Model name: model_name=EAM_Dynamo_MendelevAstaRahman_2009_AlMg__MO_658278549784_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.045270472764969
cohesive_energy=3.4109252230537166
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.28507238070982e-19, 2.9349312452265596e-19, 3.3659167597725596e-19, 3.7020694393520996e-19, 3.9732378346566e-19, 4.1837478225978597e-19, 4.350662584327979e-19, 4.48877021017878e-19, 4.60669041044118e-19, 4.711584914669159e-19, 4.80904531931538e-19, 4.90291684830144e-19, 4.9946735041306195e-19, 5.08240869660846e-19, 5.163174420728399e-19, 5.23472762920284e-19, 5.29585066778994e-19, 5.3462231011629e-19, 5.38621342994754e-19, 5.4166387642272e-19, 5.43860460587934e-19, 5.45329656561312e-19, 5.46172401470796e-19, 5.46447975851844e-19, 5.461403579381159e-19, 5.45103749655918e-19, 5.43110641923222e-19, 5.398389972365939e-19, 5.348882714375339e-19, 5.27928416139438e-19, 5.19010700994594e-19, 5.088545033116679e-19, 4.98892169001456e-19, 4.89604351054158e-19, 4.71767318587836e-19, 3.93033154439808e-19, 4.478211866160719e-20, -1.2997689986857679e-18, -6.0122479279167e-18, -2.1592694714081397e-17, -7.151940254746259e-17, -2.29734505372626e-16, -7.337408221898099e-16, -2.3716059407121598e-15, -7.8796649036754e-15, -2.73409840415466e-14, -1.008124785998748e-13, -4.0333995672632997e-13, -1.7986195110947399e-12, -9.269056458913859e-12, -5.8071693187646996e-11, -4.77115384192128e-10, -5.82580263301812e-09, -1.322595209190366e-07]
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: 0.010504968033714264
Energy: 0.05145845850684556
Energy: 0.29731358951433234
Energy: 0.05145845850684556
Energy: 0.05145845850781951
Energy: 0.42889038804494484
Energy: 0.051458458507318616
Energy: 0.42889038804494484
Energy: 0.29731358951433234
Energy: 0.051458458506344666
Energy: 0.010504968033714264
Energy: 0.051458458507318616
Energy: 0.05145845850684556
Energy: 0.42889038804494484
Energy: 0.051458458507318616
Energy: 0.42889038804494484

minimum gb energy = 0.010504968033714264 eV
minimum distance =  2.79860055716793 Angstroms
sigma value = 1


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

Energy: 0.6455817549875787
Energy: 0.5147934340764697
Energy: 0.5140307437605536
Energy: 0.5147934340788995
Energy: 0.4781027034841156
Energy: 0.522661779018089
Energy: 0.4777968922460042
Energy: 0.5226617790205189
Energy: 0.5161440836656725
Energy: 0.5137305298378227
Energy: 0.7055777126522748
Energy: 0.5137305298378227
Energy: 0.4796287985109577
Energy: 0.4779541246024994
Energy: 0.4780948626529302
Energy: 0.47795412460067704
Energy: 0.6028252078198968
Energy: 0.4780538100842565
Energy: 0.478818400795129
Energy: 0.478053810083649
Energy: 0.5052465743809088
Energy: 0.5017950886840625
Energy: 0.47833285848888213
Energy: 0.5017950886840625
Energy: 0.4865463640276811
Energy: 0.48470731803322376
Energy: 0.6023693486660711
Energy: 0.48470731803322376
Energy: 0.4976700501244268
Energy: 0.48528309442107237
Energy: 0.5364240712613698
Energy: 0.4852830944204649
Energy: 0.5279496421251164
Energy: 0.5411470385183602
Energy: 0.5302851267586183
Energy: 0.5411470385195751
Energy: 0.5356188259313318
Energy: 0.525258118485821
Energy: 0.5202157820528008
Energy: 0.5252581184852135
Energy: 0.5590932995107857
Energy: 0.5411094432143162
Energy: 0.5286362061229358
Energy: 0.5411094432155312
Energy: 0.49748191670101144
Energy: 0.5397326102268454
Energy: 0.5376961993543656
Energy: 0.5397326102244155
Energy: 0.4849766287164857
Energy: 0.5091709276345076
Energy: 0.6470041033639812
Energy: 0.5091709276339
Energy: 0.5055847545308675
Energy: 0.4863682400601854
Energy: 0.505118778869751
Energy: 0.4863682400601854
Energy: 0.6463002703668265
Energy: 0.47758785733978765
Energy: 0.4803192852605204
Energy: 0.47758785734039516
Energy: 0.5076248270870672
Energy: 0.47795577059958066
Energy: 0.4778864117456068
Energy: 0.4779557705989732
Energy: 0.5145519234524516
Energy: 0.5144582134348799
Energy: 0.7638857093331869
Energy: 0.5144582134360949
Energy: 0.47834137220285733
Energy: 0.4782775658172458
Energy: 0.47201057371217764
Energy: 0.4782775658172458
Energy: 0.7057253031710297
Energy: 0.5138143094759069
Energy: 0.5176809412978214
Energy: 0.5138143094783368
Energy: 0.5384712237699082
Energy: 0.4774907474989873
Energy: 0.4797243825310526
Energy: 0.47749074750080966
Energy: 0.4807920643377556
Energy: 0.4780175870487288
Energy: 0.6031108798901599
Energy: 0.4780175870517662
Energy: 0.47825100482575617
Energy: 0.47747222756666824
Energy: 0.5053882539003797
Energy: 0.47747222756849067
Energy: 0.6025115341681146
Energy: 0.4850429364852948
Energy: 0.48892117777902444
Energy: 0.48504293648225744
Energy: 0.5349750417340559
Energy: 0.4847096626424506
Energy: 0.49888207000303647
Energy: 0.48470966264488047
Energy: 0.5345953242033357
Energy: 0.5420274103983664
Energy: 0.5279671943587357
Energy: 0.5420274103989738
Energy: 0.5198513822919749
Energy: 0.5257444180879387
Energy: 0.5364556121249451
Energy: 0.525744418089761
Energy: 0.528328769889463
Energy: 0.541486870079777
Energy: 0.5624036755509211
Energy: 0.5414868700791696
Energy: 0.5362438034645988
Energy: 0.5402498668618583
Energy: 0.52672270351818
Energy: 0.5402498668618583
Energy: 0.5341763327324236
Energy: 0.5092342048832688
Energy: 0.4846216735576296
Energy: 0.5092342048826614
Energy: 0.5051933989386374
Energy: 0.5069907510271479
Energy: 0.5058998537177809
Energy: 0.5069907510283628
Energy: 0.4798795675224127
Energy: 0.477521747637377
Energy: 0.6482172369530249
Energy: 0.477521747637377
Energy: 0.4777898139156286
Energy: 0.47780644664981525
Energy: 0.5076389157873058
Energy: 0.4778064466486003
Energy: 0.4822396546900228
Energy: 0.5136861148589285
Energy: 0.5145040287620725
Energy: 0.513686114858321

minimum gb energy = 0.47201057371217764 eV
minimum distance =  2.5531808567841 Angstroms
sigma value = 1


