy: 1.0291464635876206
Energy: 1.0165090985989556
Energy: 0.9824729150787973
Energy: 0.9508309035365842
Energy: 0.9824729150779407
Energy: 0.9508309035395826
Energy: 0.9824729150749419
Energy: 0.950830903535299
Energy: 0.9718385598100839
Energy: 0.9543000783362332
Energy: 0.9718385598130824
Energy: 0.9543000783366618
Energy: 0.9718385598186513
Energy: 0.9543000783353766
Energy: 1.0277962508160003
Energy: 0.9253887050216011
Energy: 1.0277962508160003
Energy: 0.9253887050186024
Energy: 1.0277962508237108
Energy: 0.9253887050096066
Energy: 1.0518960465987908
Energy: 0.9942269319155509
Energy: 1.0518960465902234
Energy: 0.9942269319181211
Energy: 1.0518960465906515
Energy: 0.9942269319125522
Energy: 0.9232646448445633
Energy: 1.0362926769228817
Energy: 0.9232646448458484
Energy: 1.036292676922025
Energy: 0.9232646448394228
Energy: 1.0362926769224536
Energy: 0.9929642046139334
Energy: 1.0358836365734372
Energy: 0.9929642046224618
Energy: 1.035883636576436
Energy: 0.9929642046216052
Energy: 1.035883636573009
Energy: 1.0448014790863303
Energy: 0.9667938597598835
Energy: 1.0448014791163163
Energy: 0.9667938597585983
Energy: 1.044801479113746
Energy: 0.9667938597568848
Energy: 1.0274128970663925
Energy: 0.9995825187827045
Energy: 1.0274128970685346
Energy: 0.9995825187827045
Energy: 1.0274128970638223
Energy: 0.9995825187805628
Energy: 0.9726009954987493
Energy: 0.9477156251284826
Energy: 0.972600995495751
Energy: 0.947715625127626
Energy: 0.9726009955000344
Energy: 0.947715625127626
Energy: 0.9497397306620975
Energy: 1.057124719550157
Energy: 0.9497397306650962
Energy: 1.0571247195505853
Energy: 0.9497397306616691
Energy: 1.0571247195497286
Energy: 1.0316896312704384
Energy: 0.989991413371083
Energy: 1.0316896312631563
Energy: 0.9899914133672275
Energy: 1.0316896312494483
Energy: 0.9899914133736532
Energy: 1.0707343229494855
Energy: 1.0305720730380377
Energy: 1.0707343229452015
Energy: 1.0305720730380377
Energy: 1.070734322946915
Energy: 1.0305720730418928
Energy: 1.0317855739973938
Energy: 0.9399716145769078
Energy: 1.0317855739545565
Energy: 0.9399716145764795
Energy: 1.0317855740607538
Energy: 0.9399716145769078
Energy: 0.9497993596088313
Energy: 1.0569943920352445
Energy: 0.9497993596109732
Energy: 1.0569943920108271
Energy: 0.9497993596105448
Energy: 1.0569943920292473
Energy: 0.9723061707803875
Energy: 0.9474907196170205
Energy: 0.972306170777389
Energy: 0.9474907196174488
Energy: 0.9723061707752472
Energy: 0.9474907196191624
Energy: 1.028034202029261
Energy: 0.9936733309501841
Energy: 1.0280342020262623
Energy: 0.9936733309480422
Energy: 1.0280342020279758
Energy: 0.9936733309480422

minimum gb energy = 0.9192145968107412 eV
minimum distance =  2.29692756421455 Angstroms
sigma value = 57


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

Energy: 0.9490396436720308
Energy: 0.8436525340983111
Energy: 0.4873567898901137
Energy: 0.8436525340847036
Energy: 0.94903964366618
Energy: 0.8436525340856789
Energy: 1.0059215380918882
Energy: 0.8303996523484221
Energy: 1.0059215380899382
Energy: 0.8305528739956759
Energy: 1.005921538087988
Energy: 0.8303996523464717
Energy: 0.9052654664704004
Energy: 1.0450325247682464
Energy: 0.9052654664733258
Energy: 0.982648798401302
Energy: 0.9052654664782015
Energy: 1.0450325247711718
Energy: 0.8437780276958138
Energy: 0.6455418004722518
Energy: 0.8437780277026395
Energy: 0.6455374879359309
Energy: 0.8437780276880127
Energy: 0.6455418004771275
Energy: 0.6384142207574962
Energy: 1.0117842240985762
Energy: 0.6384142207535958
Energy: 1.0117842240995514
Energy: 0.638414220755546
Energy: 1.0117842241044266
Energy: 0.8042388545121976
Energy: 0.9030582172071826
Energy: 0.4873135496861582
Energy: 0.9030582172120583
Energy: 0.804238854516098
Energy: 0.9030582172208345
Energy: 0.8040844143786116
Energy: 0.5522114671575499
Energy: 0.48773780987403087
Energy: 0.5522114671624255
Energy: 0.8040844143961638
Energy: 0.5522114671555997
Energy: 1.0059869085835398
Energy: 0.6415470406817554
Energy: 1.0059869085854902
Energy: 0.6415470406817554
Energy: 1.0059869085776894
Energy: 0.6415470406885814
Energy: 0.8466771372917049
Energy: 0.6455068051496413
Energy: 0.8466771372946303
Energy: 0.6455296993541566
Energy: 0.8466771373014561
Energy: 0.6455068051467159
Energy: 0.552474706006783
Energy: 1.067308748084923
Energy: 0.552474706006783
Energy: 1.0673087480810224
Energy: 0.5524747060106835
Energy: 1.0673087480819976
Energy: 0.6381320262858362
Energy: 0.8294988693471045
Energy: 0.6381320262916869
Energy: 0.8294988693461294
Energy: 0.6381320262936372
Energy: 0.8294988693539306
Energy: 0.9490396436720308
Energy: 0.843652534097336
Energy: 0.4873567898891386
Energy: 0.8436525340847036
Energy: 0.94903964366618
Energy: 0.8436525340856789
Energy: 1.0059215381006645
Energy: 0.8303996523503723
Energy: 1.0059215380909134
Energy: 0.8305528739908004
Energy: 1.005921538088963
Energy: 0.8303996523484221
Energy: 0.9052654664821022
Energy: 1.0450325247672714
Energy: 0.9052654664791767
Energy: 0.9826487983983766
Energy: 0.9052654664830773
Energy: 1.0450325247701966
Energy: 0.8437780276909381
Energy: 0.645541800473227
Energy: 0.8437780277006892
Energy: 0.6455374879339807
Energy: 0.8437780276889878
Energy: 0.6455418004761523
Energy: 0.6384142207594465
Energy: 1.0117842241024766
Energy: 0.6384142207565212
Energy: 1.011784224096626
Energy: 0.638414220755546
Energy: 1.0117842241024766
Energy: 0.8042388545131726
Energy: 0.9030582172120583
Energy: 0.4873135496919646
Energy: 0.9030582172208345
Energy: 0.8042388545199985
Energy: 0.9030582172198592
Energy: 0.804084414374711
Energy: 0.5522114671643757
Energy: 0.48773780987110543
Energy: 0.5522114671536494
Energy: 0.8040844143942136
Energy: 0.5522114671614504
Energy: 1.00598690858159
Energy: 0.6415470406798051
Energy: 1.0059869085825648
Energy: 0.6415470406846808
Energy: 1.0059869085786646
Energy: 0.6415470406885814

minimum gb energy = 0.4873135496861582 eV
minimum distance =  2.3919716339544 Angstroms
sigma value = 11


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

Energy: 0.9305996434345315
Energy: 0.8772819861163667
Energy: 0.9305996434359601
Energy: 0.8772819861213667
Energy: 0.9305996434373887
Energy: 0.8772819861135093
Energy: 1.059711521663909
Energy: 0.8973483967705903
Energy: 1.0597115216646231
Energy: 0.8973483967877335
Energy: 1.059711521666766
Energy: 0.8973483967684472
Energy: 0.93651179989964
Energy: 1.1899477064966038
Energy: 1.0507380760609892
Energy: 1.1899477064987467
Energy: 1.0158796103582244
Energy: 1.1899477064923178
Energy: 1.0519594995828112
Energy: 0.857013366348992
Energy: 1.0519594995849542
Energy: 0.8570133663468491
Energy: 1.0519594995828112
Energy: 0.8570133663497063
Energy: 0.8389161393070038
Energy: 0.8140010264476986
Energy: 0.8389161393055752
Energy: 0.8140010264448413
Energy: 0.8389161393041467
Energy: 0.8140010264455557
Energy: 0.9000522690721948
Energy: 0.84061240341234
Energy: 0.9000522691635603
Energy: 0.8406124034137686
Energy: 0.90005226908213
Energy: 0.84061240341234
Energy: 0.8345359574377412
Energy: 0.9021483771152401
Energy: 0.8345359574391699
Energy: 0.9021483771295261
Energy: 0.8345359574391699
Energy: 0.9021483771195258
Energy: 1.02331601317175
Energy: 0.785285882579822
Energy: 1.023316013173893
Energy: 0.7852858825769649
Energy: 1.02331601317175
Energy: 0.7852858825769649
Energy: 1.0179160289172902
Energy: 0.7879717439134829
Energy: 1.0179160289180045
Energy: 0.7879717439106256
Energy: 1.0179160289201474
Energy: 0.7879717439134829
Energy: 0.8086811715412785
Energy: 1.1062591734733058
Energy: 0.8086811715398498
Energy: 1.106259173472591
Energy: 0.8086811715434213
Energy: 1.10625917346902
Energy: 0.9033899626118316
Energy: 1.022273134767146
Energy: 0.9033899626075457
Energy: 1.0222731347664318
Energy: 0.9033899625968312
Energy: 1.0222731347678604
Energy: 0.8400700856782631
Energy: 0.8169849395692034
Energy: 0.8400700856654056
Energy: 0.8169849395692034
Energy: 0.8400700856704058
Energy: 0.8169849395656317
Energy: 0.9297581504223836
Energy: 0.860336169306869
Energy: 0.9297581504230981
Energy: 0.8603361693090119
Energy: 0.9297581504166692
Energy: 0.8603361693090119
Energy: 0.9849685997009191
Energy: 1.1542320344757526
Energy: 0.9849685996994906
Energy: 1.1542320344757526
Energy: 0.9849685997023477
Energy: 1.1542320344771813
Energy: 1.0585251726470415
Energy: 0.9006503310757495
Energy: 1.0585251726463274
Energy: 0.9006503310786069
Energy: 1.0585251726434701
Energy: 0.900650331076464
Energy: 0.8987768613416189
Energy: 0.8777913854878873
Energy: 0.8987768613430475
Energy: 0.877791385586461
Energy: 0.8987768613451905
Energy: 0.877791385505745
Energy: 0.8592616541327148
Energy: 0.8946718126168027
Energy: 0.859261654130572
Energy: 0.8946718126160885
Energy: 0.8592616541397929
Energy: 0.8946718126153742
Energy: 1.2316439173202984
Energy: 0.9521207672805319
Energy: 1.2316439173131557
Energy: 0.9521207672719602
Energy: 1.2316439173138698
Energy: 0.9521207672762458
Energy: 0.9728011941362628
Energy: 0.8545672803996303
Energy: 0.9728011941412629
Energy: 0.8545672803989159
Energy: 0.9728011941341199
Energy: 0.8545672803996303
Energy: 0.8395781889902457
Energy: 0.938585467983894
Energy: 0.8395781889931029
Energy: 0.9385854679846083
Energy: 0.8395781889759596
Energy: 0.9385854679817511
Energy: 0.8073696394614944
Energy: 0.8417200424246682
Energy: 0.8073696394586372
Energy: 0.841720042426097
Energy: 0.8073696394607801
Energy: 0.841720042421811
Energy: 0.8686361862413642
Energy: 0.9008436565896701
Energy: 0.8686361862385069
Energy: 0.9008436565889559
Energy: 0.8686361862406499
Energy: 0.9008436565968131
Energy: 1.0294148306931177
Energy: 0.9312623287365605
Energy: 1.0294148306924034
Energy: 0.9312623287372747
Energy: 1.029414830695975
Energy: 0.931262328737989
Energy: 0.8618632763281802
Energy: 0.8271976948166896
Energy: 0.8618632763246087
Energy: 0.8271976948138324
Energy: 0.8618632763246087
Energy: 0.8271976948152611
Energy: 0.8072047072790945
Energy: 1.1053905255871093
Energy: 0.8072047072783802
Energy: 1.1053905255949665
Energy: 0.8072047072748088
Energy: 1.1053905255942524
Energy: 1.3890858498253644
Energy: 1.0238608619674663
Energy: 1.3890858498339358
Energy: 1.0238608619646092
Energy: 1.3890858498282215
Energy: 1.0238608619674663

minimum gb energy = 0.7852858825769649 eV
minimum distance =  2.28922225296711 Angstroms
sigma value = 41


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

Energy: 1.024536235151629
Energy: 0.8940903952142929
Energy: 1.0245362351527547
Energy: 0.8940903952148559
Energy: 1.0245362351521918
Energy: 0.8940903952142929
Energy: 0.9807303067630279
Energy: 0.9485610184196899
Energy: 0.9807303067658427
Energy: 0.9485610184174379
Energy: 0.9807303067613389
Energy: 0.9485610184112451
Energy: 0.9999570318903386
Energy: 1.059791341366499
Energy: 0.9999570318959685
Energy: 1.059791341365936
Energy: 0.9999570318920274
Energy: 1.059791341365936
Energy: 0.9628362888275674
Energy: 0.8890779426568196
Energy: 0.9628362888286933
Energy: 0.8890779426568196
Energy: 0.9628362888253155
Energy: 0.8890779426573825
Energy: 0.8583433826537935
Energy: 0.9318224062539
Energy: 0.8583433826537935
Energy: 0.9318224062544632
Energy: 0.8583433826549194
Energy: 0.931822406253337
Energy: 1.0026301710505083
Energy: 0.9598882260247938
Energy: 1.0026301710516343
Energy: 0.9598882260399947
Energy: 1.0026301710482564
Energy: 0.9598882260416836
Energy: 0.8942588670357096
Energy: 1.2125891565726676
Energy: 0.8942588670334575
Energy: 1.2125891565737936
Energy: 0.8942588670340207
Energy: 1.2125891565704154
Energy: 0.8728280241094544
Energy: 0.8890689647218577
Energy: 0.8728280241111435
Energy: 0.8890689647235466
Energy: 0.8728280241083284
Energy: 0.8890689647224207
Energy: 0.8676077860860161
Energy: 0.9140349046546201
Energy: 0.8676077860871421
Energy: 0.9140349046523681
Energy: 0.867607786084327
Energy: 0.9140349046529312
Energy: 0.9607790388377531
Energy: 0.9819892901557016
Energy: 0.9607790388405678
Energy: 0.9819892901557016
Energy: 0.9607790388400048
Energy: 0.9819892901568275
Energy: 0.9588990140658845
Energy: 1.047830895769571
Energy: 0.9588990140675737
Energy: 1.047830895769008
Energy: 0.9588990140653216
Energy: 1.0478308957712599
Energy: 0.8559482226486558
Energy: 0.939526361298004
Energy: 0.8559482226514709
Energy: 1.0019819966187533
Energy: 0.8559482226497818
Energy: 0.921496357569613
Energy: 0.8843212535284325
Energy: 0.888621722837988
Energy: 0.8843212535284325
Energy: 0.8886217228357359
Energy: 0.8843212535261806
Energy: 0.888621722837988
Energy: 0.8341723845895301
Energy: 0.9854027617702265
Energy: 0.834172384587278
Energy: 0.9854027617781083
Energy: 0.8341723845923449
Energy: 0.9854027617747304
Energy: 1.0002896949041435
Energy: 0.9291170427890638
Energy: 1.0002896949035804
Energy: 0.929117042783434
Energy: 1.0002896948968245
Energy: 0.9291170427879379
Energy: 0.8352588749697816
Energy: 1.0698161457738242
Energy: 0.8352588749686555
Energy: 1.1362135782154317
Energy: 0.8352588749703446
Energy: 1.0537736473566117
Energy: 0.8749196587752027
Energy: 0.8883922161090686
Energy: 0.8749196587774548
Energy: 0.8883922161079427
Energy: 0.8749196587729507
Energy: 0.8883922161085057
Energy: 1.0620866985179302
Energy: 1.0617941523864287
Energy: 1.0620866985179302
Energy: 1.0617941523802357
Energy: 1.0620866985168043
Energy: 1.0617941523999401
Energy: 0.9785043833395066
Energy: 1.0289346016225247
Energy: 0.9785043833400695
Energy: 1.0289346016332215
Energy: 0.9785043833378175
Energy: 1.0289346016377254
Energy: 0.9593219888703279
Energy: 0.9003476457948527
Energy: 0.9593219888731428
Energy: 0.9003476457965416
Energy: 0.9593219888708908
Energy: 0.9003476458083645
Energy: 0.8895793804219799
Energy: 0.9500332391307714
Energy: 0.8895793804225429
Energy: 0.9500332391375272
Energy: 0.889579380419165
Energy: 0.9500332391313344
Energy: 0.999674433362297
Energy: 1.0576682123816266
Energy: 0.9996744333572302
Energy: 1.0576682123748704
Energy: 0.999674433362297
Energy: 1.0576682123743075
Energy: 0.9610440116400021
Energy: 0.8878243113233167
Energy: 0.9610440116383132
Energy: 0.8878243113233167
Energy: 0.9610440116371871
Energy: 0.8878243113238797
Energy: 0.8352911716244922
Energy: 0.9451397392714455
Energy: 0.8352911716250552
Energy: 0.9451397392584966
Energy: 0.8352911716239292
Energy: 0.9451397392579337
Energy: 0.8359975620059894
Energy: 1.009379647780005
Energy: 0.8359975620054264
Energy: 1.009379647776064
Energy: 0.8359975620043003
Energy: 1.009379647770434
Energy: 0.8941591460654393
Energy: 0.9806216817029921
Energy: 0.8941591460637505
Energy: 0.9806216816928581
Energy: 0.8941591460682543
Energy: 0.980621681700177
Energy: 0.8684405175492019
Energy: 0.8873938697516565
Energy: 0.8684405175502765
Energy: 0.8873938697510935
Energy: 0.8684405175508397
Energy: 0.8873938697510935
Energy: 0.866831152325971
Energy: 0.9292429028735467
Energy: 0.866831152326534
Energy: 0.9292429028667908
Energy: 0.8668311523248449
Energy: 0.9292429028735467
Energy: 0.9598092935001034
Energy: 0.974434201439601
Energy: 0.9598092935012293
Energy: 0.9744342014463058
Energy: 0.9598092935006663
Energy: 0.9744342014491207
Energy: 1.0515166352116585
Energy: 0.9279520970558002
Energy: 1.0515166352161627
Energy: 0.9279520970569262
Energy: 1.0515166352122216
Energy: 0.9279520970569262
Energy: 0.8503835947754652
Energy: 0.9216647647472137
Energy: 0.8503835947749023
Energy: 0.9216647647291979
Energy: 0.8503835947765911
Energy: 0.9216647647410208
Energy: 0.8818135438622573
Energy: 0.9107490598625425
Energy: 0.8818135438616941
Energy: 0.9107490598631054
Energy: 0.8818135438611825
Energy: 0.9107490598642313
Energy: 0.8357668316061815
Energy: 0.915925252127625
Energy: 0.8357668316061815
Energy: 0.9159252521326918
Energy: 0.8357668316061815
Energy: 0.9159252521270619

minimum gb energy = 0.834172384587278 eV
minimum distance =  2.30333876221676 Angstroms
sigma value = 33


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

Energy: 1.0067774940180465
Energy: 0.908411745076324
Energy: 1.0067774940180465
Energy: 0.908411745079485
Energy: 1.0067774940137362
Energy: 0.9084117450728039
Energy: 1.0417479754015067
Energy: 0.8813728221223038
Energy: 1.0417479753994954
Energy: 0.8813728221226631
Energy: 1.0417479753999264
Energy: 0.8813728221226631
Energy: 0.9617030390761797
Energy: 1.0828277719386576
Energy: 0.9617030390726596
Energy: 1.0828277719406694
Energy: 0.9617030390718695
Energy: 1.0828277719414594
Energy: 0.9590653767011531
Energy: 0.8997398641631621
Energy: 0.9590653767106359
Energy: 0.8997398641631621
Energy: 0.9590653767027335
Energy: 0.8997398641627312
Energy: 0.9250962595504446
Energy: 1.0183535608955787
Energy: 0.9250962595496544
Energy: 1.018353560889257
Energy: 0.9250962595461342
Energy: 1.0183535608873175
Energy: 1.0632584792762338
Energy: 0.9238690663148262
Energy: 1.0632584792742943
Energy: 0.9238690663156165
Energy: 1.0632584792778144
Energy: 0.9238690663164066
Energy: 0.9348003353436741
Energy: 1.0348060188845642
Energy: 0.9348003353338322
Energy: 1.0348060189019492
Energy: 0.9348003353433149
Energy: 1.034806018883774
Energy: 0.9906402837752981
Energy: 1.0196260717029795
Energy: 0.990640283767827
Energy: 1.0196260717057095
Energy: 0.9906402837697664
Energy: 1.0196260717080803
Energy: 1.0650168312988402
Energy: 0.9403282698459692
Energy: 1.0650168312988402
Energy: 0.9403282698463286
Energy: 1.0650168313015698
Energy: 0.9403282698486992
Energy: 1.14497420680087
Energy: 0.9095126702257375
Energy: 1.1449742067751516
Energy: 0.9095126702237979
Energy: 1.1449742067759419
Energy: 0.9095126702245881
Energy: 0.9858324956222136
Energy: 0.9875740879542099
Energy: 0.9858324956297566
Energy: 0.9875740879573708
Energy: 0.9858324956261647
Energy: 0.9875740879530606
Energy: 1.020097940195867
Energy: 0.8997048217805791
Energy: 1.020097940195867
Energy: 0.8997048217805791
Energy: 1.020097940203338
Energy: 0.8997048217797887
Energy: 0.9426854618778922
Energy: 1.0669643128498947
Energy: 0.9426854618786824
Energy: 1.0669643128388315
Energy: 0.9426854618814121
Energy: 1.0669643128455844
Energy: 1.0114488223117206
Energy: 0.9864876269816669
Energy: 1.0114488223089906
Energy: 0.9864876269780749
Energy: 1.0114488223117206
Energy: 0.9864876269785061
Energy: 1.0025891988366857
Energy: 0.9357016106039442
Energy: 1.0025891988414273
Energy: 0.935701610603154
Energy: 1.0025891988394875
Energy: 0.935701610603154
Energy: 0.9277282521525492
Energy: 1.069835331179551
Energy: 0.9277282521545607
Energy: 1.0698353311949245
Energy: 0.9277282521525492
Energy: 1.0698353311815625
Energy: 1.0185485360482196
Energy: 0.9121842539929846
Energy: 1.0185485360505904
Energy: 0.9121842539921944
Energy: 1.0185485360569122
Energy: 0.9121842539949961
Energy: 0.8971617110916401
Energy: 0.96067958682882
Energy: 0.8971617110864677
Energy: 0.96067958682882
Energy: 0.8971617110919993
Energy: 0.9606795868292511
Energy: 1.083982862783956
Energy: 0.9609848984323502
Energy: 1.0839828628084534
Energy: 0.9609848984339306
Energy: 1.083982862804071
Energy: 0.9609848984327096
Energy: 1.0177141823816784
Energy: 0.9611573449324061
Energy: 1.017714182352009
Energy: 0.9611573449316159
Energy: 1.0177141823753566
Energy: 0.9611573449331964
Energy: 0.9139922191536465
Energy: 0.9810633249378398
Energy: 0.9139922191555861
Energy: 0.981063324939061
Energy: 0.9139922191540057
Energy: 0.9810633249397794
Energy: 0.8782967221358037
Energy: 1.0463981297250533
Energy: 0.8782967221338639
Energy: 1.046398129727065
Energy: 0.8782967221342232
Energy: 1.0463981297262746
Energy: 1.002800904939121
Energy: 0.8819453055391921
Energy: 1.0028009049383309
Energy: 0.8819453055384019
Energy: 1.0028009049426412
Energy: 0.8819453055352409
Energy: 0.9035974746896345
Energy: 1.0117702463629483
Energy: 0.9035974746904246
Energy: 1.01177024637121
Energy: 0.9035974746841029
Energy: 1.0117702463664684
Energy: 1.0325253539918269
Energy: 0.9117807107869766
Energy: 1.0325253539867263
Energy: 0.9117807107873358
Energy: 1.03252535399937
Energy: 0.9117807107869766
Energy: 0.9224893263857029
Energy: 1.007050271796432
Energy: 0.9224893263813206
Energy: 1.00705027179284
Energy: 0.9224893263841223
Energy: 1.0070502717972223
Energy: 1.0421357516781908
Energy: 0.9353146459175447
Energy: 1.042135751681711
Energy: 0.9353146459191252
Energy: 1.0421357516813516
Energy: 0.9353146459207057
Energy: 0.9893346456311292
Energy: 0.9057048683239888
Energy: 0.9893346456303389
Energy: 0.9057048683251382
Energy: 0.9893346456291175
Energy: 0.9057048683239888
Energy: 0.9422752925975648
Energy: 1.066774816538013
Energy: 0.9422752925944039
Energy: 1.0667748165372228
Energy: 0.9422752925923924
Energy: 1.0667748165356423
Energy: 0.9071105739259403
Energy: 1.3251796286652504
Energy: 0.9071105739259403
Energy: 1.3251796286648914
Energy: 0.9071105739219891
Energy: 1.3251796286644602
Energy: 0.9560224406033353
Energy: 0.8973821641588036
Energy: 0.9560224406049158
Energy: 0.8973821641591627
Energy: 0.9560224406025452
Energy: 0.8973821641580133
Energy: 0.9035422495165364
Energy: 1.0203180951640496
Energy: 0.9035422495133756
Energy: 1.0203180951569375
Energy: 0.9035422495153869
Energy: 1.0203180951596673
Energy: 1.016177115209243
Energy: 0.933922796352316
Energy: 1.0161771152084529
Energy: 0.9339227963526753
Energy: 1.0161771152009818
Energy: 0.9339227963507356
Energy: 0.9841000145731605
Energy: 1.006296083673302
Energy: 0.9841000145735914
Energy: 1.0062960836729427
Energy: 0.9841000145723703
Energy: 1.0062960836753132
Energy: 0.9841189241493756
Energy: 1.006213525604459
Energy: 0.9841189241473643
Energy: 1.0062135256036688
Energy: 0.9841189241489448
Energy: 1.0062135256048184
Energy: 1.016211495311268
Energy: 0.9342627464880696
Energy: 1.0162114953104777
Energy: 0.9342627464892191
Energy: 1.0162114953096875
Energy: 0.9342627464868485
Energy: 0.903426306607159
Energy: 1.019503214035273
Energy: 0.9034263066024176
Energy: 1.019503214035273
Energy: 0.9034263065988977
Energy: 1.0195032140400144
Energy: 0.95584230438862
Energy: 0.8974743240757062
Energy: 0.9558423043933613
Energy: 0.8974743240737666
Energy: 0.9558423043902003
Energy: 0.8974743240753471
Energy: 0.9070437169700589
Energy: 1.32575543928026
Energy: 0.9070437169724296
Energy: 1.3257554392821995
Energy: 0.9070437169689096
Energy: 1.3257554392818405
Energy: 0.9424223144748053
Energy: 1.0665979862914885
Energy: 0.9424223144684836
Energy: 1.066597986276905
Energy: 0.9424223144720756
Energy: 1.0665979862776953
Energy: 0.98932903451943
Energy: 0.905073533222538
Energy: 0.989329034519071
Energy: 0.9050735332228972
Energy: 0.98932903451943
Energy: 0.9050735332233283
Energy: 1.0420653950727585
Energy: 0.9351109070512591
Energy: 1.0420653950683765
Energy: 0.935110907050828
Energy: 1.0420653950683765
Energy: 0.9351109070524085
Energy: 0.9224875867988469
Energy: 1.0069066629110253
Energy: 0.9224875868024387
Energy: 1.0069066629355223
Energy: 0.9224875867980568
Energy: 1.0069066629256807
Energy: 1.02838747846735
Energy: 0.9118579123170093
Energy: 1.0283874784819333
Energy: 0.9118579123170093
Energy: 1.0283874784831544
Energy: 0.9118579123170093
Energy: 0.9035806186275592
Energy: 1.011799784500005
Energy: 0.90358061863072
Energy: 1.011799784496844
Energy: 0.9035806186302889
Energy: 1.0117997844941142
Energy: 1.002706042794052
Energy: 0.881867995229849
Energy: 1.002706042794483
Energy: 0.8818679952290588
Energy: 1.0027060427987933
Energy: 0.8818679952294181
Energy: 0.8782821605804322
Energy: 1.0464773243805687
Energy: 0.8782821605883344
Energy: 1.046477324381718
Energy: 0.878282160583593
Energy: 1.046477324381718

minimum gb energy = 0.8782821605804322 eV
minimum distance =  2.30956211161334 Angstroms
sigma value = 67


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

Energy: 1.003130222684528
Energy: 0.9410332789925272
Energy: 1.0031302226818875
Energy: 0.9410332789925272
Energy: 1.0031302226818875
Energy: 0.9410332789925272
Energy: 0.9537003975893888
Energy: 0.8868882018789355
Energy: 0.9537003975920294
Energy: 0.8868882018789355
Energy: 0.9537003975893888
Energy: 0.8868882018789355
Energy: 1.1047843936630461
Energy: 1.1593716972198373
Energy: 1.2881995598125708
Energy: 1.159371697222478
Energy: 1.1977223175255463
Energy: 1.159371697222478
Energy: 0.9537269273695218
Energy: 0.8868830092590266
Energy: 0.953726927366881
Energy: 0.8868830092590266
Energy: 0.9537269273695218
Energy: 0.8868830092590266
Energy: 1.0031302226818875
Energy: 0.9410332789925272
Energy: 1.0031302226818875
Energy: 0.9410332789925272
Energy: 1.0031302226818875
Energy: 0.9410332789925272
Energy: 0.9537003975867481
Energy: 0.8868882018789355
Energy: 0.9537003975841075
Energy: 0.8868882018789355
Energy: 0.9537003975867481
Energy: 0.8868882018762948
Energy: 1.2116038282374548
Energy: 1.159371697222478
Energy: 1.2116038282321733
Energy: 1.159371697222478
Energy: 1.211603828234814
Energy: 1.159371697222478

minimum gb energy = 0.8868830092590266 eV
minimum distance =  2.32121651853076 Angstroms
sigma value = 3


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

Energy: 1.3275842049595306
Energy: 1.0837568492083456
Energy: 1.2889535855131327
Energy: 1.0837568491831913
Energy: 1.3275842049523436
Energy: 1.0837568491831913
Energy: 1.1197016915199351
Energy: 1.0227129066186873
Energy: 1.1197016915235285
Energy: 1.0227129066366547
Energy: 1.1197016915235285
Energy: 1.0227129066438416
Energy: 1.0651435724098954
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Energy: 1.0244385652575168
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Energy: 1.1170440394446108
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Energy: 1.1164525521501012
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Energy: 1.1170090104815802
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Energy: 1.1170090106108808
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Energy: 1.0210100698540345
Energy: 1.1705716401996389
Energy: 1.0210100698432543
Energy: 1.1705716402068258
Energy: 1.0210100698468478
Energy: 1.1705716402032322
Energy: 1.2031866201904178
Energy: 1.124213671936065
Energy: 1.2031866201796373
Energy: 1.1242136719540325
Energy: 1.2031866202047916
Energy: 1.1242136719540325
Energy: 1.0504353082264208
Energy: 1.0613250362713142
Energy: 1.0504494920544543
Energy: 1.0613250894600499
Energy: 1.0504353082372013
Energy: 1.0613249927806219
Energy: 1.1174634035406164
Energy: 1.0100041185195865
Energy: 1.117463403537023
Energy: 1.0100041184729367
Energy: 1.1174634035513968
Energy: 1.0100041184729367
Energy: 1.0643576647853552
Energy: 1.0771482879975225
Energy: 1.064357664799729
Energy: 1.0771482880190835
Energy: 1.0643576647961357
Energy: 1.077148288022677
Energy: 1.1420996994317019
Energy: 1.0243983880619343
Energy: 1.1420996994317019
Energy: 1.0243983880583405
Energy: 1.1420996994532628
Energy: 1.0243983880583405
Energy: 1.1184660539559772
Energy: 1.0970528109301447
Energy: 1.1184660539344162
Energy: 1.0970528109372664
Energy: 1.1184660539416034
Energy: 1.0970528109372664
Energy: 1.1928213582578386
Energy: 1.042215751287743
Energy: 1.1928213582362779
Energy: 1.0422157512949302
Energy: 1.1928213582398712
Energy: 1.0422157512949302
Energy: 1.1342779787222594
Energy: 1.0771710083633408
Energy: 1.1342776189438244
Energy: 1.07717100838843
Energy: 1.134277978711479
Energy: 1.0771710083848365
Energy: 1.0961825146821456
Energy: 1.068491732957857
Energy: 1.0961825146749584
Energy: 1.068491732954263
Energy: 1.0961825146641782
Energy: 1.0684917329470762
Energy: 1.0504430698310796
Energy: 1.1242261615805784
Energy: 1.0504430698526406
Energy: 1.124226161576985
Energy: 1.0504430698526406
Energy: 1.1242261615662046
Energy: 1.1346469502966037
Energy: 1.1361464038206606
Energy: 1.134646950300197
Energy: 1.1361464038170672
Energy: 1.1346469503109775
Energy: 1.1361464038170672
Energy: 1.0951624845207604
Energy: 1.1222436817338288
Energy: 1.0951316134118003
Energy: 1.1222436817087398
Energy: 1.0951624845351342
Energy: 1.1222436817087398

minimum gb energy = 0.9807626033827115 eV
minimum distance =  2.2868658863036 Angstroms
sigma value = 81