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

Energy: 0.7423619578098438
Energy: 0.5349083428734459
Energy: 0.5334016136972801
Energy: 0.5349083428706755
Energy: 0.4943181835583006
Energy: 0.5415451872750562
Energy: 0.49629597338679865
Energy: 0.5415451872653595
Energy: 0.5351505724119466
Energy: 0.5337874210607712
Energy: 0.6795727029504687
Energy: 0.533787421057308
Energy: 0.4965728952850655
Energy: 0.4961001975798564
Energy: 0.49631124270422433
Energy: 0.49610019758193424
Energy: 0.6797174550721808
Energy: 0.4965490626451723
Energy: 0.4954842506729822
Energy: 0.49654906264378706
Energy: 0.5283564683424155
Energy: 0.49421187495324603
Energy: 0.49645689446079394
Energy: 0.4942118749525535
Energy: 0.5105342944430511
Energy: 0.5331033570113617
Energy: 0.5729507381688713
Energy: 0.5331033570134395
Energy: 0.5213664133950189
Energy: 0.5095408668882322
Energy: 0.5600020784420014
Energy: 0.5095408668916954
Energy: 0.5731241390973094
Energy: 0.5673442287946867
Energy: 0.5308081312963033
Energy: 0.5673442287981497
Energy: 0.5589646898384135
Energy: 0.5653586295509071
Energy: 0.5199217075216378
Energy: 0.5653586295488293
Energy: 0.616863070632448
Energy: 0.5328654154542062
Energy: 0.5105873139197841
Energy: 0.5328654154521284
Energy: 0.5269066142610566
Energy: 0.5334844479084268
Energy: 0.5283082965915161
Energy: 0.533484447909812
Energy: 0.4973228594198952
Energy: 0.49422089762264315
Energy: 0.6157912905975994
Energy: 0.4942208976240284
Energy: 0.4943106746454381
Energy: 0.4943476297514285
Energy: 0.5285214680001604
Energy: 0.49434762975419894
Energy: 0.7418624761619568
Energy: 0.5350284486729366
Energy: 0.5327057963595019
Energy: 0.5350284486736292
Energy: 0.489902793626224
Energy: 0.49456770020022023
Energy: 0.4966672484989388
Energy: 0.49456770020299073
Energy: 0.5355902706383022
Energy: 0.5338966142083484
Energy: 0.6795406740686301
Energy: 0.5338966142083484
Energy: 0.5341108237973203
Energy: 0.49422149189469483
Energy: 0.5639956781601808
Energy: 0.4942214918995432
Energy: 0.6796617006135784
Energy: 0.4965923046743857
Energy: 0.4964310225533305
Energy: 0.4965923046785415
Energy: 0.5284720785545172
Energy: 0.4946144089659394
Energy: 0.49651136181232314
Energy: 0.49461440897283404
Energy: 0.5125244812823435
Energy: 0.53298203014779
Energy: 0.5731721893064577
Energy: 0.5329820301429732
Energy: 0.5202787040098165
Energy: 0.5332391608535397
Energy: 0.5598831979158542
Energy: 0.5332391608493839
Energy: 0.5732307604358576
Energy: 0.5673329552182752
Energy: 0.5324409247227226
Energy: 0.5673329552141195
Energy: 0.5599632333562653
Energy: 0.5678240443360618
Energy: 0.5533383885921584
Energy: 0.5678240443409102
Energy: 0.6205853953988699
Energy: 0.5326686813767791
Energy: 0.5103489830948938
Energy: 0.5326686813774717
Energy: 0.5269262486320129
Energy: 0.5336642270838415
Energy: 0.5287887682428601
Energy: 0.533664227086612
Energy: 0.49680180320939843
Energy: 0.49420259908289205
Energy: 0.6186775068995968
Energy: 0.4942025990787363
Energy: 0.4949942991099587
Energy: 0.49456281266721336
Energy: 0.5286969479123258
Energy: 0.49456281266998386
Energy: 0.49746417434546625
Energy: 0.534828916740699
Energy: 0.5332888432434979
Energy: 0.5348289167434694

minimum gb energy = 0.489902793626224 eV
minimum distance =  2.54643003297696 Angstroms
sigma value = 25


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

Energy: 0.7089292153511904
Energy: 0.5536509826749506
Energy: 0.5544200704103327
Energy: 0.5536509826765609
Energy: 0.5134169030550723
Energy: 0.560689505225279
Energy: 0.5138527207074258
Energy: 0.5606895052268894
Energy: 0.5542556256963178
Energy: 0.5539170240349277
Energy: 0.6426411382540237
Energy: 0.5539170240357328
Energy: 0.5164006290107314
Energy: 0.5929487235539271
Energy: 0.5137441540192537
Energy: 0.5929487235531219
Energy: 0.6436207347073816
Energy: 0.5133899655887127
Energy: 0.5142745228009257
Energy: 0.5133899655879075
Energy: 0.5554729628182307
Energy: 0.5136478418727363
Energy: 0.513201507525082
Energy: 0.5136478418719311
Energy: 0.5457705902613429
Energy: 0.5621533430779408
Energy: 0.5442317305992536
Energy: 0.5621533430771357
Energy: 0.529875070043249
Energy: 0.5620779953059578
Energy: 0.5863311017289905
Energy: 0.5620779953059578
Energy: 0.5441266974029836
Energy: 0.5619736293029248
Energy: 0.5786001827162103
Energy: 0.56197362930373
Energy: 0.5550612867402835
Energy: 0.5622462058727004
Energy: 0.5134131474602627
Energy: 0.5622462058718951
Energy: 0.7096641592769253
Energy: 0.5130056562105423
Energy: 0.5132366203993687
Energy: 0.5130056562081269
Energy: 0.5507502851781336
Energy: 0.5131188985079039
Energy: 0.5136964145183974
Energy: 0.5131188985087091
Energy: 0.5536687314239084
Energy: 0.5535708962380725
Energy: 0.7087323428112273
Energy: 0.5535708962380725
Energy: 0.5134103974786391
Energy: 0.5166176510822919
Energy: 0.5108066058533256
Energy: 0.5166176510806817
Energy: 0.6428296500087406
Energy: 0.5541632512150027
Energy: 0.5562695721523172
Energy: 0.5541632512133924
Energy: 0.5892315190884733
Energy: 0.5932279157767691
Energy: 0.5548826252815291
Energy: 0.5932279157767691
Energy: 0.5137832279299975
Energy: 0.5134338734456481
Energy: 0.6436377191569459
Energy: 0.5134338734448429
Energy: 0.5135523684820404
Energy: 0.5135065807026282
Energy: 0.5556258092173023
Energy: 0.513506580701823
Energy: 0.5442466329264023
Energy: 0.5622267469840605
Energy: 0.5508102227689102
Energy: 0.5622267469848657
Energy: 0.5877027245793199
Energy: 0.5622095094175882
Energy: 0.5587276785992126
Energy: 0.5622095094191984
Energy: 0.5831619971649484
Energy: 0.5619591049646915
Energy: 0.5448924491162406
Energy: 0.5619591049663017
Energy: 0.5105402400361724
Energy: 0.5635084415816726
Energy: 0.5552510369313891
Energy: 0.5635084415816726
Energy: 0.5127335386476096
Energy: 0.5130998802011237
Energy: 0.5130619735742107
Energy: 0.5130998802019289
Energy: 0.5133877184036361
Energy: 0.5168617204980827
Energy: 0.5500344062143661
Energy: 0.5168617204980827
Energy: 0.5112018633504668
Energy: 0.554251002760154
Energy: 0.554398055632506
Energy: 0.554251002760154

minimum gb energy = 0.5105402400361724 eV
minimum distance =  2.53844838863714 Angstroms
sigma value = 9


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

Energy: 0.7131446290788214
Energy: 0.5819213505272252
Energy: 0.5831496588954407
Energy: 0.5819213505262646
Energy: 0.5825632818905623
Energy: 0.587745015809117
Energy: 0.562686685439975
Energy: 0.5877450158100775
Energy: 0.5828814839272064
Energy: 0.5822716636774032
Energy: 0.8220453737769737
Energy: 0.5822716636774032
Energy: 0.5825432581184883
Energy: 0.5878596691987709
Energy: 0.5489000426475624
Energy: 0.5878596691978103
Energy: 0.6306490062579202
Energy: 0.5485024113134911
Energy: 0.5485573165938723
Energy: 0.5485024113144514
Energy: 0.6050009821944763
Energy: 0.5491997306488065
Energy: 0.5488093771837531
Energy: 0.5491997306478459
Energy: 0.571445831787624
Energy: 0.600284237666178
Energy: 0.6208839358019261
Energy: 0.6002842376652175
Energy: 0.5776733992835414
Energy: 0.5981094901815468
Energy: 0.6174398253272185
Energy: 0.5981094901796259
Energy: 0.5591742310794368
Energy: 0.559506493849685
Energy: 0.7138764731636514
Energy: 0.5595064938516058
Energy: 0.5593011835023991
Energy: 0.539272118944022
Energy: 0.5408950245325556
Energy: 0.539272118944022
Energy: 0.6587600148276164
Energy: 0.5351051550851036
Energy: 0.5353219886353886
Energy: 0.5351051550851036
Energy: 0.53926088864745
Energy: 0.5222730781356523
Energy: 0.5348463995080178
Energy: 0.5222730781346919
Energy: 0.5966530404788984
Energy: 0.596945456350395
Energy: 0.8214582662855081
Energy: 0.5969454563513554
Energy: 0.5967691831482091
Energy: 0.5809443437858798
Energy: 0.6188003339053579
Energy: 0.5809443437878009
Energy: 0.6306205355717789
Energy: 0.5521423517237535
Energy: 0.5517021392809185
Energy: 0.5521423517208719
Energy: 0.6040291975441539
Energy: 0.552741858495391
Energy: 0.5518698761555286
Energy: 0.552741858495391
Energy: 0.5703728852198924
Energy: 0.5960707194750471
Energy: 0.6173552788793661
Energy: 0.5960707194779284
Energy: 0.570368935491094
Energy: 0.6077528591930046
Energy: 0.6057701860521877
Energy: 0.6077528591920441
Energy: 0.5432656094358017
Energy: 0.5435463876187768
Energy: 0.5495527070388835
Energy: 0.5435463876168558
Energy: 0.5438505030269912
Energy: 0.5478558114695853
Energy: 0.5499728616542867
Energy: 0.5478558114686249
Energy: 0.5490971443290571
Energy: 0.5658937741537801
Energy: 0.5829803242108794
Energy: 0.5658937741528197

minimum gb energy = 0.5222730781346919 eV
minimum distance =  2.45639898433267 Angstroms
sigma value = 25