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

Energy: 1.306408982152005
Energy: 1.1021385588498083
Energy: 1.3064089821505254
Energy: 1.1021385588522743
Energy: 1.306408982152005
Energy: 1.102138558851288
Energy: 1.0560674500085092
Energy: 1.0321431750178656
Energy: 1.056067450009496
Energy: 1.032143175016386
Energy: 1.0560674500109755
Energy: 1.0321431750178656
Energy: 1.105299882040702
Energy: 0.9697929245529032
Energy: 1.1052998820421818
Energy: 0.9697929245524102
Energy: 1.105299882040702
Energy: 0.9697929245529032
Energy: 1.0544443725472568
Energy: 1.0459762235669183
Energy: 1.054444372548243
Energy: 1.0459762235797416
Energy: 1.0544443725442976
Energy: 1.0459762235733299
Energy: 1.0962568909486234
Energy: 1.0061867639778768
Energy: 1.0962568909491168
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Energy: 1.0962568909491168
Energy: 1.0061867639773838
Energy: 1.0350317543292462
Energy: 1.0425878364203396
Energy: 1.0350317543248073
Energy: 1.042587836412942
Energy: 1.0350317543302328
Energy: 1.042587836416394
Energy: 0.9695628613883855
Energy: 1.0424157353369983
Energy: 0.9695628613878923
Energy: 1.0424157353325596
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Energy: 1.113399317703986
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Energy: 1.0436007791228745
Energy: 0.9705837371246911
Energy: 1.0436007791238608
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Energy: 1.0436007791218882
Energy: 1.0559586897064461
Energy: 1.0310618350997396
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Energy: 1.031061835095301
Energy: 1.0559586897055047
Energy: 1.0310618350977667
Energy: 1.1117585423512564
Energy: 0.9695063132636644
Energy: 1.1117585423478042
Energy: 0.9695063132676099
Energy: 1.111758542357175
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Energy: 0.9694573438936032
Energy: 0.9593063931003648
Energy: 0.9694573438876849
Energy: 0.9593063931008581
Energy: 0.9694573438911371
Energy: 0.9593063931018445
Energy: 1.031334333398313
Energy: 0.9733327753576849
Energy: 1.0313343333992993
Energy: 0.9733327753571916
Energy: 1.0313343333968332
Energy: 0.9733327753562051
Energy: 1.1521699863829387
Energy: 1.042415894340718
Energy: 1.1521699863854047
Energy: 1.0424158943412114
Energy: 1.1521699863819521
Energy: 1.0424158943417043
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Energy: 1.1641452760380475
Energy: 0.9876976167254661
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Energy: 0.9876976167249728
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Energy: 0.973534675582638
Energy: 1.0799034662350546
Energy: 0.9735346755831311
Energy: 1.0799034662325886
Energy: 0.9735346755821447
Energy: 1.079903466231109
Energy: 1.046378526128504
Energy: 1.1928249388940626
Energy: 1.0463785261368883
Energy: 1.1928249388901169
Energy: 1.0463785261418204
Energy: 1.192824938889624
Energy: 1.0063529963978517
Energy: 1.031144924596216
Energy: 1.0063529963998243
Energy: 1.0311449245976956
Energy: 1.006352996405743
Energy: 1.0311449245972024
Energy: 1.0758537176411858
Energy: 1.0010701402876292
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Energy: 1.0010701402881224
Energy: 1.0758537176416787
Energy: 1.0010701402885707
Energy: 1.0768838907963671
Energy: 0.9459304480197553
Energy: 1.076883890795874
Energy: 0.9459304480222214
Energy: 1.07688389079834
Energy: 0.9459304480217281
Energy: 1.0551515911567504
Energy: 1.0952200831788161
Energy: 1.055151591155764
Energy: 1.0952200831768435
Energy: 1.0551515911597096
Energy: 1.0952200831778298
Energy: 1.1117535991836873
Energy: 1.1426308213472358
Energy: 1.1117535991851668
Energy: 1.1426308213511813
Energy: 1.1117535991827008
Energy: 1.1426308213521676
Energy: 0.9735103096196558
Energy: 1.3022818044907136
Energy: 0.9735103096162036
Energy: 1.3022818044892341
Energy: 0.9735103096166967
Energy: 1.302281804489727
Energy: 0.9874540308141992
Energy: 1.054729222616993
Energy: 0.987454030815679
Energy: 1.0547292226184726
Energy: 0.9874540308146926
Energy: 1.054729222619459
Energy: 1.0482833098411684
Energy: 1.0415640282907683
Energy: 1.0482833098461002
Energy: 1.0415640282853431
Energy: 1.0482833098525117
Energy: 1.0415640282912617
Energy: 1.0314965759004584
Energy: 1.056169023673463
Energy: 1.0314965759034176
Energy: 1.0561690236724768
Energy: 1.031496575901938
Energy: 1.0561690236724768
Energy: 0.9697459331372585
Energy: 0.9591748057595515
Energy: 0.9697459331416973
Energy: 0.9591748057605379
Energy: 0.9697459331372585
Energy: 0.9591748057600448
Energy: 1.0464652030780208
Energy: 0.9695442147450791
Energy: 1.04646520308098
Energy: 0.9695442147450791
Energy: 1.0464652030819663
Energy: 0.9695442147416267
Energy: 1.1083298692778727
Energy: 1.0952704651600134
Energy: 1.1083298692818182
Energy: 1.0952704651570542
Energy: 1.1083298692763932
Energy: 1.0952704651609997
Energy: 0.9707611403735326
Energy: 1.0503663943689932
Energy: 0.9707611403656413
Energy: 1.0503663943601158
Energy: 0.9707611403651482
Energy: 1.0503663944222592
Energy: 0.9732997953526017
Energy: 0.9886653500451075
Energy: 0.9732997953511221
Energy: 0.9886653500460939
Energy: 0.9732997953511221
Energy: 0.9886653500456006
Energy: 0.9866962456478157
Energy: 1.1521817830840344
Energy: 0.9866962456483089
Energy: 1.1521817830820615
Energy: 0.9866962456473225
Energy: 1.152181783085021
Energy: 1.2238039195886192
Energy: 1.0469001190453984
Energy: 1.2238039195886192
Energy: 1.0469001190409595
Energy: 1.2238039195871395
Energy: 1.04690011903948
Energy: 1.0312103385239306
Energy: 1.0093441782455657
Energy: 1.03121033852541
Energy: 1.0093441782494665
Energy: 1.0312103385259033
Energy: 1.0093441782524257
Energy: 1.0017524753781204
Energy: 1.047916897629347
Energy: 1.0017524753766407
Energy: 1.047916897627374
Energy: 1.0017524753766407
Energy: 1.04791689762984

minimum gb energy = 0.9459304480197553 eV
minimum distance =  2.2918195060943 Angstroms
sigma value = 43


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

Energy: 1.2762313096429516
Energy: 1.0414034120148516
Energy: 1.2762313096417401
Energy: 1.0414034120154576
Energy: 1.2762313096435574
Energy: 1.0414034120154576
Energy: 1.0879166378261533
Energy: 1.002441998100419
Energy: 1.0879166378267593
Energy: 1.002441998096784
Energy: 1.0879166378279708
Energy: 1.0024419980979957
Energy: 1.0724062871171427
Energy: 1.225861266140825
Energy: 1.0724062871189604
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Energy: 1.0323591762870696
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Energy: 1.0323591762816176
Energy: 1.1039991567769103
Energy: 1.0800063826697346
Energy: 1.1039991567763043
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Energy: 1.1039991567769103
Energy: 1.080006382668523
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Energy: 1.0789802157753678
Energy: 1.0335329161747133
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Energy: 1.033532916175319
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Energy: 0.9770036220959892
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Energy: 0.9770036220972008
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Energy: 1.023386086635561
Energy: 1.0870395622671187
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Energy: 1.0539372519829835
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Energy: 1.0539372519835895
Energy: 1.1329775525263373
Energy: 1.0791083255017209
Energy: 1.132977552533001
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Energy: 1.1329775525354244
Energy: 1.0791083255023268
Energy: 0.9741403321553854
Energy: 1.0869332757045809
Energy: 0.9741403321553854
Energy: 1.0869332757057923
Energy: 0.9741403321559914
Energy: 1.0869332757039751
Energy: 1.040496761067612
Energy: 1.0810449679081988
Energy: 1.0404967610640043
Energy: 1.0810449679094105
Energy: 1.040496761067612
Energy: 1.0810449679075929
Energy: 1.0576006713595694
Energy: 1.1197822828488175
Energy: 1.0576006713589634
Energy: 1.1197822828482116
Energy: 1.057600671360175
Energy: 1.1197822828488175
Energy: 1.1108037689723174
Energy: 1.0019669310139139
Energy: 1.1108037689692885
Energy: 1.0019669310151256
Energy: 1.110803768966865
Energy: 1.0019669310139139
Energy: 1.1673259536937985
Energy: 1.0566915948233324
Energy: 1.1673259536937985
Energy: 1.0566915948221205
Energy: 1.16732595369501
Energy: 1.0566915948233324
Energy: 1.1679611387085007
Energy: 1.0302405226705362
Energy: 1.1679611387078948
Energy: 1.0302405226705362
Energy: 1.1679611387066833
Energy: 1.0302405226705362
Energy: 1.1108216240658664
Energy: 1.004335890139528
Energy: 1.1108216240664723
Energy: 1.0043358901407395
Energy: 1.1108216240670783
Energy: 1.0043358901413455
Energy: 1.0578886087668173
Energy: 1.0100325475097778
Energy: 1.0578886087668173
Energy: 1.0100325475043253
Energy: 1.0578886087668173
Energy: 1.0100325475140182
Energy: 1.1696367187414958
Energy: 1.0957840797413811
Energy: 1.1696367187414958
Energy: 1.0957840797407754
Energy: 1.1696367187390726
Energy: 1.0957840797413811
Energy: 0.9741923471420728
Energy: 1.1121947988884446
Energy: 0.9741923471420728
Energy: 1.1121947988884446
Energy: 0.9741923471420728
Energy: 1.1121947988884446
Energy: 1.135321925337307
Energy: 1.0788861013119164
Energy: 1.1353219253391245
Energy: 1.0788861013125224
Energy: 1.1353219253397302
Energy: 1.0788861013100992
Energy: 1.0487499521149068
Energy: 1.0308959193252192
Energy: 1.048749952116118
Energy: 1.0308959193276424
Energy: 1.048749952116118
Energy: 1.0308959193240075
Energy: 1.1697710932606744
Energy: 1.0864566988984317
Energy: 1.1697710932606744
Energy: 1.0864566988972202
Energy: 1.169771093258251
Energy: 1.0864566988990374
Energy: 1.0687345974376679
Energy: 1.0018944626801096
Energy: 1.0687345974376679
Energy: 1.001894462678898
Energy: 1.068734597439485
Energy: 1.001894462677108
Energy: 1.1032489729166608
Energy: 0.9778233783240792
Energy: 1.1032489729069677
Energy: 0.9778233783246851
Energy: 1.1032489729021213
Energy: 0.9778233783234735
Energy: 1.0487432413175104
Energy: 1.0809275621643242
Energy: 1.0487432413175104
Energy: 1.0809275621691705
Energy: 1.0487432413175104
Energy: 1.0809275621649297
Energy: 1.0995657130380079
Energy: 1.1098035993988087
Energy: 1.0995657130374024
Energy: 1.1098035993975972
Energy: 1.0995657130380079
Energy: 1.109803599398203
Energy: 1.0335282139580393
Energy: 1.0789147913670614
Energy: 1.0335282139550102
Energy: 1.0789147913670614
Energy: 1.0335282139592505
Energy: 1.0789147913664554

minimum gb energy = 0.9741403321553854 eV
minimum distance =  2.30276950779903 Angstroms
sigma value = 57


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

Energy: 1.158075482814121
Energy: 0.9939131054553545
Energy: 1.1580754828133368
Energy: 0.9939131054561389
Energy: 1.1580754828133368
Energy: 0.9939131054561389
Energy: 1.0611369409427005
Energy: 0.9371430551069045
Energy: 1.0611369409419162
Energy: 0.93714305510612
Energy: 1.0611369409403473
Energy: 0.9371430551045511
Energy: 1.066220464949281
Energy: 1.1916560991751293
Energy: 1.0662204649422216
Energy: 1.1916560991751293
Energy: 1.066220464953203
Energy: 1.191656099178267
Energy: 1.0555285351880828
Energy: 1.0799313721123325
Energy: 1.055528535184161
Energy: 1.0799313721107995
Energy: 1.055528535183412
Energy: 1.0799313721107995
Energy: 1.0813169899738861
Energy: 1.0785126257822861
Energy: 1.0813169899731014
Energy: 1.0785126257815016
Energy: 1.0813169899731014
Energy: 1.0785126257862079
Energy: 1.0656707075496745
Energy: 0.9368586667444561
Energy: 1.0656707075535963
Energy: 0.9368586667405697
Energy: 1.0656707075575182
Energy: 0.9368586667436717
Energy: 1.088514529442697
Energy: 1.137588144400512
Energy: 1.088514529442697
Energy: 1.1375881443997278
Energy: 1.088514529442697
Energy: 1.1375881443997278
Energy: 1.0561605299897616
Energy: 0.9942827332918475
Energy: 1.0561605299889771
Energy: 0.9942827332942007
Energy: 1.0561605299889771
Energy: 0.9942827332934161
Energy: 1.0609350640448172
Energy: 0.9368434738912856
Energy: 1.0609350640471704
Energy: 0.9368434738905012
Energy: 1.0609350640448172
Energy: 0.9368434738912856
Energy: 0.927146663477903
Energy: 0.9361520205132938
Energy: 0.9271466634771185
Energy: 1.0713558183696983
Energy: 0.927146663477903
Energy: 1.0556958684529196
Energy: 1.0884094012868724
Energy: 1.0796443684399206
Energy: 1.0884094012837349
Energy: 1.0796443684375674
Energy: 1.0884094012915788
Energy: 1.0796443684383519
Energy: 1.0689756130407957
Energy: 1.1426416599608935
Energy: 1.0689756130423644
Energy: 1.1426416599569718
Energy: 1.068975613045502
Energy: 1.1426416599561875
Energy: 1.075089497694987
Energy: 0.9368382775113429
Energy: 1.075089497696556
Energy: 0.9368382775121272
Energy: 1.0750894976902807
Energy: 0.936838277513696
Energy: 1.0470086770880696
Energy: 0.99224313743563
Energy: 1.0470086770825788
Energy: 1.059509924040156
Energy: 1.0470086771154876
Energy: 0.9456880803072559
Energy: 1.0469284882530934
Energy: 0.9429824001568587
Energy: 1.046928488244465
Energy: 0.9429824001560742
Energy: 1.046928488246818
Energy: 0.9429824001552898
Energy: 1.059495176514897
Energy: 1.0368138342273232
Energy: 1.0594951765156817
Energy: 1.0368138342265392
Energy: 1.059495176514113
Energy: 1.0368138342273232
Energy: 0.9198003369566069
Energy: 1.0600434269287269
Energy: 0.9198003369566069
Energy: 1.0600434269271584
Energy: 0.9198003369573915
Energy: 1.0600434269287269
Energy: 1.0850504562683645
Energy: 1.014135154436873
Energy: 1.085050456271502
Energy: 1.2258759849257224
Energy: 1.085050456266831
Energy: 1.076355924646338
Energy: 0.919703651643054
Energy: 1.060207006704371
Energy: 0.919703651646976
Energy: 1.060207006704371
Energy: 0.919703651644623
Energy: 1.0602070067020177
Energy: 1.0594965337776439
Energy: 1.0368493463289206
Energy: 1.0594965337760751
Energy: 1.0368493463304893
Energy: 1.0594965337784281
Energy: 1.0368493463304893
Energy: 1.0465761742379869
Energy: 0.9430427004912142
Energy: 1.0465761742293587
Energy: 0.9430427004888611
Energy: 1.0465761742293587
Energy: 0.9430427004896453
Energy: 1.0475488486631865
Energy: 0.9921902196608672
Energy: 1.047548848662402
Energy: 0.9921902196600826
Energy: 1.0475488486294933
Energy: 0.9921902196608672
Energy: 1.0753498655953766
Energy: 0.9370262585233452
Energy: 1.0753498655930236
Energy: 0.9370262585162856
Energy: 1.0753498655992986
Energy: 0.9370262585217763
Energy: 1.0686530799456506
Energy: 1.142563415284723
Energy: 1.0686530799440819
Energy: 1.1425634152760946
Energy: 1.068653079946435
Energy: 1.142563415279232

minimum gb energy = 0.919703651643054 eV
minimum distance =  2.30353229346436 Angstroms
sigma value = 17