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

Energy: 0.5953850330360054
Energy: 0.5848410105865041
Energy: 0.5859680648244933
Energy: 0.5848410105876918
Energy: 0.5851124570188545
Energy: 0.5642732483300742
Energy: 0.5406185341185169
Energy: 0.564273248331262
Energy: 0.5852467758409114
Energy: 0.5847239667491126
Energy: 0.7125519685275539
Energy: 0.5847239667491126
Energy: 0.5848752273366867
Energy: 0.5644162140443225
Energy: 0.5391014045179487
Energy: 0.5644162140443225
Energy: 0.5587613972272966
Energy: 0.5608373215673501
Energy: 0.5618792267218772
Energy: 0.5608373215661624
Energy: 0.5262004898934507
Energy: 0.5601005840718991
Energy: 0.5394072497283429
Energy: 0.5601005840718991
Energy: 0.5948577107218541
Energy: 0.5601439314929453
Energy: 0.5597028536797051
Energy: 0.560143931494133
Energy: 0.5235988525664498
Energy: 0.593425740468686
Energy: 0.5400287635902329
Energy: 0.5934257404698737
Energy: 0.5848145821668456
Energy: 0.5844862799076145
Energy: 0.6401389076466971
Energy: 0.5844862799076145
Energy: 0.584607232599618
Energy: 0.5958677714020878
Energy: 0.5890575590566111
Energy: 0.5958677714008999
Energy: 0.7120874809803677
Energy: 0.5855101656834096
Energy: 0.5852168419078687
Energy: 0.5855101656822219
Energy: 0.5825177723605764
Energy: 0.564362827854071
Energy: 0.584728709657041
Energy: 0.564362827854071
Energy: 0.540065310304665
Energy: 0.5612562594593313
Energy: 0.5587456691791033
Energy: 0.5612562594605193
Energy: 0.5621722676556042
Energy: 0.5611739268756922
Energy: 0.5264941352690764
Energy: 0.5611739268756922
Energy: 0.5595135921458856
Energy: 0.5605381777610509
Energy: 0.6005537866719188
Energy: 0.560538177759863
Energy: 0.5394940961439886
Energy: 0.5969635034810072
Energy: 0.5974031558073724
Energy: 0.5969635034810072
Energy: 0.6400064714675788
Energy: 0.5273456189905088
Energy: 0.5864185344631044
Energy: 0.5273456189905088

minimum gb energy = 0.5235988525664498 eV
minimum distance =  2.59938711534917 Angstroms
sigma value = 17


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

Energy: 0.8176619054274333
Energy: 0.6394793149771967
Energy: 0.6407945768056207
Energy: 0.639479314978542
Energy: 0.5964393434062989
Energy: 0.575086672336228
Energy: 0.6380053412276637
Energy: 0.5750866723348825
Energy: 0.5718946888169829
Energy: 0.5704075541024054
Energy: 0.7468098188315165
Energy: 0.5704075541044235
Energy: 0.5701675495186427
Energy: 0.5761636673383611
Energy: 0.575631285638179
Energy: 0.5761636673376883
Energy: 0.6275824855081525
Energy: 0.6056438080551799
Energy: 0.5797511984282133
Energy: 0.6056438080558528
Energy: 0.5770712325261766
Energy: 0.6234161801182886
Energy: 0.5704666292161028
Energy: 0.6234161801182886
Energy: 0.676029801392908
Energy: 0.5697583030565374
Energy: 0.5716800584070632
Energy: 0.5697583030585556
Energy: 0.6747720375374665
Energy: 0.575122860123959
Energy: 0.5696775995409652
Energy: 0.5751228601246318
Energy: 0.6404939382296932
Energy: 0.6396275199933126
Energy: 0.7439532610505502
Energy: 0.6396275199946581
Energy: 0.639898925372494
Energy: 0.6092747292326212
Energy: 0.6126333580271194
Energy: 0.609274729230603
Energy: 0.6270553339842675
Energy: 0.5590705879839526
Energy: 0.5515900028077555
Energy: 0.5590705879839526
Energy: 0.6077564613692719
Energy: 0.5590640811780926
Energy: 0.5594243692811761
Energy: 0.5590640811760744
Energy: 0.5987039234456698
Energy: 0.5606342766704008
Energy: 0.5594192169856331
Energy: 0.5606342766704008
Energy: 0.6786380324530666
Energy: 0.5757230559012273
Energy: 0.5513112105311665
Energy: 0.5757230559025727
Energy: 0.6403030072107201
Energy: 0.6485221369089471
Energy: 0.6719663250398774
Energy: 0.6485221369096198
Energy: 0.6391005824886307
Energy: 0.6387428590727433
Energy: 0.6716198544871546
Energy: 0.6387428590713978
Energy: 0.6363831230034063
Energy: 0.5702156486517397
Energy: 0.5703279925360905
Energy: 0.5702156486503943
Energy: 0.6362891914483804
Energy: 0.5702647766828071
Energy: 0.5695157517354955
Energy: 0.5702647766834797
Energy: 0.5760318746154733
Energy: 0.6228817123537865
Energy: 0.6290342992540942
Energy: 0.6228817123544593
Energy: 0.5771113068697123
Energy: 0.606445286613635
Energy: 0.5993205435733618
Energy: 0.606445286613635
Energy: 0.5720774996059687
Energy: 0.5757350727706684
Energy: 0.6563630695809415
Energy: 0.5757350727699956
Energy: 0.5693692147577553
Energy: 0.569767095263761
Energy: 0.6761339412548676
Energy: 0.5697670952630883
Energy: 0.6109802026494675
Energy: 0.6078211562854041
Energy: 0.6387795418139747
Energy: 0.6078211562854041
Energy: 0.7444797626365222
Energy: 0.6390556244398565
Energy: 0.6390406358225983
Energy: 0.6390556244385112
Energy: 0.5541592312137561
Energy: 0.5757870491878762
Energy: 0.6390366735282887
Energy: 0.5757870491878762
Energy: 0.5606933126801711
Energy: 0.5586354294429257
Energy: 0.6273010425568439
Energy: 0.558635429439562
Energy: 0.5507330914061828
Energy: 0.5609900873150159
Energy: 0.6112554136305447
Energy: 0.5609900873177068
Energy: 0.5601245761097972
Energy: 0.5596476526054374
Energy: 0.6768656146706643
Energy: 0.55964765260611
Energy: 0.5540543247035544
Energy: 0.5751070895297136
Energy: 0.598071568831807
Energy: 0.5751070895310592
Energy: 0.8137081404790085
Energy: 0.639024960893899
Energy: 0.6398563845170213
Energy: 0.6390249608959173

minimum gb energy = 0.5507330914061828 eV
minimum distance =  2.48673890009762 Angstroms
sigma value = 53


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

Energy: 0.7435754425585809
Energy: 0.5943524162520835
Energy: 0.5969688550299632
Energy: 0.5943524162520835
Energy: 0.5940872995415091
Energy: 0.5361041055774499
Energy: 0.5970965973984659
Energy: 0.5361041055774499
Energy: 0.5938781653821833
Energy: 0.5955632367384229
Energy: 0.6198413449549194
Energy: 0.5955632367353255
Energy: 0.5932725614325353
Energy: 0.5362837210184226
Energy: 0.6228427953230843
Energy: 0.5362837210184226
Energy: 0.6213570026073756
Energy: 0.5358439792039981
Energy: 0.5008385815546353
Energy: 0.5358439792024493
Energy: 0.6224884001817916
Energy: 0.5374687680653368
Energy: 0.5012206797246428
Energy: 0.5374687680653368
Energy: 0.6782091691031726
Energy: 0.5930869883991085
Energy: 0.5968037504211717
Energy: 0.5930869883975597
Energy: 0.6786379479563898
Energy: 0.5370452086303048
Energy: 0.5953800935480125
Energy: 0.537045208628756
Energy: 0.594784472596285
Energy: 0.5951528349736108
Energy: 0.6194079778236368
Energy: 0.5951528349751597
Energy: 0.5925001331344368
Energy: 0.5354722627410746
Energy: 0.5943473107830392
Energy: 0.535472262739526
Energy: 0.6221040978023665
Energy: 0.5368979394907044
Energy: 0.5096087349106225
Energy: 0.5368979394907044
Energy: 0.5942820010252436
Energy: 0.5356497744831261
Energy: 0.5024700037154959
Energy: 0.5356497744831261
Energy: 0.6786846354758869
Energy: 0.5373301266361885
Energy: 0.59563714271927
Energy: 0.5373301266346397

minimum gb energy = 0.5008385815546353 eV
minimum distance =  2.58833129525868 Angstroms
sigma value = 9