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

Energy: 1.1132715118644498
Energy: 0.9933367236495357
Energy: 1.1132715118633405
Energy: 0.9933367236495357
Energy: 1.1132715118633405
Energy: 0.9933367236495357
Energy: 0.9449096669944088
Energy: 0.9411343203345555
Energy: 0.9449096669944088
Energy: 0.9411343203345555
Energy: 0.9449096669944088
Energy: 0.9411343203334462
Energy: 1.0460678797365979
Energy: 1.1210324040019217
Energy: 1.0460678797388165
Energy: 1.1210324040030308
Energy: 1.0460678797388165
Energy: 1.1210324040019217
Energy: 0.8830713026780005
Energy: 1.070247073183476
Energy: 0.8830713026780005
Energy: 1.070247073186804
Energy: 0.8830713026791098
Energy: 1.070247073183476
Energy: 1.0901294032515068
Energy: 1.0451233041474646
Energy: 1.0901294032537252
Energy: 1.0451233041474646
Energy: 1.090129403257053
Energy: 1.045123304145246
Energy: 0.9968166356655024
Energy: 1.0801446875469625
Energy: 0.9968166356621744
Energy: 1.0801446875458534
Energy: 0.9968166356643932
Energy: 1.0801446875458534
Energy: 1.1021819781254578
Energy: 0.9349044354796182
Energy: 1.1021819781254578
Energy: 0.9349044354796182
Energy: 1.1021819781254578
Energy: 0.9349044354796182
Energy: 0.8826234512159795
Energy: 1.0612026306750413
Energy: 0.8826234512148702
Energy: 1.0612026306717133
Energy: 0.8826234512137608
Energy: 1.0612026306761504
Energy: 1.0245965254299565
Energy: 0.9403352989241108
Energy: 1.024596525432175
Energy: 0.9403352989218922
Energy: 1.0245965254299565
Energy: 0.9403352989207828
Energy: 1.010255998348252
Energy: 0.9474306815590895
Energy: 1.010255998348252
Energy: 0.9474306815590895
Energy: 1.010255998348252
Energy: 0.9474306815579804
Energy: 0.9929817236749543
Energy: 1.0622606213072832
Energy: 0.9929817236782822
Energy: 1.0622606213095018
Energy: 0.9929817236749543
Energy: 1.0622606213083925
Energy: 1.0079074356360807
Energy: 0.9406790901292587
Energy: 1.0079074356327526
Energy: 0.9406790901292587
Energy: 1.0079074356316435
Energy: 0.940679090130368
Energy: 0.8819976699808476
Energy: 1.0780342437784407
Energy: 0.8819976699808476
Energy: 1.078034243776222
Energy: 0.8819976699819569
Energy: 1.0780342437773314
Energy: 1.010383032115997
Energy: 1.045686169433596
Energy: 1.010383032115997
Energy: 1.045686169433596
Energy: 1.010383032115997
Energy: 1.0456861694324866
Energy: 0.9966852825422108
Energy: 1.1809361726283216
Energy: 0.9966852825422108
Energy: 1.1809361726283216
Energy: 0.9966852825411014
Energy: 1.1809361726272125
Energy: 0.9966193710196316
Energy: 1.078139785495437
Energy: 0.9966193710240688
Energy: 1.0781397854932184
Energy: 0.9966193710218503
Energy: 1.0781397854932184
Energy: 1.0081827477318321
Energy: 1.0472920252181381
Energy: 1.0081827477307228
Energy: 1.0472920252181381
Energy: 1.0081827477340508
Energy: 1.0472920252170288

minimum gb energy = 0.8819976699808476 eV
minimum distance =  2.27672052793145 Angstroms
sigma value = 17


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

Energy: 1.0208227253583753
Energy: 0.9081457970620513
Energy: 1.0208227253549482
Energy: 0.9081457970599094
Energy: 1.0208227253558049
Energy: 0.9081457970611945
Energy: 0.9139821319377279
Energy: 0.8703350894971257
Energy: 0.9139821319334441
Energy: 0.8703350894979826
Energy: 0.9139821319304456
Energy: 0.870335089496269
Energy: 0.9880905950413843
Energy: 0.940841372247069
Energy: 0.9880905950400991
Energy: 0.9408413722444987
Energy: 0.9880905950405274
Energy: 0.9408413722462123
Energy: 0.84294436902014
Energy: 0.9361521823230172
Energy: 0.8429443690278507
Energy: 0.936152182323874
Energy: 0.8429443690218535
Energy: 0.9361521823251591
Energy: 1.0274370981926935
Energy: 0.8695722947841898
Energy: 1.0274370981914083
Energy: 0.8695722947880452
Energy: 1.0274370981982623
Energy: 0.8695722947824762
Energy: 0.9481602562417737
Energy: 0.8855740279436918
Energy: 0.9481602562417737
Energy: 0.8855740279449379
Energy: 0.9481602562387752
Energy: 0.885574027942835
Energy: 0.9175841562387471
Energy: 0.9069390764098679
Energy: 0.9175841562366053
Energy: 0.9069390764000154
Energy: 0.9175841562344632
Energy: 0.906939076399587
Energy: 0.9284108992866253
Energy: 1.0132793103575046
Energy: 0.928410899293051
Energy: 1.0132793103712123
Energy: 0.9284108992917659
Energy: 1.0132793103908786
Energy: 0.9422766129878487
Energy: 0.9694057305981219
Energy: 0.9422766129865636
Energy: 0.9694057306015489
Energy: 0.9422766129839933
Energy: 0.969405730599407
Energy: 0.9173596843589068
Energy: 0.8231215628183303
Energy: 0.9173596843606203
Energy: 0.8231215628153319
Energy: 0.9173596843640472
Energy: 0.8231215628170453
Energy: 0.8443341469967772
Energy: 1.1009426331180177
Energy: 0.8443341470032029
Energy: 1.1009426331175893
Energy: 0.844334147004488
Energy: 1.100942633117161
Energy: 0.9933220850220194
Energy: 0.8979514076248701
Energy: 0.9933220850190206
Energy: 0.897951407627012
Energy: 0.993322085023733
Energy: 0.8979514076261553
Energy: 0.9389407903471241
Energy: 0.8976979940578531
Energy: 0.9389407903462672
Energy: 0.8976979940578531
Energy: 0.9389407903484092
Energy: 0.8976979940582815
Energy: 0.9225589063959457
Energy: 0.9979985766035748
Energy: 0.9225589063985159
Energy: 0.9979985766022897
Energy: 0.9225589063980875
Energy: 0.9979985766052882
Energy: 0.9546744342138841
Energy: 0.8969034890430354
Energy: 0.9546744342254112
Energy: 0.8969034890434636
Energy: 0.9546744342143125
Energy: 0.8969034890443206
Energy: 0.8425070578601649
Energy: 0.9875508998185076
Energy: 0.8425070578593081
Energy: 0.9963768754215652
Energy: 0.8425070578601649
Energy: 0.9565635967634041
Energy: 0.9380262018296642
Energy: 0.9357081468325289
Energy: 0.9380262018266655
Energy: 0.9357081468329572
Energy: 0.9380262018292358
Energy: 0.9357081468329572
Energy: 0.9565540483382434
Energy: 1.1270247614130913
Energy: 0.9565540483292476
Energy: 1.1270247614152331
Energy: 0.9565540483408137
Energy: 1.1270247614135194
Energy: 0.9289374666836248
Energy: 0.9538186842642205
Energy: 0.9289374666844814
Energy: 0.9538186842586516
Energy: 0.928937466684053
Energy: 0.9538186842625069
Energy: 0.9368692012711244
Energy: 0.9248642332906626
Energy: 0.9368692012749407
Energy: 0.9366795995999888
Energy: 0.9368692012719422
Energy: 0.9117143853265757
Energy: 0.9289079763919098
Energy: 0.954714133650503
Energy: 0.9289079763829139
Energy: 0.9547141336453625
Energy: 0.9289079763889113
Energy: 0.9547141336479327
Energy: 0.9567676928607458
Energy: 1.1270199993342935
Energy: 0.9567676928581756
Energy: 1.1270199993338652
Energy: 0.9567676928521782
Energy: 1.1270199993330086
Energy: 0.9380996702332531
Energy: 0.9355521238672956
Energy: 0.9380996702332531
Energy: 0.9355521238694374
Energy: 0.9380996702353952
Energy: 0.9355521238681522
Energy: 0.8425017829981811
Energy: 1.0266904793330909
Energy: 0.842501782995611
Energy: 1.026690479333519
Energy: 0.8425017829977527
Energy: 1.0266904793356613
Energy: 0.954770119243684
Energy: 0.8968523276861401
Energy: 0.9547701192591055
Energy: 0.8968523276651498
Energy: 0.9547701192620653
Energy: 0.8968523276750024
Energy: 0.9225397315410853
Energy: 0.9978090455529296
Energy: 0.9225397315419421
Energy: 0.9978090455503593
Energy: 0.9225397315432272
Energy: 0.997809045549931
Energy: 0.9389302159200139
Energy: 0.8979819057914136
Energy: 0.9389302159161586
Energy: 0.8979819057905568
Energy: 0.9389302159230126
Energy: 0.8979819057939837
Energy: 0.9933472535269697
Energy: 0.8980674906418099
Energy: 0.9933472535265413
Energy: 0.8980674906375262
Energy: 0.9933472535256845
Energy: 0.8980674906396682
Energy: 0.8443377427810224
Energy: 1.10086397885778
Energy: 0.8443377427857345
Energy: 1.1008639788582084
Energy: 0.8443377427844493
Energy: 1.1008639788569232
Energy: 0.9172658040676513
Energy: 0.9706255363975631
Energy: 0.9172658040505165
Energy: 0.97062553639842
Energy: 0.9172658040667946
Energy: 0.9706255363975631
Energy: 0.9425070473195382
Energy: 0.9693551809011214
Energy: 0.94250704732168
Energy: 0.9693551809071186
Energy: 0.9425070473293907
Energy: 0.9693551809058335
Energy: 0.9284006437045244
Energy: 1.0128339541485583
Energy: 0.9284006437062378
Energy: 1.0128339541378488
Energy: 0.9284006437040959
Energy: 1.012833954144703
Energy: 0.9176951986787133
Energy: 0.9065860069557995
Energy: 0.9176951986748579
Energy: 0.9065860069510873
Energy: 0.9176951986748579
Energy: 0.9065860069566561
Energy: 0.9481708527887853
Energy: 0.8950075738134766
Energy: 0.9481708527892135
Energy: 0.8950075738156184
Energy: 0.9481708527900703
Energy: 0.8950075738151901
Energy: 1.0273577467970916
Energy: 0.8696128767329395
Energy: 1.0273577467898092
Energy: 0.8696128767248004
Energy: 1.0273577467945212
Energy: 0.8696128767188033
Energy: 0.8427597499509616
Energy: 0.9362208791028164
Energy: 0.8427597499501046
Energy: 0.9362208791053865
Energy: 0.8427597499531033
Energy: 0.9362208791058149
Energy: 0.988314113436598
Energy: 0.9407943375881527
Energy: 0.9883141134357414
Energy: 0.9407943375885811
Energy: 0.9883141134374547
Energy: 0.9407943375881527
Energy: 0.9135335813190983
Energy: 0.8801064051250678
Energy: 0.9135335813156714
Energy: 0.8801064051250678
Energy: 0.9135335813135295
Energy: 0.8801064051254962
Energy: 1.0208227253588038
Energy: 0.9081457970616229
Energy: 1.02082272535709
Energy: 0.9081457970629081
Energy: 1.0208227253540914
Energy: 0.9081457970611945
Energy: 0.9139821319450102
Energy: 0.8703350894924137
Energy: 0.9139821319441535
Energy: 0.8703350894894152
Energy: 0.9139821319424399
Energy: 0.8703350894915569
Energy: 0.9880905950328167
Energy: 0.9408413722359313
Energy: 0.9880905950332451
Energy: 0.9408413722350746
Energy: 0.98809059503196
Energy: 0.9408413722355028
Energy: 0.8429443690227103
Energy: 0.9575744113428252
Energy: 0.8429443690278507
Energy: 0.9575744113393981
Energy: 0.8429443690192834
Energy: 0.9575744113376847
Energy: 1.0274370981986904
Energy: 0.8695722947824762
Energy: 1.0274370981914083
Energy: 0.8695722947696253
Energy: 1.0274370981939787
Energy: 0.869572294764913

minimum gb energy = 0.8231215628153319 eV
minimum distance =  2.31389221709109 Angstroms
sigma value = 57


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

Energy: 0.8663871432682113
Energy: 0.8484839149657663
Energy: 0.8663871432723962
Energy: 0.8484839149629764
Energy: 0.8663871432703038
Energy: 0.8484839149657663
Energy: 0.9465864520739974
Energy: 0.8325684485823487
Energy: 0.9465864520746947
Energy: 0.8325684485823487
Energy: 0.9465864520767873
Energy: 0.8325684485830462
Energy: 0.9356927982854398
Energy: 0.885699659440613
Energy: 0.9356927982847424
Energy: 0.885699659443403
Energy: 0.9356927982812548
Energy: 0.8856996594441003
Energy: 0.8064393639517883
Energy: 0.9099498090490484
Energy: 0.8064393639476034
Energy: 0.9099498090504434
Energy: 0.8064393639469059
Energy: 0.9099498090504434
Energy: 0.9477701675583337
Energy: 0.7750847942197735
Energy: 0.9477701675548461
Energy: 0.7750847942204709
Energy: 0.9477701675541487
Energy: 0.7750847942218659
Energy: 0.9006239228176862
Energy: 0.8328575930193359
Energy: 0.900623922823266
Energy: 0.8328575930158485
Energy: 0.9006239228148962
Energy: 0.8328575930186385
Energy: 0.7892837536003573
Energy: 0.8766267607295907
Energy: 0.7892837536024497
Energy: 0.8766267607247081
Energy: 0.7892837536101222
Energy: 0.8766267607254057
Energy: 1.0567654943784994
Energy: 0.8707842866938166
Energy: 1.0567654943784994
Energy: 0.870784286687539
Energy: 1.0567654943826843
Energy: 0.870784286688934
Energy: 0.8366180016537985
Energy: 0.8352848138061232
Energy: 0.8366180016565886
Energy: 0.8352848138040307
Energy: 0.8366180016572861
Energy: 0.8352848138054257
Energy: 0.8531567945953151
Energy: 0.8522621273130703
Energy: 0.8531567945960127
Energy: 0.8522621273130703
Energy: 0.8531567945904329
Energy: 0.8522621273116753
Energy: 0.7896693849125478
Energy: 1.0416860413174491
Energy: 0.7896693848847116
Energy: 1.0416860413202391
Energy: 0.7896693849055729
Energy: 1.0416860413188442
Energy: 0.8638493725860635
Energy: 0.8011572198089488
Energy: 0.8638493725811812
Energy: 0.8011572198180162
Energy: 0.863849372585366
Energy: 0.8011572198152264
Energy: 0.8523451536184276
Energy: 0.9094729483754362
Energy: 0.8523451536051753
Energy: 0.9094729483726463
Energy: 0.8523451536267975
Energy: 0.9094729483761337
Energy: 0.8034077729981416
Energy: 0.875616194165363
Energy: 0.803407772996049
Energy: 0.8756161941744304
Energy: 0.8034077729953516
Energy: 0.8756161941751279
Energy: 0.9246449636966689
Energy: 0.84688878358553
Energy: 0.9246449636966689
Energy: 0.8468887835715803
Energy: 0.9246449636980639
Energy: 0.8468887835666977
Energy: 0.850070858089717
Energy: 0.939795865083136
Energy: 0.850070858089717
Energy: 0.9397958650824385
Energy: 0.8500708580883221
Energy: 0.939795865081741
Energy: 0.8630620317724124
Energy: 0.952826633560073
Energy: 0.8630620317696223
Energy: 0.9528266335593755
Energy: 0.8630620317703198
Energy: 0.952826633560073
Energy: 0.9006398410244052
Energy: 0.9392777489534517
Energy: 0.9006398410202203
Energy: 0.939277748968099
Energy: 0.9006398410174303
Energy: 0.939277748970889
Energy: 0.803078461537245
Energy: 0.9994346281653398
Energy: 0.8030784615379425
Energy: 0.9994346281653398
Energy: 0.803078461542825
Energy: 0.9994346281660373
Energy: 0.8034460653659969
Energy: 0.8998214119639808
Energy: 0.8034460653673919
Energy: 0.8998214119660732
Energy: 0.8034460653666944
Energy: 0.8998214119632832
Energy: 0.8873148876262205
Energy: 1.0553486047723442
Energy: 0.887314887628313
Energy: 1.0553486047772267
Energy: 0.887314887629708
Energy: 1.0553486047709493
Energy: 0.7893516180672858
Energy: 1.003500021519316
Energy: 0.7893516180596134
Energy: 1.0035000215186185
Energy: 0.7893516180672858
Energy: 1.003500021519316
Energy: 0.8761428254177436
Energy: 0.8639204730841482
Energy: 0.8761428254149536
Energy: 0.8639204730841482
Energy: 0.876142825418441
Energy: 0.8639204730841482
Energy: 0.8634208565444702
Energy: 0.8183039454030543
Energy: 0.8634208565395878
Energy: 0.8183039454183991
Energy: 0.8634208565409827
Energy: 0.8183039454170041
Energy: 0.863466169836083
Energy: 1.0632244374760187
Energy: 0.8634661698507304
Energy: 1.0632244374746238
Energy: 0.8634661698597978
Energy: 1.0632244374767164
Energy: 0.8491257738640037
Energy: 0.8626541877951953
Energy: 0.8491257738674912
Energy: 0.8626541877944979
Energy: 0.8491257738653988
Energy: 0.8626541877944979
Energy: 0.7890052835530332
Energy: 0.999125017551877
Energy: 0.7890052835516382
Energy: 0.999125017556062
Energy: 0.7890052835530332
Energy: 0.9991250175539695

minimum gb energy = 0.7750847942197735 eV
minimum distance =  2.26892747640919 Angstroms
sigma value = 43


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

Energy: 0.8224175866109529
Energy: 0.780406492175743
Energy: 0.8224175866109529
Energy: 0.780406492175743
Energy: 0.8224175866109529
Energy: 0.780406492175743
Energy: 0.8431881818339022
Energy: 0.7880766379146754
Energy: 0.8431881818328859
Energy: 0.7880766379151836
Energy: 0.8431881818328859
Energy: 0.7880766379142135
Energy: 0.8284423171126474
Energy: 0.8263888255041321
Energy: 0.8284423171141718
Energy: 0.8263888255051484
Energy: 0.8284423171136637
Energy: 0.8263888255056566
Energy: 0.7856071750673908
Energy: 0.8001663352934651
Energy: 0.785607175078571
Energy: 0.8001663352924487
Energy: 0.7856071750780629
Energy: 0.8001663352924487
Energy: 0.8352398204286633
Energy: 0.7509667750765125
Energy: 0.8352398204276469
Energy: 0.7509667750785454
Energy: 0.8352398204225648
Energy: 0.7509667750765125
Energy: 0.7876038984152803
Energy: 0.7632015757690157
Energy: 0.7876038984178213
Energy: 0.7632015757700322
Energy: 0.7876038984137558
Energy: 0.7632015757705404
Energy: 0.776594631701729
Energy: 0.7773703755298816
Energy: 0.776594631701729
Energy: 0.7773703755273406
Energy: 0.7765946317037619
Energy: 0.7773703755268323
Energy: 0.8355351572512315
Energy: 0.7377770466058368
Energy: 0.8355351572542807
Energy: 0.7377770466053286
Energy: 0.8355351572492449
Energy: 0.7377770466032959
Energy: 0.7481111840795684
Energy: 0.7539213699453088
Energy: 0.7481111840795684
Energy: 0.7539213699468333
Energy: 0.7481111840816012
Energy: 0.7539213699488662
Energy: 0.8449272227928709
Energy: 0.7422268330201638
Energy: 0.8449272227923625
Energy: 0.742226833020672
Energy: 0.8449272227949035
Energy: 0.7422268330176229
Energy: 0.9065222986091148
Energy: 0.8920365811557459
Energy: 0.9065222986075903
Energy: 0.8920365811567622
Energy: 0.9065222986091148
Energy: 0.8920365811557459
Energy: 0.7236960969707246
Energy: 0.7522705034964424
Energy: 0.7236960969681836
Energy: 0.7522705034872949
Energy: 0.7236960969712327
Energy: 0.7522705034964424
Energy: 0.8441912436372956
Energy: 0.7131884389190193
Energy: 0.844191243635771
Energy: 0.7131884389195274
Energy: 0.8441912436347545
Energy: 0.7131884389164783
Energy: 0.9050617380569196
Energy: 0.8922959161270824
Energy: 0.9050617380569196
Energy: 0.8922959161280989
Energy: 0.9050617380543786
Energy: 0.8922959161291152
Energy: 0.741954011265866
Energy: 0.7528992840987291
Energy: 0.7419540112714561
Energy: 0.7528992840982208
Energy: 0.7419540112694235
Energy: 0.7528992840977126
Energy: 0.79999232598491
Energy: 0.780783950570231
Energy: 0.7999923259910083
Energy: 0.7807839505712473
Energy: 0.7999923259833854
Energy: 0.7807839505671818
Energy: 0.9141076197366922
Energy: 0.812299163463074
Energy: 0.914107619735676
Energy: 0.8122991634686642
Energy: 0.9141076197361842
Energy: 0.8122991634645985
Energy: 0.7594729582026072
Energy: 0.7448142363698919
Energy: 0.7594729582015908
Energy: 0.7448142363683672
Energy: 0.7594729582051482
Energy: 0.7448142363673508
Energy: 0.7658928819778055
Energy: 0.8473912360052748
Energy: 0.7658928819783136
Energy: 0.8473912360047666
Energy: 0.7658928819823793
Energy: 0.8473912360042584
Energy: 0.7933881726507894
Energy: 0.7403177603479179
Energy: 0.7933881726507894
Energy: 0.7403177603494423
Energy: 0.7933881726502813
Energy: 0.7403177603469013
Energy: 0.819649463855103
Energy: 0.7656340386543733
Energy: 0.81964946384748
Energy: 0.7656340386564061
Energy: 0.8196494638545949
Energy: 0.7656340386564061
Energy: 0.795539922077924
Energy: 0.8347704263263218
Energy: 0.7955399220784323
Energy: 0.8347704263273383
Energy: 0.795539922075383
Energy: 0.8347704263273383
Energy: 0.8106362480086371
Energy: 0.8353175015308644
Energy: 0.8106362480096535
Energy: 0.8353175015303561
Energy: 0.8106362480116863
Energy: 0.8353175015303561
Energy: 0.8735187916336994
Energy: 0.7648889869478984
Energy: 0.8735187916357322
Energy: 0.7648889869575541
Energy: 0.8735187916372568
Energy: 0.7648889869514558
Energy: 0.7210857703109838
Energy: 0.8159700566129842
Energy: 0.7210857703089509
Energy: 0.815970056617558
Energy: 0.721085770314033
Energy: 0.815970056617558
Energy: 0.7444626831874415
Energy: 0.799709478634647
Energy: 0.744462683185917
Energy: 0.799709478634647
Energy: 0.7444626831843923
Energy: 0.7997094786356634
Energy: 0.8003039355830031
Energy: 0.7422442235201788
Energy: 0.8003039355830031
Energy: 0.7422442235191623
Energy: 0.8014622148572856
Energy: 0.7422442235176377
Energy: 0.6834777222399706
Energy: 0.8134382078554313
Energy: 0.6834777222399706
Energy: 0.8134382078564478
Energy: 0.6834777222394622
Energy: 0.8134382078584805
Energy: 0.7444135762412821
Energy: 0.7507256718531645
Energy: 0.7444135762387412
Energy: 0.7507256718531645
Energy: 0.744413576240774
Energy: 0.7507256718531645
Energy: 0.7367971246607321
Energy: 0.7380089640471101
Energy: 0.7367971246581912
Energy: 0.7380089640471101
Energy: 0.7367971246581912
Energy: 0.7380089640466019
Energy: 0.6688258865343449
Energy: 0.8125830252883166
Energy: 0.6688258865333285
Energy: 0.812583025289333
Energy: 0.7362224798539847
Energy: 0.8125830252852674
Energy: 0.7449777818466354
Energy: 0.7276230723405469
Energy: 0.7449777818466354
Energy: 0.7276230723405469
Energy: 0.744977781845619
Energy: 0.7276230723405469
Energy: 0.7199500802636737
Energy: 0.8163916456289071
Energy: 0.7199500802677391
Energy: 0.8163916456268743
Energy: 0.7199500802641818
Energy: 0.8163916456289071
Energy: 0.9043074235594731
Energy: 0.8182530986213533
Energy: 0.9043074235594731
Energy: 0.8182530986203369
Energy: 0.904307423556932
Energy: 0.8182530986147467
Energy: 0.7464497850064622
Energy: 0.7133984206840964
Energy: 0.7464497850064622
Energy: 0.7133984206769817
Energy: 0.7464497850059539
Energy: 0.7133984206835882
Energy: 0.6674251099731515
Energy: 0.8150638393562666
Energy: 0.6674251099736597
Energy: 0.8150638393567748
Energy: 0.6674251099772172
Energy: 0.8150638393588076

minimum gb energy = 0.6674251099731515 eV
minimum distance =  2.25787672682908 Angstroms
sigma value = 81


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

Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.5543239066194378
Energy: 0.0853412926222537
Energy: 0.5543239066175706
Energy: 0.08534129262412093
Energy: 0.5543239066175706
Energy: 0.0853412926222537
Energy: 0.5542886386590448
Energy: 0.08607305621914008
Energy: 0.5542886386590448
Energy: 0.08607305622474178
Energy: 0.5542886386590448
Energy: 0.08607305622660902
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.5543239066175706
Energy: 0.08534129262972263
Energy: 0.5543239066175706
Energy: 0.08534129262972263
Energy: 0.5543239066194378
Energy: 0.08534129262972263
Energy: 0.5542886386590448
Energy: 0.08607305623221072
Energy: 0.5542886386590448
Energy: 0.08607305622100732
Energy: 0.5542886386571776
Energy: 0.08607305621540562
Energy: 0.08394471487906024
Energy: 0.1365236770897871
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.5543239066194378
Energy: 0.08534129263345709
Energy: 0.5543239066194378
Energy: 0.08534129263345709
Energy: 0.5543239066194378
Energy: 0.08534129262598818
Energy: 0.5542886386590448
Energy: 0.08607305623034348
Energy: 0.554288638660912
Energy: 0.08607305623034348
Energy: 0.5542886386590448
Energy: 0.08607305623221072
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.13652367708791982
Energy: 0.08394471487906024
Energy: 0.1365236770897871

minimum gb energy = 0.08394471487906024 eV
minimum distance =  2.46412366594235 Angstroms
sigma value = 3


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

Energy: 0.8732504909047955
Energy: 0.7511976914833366
Energy: 0.8732504909075893
Energy: 0.7511976914838954
Energy: 0.8732504909075893
Energy: 0.7511976914838954
Energy: 0.7435710286016215
Energy: 0.7491676145910462
Energy: 0.74357102859771
Energy: 0.7491676145904874
Energy: 0.7435710286032978
Energy: 0.749167614591605
Energy: 0.76049208332004
Energy: 0.7526150485607991
Energy: 0.7903805851672905
Energy: 0.7526150485613577
Energy: 0.7572729034403622
Energy: 0.7526150485624753
Energy: 0.8146613037155481
Energy: 0.7504556403120161
Energy: 0.814661303716107
Energy: 0.7504556403108985
Energy: 0.8146613037149893
Energy: 0.750455640309781
Energy: 0.6470897347886239
Energy: 0.7557403110481645
Energy: 0.6470897347903003
Energy: 0.7557403110487233
Energy: 0.6470897347886239
Energy: 0.7557403110481645
Energy: 0.7622365823378947
Energy: 0.7692296696074714
Energy: 0.7622365823362183
Energy: 0.7692296696074714
Energy: 0.7622365823351006
Energy: 0.7692296696074714
Energy: 0.7590210952869019
Energy: 0.7363416919867001
Energy: 0.7590210952846667
Energy: 0.736341691989494
Energy: 0.7590210952874606
Energy: 0.7363416919911702
Energy: 0.6435511845825778
Energy: 0.7547732220181372
Energy: 0.6435511845825778
Energy: 0.7547732220159021
Energy: 0.6435511845820191
Energy: 0.7547732220170196
Energy: 0.7702769263831803
Energy: 0.7724359811558452
Energy: 0.7702769263831803
Energy: 0.7724359811558452
Energy: 0.7702769263826216
Energy: 0.7724359811536101
Energy: 0.723479033206638
Energy: 0.677183565404191
Energy: 0.7234790332027264
Energy: 0.677183565399162
Energy: 0.7234790332049618
Energy: 0.6771835653980445
Energy: 0.6798072335396947
Energy: 0.7498936030714932
Energy: 0.6798072335408123
Energy: 0.7498936030709344
Energy: 0.6798072335419298
Energy: 0.7498936030703757
Energy: 0.7890450093094842
Energy: 0.8006443793597341
Energy: 0.7890450093089254
Energy: 0.8006443793586165
Energy: 0.7890450093083666
Energy: 0.8006443793597341
Energy: 0.7748599558864705
Energy: 0.6450617365466839
Energy: 0.774859955885353
Energy: 0.64506173654389
Energy: 0.7748599558892644
Energy: 0.6450617365450075
Energy: 0.7000669686476223
Energy: 0.7861141833283192
Energy: 0.7000669686498573
Energy: 0.7861141833283192
Energy: 0.7000669686492985
Energy: 0.7861141833294367
Energy: 0.7619723740623984
Energy: 0.7793445248121249
Energy: 0.7619723740596043
Energy: 0.7793445248132425
Energy: 0.7619723740612807
Energy: 0.7793445248126837
Energy: 0.7788151592339899
Energy: 0.640598469470766
Energy: 0.7788151592345487
Energy: 0.6405984694662958
Energy: 0.7788151592345487
Energy: 0.6405984694730011
Energy: 0.7506393823949765
Energy: 0.8103019000081618
Energy: 0.7506393823955353
Energy: 0.8103019000070443
Energy: 0.750639382393859
Energy: 0.8103019000070443
Energy: 0.7579739282182962
Energy: 0.7603211399513505
Energy: 0.7579739282188551
Energy: 0.7603211399513505
Energy: 0.7579739282194139
Energy: 0.7603211399507918
Energy: 0.7788541679072009
Energy: 0.7261830419036679
Energy: 0.7788541679072009
Energy: 0.7261830419019915
Energy: 0.7788541679066421
Energy: 0.7261830419019915
Energy: 0.7436945641319097
Energy: 0.8605805300056828
Energy: 0.7436945641330274
Energy: 0.8605805300045651
Energy: 0.7436945641347036
Energy: 0.8605805300056828
Energy: 0.797269566692606
Energy: 0.7484112083468014
Energy: 0.797269566692606
Energy: 0.7484112083468014
Energy: 0.7972695666909296
Energy: 0.7484112083456838
Energy: 0.8103077968802197
Energy: 0.7428174093424725
Energy: 0.810307796879661
Energy: 0.7428174093430313
Energy: 0.810307796879661
Energy: 0.7428174093430313
Energy: 0.7537956948213161
Energy: 0.8006742088233157
Energy: 0.7537956948196398
Energy: 0.8006742088210806
Energy: 0.7537956948201986
Energy: 0.8006742088233157
Energy: 0.7661292811149564
Energy: 0.7263816943826352
Energy: 0.7661292811149564
Energy: 0.7263816943820764
Energy: 0.7661292811121626
Energy: 0.7263816943826352
Energy: 0.7796704631401209
Energy: 0.7657611098634108
Energy: 0.7796704631395621
Energy: 0.7657611098611756
Energy: 0.7796704631417973
Energy: 0.7657611098628521
Energy: 0.7213689925871289
Energy: 0.7831004977020386
Energy: 0.7213689925848937
Energy: 0.7831004977025974
Energy: 0.7213689925876876
Energy: 0.783100497700921
Energy: 0.85574373970221
Energy: 0.6567905789930953
Energy: 0.8557437397027687
Energy: 0.6567905789930953
Energy: 0.8557437397005337
Energy: 0.6567905789908602
Energy: 0.7620858935956946
Energy: 0.7730769456752867
Energy: 0.7620858935956946
Energy: 0.7730769456747278
Energy: 0.7620858935951358
Energy: 0.7730769456758455
Energy: 0.6943869321884759
Energy: 0.7523652710379614
Energy: 0.6943869321890346
Energy: 0.7523652710374026
Energy: 0.6943869321890346
Energy: 0.7523652710396377
Energy: 0.8491581578563888
Energy: 0.6946917557647496
Energy: 0.8491581578563888
Energy: 0.6946917557630734
Energy: 0.8491581578569474
Energy: 0.6946917557647496
Energy: 0.7666966479022364
Energy: 0.7687734164313511
Energy: 0.7666966479011188
Energy: 0.7687734164319098
Energy: 0.7666966479011188
Energy: 0.7687734164313511
Energy: 0.6720931677454519
Energy: 0.768326235352292
Energy: 0.6720931677465695
Energy: 0.768326235352292
Energy: 0.6720931677437756
Energy: 0.768326235352292
Energy: 0.7745771252552208
Energy: 0.7683760947980665
Energy: 0.7745771252529858
Energy: 0.7683760947975078
Energy: 0.7745771252541033
Energy: 0.7683760947963902

minimum gb energy = 0.6405984694662958 eV
minimum distance =  2.32592178927446 Angstroms
sigma value = 67