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

Energy: 0.7380543983179373
Energy: 0.6710684854983238
Energy: 0.6710989852516955
Energy: 0.6710684854988969
Energy: 0.5706658056392544
Energy: 0.5626970118502379
Energy: 0.675156348748475
Energy: 0.5626970118508111
Energy: 0.5663016849310746
Energy: 0.5622440933323677
Energy: 0.6892097596285872
Energy: 0.562244093332941
Energy: 0.5639852330192405
Energy: 0.5623655671432413
Energy: 0.6734439345892249
Energy: 0.5623655671443876
Energy: 0.5635259885254226
Energy: 0.5620224801411766
Energy: 0.7061772780087513
Energy: 0.5620224801406033
Energy: 0.5727902589877052
Energy: 0.5618687359018323
Energy: 0.7057611045055244
Energy: 0.5618687359029788
Energy: 0.6744626155761867
Energy: 0.6666293797027089
Energy: 0.6705872373543027
Energy: 0.6666293797015623
Energy: 0.673739292018581
Energy: 0.6654618908218485
Energy: 0.6655710427359091
Energy: 0.6654618908235681
Energy: 0.5946056845061168
Energy: 0.6358284147454432
Energy: 0.5995272449291631
Energy: 0.6358284147471628
Energy: 0.5592551303929489
Energy: 0.6284550681160772
Energy: 0.6672934055215723
Energy: 0.6284550681229557
Energy: 0.5945630109043863
Energy: 0.5938541715727967
Energy: 0.6240240945846065
Energy: 0.5938541715739433
Energy: 0.5934192380031145
Energy: 0.602287869403359
Energy: 0.7378988037244089
Energy: 0.602287869403359
Energy: 0.6743230615340574
Energy: 0.5943882982572002
Energy: 0.6005791000612706
Energy: 0.5943882982577734
Energy: 0.6751110762676944
Energy: 0.5941899526489318
Energy: 0.5970784744716773
Energy: 0.5941899526500782
Energy: 0.6668522541434522
Energy: 0.6088515371257216
Energy: 0.5992016015280689
Energy: 0.608851537124002
Energy: 0.6393316743215561
Energy: 0.6351079384794148
Energy: 0.604825444697274
Energy: 0.6351079384799879
Energy: 0.6673834757406168
Energy: 0.5657175075177768
Energy: 0.5957243420729389
Energy: 0.5657175075160571
Energy: 0.6704898954179449
Energy: 0.6708176695572127
Energy: 0.7373830356361527
Energy: 0.6708176695560661
Energy: 0.6750832410277242
Energy: 0.5622748207430347
Energy: 0.5639217901416961
Energy: 0.5622748207395953
Energy: 0.6899075084862943
Energy: 0.5625275170084636
Energy: 0.5621972287313194
Energy: 0.56252751700961
Energy: 0.6736463792623874
Energy: 0.5622862049096059
Energy: 0.5648076705782973
Energy: 0.5622862049101791
Energy: 0.7062538992974496
Energy: 0.5618293621806575
Energy: 0.5625674821446919
Energy: 0.5618293621800842
Energy: 0.7057669416166037
Energy: 0.561954140466666
Energy: 0.5720628368161171
Energy: 0.561954140466666
Energy: 0.6766194576069892
Energy: 0.6664958741044655
Energy: 0.6744947197979736
Energy: 0.666495874103319
Energy: 0.6657302552349323
Energy: 0.6659219337396611
Energy: 0.6736024264304681
Energy: 0.6659219337402343
Energy: 0.6016278639793453
Energy: 0.6319810656118692
Energy: 0.593865645890155
Energy: 0.631981036312397
Energy: 0.6672526900751213
Energy: 0.6008772700894033
Energy: 0.5589237379857839
Energy: 0.6008772700739524
Energy: 0.6242287700637933
Energy: 0.5954024782605228
Energy: 0.5941865144912064
Energy: 0.5954024782622425
Energy: 0.7387430100009456
Energy: 0.5945969774480461
Energy: 0.5936233368650816
Energy: 0.5945969774480461
Energy: 0.6006792205533957
Energy: 0.5948608409634731
Energy: 0.673812617034357
Energy: 0.5948608409594607
Energy: 0.5962329002752119
Energy: 0.5942469605884899
Energy: 0.6880148750613551
Energy: 0.5942469605879167
Energy: 0.5929296553629221
Energy: 0.5875889638504646
Energy: 0.6326725263623273
Energy: 0.5875889638498913
Energy: 0.6026943305054958
Energy: 0.6362163856461479
Energy: 0.6399522012823402
Energy: 0.6362163856444283
Energy: 0.5945847841465135
Energy: 0.5651555212978904
Energy: 0.6271457790865979
Energy: 0.5651555212967438
Energy: 0.7368041428434937
Energy: 0.6712584608227009
Energy: 0.6697501657973259
Energy: 0.6712584608215546

minimum gb energy = 0.5589237379857839 eV
minimum distance =  2.48520992941294 Angstroms
sigma value = 73


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

Energy: 0.776036173985566
Energy: 0.652268827146812
Energy: 0.6519212108286717
Energy: 0.6522688271477215
Energy: 0.5869399030130941
Energy: 0.5761988608462296
Energy: 0.6385606188337088
Energy: 0.576198860843522
Energy: 0.5762762725639947
Energy: 0.5768096854509066
Energy: 0.6686176421790899
Energy: 0.5768096854499972
Energy: 0.5764681080300941
Energy: 0.5770899913784693
Energy: 0.7058198120088183
Energy: 0.5770899913775598
Energy: 0.5782493259956446
Energy: 0.5766420144627973
Energy: 0.6864240183252064
Energy: 0.5766420144627973
Energy: 0.5873309566794189
Energy: 0.5770250849400959
Energy: 0.686398053096149
Energy: 0.5770250849400959
Energy: 0.602021138337971
Energy: 0.6906607287881072
Energy: 0.6670893151720811
Energy: 0.6906607287890166
Energy: 0.6032144700936569
Energy: 0.6559360046805566
Energy: 0.6583510876144901
Energy: 0.6559360046769188
Energy: 0.6010588324717147
Energy: 0.6415043561151472
Energy: 0.6693924317737681
Energy: 0.6415043561124188
Energy: 0.5968861739595182
Energy: 0.6374947482746941
Energy: 0.6560770428133084
Energy: 0.6374947482746941
Energy: 0.6033807607849739
Energy: 0.5673113975440979
Energy: 0.5671427162882761
Energy: 0.5673113975450075
Energy: 0.6012227831050153
Energy: 0.5818155018997275
Energy: 0.702025356933063
Energy: 0.581815501896999
Energy: 0.6612101104402682
Energy: 0.6057309940142713
Energy: 0.6015009215703409
Energy: 0.6057309940179091
Energy: 0.6684831889001597
Energy: 0.6021904844067221
Energy: 0.6038967692305173
Energy: 0.6021904844076315
Energy: 0.6723610719126097
Energy: 0.5921324954307529
Energy: 0.5907765217247104
Energy: 0.5921324954252962
Energy: 0.6870119738181992
Energy: 0.591850467639359
Energy: 0.5908129542394288
Energy: 0.59185046763754
Energy: 0.6858015899530017
Energy: 0.590959849989718
Energy: 0.602756757441232
Energy: 0.5909598499869896
Energy: 0.6527180085057551
Energy: 0.6531195460660597
Energy: 0.6023691283696935
Energy: 0.6531195460660597
Energy: 0.6450635111865302
Energy: 0.6147604962582096
Energy: 0.6029338258635972
Energy: 0.6147604962573001
Energy: 0.6448337858659917
Energy: 0.6143448768161626
Energy: 0.6446831395795742
Energy: 0.6143448768152532
Energy: 0.6441571078050281
Energy: 0.6390210498775032
Energy: 0.5993500022901068
Energy: 0.6390210498784126
Energy: 0.6840353630702509
Energy: 0.6400971604718154
Energy: 0.6413556009001543
Energy: 0.6400971604727248

minimum gb energy = 0.5671427162882761 eV
minimum distance =  2.5363579886298 Angstroms
sigma value = 7


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

Energy: 0.8931926320915607
Energy: 0.6590770996675198
Energy: 0.6611955121188288
Energy: 0.6590770996707352
Energy: 0.5839998307881782
Energy: 0.576889196830334
Energy: 0.6579583699689304
Energy: 0.5768891968232601
Energy: 0.582481874872531
Energy: 0.5778380323488128
Energy: 0.6332665858720804
Energy: 0.5778380323436682
Energy: 0.5787517117711578
Energy: 0.5787048270567541
Energy: 0.6554036388591227
Energy: 0.5787048270573972
Energy: 0.5847141116192667
Energy: 0.5849723846451302
Energy: 0.6835341181691401
Energy: 0.584972384643844
Energy: 0.5892569776476666
Energy: 0.584481645503763
Energy: 0.6832995610609628
Energy: 0.5844816455050492
Energy: 0.6928550736367919
Energy: 0.584909699200582
Energy: 0.5884250683119864
Energy: 0.5849096992070127
Energy: 0.65512254445765
Energy: 0.5839780305492815
Energy: 0.585776321343894
Energy: 0.5839780305447799
Energy: 0.6567043740605776
Energy: 0.5772666957984911
Energy: 0.5784772655697209
Energy: 0.5772666958023496
Energy: 0.6842084666214551
Energy: 0.5783305454765092
Energy: 0.5830673152222748
Energy: 0.5783305454771522
Energy: 0.699220543813598
Energy: 0.6407616790259993
Energy: 0.5897295522857435
Energy: 0.6407616790208548
Energy: 0.6588893648121399
Energy: 0.6424522815069551
Energy: 0.6550099752452646
Energy: 0.6424522815088844
Energy: 0.6408605970534118
Energy: 0.6125484698346667
Energy: 0.6432694321962503
Energy: 0.6125484698372391
Energy: 0.6354044469257858
Energy: 0.6111619464892344
Energy: 0.5853675302926413
Energy: 0.6111619464911637
Energy: 0.6439547097239939
Energy: 0.6132780767081661
Energy: 0.5912647628966436
Energy: 0.6132780767081661
Energy: 0.5934871956879026
Energy: 0.6418607570232451
Energy: 0.6591071964273671
Energy: 0.6418607570174573
Energy: 0.5934485094059159
Energy: 0.6408478474401699
Energy: 0.6562582077928079
Energy: 0.6408478474478576
Energy: 0.584394328246037
Energy: 0.5793292134649133
Energy: 0.6329280312505765
Energy: 0.5793292134719872
Energy: 0.5770200565388687
Energy: 0.5776944952154329
Energy: 0.6546319442572958
Energy: 0.5776944952109314
Energy: 0.5837951950572418
Energy: 0.5849054357108293
Energy: 0.5956958780110169
Energy: 0.5849054357198324
Energy: 0.5879892405441203
Energy: 0.6264271317896023
Energy: 0.6830206040397792
Energy: 0.6264271317934609
Energy: 0.6550148242170559
Energy: 0.5845651645142025
Energy: 0.589253954611907
Energy: 0.5845651645103439
Energy: 0.6558747174076874
Energy: 0.584774498906817
Energy: 0.5851135995559363
Energy: 0.5847744988958846
Energy: 0.7039951938920874
Energy: 0.5784352519819475
Energy: 0.5793458031000102
Energy: 0.5784352519774458
Energy: 0.6862181935077328
Energy: 0.5777779220330672
Energy: 0.5816996146027109
Energy: 0.5777779220375688
Energy: 0.6867735227459532
Energy: 0.6555383419198195
Energy: 0.5846750543143149
Energy: 0.6555383419223918
Energy: 0.6613329994036173
Energy: 0.6589624253200195
Energy: 0.7880215202992674
Energy: 0.6589624253219487
Energy: 0.6415141304179226
Energy: 0.641657982062935
Energy: 0.5846146377558357
Energy: 0.6416579820590765
Energy: 0.6341902838513888
Energy: 0.6119684491454268
Energy: 0.6408504266867019
Energy: 0.6119684491505716
Energy: 0.6431037261568742
Energy: 0.644147333434289
Energy: 0.5851294515574217
Energy: 0.6441473334375044
Energy: 0.5933616027756495
Energy: 0.6427975190062656
Energy: 0.6435343355109961
Energy: 0.6427975190011209

minimum gb energy = 0.5768891968232601 eV
minimum distance =  2.52745091970594 Angstroms
sigma value = 29


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

Energy: 0.5358512029195965
Energy: 0.6341906305225316
Energy: 0.6040365809334071
Energy: 0.6341906305240499
Energy: 0.5556864199312643
Energy: 0.5894083381078364
Energy: 0.5426626020124979
Energy: 0.5894083381080605
Energy: 0.6022747357202992
Energy: 0.6006291652961049
Energy: 0.539693754152831
Energy: 0.6006291652958811
Energy: 0.5507988839694271
Energy: 0.5427195235110035
Energy: 0.5609466879952121
Energy: 0.5427195235114266
Energy: 0.5432666300328234
Energy: 0.5440913979655473
Energy: 0.5417938034204994
Energy: 0.5440913979653231
Energy: 0.5557771810038863
Energy: 0.5986323823124688
Energy: 0.5429156403556902
Energy: 0.5986323823124688
Energy: 0.5403792611170916
Energy: 0.6019334471194513
Energy: 0.6015580588979365
Energy: 0.6019334471200984
Energy: 0.5427683427075207
Energy: 0.5457527065674601
Energy: 0.5493924679150509
Energy: 0.5457527065683312
Energy: 0.5359065083317068
Energy: 0.5430679480726728
Energy: 0.5608966611096544
Energy: 0.5430679480724488

minimum gb energy = 0.5358512029195965 eV
minimum distance =  2.53617173912283 Angstroms
sigma value = 5


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

Energy: 0.7299078548614413
Energy: 0.6248459536200862
Energy: 0.625483288508925
Energy: 0.6248459536243385
Energy: 0.6227007587436149
Energy: 0.5473923441153998
Energy: 0.6346143800469343
Energy: 0.5473923441153998
Energy: 0.6342584065011828
Energy: 0.5912221564139408
Energy: 0.6415499175658236
Energy: 0.5912221564115109
Energy: 0.5625202789939154
Energy: 0.5460517305718936
Energy: 0.6487225611623246
Energy: 0.5460517305706786
Energy: 0.6437170033942369
Energy: 0.5459474254716092
Energy: 0.6369142358055571
Energy: 0.5459474254685721
Energy: 0.5620537065861102
Energy: 0.5475439509971822
Energy: 0.6371412158211749
Energy: 0.5475439509977897
Energy: 0.546694989362357
Energy: 0.5461628208983184
Energy: 0.635840912649577
Energy: 0.546162820895281
Energy: 0.5463341611716211
Energy: 0.5472257906668663
Energy: 0.729170719295861
Energy: 0.5472257906674738
Energy: 0.546300747955871
Energy: 0.5605424418484466
Energy: 0.696244184330243
Energy: 0.5605424418466242
Energy: 0.6455861948513999
Energy: 0.5310839954877514
Energy: 0.5362398141892497
Energy: 0.5310839954889665
Energy: 0.5469122069467224
Energy: 0.5309286102325655
Energy: 0.5331764950032001
Energy: 0.5309286102349954
Energy: 0.7074942635762622
Energy: 0.5320332450535041
Energy: 0.5307123954192015
Energy: 0.5320332450535041
Energy: 0.7059506601548111
Energy: 0.5345097236238261
Energy: 0.5302877424265946
Energy: 0.5345097236299007
Energy: 0.5481953304472991
Energy: 0.5617446466190389
Energy: 0.6367274500102689
Energy: 0.561744646617824
Energy: 0.5475012420695944
Energy: 0.5467139610163494
Energy: 0.6373731342030091
Energy: 0.5467139610157419
Energy: 0.5497216093703883
Energy: 0.5470774267493242
Energy: 0.6802409955652692
Energy: 0.5470774267505392
Energy: 0.5682993202420511
Energy: 0.5630242059154713
Energy: 0.5616496592437717
Energy: 0.5630242059148639
Energy: 0.6497150398302305
Energy: 0.5478240292191799
Energy: 0.5476062626822954
Energy: 0.5478240292197875
Energy: 0.6462770311581123
Energy: 0.592563311287421
Energy: 0.6347496469132167
Energy: 0.592563311286206
Energy: 0.6435579680359628
Energy: 0.5462751498832307
Energy: 0.5606540405766797
Energy: 0.5462751497976054
Energy: 0.6374939478356719
Energy: 0.5482378862726373
Energy: 0.6438658847327258
Energy: 0.5482378862714223
Energy: 0.6367926119692006
Energy: 0.5654700593819486
Energy: 0.5629171564712736
Energy: 0.565470059382556
Energy: 0.6474125632121394
Energy: 0.5462122993135001
Energy: 0.5474904062497141
Energy: 0.546212299317145
Energy: 0.7180075306952747
Energy: 0.5468916295121151
Energy: 0.5498064988768742
Energy: 0.5468916295139375
Energy: 0.7091736694027705
Energy: 0.5597086768143462
Energy: 0.5471924826941144
Energy: 0.5597086768155611
Energy: 0.5414792364873208
Energy: 0.5314493070281043
Energy: 0.6454937606491111
Energy: 0.5314493070268894
Energy: 0.5436039464593166
Energy: 0.5314007242470934
Energy: 0.5459670534804695
Energy: 0.5314007242483083
Energy: 0.5313376110616805
Energy: 0.5319779792211754
Energy: 0.5605383852976692
Energy: 0.531977979220568
Energy: 0.5301784918039726
Energy: 0.5310435953970111
Energy: 0.705832344534514
Energy: 0.5310435953982261
Energy: 0.6369310065346319
Energy: 0.5603737811493734
Energy: 0.5984793039080746
Energy: 0.5603737811505883
Energy: 0.6386257914551682
Energy: 0.5468394442838489
Energy: 0.5483512919620608
Energy: 0.5468394442832415
Energy: 0.6458515558588417
Energy: 0.5468138315559126
Energy: 0.5478890388114763
Energy: 0.5468138315546976
Energy: 0.5628232248176019
Energy: 0.5628041250075809
Energy: 0.563363917420708
Energy: 0.562804125005151