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

Energy: 0.9931704368501723
Energy: 0.9027516893387066
Energy: 0.9931704368557456
Energy: 0.9027516893363181
Energy: 0.99317043684858
Energy: 0.9027516893387066
Energy: 0.8862707881186952
Energy: 0.9057084581984454
Energy: 0.8862707881147142
Energy: 0.9057084581992416
Energy: 0.8862707881202874
Energy: 0.9057084581976493
Energy: 0.9277058298611418
Energy: 0.9300044896380734
Energy: 0.9277058298627343
Energy: 0.9300044896388695
Energy: 0.9593551603781254
Energy: 0.930004489636481
Energy: 0.9497625751487067
Energy: 0.8709508413381543
Energy: 0.9497625751471865
Energy: 0.8709508413349696
Energy: 0.9497625751471865
Energy: 0.8709508413405428
Energy: 0.786672443259883
Energy: 0.8624032731197159
Energy: 0.7866724432590867
Energy: 0.8624032731197159
Energy: 0.7866724432622715
Energy: 0.8624032731205121
Energy: 0.9225655114856611
Energy: 0.9168197310327358
Energy: 0.9225655114872535
Energy: 0.9168197310343282
Energy: 0.9225655114864574
Energy: 0.916819731033532
Energy: 0.8749544791489295
Energy: 0.8532772485722362
Energy: 0.8749544791489295
Energy: 0.8532772485730322
Energy: 0.874954479151318
Energy: 0.8532772485754209
Energy: 0.85615477257004
Energy: 0.8549547223072766
Energy: 0.85615477257004
Energy: 0.8549547223072766
Energy: 0.8561547725708362
Energy: 0.8549547223080728
Energy: 0.9457604508699725
Energy: 0.9622118470239793
Energy: 0.9457604508715647
Energy: 0.9622118470239793
Energy: 0.9457604508699725
Energy: 0.9622118470215907
Energy: 0.9052738043367645
Energy: 0.8064208541804714
Energy: 0.9052738043383569
Energy: 0.8064208541844524
Energy: 0.9052738043375606
Energy: 0.8064208541844524
Energy: 0.891598783145882
Energy: 0.9243515944988043
Energy: 0.8915987831442896
Energy: 0.9243515944996005
Energy: 0.8915987831466782
Energy: 0.9243515945003242
Energy: 0.876295798582511
Energy: 0.9218219722806489
Energy: 0.876295798577734
Energy: 0.921821972281445
Energy: 0.8762957985833072
Energy: 0.921821972281445
Energy: 0.9037713603220409
Energy: 0.8686860832188744
Energy: 0.9037713603220409
Energy: 0.8686860832204669
Energy: 0.903771360322837
Energy: 0.8686860832188744
Energy: 0.8801981792131659
Energy: 0.9320947628065718
Energy: 0.8801981792147583
Energy: 0.9320947628065718
Energy: 0.8801981792147583
Energy: 0.9320947628113491
Energy: 0.891585539607396
Energy: 0.882401719376567
Energy: 0.8915855396081923
Energy: 0.8824017193733823
Energy: 0.8915855396081923
Energy: 0.8824017193725862
Energy: 0.9503044863256793
Energy: 0.8995423490679657
Energy: 0.9503044863248831
Energy: 0.8995423490671696
Energy: 0.9503044863264756
Energy: 0.8995423490671696
Energy: 0.9028108724927096
Energy: 0.936152583303534
Energy: 0.9028108724935059
Energy: 0.936152583303534
Energy: 0.9028108724911174
Energy: 0.9361525833051264
Energy: 0.9161500047388932
Energy: 0.8617446822691145
Energy: 0.9161500047388932
Energy: 0.8617446822699105
Energy: 0.9161500047388932
Energy: 0.8617446822691145
Energy: 0.9231541518175711
Energy: 0.9334432546715726
Energy: 0.9231541518183675
Energy: 0.9334432546715726
Energy: 0.9231541518183675
Energy: 0.9334432546715726
Energy: 0.7945773514675913
Energy: 0.9306083238577175
Energy: 0.7945773514612219
Energy: 0.9306083238585136
Energy: 0.794577351444502
Energy: 0.9306083238577175
Energy: 0.9604075668571478
Energy: 0.8657078165549653
Energy: 0.9604075668539629
Energy: 0.8657078165541692
Energy: 0.9604075668563516
Energy: 0.865707816553373
Energy: 0.9572401777455971
Energy: 0.9692266669656388
Energy: 0.957240177744801
Energy: 0.9692266669648424
Energy: 0.9572401777440048
Energy: 0.9692266669656388
Energy: 0.833526116572613
Energy: 0.9303768410132036
Energy: 0.8335261165718169
Energy: 0.9303768410132036
Energy: 0.833526116572613
Energy: 0.9303768410163882

minimum gb energy = 0.7866724432590867 eV
minimum distance =  2.32995078716922 Angstroms
sigma value = 33


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

Energy: 1.0822050477082892
Energy: 0.9687743414561094
Energy: 1.082205047711825
Energy: 0.9687743414545942
Energy: 1.082205047708794
Energy: 0.9687743414561094
Energy: 0.9731125455563402
Energy: 1.0246093293826284
Energy: 0.973112545554825
Energy: 1.0246093293856586
Energy: 0.9731125455558352
Energy: 1.0246093293836385
Energy: 1.0390225639678397
Energy: 1.0063697067943698
Energy: 1.039022563970365
Energy: 1.0063697067928545
Energy: 1.03902256396986
Energy: 1.0063697067938648
Energy: 1.0364750036683872
Energy: 0.9629534847820304
Energy: 1.0364750036688921
Energy: 0.9629534847835456
Energy: 1.0364750036658619
Energy: 0.9629534847815252
Energy: 0.9752804552865559
Energy: 0.9928035719087155
Energy: 0.9752804552905966
Energy: 0.9928035719082103
Energy: 0.9752804552865559
Energy: 0.9928035719092205
Energy: 1.0951074540565457
Energy: 1.0171162057044911
Energy: 1.095107454053515
Energy: 1.0507921322161151
Energy: 1.0951074540540202
Energy: 1.0443464859224454
Energy: 0.9768105978282211
Energy: 0.9324899250279047
Energy: 0.9768105978332718
Energy: 0.9324899250289149
Energy: 0.9768105978272568
Energy: 0.93248992502942
Energy: 0.963403877116232
Energy: 1.0231875468898721
Energy: 0.9634038771172422
Energy: 1.023187546888862
Energy: 0.963403877116232
Energy: 1.0231875468903773
Energy: 1.0038545271119712
Energy: 1.028531883228315
Energy: 1.0038545271124761
Energy: 1.0285318832293253
Energy: 1.003854527110961
Energy: 1.0285318832303356
Energy: 1.0643756108340237
Energy: 0.9401593000489361
Energy: 1.064375610830993
Energy: 0.9629823884973103
Energy: 1.0643756108335185
Energy: 0.9717052333444641
Energy: 1.0276266297824197
Energy: 1.0059095696021094
Energy: 1.0276266297844399
Energy: 1.0059095696016043
Energy: 1.0276266297844399
Energy: 1.0059095696000888
Energy: 0.9748725397644151
Energy: 0.9790010409750168
Energy: 0.9748725397649203
Energy: 0.9790010409760271
Energy: 0.9748725397618898
Energy: 0.9790010409745118
Energy: 1.0674053063157252
Energy: 0.9771445322588551
Energy: 1.067405306314715
Energy: 0.9771445322588551
Energy: 1.067405306314715
Energy: 0.97714453225835
Energy: 0.9771889705378318
Energy: 1.0102195582347755
Energy: 0.9771889705398522
Energy: 1.01021955823225
Energy: 0.9771889705398522
Energy: 1.0102195582342703
Energy: 1.0118525238243452
Energy: 0.9923609423143137
Energy: 1.011852523827881
Energy: 0.9923609423138087
Energy: 1.0118525238248504
Energy: 0.9923609423133035
Energy: 1.0360831260933023
Energy: 1.0263760784718308
Energy: 1.0360831260933023
Energy: 1.0263760784688
Energy: 1.0360831260917873
Energy: 1.0263760784718308
Energy: 0.8940074058184315
Energy: 1.0068283165389922
Energy: 0.8940074058199468
Energy: 1.006828316537982
Energy: 0.8940074058229772
Energy: 1.0068283165364669
Energy: 1.0590810747899437
Energy: 1.074292727289535
Energy: 1.059081074792469
Energy: 1.0742927272905451
Energy: 1.059081074792469
Energy: 1.07429272729004
Energy: 0.9654265787741679
Energy: 1.045839477382935
Energy: 0.9654265787721474
Energy: 1.0458394773849093
Energy: 0.9654265787706322
Energy: 1.045839477382935
Energy: 0.9683829468396419
Energy: 1.0081268850318121
Energy: 0.9683829468386316
Energy: 1.008126885030297
Energy: 0.968382946841157
Energy: 1.0081268850328222
Energy: 1.0319892201627083
Energy: 1.0251894839854645
Energy: 1.031989220160688
Energy: 1.0251894839859697
Energy: 1.0319892201596779
Energy: 1.0251894839859697
Energy: 1.0123509759578861
Energy: 0.8729329403308234
Energy: 1.0123509759573812
Energy: 0.8729329403267825
Energy: 1.0123509759563711
Energy: 0.8729329403303182
Energy: 0.9850624960379465
Energy: 1.0057368439635865
Energy: 0.9850624960369364
Energy: 1.0057368439661118
Energy: 0.9850624960394618
Energy: 1.0057368439640917
Energy: 1.0640374557361134
Energy: 0.9720733340456565
Energy: 1.0640374557351033
Energy: 0.9720733340451514
Energy: 1.0640374557376289
Energy: 0.9720733340461616
Energy: 0.9747317594192102
Energy: 0.9730272543767297
Energy: 0.9747317594197152
Energy: 0.9730272543747093
Energy: 0.9747317594202203
Energy: 0.9730272543777397
Energy: 1.0023659997069077
Energy: 1.028049593609212
Energy: 1.0023659997079177
Energy: 1.028049593608202
Energy: 1.0023659997058973
Energy: 1.0280495936071918
Energy: 0.9751956435091926
Energy: 0.8729567285520192
Energy: 0.9751956435096977
Energy: 0.8729567285505039
Energy: 0.9751956435102028
Energy: 0.8729567285530295
Energy: 1.038368956364376
Energy: 1.068250513955702
Energy: 1.0383689563618508
Energy: 1.0682505139541865
Energy: 1.0383689563638712
Energy: 1.068250513955702
Energy: 0.9624471535194141
Energy: 0.9931924704316433
Energy: 0.9624471535148682
Energy: 0.9931924704316433
Energy: 0.962447153512848
Energy: 0.9931924704321483
Energy: 0.9651904021422995
Energy: 0.9277742273012831
Energy: 0.9651904021402792
Energy: 0.9277742273007781
Energy: 0.965190402145835
Energy: 0.927774227299768
Energy: 1.090911989473684
Energy: 1.0611079865917878
Energy: 1.0909119894721684
Energy: 1.0611079865912827
Energy: 1.0909119894741892
Energy: 1.0611079865907775
Energy: 0.9183052164760647
Energy: 1.00798388431212
Energy: 0.9183052164745493
Energy: 1.0079838843100997
Energy: 0.9183052164760647
Energy: 1.0079838843116151
Energy: 1.0368132714008411
Energy: 1.0246507816760613
Energy: 1.036813271404377
Energy: 1.0246507816780817
Energy: 1.0368132714069023
Energy: 1.0246507816780817
Energy: 1.013120922595339
Energy: 1.0247214212374185
Energy: 1.013120922595339
Energy: 1.0247214212374185
Energy: 1.0131209225963496
Energy: 1.0247214212374185
Energy: 0.9720217441264672
Energy: 1.0070382153925124
Energy: 0.9720217441234367
Energy: 1.007038215390492
Energy: 0.9720217441244469
Energy: 1.0070382153909974
Energy: 1.065095769014628
Energy: 0.9717017013030307
Energy: 1.0650957690156384
Energy: 0.97170170129798
Energy: 1.0650957690161433
Energy: 0.9717017013010104
Energy: 0.9737731109834371
Energy: 0.9958132497748485
Energy: 0.9737731109814167
Energy: 0.9958132497768687
Energy: 0.9737731109864678
Energy: 0.9958132497758586

minimum gb energy = 0.8729329403267825 eV
minimum distance =  2.29699417282681 Angstroms
sigma value = 41


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

Energy: 1.1782705135053742
Energy: 1.1118236557427221
Energy: 1.1782705135053742
Energy: 1.111823655738585
Energy: 1.1782705135053742
Energy: 1.1118236557413432
Energy: 1.0958092844061804
Energy: 1.133666091319201
Energy: 1.0958092844061804
Energy: 1.133666091319201
Energy: 1.0958092844061804
Energy: 1.133666091319201
Energy: 1.1871210564917183
Energy: 1.1206487069337916
Energy: 1.2607967486717113
Energy: 1.1206487069324753
Energy: 1.2442760662423609
Energy: 1.1206487069337916
Energy: 1.1662223772538485
Energy: 1.141365928216947
Energy: 1.1662223772538485
Energy: 1.1413659282141888
Energy: 1.1662223772524694
Energy: 1.141365928215568
Energy: 1.0789334534488606
Energy: 1.1089022083887656
Energy: 1.0789334534502395
Energy: 1.1089022083860076
Energy: 1.0789334534502395
Energy: 1.1089022083860076
Energy: 1.2521493055333188
Energy: 1.1861642917610897
Energy: 1.2521493055346977
Energy: 1.1861642917514366
Energy: 1.2521493055333188
Energy: 1.186164291739025
Energy: 1.162675666780061
Energy: 1.0599789569729248
Energy: 1.162675666780061
Energy: 1.0599789569743037
Energy: 1.162675666778682
Energy: 1.0599789569743037
Energy: 1.1641571158261872
Energy: 1.1272200405551287
Energy: 1.1641571158261872
Energy: 1.1272200405565078
Energy: 1.1641571158261872
Energy: 1.1272200405565078
Energy: 1.0998963864384308
Energy: 1.0962506717337634
Energy: 1.0998963864356726
Energy: 1.0962506717351423
Energy: 1.0998963864356726
Energy: 1.0962506717351423
Energy: 1.1669934431016737
Energy: 1.1208238705771145
Energy: 1.1669934431016737
Energy: 1.1208238705771145
Energy: 1.1669934431002948
Energy: 1.1208238705771145
Energy: 1.02077280676354
Energy: 1.1210192351582988
Energy: 1.020772806762161
Energy: 1.1210192351555408
Energy: 1.0207728067662982
Energy: 1.1210192351555408
Energy: 1.0929267618247456
Energy: 1.134603782477198
Energy: 1.0929267618233662
Energy: 1.134603782477198
Energy: 1.0929267618247456
Energy: 1.1346037824758188
Energy: 1.1859294159875
Energy: 1.1731012518133055
Energy: 1.185929415986121
Energy: 1.1731012518133055
Energy: 1.1859294159875
Energy: 1.1731012518133055
Energy: 1.0855769026671722
Energy: 1.1239923375454564
Energy: 1.085576902665793
Energy: 1.1239923375454564
Energy: 1.085576902665793
Energy: 1.1239923375454564

minimum gb energy = 1.020772806762161 eV
minimum distance =  2.28960310605421 Angstroms
sigma value = 11