minimum gb energy = 0.5301784918039726 eV
minimum distance =  2.51580945299281 Angstroms
sigma value = 1


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

Energy: 0.8390911936141038
Energy: 0.6164022901903689
Energy: 0.6186354455019658
Energy: 0.6164022901903689
Energy: 0.5501850591755065
Energy: 0.5276100438083808
Energy: 0.6454568599569263
Energy: 0.5276100438083808
Energy: 0.640601960727911
Energy: 0.5850075043436012
Energy: 0.6460996378119895
Energy: 0.585007504344441
Energy: 0.5953857943426415
Energy: 0.584203698605357
Energy: 0.5608030133248145
Energy: 0.5842036986078768
Energy: 0.5671067499812303
Energy: 0.5549223842001707
Energy: 0.5987776131030633
Energy: 0.5549223842018505
Energy: 0.5527687279788408
Energy: 0.532688623399685
Energy: 0.6011288737101297
Energy: 0.532688623398845
Energy: 0.5327331650677166
Energy: 0.5319567419325639
Energy: 0.6487292628416684
Energy: 0.5319567419342438
Energy: 0.532715938251077
Energy: 0.5374957015201884
Energy: 0.694575907457857
Energy: 0.5374957015210283
Energy: 0.5711775692881863
Energy: 0.5562825553742179
Energy: 0.6910643187964144
Energy: 0.5562825553733779
Energy: 0.711277733518301
Energy: 0.5005976958228351
Energy: 0.5654176735117273
Energy: 0.5005976958211552
Energy: 0.535618416742367
Energy: 0.5038924710188626
Energy: 0.571149588356043
Energy: 0.5038924710138231
Energy: 0.7214079540399169
Energy: 0.5012366835834451
Energy: 0.556139461951169
Energy: 0.5012366835834451
Energy: 0.7211130184894663
Energy: 0.49941509108443494
Energy: 0.5684855738985524
Energy: 0.4994150910877947
Energy: 0.5694432583168001
Energy: 0.4993104184191987
Energy: 0.6732870700758536
Energy: 0.4993104184175189
Energy: 0.5941893631032064
Energy: 0.5544706841347754
Energy: 0.6733517952350473
Energy: 0.554470684138135
Energy: 0.5961157443142974
Energy: 0.5322211479103944
Energy: 0.5264855287829143
Energy: 0.5322211479129141
Energy: 0.5666320777063877
Energy: 0.5664448441033728
Energy: 0.5973461443998099
Energy: 0.5664448441084123
Energy: 0.5394258644705205
Energy: 0.5341075773807599
Energy: 0.5950171163860867
Energy: 0.5341075773816
Energy: 0.5376279181719341
Energy: 0.5322698359100061
Energy: 0.6857474919087798
Energy: 0.5322698359083262
Energy: 0.5499834367272154
Energy: 0.6025171641348359
Energy: 0.6944156646264077
Energy: 0.6025171641306363
Energy: 0.6881089756512733
Energy: 0.5554849545515897
Energy: 0.6606913545886307
Energy: 0.5554849545532696
Energy: 0.68746209656444
Energy: 0.5270294676778432
Energy: 0.5278428068674511
Energy: 0.5270294676761634
Energy: 0.6201020810817967
Energy: 0.526795375938084
Energy: 0.5276014090670996
Energy: 0.5267953759364042
Energy: 0.6912084858737532
Energy: 0.5385867953149445
Energy: 0.542521369764974
Energy: 0.5385867953157844

minimum gb energy = 0.4993104184175189 eV
minimum distance =  2.45956605776942 Angstroms
sigma value = 17


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

Energy: 0.8217167062038562
Energy: 0.6133906163338176
Energy: 0.6135802046883988
Energy: 0.6133906163343368
Energy: 0.519131491968519
Energy: 0.517674063909411
Energy: 0.5992188597327376
Energy: 0.5176740639114874
Energy: 0.6613565547936304
Energy: 0.6198299102713346
Energy: 0.597853478346532
Energy: 0.6198299102723729
Energy: 0.6671220859244498
Energy: 0.5426786521341604
Energy: 0.6183997724631779
Energy: 0.5426786521300073
Energy: 0.5982121428761675
Energy: 0.5087568463329858
Energy: 0.711705964818735
Energy: 0.5087568463340241
Energy: 0.5155608378782228
Energy: 0.508764905812798
Energy: 0.7099983611217371
Energy: 0.5087649058112403
Energy: 0.5065934202618508
Energy: 0.5054489575091772
Energy: 0.5714139312014752
Energy: 0.5054489575117729
Energy: 0.5116325018891796
Energy: 0.5063497371515067
Energy: 0.7504041167576462
Energy: 0.5063497371525449
Energy: 0.7012730943468666
Energy: 0.506259761257552
Energy: 0.6473583793422799
Energy: 0.506259761257552
Energy: 0.5980211067181489
Energy: 0.5443850674323149
Energy: 0.5948162554511439
Energy: 0.5443850674323149
Energy: 0.7006117626952185
Energy: 0.5172035912553837
Energy: 0.5265757701578478
Energy: 0.517203591252788
Energy: 0.7097044885610887
Energy: 0.5185377054775369
Energy: 0.6063597861680964
Energy: 0.5185377054790942
Energy: 0.7133268241841827
Energy: 0.5307260498314708
Energy: 0.5348227131253893
Energy: 0.5307260498267985
Energy: 0.5173915274203801
Energy: 0.5167056351850324
Energy: 0.5187166209673838
Energy: 0.5167056351860706
Energy: 0.6623158924879007
Energy: 0.517453425723366
Energy: 0.5239414309239805
Energy: 0.5174534257228469
Energy: 0.5045886514584412
Energy: 0.516739738332935
Energy: 0.5194772395545373
Energy: 0.5167397383308584
Energy: 0.517972295014561
Energy: 0.5183614179113484
Energy: 0.7431897022740119
Energy: 0.5183614179077145
Energy: 0.5191963824043857
Energy: 0.5169180554616077
Energy: 0.7016576408411475
Energy: 0.5169180554610887
Energy: 0.5164268930751396
Energy: 0.5183425010137641
Energy: 0.6635146396031978
Energy: 0.5183425010127259
Energy: 0.5453860338533034
Energy: 0.5395192103470168
Energy: 0.7512237068074045
Energy: 0.5395192103496125
Energy: 0.5993070481970318
Energy: 0.5174913575087967
Energy: 0.5183017564132525
Energy: 0.5174913575077584
Energy: 0.6000431382067547
Energy: 0.6202850755528712
Energy: 0.661075797616429
Energy: 0.6202850755549476
Energy: 0.569333450640618
Energy: 0.5415828576819717
Energy: 0.6635750152157944
Energy: 0.54158285768301
Energy: 0.7147357605819404
Energy: 0.5126009356091428
Energy: 0.506377446973514
Energy: 0.5126009356091428
Energy: 0.7099644300274102
Energy: 0.5068098807813494
Energy: 0.5134620852705071
Energy: 0.5068098807818685
Energy: 0.6074369382395386
Energy: 0.5057725990884021
Energy: 0.5086620844425117
Energy: 0.505772599091517
Energy: 0.8283607772248331
Energy: 0.5061201193686846
Energy: 0.514352112514994
Energy: 0.5061201193692039
Energy: 0.6474287661595272
Energy: 0.506345229878601
Energy: 0.7022173383026493
Energy: 0.5063452298775627
Energy: 0.5939433032208166
Energy: 0.5442154566102133
Energy: 0.5987112847300793
Energy: 0.54421545661229
Energy: 0.5274221242155288
Energy: 0.5168882008902177
Energy: 0.589268933805875
Energy: 0.516888200890737
Energy: 0.6088018552100063
Energy: 0.518528372657378
Energy: 0.7099209062933967
Energy: 0.5185283726563397
Energy: 0.5370613529029526
Energy: 0.5290264636992011
Energy: 0.7103000102634284
Energy: 0.5290264636997204
Energy: 0.5169531912466958
Energy: 0.5164445583699732
Energy: 0.5177153621749357
Energy: 0.5164445583710113
Energy: 0.5227233935586983
Energy: 0.5178757951272159
Energy: 0.6660105308252842
Energy: 0.5178757951272159
Energy: 0.5902361148411536
Energy: 0.529936626385317
Energy: 0.7579213828781032
Energy: 0.5299366263868746
Energy: 0.7454310806766729
Energy: 0.5181974900158394
Energy: 0.517307701350148
Energy: 0.5181974900168776
Energy: 0.5903809029012466
Energy: 0.516770171824623
Energy: 0.5174560512086737
Energy: 0.5167701718251423
Energy: 0.6621095210922037
Energy: 0.5187900904889877
Energy: 0.5409013208384863
Energy: 0.5187900904889877