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

Energy: 1.3352557978211075
Energy: 1.2056376985552588
Energy: 1.33525579781929
Energy: 1.2056376985558646
Energy: 1.3352557978211075
Energy: 1.2056376985522297
Energy: 1.1676919084000805
Energy: 1.2337079292699944
Energy: 1.1676919083994746
Energy: 1.2337079292693884
Energy: 1.1676919083994746
Energy: 1.2337079292699944
Energy: 1.2962443676425286
Energy: 1.2308108143191927
Energy: 1.2962443676394997
Energy: 1.2308108143185867
Energy: 1.2962443676437403
Energy: 1.2308108143185867
Energy: 1.2519093965104142
Energy: 1.1646978751705546
Energy: 1.2519093965122317
Energy: 1.1646978751705546
Energy: 1.2519093965104142
Energy: 1.1646978751717665
Energy: 1.263608474939498
Energy: 1.221070802711185
Energy: 1.26360847493344
Energy: 1.2210708027123967
Energy: 1.263608474927988
Energy: 1.2210708027117907
Energy: 1.2293697223490758
Energy: 1.277943708331917
Energy: 1.2293697223496813
Energy: 1.277943708332523
Energy: 1.229369722347864
Energy: 1.2779437083331284
Energy: 1.2510883224331344
Energy: 1.2137831500038077
Energy: 1.2510883224331344
Energy: 1.2137831500044136
Energy: 1.251088322431923
Energy: 1.2137831500038077
Energy: 1.2259280684371183
Energy: 1.2287102816075322
Energy: 1.2259280684371183
Energy: 1.2287102816081379
Energy: 1.2259280684365126
Energy: 1.2287102816081379
Energy: 1.2507867851053116
Energy: 1.2298229390199547
Energy: 1.2507867851053116
Energy: 1.2298229390193487
Energy: 1.2507867851034942
Energy: 1.2298229390205604
Energy: 1.221299918058781
Energy: 1.2433987178604413
Energy: 1.2212999180599924
Energy: 1.2433987178604413
Energy: 1.2212999180605981
Energy: 1.2433987178610473
Energy: 1.2090233776770902
Energy: 1.2454627473733075
Energy: 1.2090233776764845
Energy: 1.245462747372702
Energy: 1.2090233776783021
Energy: 1.245462747372096
Energy: 1.2684588377934505
Energy: 1.285270905930512
Energy: 1.2684588377940564
Energy: 1.2852709059299061
Energy: 1.2684588377934505
Energy: 1.2852709059299061
Energy: 1.25158974062179
Energy: 1.2008753059284747
Energy: 1.25158974062179
Energy: 1.2008753059290804
Energy: 1.2515897406230017
Energy: 1.2008753059284747
Energy: 1.220758610471519
Energy: 1.2385762472171158
Energy: 1.2207586104733366
Energy: 1.2385762472177217
Energy: 1.2207586104654609
Energy: 1.23857624721651
Energy: 1.1590202127303548
Energy: 1.2326550088073123
Energy: 1.2000981075529096
Energy: 1.2326550088073123
Energy: 1.2047055265027589
Energy: 1.232655008807918
Energy: 1.2524164144637508
Energy: 1.2140860782175458
Energy: 1.2524164144637508
Energy: 1.2140860782163343
Energy: 1.2524164144637508
Energy: 1.2140860782163343
Energy: 1.167710183443635
Energy: 1.2306347508516167
Energy: 1.1677101834418175
Energy: 1.2306347508516167
Energy: 1.1677101834418175
Energy: 1.2306347508522226
Energy: 1.2568760460751722
Energy: 1.2643652523989088
Energy: 1.2568760460733548
Energy: 1.2643652523995146
Energy: 1.256876046076384
Energy: 1.2643652523989088
Energy: 1.2095837855070581
Energy: 1.1498798453675736
Energy: 1.2095837855058467
Energy: 1.1498798453693908
Energy: 1.2095837855070581
Energy: 1.149879845368785
Energy: 1.2235402243065274
Energy: 1.2332446479486077
Energy: 1.2235402243065274
Energy: 1.2332446479510308
Energy: 1.2235402243077391
Energy: 1.2332446479510308
Energy: 1.1852463178111565
Energy: 1.204812162667134
Energy: 1.1852463178117625
Energy: 1.204812162667134
Energy: 1.1852463178123682
Energy: 1.2048121626665282
Energy: 1.278278266761537
Energy: 1.2763800885366647
Energy: 1.2782782667639605
Energy: 1.2763800885372705
Energy: 1.278278266761537
Energy: 1.2763800885372705
Energy: 1.2182880815433081
Energy: 1.231250767863575
Energy: 1.2182880815420967
Energy: 1.2312507678611515
Energy: 1.2182880815427024
Energy: 1.231250767862969
Energy: 1.2618534706686357
Energy: 1.2325721880584999
Energy: 1.261853470673482
Energy: 1.2325721880584999
Energy: 1.2618534706692415
Energy: 1.2325721880597114
Energy: 1.2283918362680544
Energy: 1.239690254660235
Energy: 1.228391836265631
Energy: 1.2396902546596291
Energy: 1.2283918362662367
Energy: 1.239690254660235
Energy: 1.1922634491180082
Energy: 1.2304160733112486
Energy: 1.1922634491180082
Energy: 1.230416073310037
Energy: 1.1922634491204314
Energy: 1.230416073310643
Energy: 1.2103276101246048
Energy: 1.284439744623939
Energy: 1.2103276101252103
Energy: 1.2844397446245448
Energy: 1.2103276101252103
Energy: 1.2844397446263622
Energy: 1.251198224272281
Energy: 1.2018345676481188
Energy: 1.2511982242740987
Energy: 1.2018345676481188
Energy: 1.2511982242716753
Energy: 1.2018345676475128
Energy: 1.225931757547341
Energy: 1.2380690976064574
Energy: 1.225931757546735
Energy: 1.2380690976058517
Energy: 1.2259317575485524
Energy: 1.2380690976052457
Energy: 1.2119631109466682
Energy: 1.1562486052636853
Energy: 1.211963110945457
Energy: 1.1562486052648968
Energy: 1.2119631109436393
Energy: 1.1562486052655028
Energy: 1.2239673535962874
Energy: 1.3006569694931593
Energy: 1.2239673535956814
Energy: 1.3006569694931593
Energy: 1.2239673535962874
Energy: 1.300656969493765

minimum gb energy = 1.1498798453675736 eV
minimum distance =  2.22073092901468 Angstroms
sigma value = 57


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

Energy: 1.1360421867934567
Energy: 1.1051750586405238
Energy: 1.1360421867934567
Energy: 1.1051750586416018
Energy: 1.1360421867913006
Energy: 1.1051750586416018
Energy: 1.1370685347083493
Energy: 1.1645791015430935
Energy: 1.1370685347061933
Energy: 1.1645791015420157
Energy: 1.1370685347061933
Energy: 1.1645791015420157
Energy: 1.2900577140809166
Energy: 1.1709092848614364
Energy: 1.2900577140798388
Energy: 1.1709092848614364
Energy: 1.2900577140798388
Energy: 1.1709092848592801
Energy: 1.1391207715587524
Energy: 1.2522752860731918
Energy: 1.1391207715609084
Energy: 1.5021256836925625
Energy: 1.1391207715576743
Energy: 1.2047758009063847
Energy: 1.2900970569076018
Energy: 1.1709574667563674
Energy: 1.2900970569086798
Energy: 1.1709574667563674
Energy: 1.2900970569076018
Energy: 1.1709574667574454
Energy: 1.1371683131908434
Energy: 1.1645687459981533
Energy: 1.1371683131951558
Energy: 1.2554068796609654
Energy: 1.1371683131919215
Energy: 1.2131333319390372
Energy: 1.136042186792379
Energy: 1.1051750586416018
Energy: 1.136042186792379
Energy: 1.1051750586416018
Energy: 1.1360421867934567
Energy: 1.1051750586416018
Energy: 1.1370685347051153
Energy: 1.1645791015430935
Energy: 1.1370685346964908
Energy: 1.1645791015441718
Energy: 1.1370685347008032
Energy: 1.1645791015430935
Energy: 1.2900577140830236
Energy: 1.1709092848592801
Energy: 1.2900577140809166
Energy: 1.1709092848603582
Energy: 1.2900577140830236
Energy: 1.1709092848603582
Energy: 1.1391207715706109
Energy: 1.3161937986696617
Energy: 1.1391207715727667
Energy: 1.440664137296376
Energy: 1.1391207715706109
Energy: 1.204775800909619
Energy: 1.2900970569086798
Energy: 1.1709574667455869
Energy: 1.2900970569097578
Energy: 1.1709574667477431
Energy: 1.2900970569086798
Energy: 1.1709574667477431
Energy: 1.137168313183346
Energy: 1.1645687460013876
Energy: 1.1371683131865802
Energy: 1.1645687460013876
Energy: 1.137168313180112
Energy: 1.1645687460003094
Energy: 1.1360421867934567
Energy: 1.1051750586394458
Energy: 1.136042186792379
Energy: 1.1051750586394458
Energy: 1.136042186792379
Energy: 1.1051750586416018
Energy: 1.1370685347051153
Energy: 1.1645791015430935
Energy: 1.1370685347008032
Energy: 1.1645791015430935
Energy: 1.1370685347051153
Energy: 1.1645791015441718
Energy: 1.2900577140766045
Energy: 1.1709092848614364
Energy: 1.2900577140766045
Energy: 1.1709092848614364
Energy: 1.2900577140766045
Energy: 1.1709092848614364
Energy: 1.1391207715609084
Energy: 1.2892081157316055
Energy: 1.1391207715630645
Energy: 1.3178765878107277
Energy: 1.1391207715609084
Energy: 1.204775800905307
Energy: 1.2900970569065238
Energy: 1.1709574667542113
Energy: 1.2900970569076018
Energy: 1.1709574667531333
Energy: 1.2900970569054455
Energy: 1.1709574667542113

minimum gb energy = 1.1051750586394458 eV
minimum distance =  2.27578407046209 Angstroms
sigma value = 9


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

Energy: 1.2939191752549752
Energy: 1.185356785557403
Energy: 1.293919175250574
Energy: 1.185356785557403
Energy: 1.2939191752549752
Energy: 1.1853567855556424
Energy: 1.2364964364322084
Energy: 1.2302426787944707
Energy: 1.236496436431328
Energy: 1.2302426787935903
Energy: 1.2364964364322084
Energy: 1.2302426787935903
Energy: 1.2254889445954578
Energy: 1.231167559670574
Energy: 1.2950930257371815
Energy: 1.2311675596714542
Energy: 1.2420287268994736
Energy: 1.2311675596714542
Energy: 1.2078621938251197
Energy: 1.2998782088858307
Energy: 1.207862193826
Energy: 1.2998782088867111
Energy: 1.207862193826
Energy: 1.29987820888319
Energy: 1.2411227775284825
Energy: 1.1857345360645233
Energy: 1.241122777526722
Energy: 1.1857345360645233
Energy: 1.2411227775284825
Energy: 1.1857345360662839
Energy: 1.2445561424905465
Energy: 1.2451982385837195
Energy: 1.2445561424887859
Energy: 1.2451982385837195
Energy: 1.2445561424861453
Energy: 1.2451982385837195
Energy: 1.2198934951991196
Energy: 1.2574629995935582
Energy: 1.2198934952026406
Energy: 1.2574629995935582
Energy: 1.2198934952
Energy: 1.2574629995917979
Energy: 1.2151095661295024
Energy: 1.2761816776632415
Energy: 1.2151095661303826
Energy: 1.2761816776632415
Energy: 1.2151095661295024
Energy: 1.276181677665002
Energy: 1.3060031739603768
Energy: 1.2159015780522313
Energy: 1.3060031739594966
Energy: 1.2159015780522313
Energy: 1.3060031739638975
Energy: 1.2159015780531115
Energy: 1.22256586343411
Energy: 1.2282769414680474
Energy: 1.2225658634323493
Energy: 1.2282769414671675
Energy: 1.2225658634332295
Energy: 1.2282769414689279
Energy: 1.1885936275166773
Energy: 1.235717289086669
Energy: 1.1885936275184377
Energy: 1.2357172890857888
Energy: 1.1885936275131563
Energy: 1.2357172890857888
Energy: 1.298199319391564
Energy: 1.247666812786941
Energy: 1.298199319396845
Energy: 1.2476668127860608
Energy: 1.2981993193950847
Energy: 1.2476668127843002
Energy: 1.1946485948324017
Energy: 1.2677164720369143
Energy: 1.1946485948288807
Energy: 1.2677164720395548
Energy: 1.194648594833282
Energy: 1.2677164720369143
Energy: 1.2562991543664779
Energy: 1.2246904105802374
Energy: 1.2562991543638373
Energy: 1.224690410578477
Energy: 1.2562991543673578
Energy: 1.224690410578477
Energy: 1.2576506292369576
Energy: 1.233146046354195
Energy: 1.2576506292395981
Energy: 1.233146046354195
Energy: 1.314322402972175
Energy: 1.233146046354195
Energy: 1.2927430807998193
Energy: 1.234958546934572
Energy: 1.2927430808006997
Energy: 1.2349585469354523
Energy: 1.2927430808006997
Energy: 1.2349585469328117
Energy: 1.2140484727604017
Energy: 1.2337943833169782
Energy: 1.214048472757761
Energy: 1.2337943833160978
Energy: 1.2140484727560408
Energy: 1.2337943833152176
Energy: 1.3709187744248426
Energy: 1.2359128980403855
Energy: 1.3709187744222018
Energy: 1.2359128980412657
Energy: 1.3709187744248426
Energy: 1.2359128980403855
Energy: 1.2087775786956747
Energy: 1.230785830767048
Energy: 1.2087775786956747
Energy: 1.230785830767048
Energy: 1.2087775786956747
Energy: 1.2307858307661679
Energy: 1.2268716482149666
Energy: 1.1862600190582258
Energy: 1.2268716482140865
Energy: 1.1862600190547048
Energy: 1.226871648213206
Energy: 1.1862600190564654
Energy: 1.3015920100915552
Energy: 1.2570415089716542
Energy: 1.301592010090675
Energy: 1.2570415089707738
Energy: 1.3015920100880345
Energy: 1.2570415089716542

minimum gb energy = 1.1853567855556424 eV
minimum distance =  2.25115933738105 Angstroms
sigma value = 27