minimum gb energy = 0.5045886514584412 eV
minimum distance =  2.47475325715618 Angstroms
sigma value = 89


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

Energy: 0.8547892028450834
Energy: 0.46787604549473305
Energy: 0.4685281272688155
Energy: 0.46787604549473305
Energy: 0.5135631076736576
Energy: 0.5121130607239509
Energy: 0.4682918123443043
Energy: 0.5121130607239509
Energy: 0.46468394594821455
Energy: 0.5130871501340821
Energy: 0.5133104303331361
Energy: 0.5130871501340821
Energy: 0.4668968904766155
Energy: 0.5118017495357146
Energy: 0.4826756900962523
Energy: 0.5118017495370729
Energy: 0.5145371321651223
Energy: 0.46977520785244037
Energy: 0.6178304349064478
Energy: 0.46977520785379867
Energy: 0.46768883025913355
Energy: 0.46945611019751604
Energy: 0.6172257139992536
Energy: 0.46945611019751604
Energy: 0.46858324778172916
Energy: 0.46768652467846916
Energy: 0.5150148415596203
Energy: 0.4676865246798275
Energy: 0.46806931193362256
Energy: 0.4684703590399457
Energy: 0.464592941657293
Energy: 0.4684703590413041
Energy: 0.4837804299944482
Energy: 0.4679887195245472
Energy: 0.46488685621953796
Energy: 0.4679887195245472
Energy: 0.5127151301026781
Energy: 0.5115678928282922
Energy: 0.5146259297849037
Energy: 0.5115678928282922
Energy: 0.5146043286468502
Energy: 0.5115450205286155
Energy: 0.4644314651830609
Energy: 0.5115450205299737
Energy: 0.6170594434348831
Energy: 0.46894210541729064
Energy: 0.514621672526259
Energy: 0.46894210541729064
Energy: 0.61752873905997
Energy: 0.4684969142675178
Energy: 0.4677467598546106
Energy: 0.4684969142675178
Energy: 0.5137256624774115
Energy: 0.4673794250421516
Energy: 0.4677995953659972
Energy: 0.4673794250421516
Energy: 0.4652101448852156
Energy: 0.46805351286565533
Energy: 0.46802662677204493
Energy: 0.4680535128670137

minimum gb energy = 0.4644314651830609 eV
minimum distance =  2.53132345851699 Angstroms
sigma value = 13


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

Energy: 0.7610521923943631
Energy: 0.5827365174686884
Energy: 0.5862640603969825
Energy: 0.5827365174658418
Energy: 0.6680307998856903
Energy: 0.45554200772239617
Energy: 0.540338267243551
Energy: 0.45554200772239617
Energy: 0.720185249079314
Energy: 0.4550328705046322
Energy: 0.5337937382076995
Energy: 0.4550328705159929
Energy: 0.5996476815271724
Energy: 0.45554225784954083
Energy: 0.5456515052504647
Energy: 0.45554225784157026
Energy: 0.5458543203022942
Energy: 0.45550029612486687
Energy: 0.6676226591871515
Energy: 0.4555002961311295
Energy: 0.5424796539374569
Energy: 0.45523535543085203
Energy: 0.6669958296458046
Energy: 0.4552353554319906
Energy: 0.5373073769430884
Energy: 0.4551980030806462
Energy: 0.5489838119824094
Energy: 0.4551980030760915
Energy: 0.4830295288445181
Energy: 0.4663366557851128
Energy: 0.6723032901440974
Energy: 0.4663366557890981
Energy: 0.4584527929572721
Energy: 0.4562672217270131
Energy: 0.6717392150514768
Energy: 0.45626722172587447
Energy: 0.4580012659628385
Energy: 0.455268042065834
Energy: 0.6750794386680892
Energy: 0.4552680420817752
Energy: 0.45497290990267264
Energy: 0.45612195847603343
Energy: 0.7638940114152878
Energy: 0.4561219584794494
Energy: 0.6684193998730034
Energy: 0.4547002853768596
Energy: 0.5580284113501344
Energy: 0.45470028537970614
Energy: 0.669007729129028
Energy: 0.477081584810543
Energy: 0.6660046523667241
Energy: 0.47708158480541907
Energy: 0.5585279692700498
Energy: 0.4784912768291597
Energy: 0.601516373222888
Energy: 0.47849127682403586
Energy: 0.6705438816862932
Energy: 0.4561433172876799
Energy: 0.5592098851010158
Energy: 0.4561433172802786
Energy: 0.7715218985815716
Energy: 0.4559904817244649
Energy: 0.455510841489643
Energy: 0.455990481715925
Energy: 0.6334517333808152
Energy: 0.45544358751549713
Energy: 0.4569662039318505
Energy: 0.4554435875177745
Energy: 0.7605442694893244
Energy: 0.45549758769722254
Energy: 0.46517703377443204
Energy: 0.4554975876983612
Energy: 0.6081830249661452
Energy: 0.4561210391296534
Energy: 0.5471093279268713
Energy: 0.45612103912851476
Energy: 0.6734521639866345
Energy: 0.45492232180826203
Energy: 0.5309932448838517
Energy: 0.45492232180883135
Energy: 0.5989459997165186
Energy: 0.4560376774909719
Energy: 0.5507923404819745
Energy: 0.45603767748357066
Energy: 0.6736777996654003
Energy: 0.48558682786038
Energy: 0.6656234920511224
Energy: 0.4855868278563948
Energy: 0.543720747287402
Energy: 0.45561331804573457
Energy: 0.6654500687191304
Energy: 0.4556133180491505
Energy: 0.45929308741423813
Energy: 0.45508118507183576
Energy: 0.5601869846870234
Energy: 0.455081185069015
Energy: 0.5430815510982584
Energy: 0.4654812695498914
Energy: 0.669570209103964
Energy: 0.46548126955273805
Energy: 0.46904568239357686
Energy: 0.4557914357983033
Energy: 0.670521259262004
Energy: 0.45579143580627385
Energy: 0.4554426497634922
Energy: 0.4550731104065837
Energy: 0.5576461659968215
Energy: 0.4550731104099738
Energy: 0.45526819458504364
Energy: 0.4559126107240189
Energy: 0.719657928009792
Energy: 0.45591261071664346
Energy: 0.6532831117024911
Energy: 0.4556277961409968
Energy: 0.6108413106352035
Energy: 0.4556277961455515
Energy: 0.5293649303515912
Energy: 0.478933662007519
Energy: 0.6671050298893912
Energy: 0.4789336620171976
Energy: 0.6694896424186693
Energy: 0.4801590154981957
Energy: 0.5979748895431433
Energy: 0.4801590155055969
Energy: 0.672634984336888
Energy: 0.45575102069148427
Energy: 0.5472608673948786
Energy: 0.4557510206988855
Energy: 0.6705286706699805
Energy: 0.4556429880340716
Energy: 0.4556557347307851
Energy: 0.4556429880323636
Energy: 0.6363185947736398
Energy: 0.45510352444197655
Energy: 0.4558711934498037
Energy: 0.45510352444197655
Energy: 0.6108291846476998
Energy: 0.4660309433733366
Energy: 0.46582858174710257
Energy: 0.4660309433818765

minimum gb energy = 0.4547002853768596 eV
minimum distance =  2.53703981237314 Angstroms
sigma value = 37