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

Energy: 1.3675386671895715
Energy: 1.2472064311709692
Energy: 1.340565004379961
Energy: 1.247206431173195
Energy: 1.3675386671895715
Energy: 1.2472064311687434
Energy: 1.3357880959661335
Energy: 1.233378932316579
Energy: 1.335788095951328
Energy: 1.2333789323180628
Energy: 1.3357880959683597
Energy: 1.2333789323239985
Energy: 1.2201956856089209
Energy: 1.2431973059363746
Energy: 1.2201956856089209
Energy: 1.2431973059356327
Energy: 1.220195685607437
Energy: 1.2431973059393424
Energy: 1.2208568125283736
Energy: 1.29735874161648
Energy: 1.2208568125283736
Energy: 1.29735874162019
Energy: 1.2208568125276318
Energy: 1.2973587416157382
Energy: 1.2197203566053867
Energy: 1.2532318229803163
Energy: 1.2197203566098382
Energy: 1.2532318229795743
Energy: 1.2197203566068706
Energy: 1.253231822983284
Energy: 1.2472332127273111
Energy: 1.316170119180696
Energy: 1.2472332127250854
Energy: 1.31617011918218
Energy: 1.2472332127273111
Energy: 1.3161701191762443
Energy: 1.2179969648637132
Energy: 1.2896689047338832
Energy: 1.2179969648562938
Energy: 1.2896689047346248
Energy: 1.2179969648637132
Energy: 1.2896689047272392
Energy: 1.3207120398169794
Energy: 1.2198466431043307
Energy: 1.3207120398103358
Energy: 1.2198466431035886
Energy: 1.3207120398229153
Energy: 1.2198466430917174
Energy: 1.3283130136229981
Energy: 1.2535112163634419
Energy: 1.3281848772801297
Energy: 1.253511216361958
Energy: 1.32831301362374
Energy: 1.253511216360474
Energy: 1.3207231880612513
Energy: 1.2474369948073496
Energy: 1.3207435443815625
Energy: 1.2474369948088333
Energy: 1.3207231880605095
Energy: 1.2474369948088333
Energy: 1.3184207174486693
Energy: 1.255737986497423
Energy: 1.3188223451268206
Energy: 1.255737986495939
Energy: 1.3184207174494114
Energy: 1.255737986497423
Energy: 1.290932522538161
Energy: 1.21984596040203
Energy: 1.2909325225403867
Energy: 1.2198459604042557
Energy: 1.2909325225374189
Energy: 1.2198459604205454
Energy: 1.2794693539303634
Energy: 1.3371619779098074
Energy: 1.279469353918492
Energy: 1.3371619779083235
Energy: 1.2794693539296214
Energy: 1.3371619779046138
Energy: 1.247242959059215
Energy: 1.2140122670717772
Energy: 1.2472429590562473
Energy: 1.2140122670702933
Energy: 1.247242959059215
Energy: 1.2140122670717772
Energy: 1.254641225634995
Energy: 1.3426864691946738
Energy: 1.2540954524065588
Energy: 1.3426864691946738
Energy: 1.254641225636479
Energy: 1.3426864692035771
Energy: 1.236367779863314
Energy: 1.2526757408087492
Energy: 1.2363677798699917
Energy: 1.252675740809491
Energy: 1.236367779863314
Energy: 1.252675740810975
Energy: 1.2198781321361616
Energy: 1.2216874373314859
Energy: 1.2198781321376455
Energy: 1.221687437332228
Energy: 1.2198781321369034
Energy: 1.2216874373448412
Energy: 1.2986003783377063
Energy: 1.2258511765655489
Energy: 1.2986003783436422
Energy: 1.2258511765655489
Energy: 1.2986003783384485
Energy: 1.2258511765648068
Energy: 1.2608281975855238
Energy: 1.2195603802794843
Energy: 1.1585627157986151
Energy: 1.2195603802802264
Energy: 1.260828197579588
Energy: 1.2195603802750328
Energy: 1.3675386671843777
Energy: 1.247206431174679
Energy: 1.3405650043829291
Energy: 1.247206431176163
Energy: 1.3675386671843777
Energy: 1.2472064311717113
Energy: 1.3357880959609398
Energy: 1.2333789323225146
Energy: 1.3357880959505861
Energy: 1.2333789323202888
Energy: 1.335788095959456
Energy: 1.2333789323188047
Energy: 1.2201956856089209
Energy: 1.2431973059460202
Energy: 1.2201956856111467
Energy: 1.243197305946762
Energy: 1.220195685607437
Energy: 1.243197305946762
Energy: 1.2208568125291157
Energy: 1.297358741620932
Energy: 1.2208568125298578
Energy: 1.2973587416216739
Energy: 1.2208568125305996
Energy: 1.2973587416261256
Energy: 1.219720356616516
Energy: 1.2532318229847679
Energy: 1.2197203566187418
Energy: 1.253231822984026
Energy: 1.219720356617258
Energy: 1.2532318229818
Energy: 1.247233212728053
Energy: 1.3161701191866315
Energy: 1.2472332127332468
Energy: 1.3161701191858899
Energy: 1.2472332127295371
Energy: 1.3161701191777282

minimum gb energy = 1.1585627157986151 eV
minimum distance =  2.23960041419004 Angstroms
sigma value = 19


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

Energy: 1.2532866325341938
Energy: 1.2477902378842445
Energy: 1.2532866325335532
Energy: 1.2477902378842445
Energy: 1.2532866325329128
Energy: 1.2477902378855255
Energy: 1.2469563763051146
Energy: 1.2169567139967954
Energy: 1.246956376305755
Energy: 1.2169567139955146
Energy: 1.2469563763063953
Energy: 1.2169567139955146
Energy: 1.258100434878539
Energy: 1.1803788336429029
Energy: 1.2854506982926892
Energy: 1.1803788336429029
Energy: 1.2386539732750281
Energy: 1.1803788336435435
Energy: 1.19718232398388
Energy: 1.222321097046736
Energy: 1.1971823239825992
Energy: 1.222321097046736
Energy: 1.1971823239845205
Energy: 1.222321097046736
Energy: 1.2202609172529137
Energy: 1.2454770649720683
Energy: 1.2202609172529137
Energy: 1.245477064972709
Energy: 1.2202609172535543
Energy: 1.2454770649720683
Energy: 1.2348795498436984
Energy: 1.2119887879601614
Energy: 1.2348795498449794
Energy: 1.2119887879601614
Energy: 1.234879549843058
Energy: 1.211988787960802
Energy: 1.1694353196464171
Energy: 1.2548514371639765
Energy: 1.1694353196470575
Energy: 1.2548514371646171
Energy: 1.169435319647698
Energy: 1.2548514371652575
Energy: 1.2080867204074248
Energy: 1.2638213789697235
Energy: 1.2080867204087058
Energy: 1.263821378969083
Energy: 1.2080867204080652
Energy: 1.263821378970364
Energy: 1.29480413950245
Energy: 1.1787776226367686
Energy: 1.2948041395043715
Energy: 1.1787776226380495
Energy: 1.2948041395030907
Energy: 1.1787776226367686
Energy: 1.2285392662017594
Energy: 1.2278279732013075
Energy: 1.228539266203681
Energy: 1.2278279732032291
Energy: 1.2285392662024
Energy: 1.2278279732025885
Energy: 1.193410782325213
Energy: 1.2731915221839711
Energy: 1.1934107823245723
Energy: 1.2731915221839711
Energy: 1.193410782323932
Energy: 1.2731915221839711
Energy: 1.238991528062906
Energy: 1.1777060238778458
Energy: 1.2389915280616248
Energy: 1.1777060238772055
Energy: 1.2389915280609844
Energy: 1.1777060238784862
Energy: 1.213226850328173
Energy: 1.209955808279599
Energy: 1.213226850328173
Energy: 1.209955808279599
Energy: 1.2132268503294537
Energy: 1.209955808279599
Energy: 1.205746850261213
Energy: 1.2248410629151372
Energy: 1.2057468502599318
Energy: 1.2248410629144966
Energy: 1.2057468502586512
Energy: 1.2248410629132158
Energy: 1.2528797315661244
Energy: 1.1845398263183375
Energy: 1.2528797315661244
Energy: 1.1845398263176972
Energy: 1.2528797315642028
Energy: 1.1845398263176972
Energy: 1.234913605978102
Energy: 1.1715453861913567
Energy: 1.2349136059755401
Energy: 1.1715453861913567
Energy: 1.2349136059761807
Energy: 1.1715453861913567
Energy: 1.1956306659623595
Energy: 1.2317417234106223
Energy: 1.1956306659623595
Energy: 1.2317417234106223
Energy: 1.1956306659636113
Energy: 1.2317417234099817
Energy: 1.2360033223308518
Energy: 1.2435933834251698
Energy: 1.2360033223302114
Energy: 1.2435933834251698
Energy: 1.2360033223295712
Energy: 1.2435933834258104
Energy: 1.2277361931546817
Energy: 1.2090146797896393
Energy: 1.2277361931540411
Energy: 1.209014679788999
Energy: 1.2277361931546817
Energy: 1.2090146797896393
Energy: 1.204326101787534
Energy: 1.2471506212340369
Energy: 1.2043261017888145
Energy: 1.2471506212327559
Energy: 1.2043261017900955
Energy: 1.2471506212327559
Energy: 1.1742332960344957
Energy: 1.2855351498867698
Energy: 1.1742332960332147
Energy: 1.2855351498880507
Energy: 1.1742332960332147
Energy: 1.2855351498874101
Energy: 1.2669879258430854
Energy: 1.1788901325750392
Energy: 1.266987925836681
Energy: 1.1788901325750392
Energy: 1.266987925842445
Energy: 1.1788901325750392
Energy: 1.271200883268693
Energy: 1.220419636281084
Energy: 1.2712008832654906
Energy: 1.220419636281084
Energy: 1.2712008832667716
Energy: 1.2204196362791624
Energy: 1.2489527288624087
Energy: 1.2489047488326845
Energy: 1.2489527288643303
Energy: 1.2489047488314036
Energy: 1.248952728858566
Energy: 1.2489047488314036
Energy: 1.2314470806727007
Energy: 1.1788348197242244
Energy: 1.2314470806727007
Energy: 1.1788348197267862
Energy: 1.231447080673341
Energy: 1.1788348197242244
Energy: 1.234261645258325
Energy: 1.1928450466052973
Energy: 1.2342616452564037
Energy: 1.192845046603376
Energy: 1.2342616452551227
Energy: 1.1928450466052973
Energy: 1.18120425255787
Energy: 1.2275814617546263
Energy: 1.1812042525565893
Energy: 1.227581461755267
Energy: 1.1812042525585107
Energy: 1.227581461756548
Energy: 1.2570790335571824
Energy: 1.2162442752729332
Energy: 1.2570790335578228
Energy: 1.2162442752710119
Energy: 1.2570790335578228
Energy: 1.2162442752703715
Energy: 1.241624272376462
Energy: 1.215722613876067
Energy: 1.2416242723771023
Energy: 1.2157226138767077
Energy: 1.2416242723790236
Energy: 1.2157226138773483

minimum gb energy = 1.1694353196464171 eV
minimum distance =  2.24735947814463 Angstroms
sigma value = 101


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

Energy: 1.177449411478674
Energy: 1.256894149385694
Energy: 1.1774494114758594
Energy: 1.256894149385694
Energy: 1.177449411477548
Energy: 1.256894149385694
Energy: 1.2061607048981506
Energy: 1.187337851122062
Energy: 1.2061607048970244
Energy: 1.1937917653659942
Energy: 1.2061607048998393
Energy: 1.161180748693005
Energy: 1.1990764758472925
Energy: 1.1302564668747292
Energy: 1.1990764758456036
Energy: 1.1302564668736035
Energy: 1.1990764758450405
Energy: 1.1302564668747292
Energy: 1.1033331395818962
Energy: 1.199342639060732
Energy: 1.1033331395818962
Energy: 1.2699753239116371
Energy: 1.1033331395818962
Energy: 1.1853983715575547
Energy: 1.1647716160958452
Energy: 1.172148492405153
Energy: 1.1647716160947192
Energy: 1.1721484924045902
Energy: 1.1647716160941564
Energy: 1.172148492405153
Energy: 1.1973307320117093
Energy: 1.128782242548626
Energy: 1.1973307320111461
Energy: 1.1287822425475003
Energy: 1.1973307320100202
Energy: 1.128782242548626
Energy: 1.1591629531102645
Energy: 1.18133966018898
Energy: 1.1591629531119534
Energy: 1.1813396601901063
Energy: 1.1591629531102645
Energy: 1.18133966018898
Energy: 1.1106004687700026
Energy: 1.183708997634393
Energy: 1.1106004687688769
Energy: 1.313888699353067
Energy: 1.1106004687621207
Energy: 1.1981212935064274
Energy: 1.1991123289129795
Energy: 1.129629337586446
Energy: 1.1991123289096013
Energy: 1.1296293375870086
Energy: 1.1991123289090384
Energy: 1.129629337586446
Energy: 1.165652807808558
Energy: 1.2128463161107619
Energy: 1.165652807808558
Energy: 1.3124655384195265
Energy: 1.165652807809121
Energy: 1.2092316180255616
Energy: 1.1072474860291952
Energy: 1.3324385238908347
Energy: 1.107247486029758
Energy: 1.3324385238885825
Energy: 1.1072474860308843
Energy: 1.3324385238880194
Energy: 1.223466956784313
Energy: 1.18857430869852
Energy: 1.223466956785439
Energy: 1.1947112688406363
Energy: 1.22346695678375
Energy: 1.161582578310276
Energy: 1.2108325816439314
Energy: 1.1293429414547336
Energy: 1.2108325816428054
Energy: 1.1293429414541705
Energy: 1.2108325816428054
Energy: 1.1293429414547336
Energy: 1.177500235726296
Energy: 1.208404245425709
Energy: 1.1775002357268591
Energy: 1.245764433393771
Energy: 1.177500235726296
Energy: 1.2286530992763964
Energy: 1.2349353431747045
Energy: 1.171470610694737
Energy: 1.2349353431763934
Energy: 1.171470610695863
Energy: 1.2349353431752674
Energy: 1.1714706106953001
Energy: 1.1998161491016472
Energy: 1.1281654489597255
Energy: 1.1998161491033361
Energy: 1.1281654489602886
Energy: 1.1998161491038992
Energy: 1.1281654489619775
Energy: 1.104981858749276
Energy: 1.21724944642787
Energy: 1.1049818587498388
Energy: 1.21724944642787
Energy: 1.104981858749276
Energy: 1.2172494464284331
Energy: 1.1087756550686565
Energy: 1.1720351466836323
Energy: 1.1087756550675303
Energy: 1.1720351466813805
Energy: 1.1087756550692194
Energy: 1.1720351466830694
Energy: 1.1974709749925934
Energy: 1.1292190911933804
Energy: 1.1974709749909047
Energy: 1.1292190911928173
Energy: 1.1974709749835857
Energy: 1.1292190911922544
Energy: 1.165427064977415
Energy: 1.1479535475627107
Energy: 1.1654270649768521
Energy: 1.1479535475638367
Energy: 1.165427064979104
Energy: 1.1479535475621478
Energy: 1.1069987347548724
Energy: 1.334515626013086
Energy: 1.1069987347537464
Energy: 1.33451562601196
Energy: 1.1069987347554355
Energy: 1.334515626009145
Energy: 1.2167761710940892
Energy: 1.1247277389807488
Energy: 1.2167761710980303
Energy: 1.1247277389801857
Energy: 1.2167761710980303
Energy: 1.1247277389818746
Energy: 1.2402525532016087
Energy: 1.1228297999424455
Energy: 1.2402525532044237
Energy: 1.1228297999413197
Energy: 1.2402525532038606
Energy: 1.1228297999424455
Energy: 1.1034221800711785
Energy: 1.2344872181135
Energy: 1.1034221800694897
Energy: 1.2344872181174409
Energy: 1.1034221800723045
Energy: 1.2344872181230708
Energy: 1.2231776296962698
Energy: 1.1594031833068283
Energy: 1.2231776296962698
Energy: 1.1594031833068283
Energy: 1.223177629692329
Energy: 1.1594031833073912
Energy: 1.2147190066995144
Energy: 1.1277002267930318
Energy: 1.2147190066995144
Energy: 1.1277002267930318
Energy: 1.2147190066995144
Energy: 1.1277002267930318
Energy: 1.1769788268015369
Energy: 1.2104182427007322
Energy: 1.1769788268009738
Energy: 1.2104182427012953
Energy: 1.1769788268009738
Energy: 1.2104182427007322
Energy: 1.1772508376120432
Energy: 1.217113644760098
Energy: 1.177250837610917
Energy: 1.217113644761224
Energy: 1.1772508376114799
Energy: 1.217113644760098
Energy: 1.2335810857866232
Energy: 1.1425116911594628
Energy: 1.233581085787186
Energy: 1.1425116911583368
Energy: 1.2335810857854972
Energy: 1.1425116911600257
Energy: 1.107575207720969
Energy: 1.2083677998066031
Energy: 1.1075752077226582
Energy: 1.2083677998066031
Energy: 1.1075752077215322
Energy: 1.2083677998071662
Energy: 1.1051078631972806
Energy: 1.2001287713418454
Energy: 1.1051078631972806
Energy: 1.2001287713418454
Energy: 1.1051078631950286
Energy: 1.2001287713424085
Energy: 1.2417851857538091
Energy: 1.1239317262543111
Energy: 1.2417851857588762
Energy: 1.123931726254874
Energy: 1.241785185755498
Energy: 1.1239317262543111
Energy: 1.2408093469606825
Energy: 1.1226311684938577
Energy: 1.2408093469589934
Energy: 1.1226311684949837
Energy: 1.2408093469601196
Energy: 1.1226311684932944

minimum gb energy = 1.1033331395818962 eV
minimum distance =  2.26491814369575 Angstroms
sigma value = 33


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

Energy: 0.020532783014127223
Energy: 0.8902877627366235
Energy: 0.020532783014594994
Energy: 0.8902877627361557
Energy: 0.020532783014594994
Energy: 0.8902877627366235
Energy: 0.022482325153080986
Energy: 0.4173166328768204
Energy: 0.02248232515396455
Energy: 0.4173166328754691
Energy: 0.022482325154432325
Energy: 0.41731663287728815
Energy: 1.3086869742653047
Energy: 0.41695382335848047
Energy: 1.9547671495846046
Energy: 0.41695382335712916
Energy: 2.4043824483787946
Energy: 0.41695382335390674
Energy: 0.022482325153496782
Energy: 0.41731663287957504
Energy: 0.022482325152145443
Energy: 0.41731663288004284
Energy: 0.022482325152145443
Energy: 0.4173166328791073

minimum gb energy = 0.020532783014127223 eV
minimum distance =  2.48298674880045 Angstroms
sigma value = 1