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

Energy: 0.7345277939326997
Energy: 0.4314274823895072
Energy: 0.43126492081957984
Energy: 0.4314274823904866
Energy: 0.6734834441508459
Energy: 0.4316998040099265
Energy: 0.5563742049616913
Energy: 0.43169980400796754
Energy: 0.7010709345487648
Energy: 0.4320456604165037
Energy: 0.5545870844095548
Energy: 0.4320456604165037
Energy: 0.6999903291319429
Energy: 0.5275015285411176
Energy: 0.5440757629485895
Energy: 0.5275015285411176
Energy: 0.6748530672634627
Energy: 0.42447338964553744
Energy: 0.6009592987607125
Energy: 0.4244733896484759
Energy: 0.4774633425845251
Energy: 0.42407257206108007
Energy: 0.6754893257286699
Energy: 0.4240725720601005
Energy: 0.4771487343746545
Energy: 0.42391932073044436
Energy: 0.6557399241922799
Energy: 0.4239193207294648
Energy: 0.5481416108342976
Energy: 0.42458345164681793
Energy: 0.7051845104310004
Energy: 0.42458345164681793
Energy: 0.4811795664698921
Energy: 0.42440262496057163
Energy: 0.7055165740235538
Energy: 0.4244026249615511
Energy: 0.47807279936579267
Energy: 0.4152997035469828
Energy: 0.6546138762644534
Energy: 0.4152997035489418
Energy: 0.47905861099849417
Energy: 0.5258726980464428
Energy: 0.6601949270782792
Energy: 0.5258726980464428
Energy: 0.5991368573644065
Energy: 0.415403063985097
Energy: 0.654507788476456
Energy: 0.41540306398607646
Energy: 0.6054718046510047
Energy: 0.4244530328460544
Energy: 0.700939371423197
Energy: 0.42445303284507485
Energy: 0.6522275799044709
Energy: 0.46907741155956467
Energy: 0.7001886373872357
Energy: 0.46907741156054417
Energy: 0.600959298761692
Energy: 0.46935086117089647
Energy: 0.6549256049947049
Energy: 0.46935086117089647
Energy: 0.6182273592822741
Energy: 0.4692596174929527
Energy: 0.47742331109082026
Energy: 0.4692596174939322
Energy: 0.6522276162830182
Energy: 0.5464652186226375
Energy: 0.47707229104600357
Energy: 0.5464652186226375
Energy: 0.7051845104310004
Energy: 0.485561889320709
Energy: 0.47684650201414996
Energy: 0.485561889322668
Energy: 0.7055165740245333
Energy: 0.4323633118005414
Energy: 0.4316742705162435
Energy: 0.4323633118034799
Energy: 0.6107018051196843
Energy: 0.4317739690289476
Energy: 0.43172870202405
Energy: 0.431773969026009

minimum gb energy = 0.4152997035469828 eV
minimum distance =  2.50299657207594 Angstroms
sigma value = 25


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

Energy: 0.8333606905079439
Energy: 0.38695564736379473
Energy: 0.38691168549040555
Energy: 0.3869556473653245
Energy: 0.7280908077690583
Energy: 0.3875773160459565
Energy: 0.48483811818558886
Energy: 0.3875773160474863
Energy: 0.7553595679870269
Energy: 0.3868990831839816
Energy: 0.48625471483976623
Energy: 0.3868990831839816
Energy: 0.6123785602676748
Energy: 0.4314402551236277
Energy: 0.5038435955630816
Energy: 0.4314402551259222
Energy: 0.7277451032779427
Energy: 0.522171112357394
Energy: 0.654498296552262
Energy: 0.5221711123619832
Energy: 0.612691145427188
Energy: 0.42134120205583775
Energy: 0.6535078867401913
Energy: 0.421341202054308
Energy: 0.614069728004427
Energy: 0.3856978672595097
Energy: 0.6539448268863213
Energy: 0.38569786726180433
Energy: 0.4800748462226438
Energy: 0.3858140836662858
Energy: 0.6843094587056676
Energy: 0.38581408366552095
Energy: 0.4828665287208403
Energy: 0.38539076265464156
Energy: 0.724783080621057
Energy: 0.38539076265540645
Energy: 0.4818685795193448
Energy: 0.38479505054979196
Energy: 0.7162302049386523
Energy: 0.38479505055132174
Energy: 0.42832116676815407
Energy: 0.3827125875178502
Energy: 0.7178654108591361
Energy: 0.3827125875178502
Energy: 0.42499762736163893
Energy: 0.38458451065578014
Energy: 0.7163063522735271
Energy: 0.3845845106573099
Energy: 0.43089453622038887
Energy: 0.38004685668524113
Energy: 0.7164800806366308
Energy: 0.38004685668447624
Energy: 0.4608014636544619
Energy: 0.3814213765335374
Energy: 0.715840890926288
Energy: 0.3814213765343023
Energy: 0.5212511128507266
Energy: 0.3797756716185816
Energy: 0.716483140884648
Energy: 0.3797756716185816
Energy: 0.5229596210605928
Energy: 0.38515459574903427
Energy: 0.6870395870375631
Energy: 0.3851545957513288
Energy: 0.6488534526011274
Energy: 0.5198364993883829
Energy: 0.6870893734064376
Energy: 0.5198364993891479
Energy: 0.5142568638731361
Energy: 0.42068650611020075
Energy: 0.5732140373951398
Energy: 0.42068650611020075
Energy: 0.6482220076668213
Energy: 0.42006394145982817
Energy: 0.6130069387310579
Energy: 0.42006394146059306
Energy: 0.7286583168772541
Energy: 0.49172841824704916
Energy: 0.6121684348010143
Energy: 0.49172841824628427
Energy: 0.7187084755934008
Energy: 0.38725148948495747
Energy: 0.4859142175996808
Energy: 0.38725148948266286
Energy: 0.7300202100505014
Energy: 0.38704104420911145
Energy: 0.4264665441185197
Energy: 0.38704104420605195
Energy: 0.6913996380654388
Energy: 0.38803766193121964
Energy: 0.4863477382805358
Energy: 0.3880376619319846
Energy: 0.7176080437513105
Energy: 0.3895047072011906
Energy: 0.38727395884057936
Energy: 0.38950470720195557
Energy: 0.7339871495028604
Energy: 0.3870993437593135
Energy: 0.38882682561528964
Energy: 0.38709934376007843
Energy: 0.6864314753363464
Energy: 0.3881415464433558
Energy: 0.39094809352444493
Energy: 0.3881415464456504

minimum gb energy = 0.3797756716185816 eV
minimum distance =  2.52103385471207 Angstroms
sigma value = 41


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

Energy: 0.8426543642090419
Energy: 0.3523114821338829
Energy: 0.3538296181022807
Energy: 0.35231148196027084
Energy: 0.7673302724950253
Energy: 0.3517885612236432
Energy: 0.4267633462285992
Energy: 0.3517885612236432
Energy: 0.7653715228109436
Energy: 0.35123206033569293
Energy: 0.4318439108809443
Energy: 0.35123206033506577
Energy: 0.6494426041554311
Energy: 0.35183534048835563
Energy: 0.5278121536134083
Energy: 0.35183534048898274
Energy: 0.7028651015788367
Energy: 0.3522803196607117
Energy: 0.5752294501640793
Energy: 0.3522803196582035
Energy: 0.6380756749716046
Energy: 0.47237066250666154
Energy: 0.5746669750181027
Energy: 0.4723706625060345
Energy: 0.642992013730223
Energy: 0.5806292584513655
Energy: 0.6461392150845556
Energy: 0.5806292584501115
Energy: 0.5724502804433899
Energy: 0.47483675205039416
Energy: 0.5744005135842797
Energy: 0.47483675204914
Energy: 0.5029199419375276
Energy: 0.47122352427355935
Energy: 0.701682903890569
Energy: 0.4712235242741864
Energy: 0.5071259408468474
Energy: 0.4693916369758703
Energy: 0.7674446646860834
Energy: 0.46939163697398906
Energy: 0.42132586838821884
Energy: 0.3522446427514606
Energy: 0.7504022982009985
Energy: 0.35224464274957934
Energy: 0.4231988695221052
Energy: 0.35110792159425847
Energy: 0.7702041199148237
Energy: 0.3511079215961396
Energy: 0.42158956146020493
Energy: 0.352036936484311
Energy: 0.7667367289967056
Energy: 0.35203693648493806
Energy: 0.3516423516158276
Energy: 0.3522373076721819
Energy: 0.7001998600242823
Energy: 0.3522373076696737
Energy: 0.35329194028214933
Energy: 0.3517960014749838
Energy: 0.7664624066653932
Energy: 0.3517960014749838
Energy: 0.3530541778272758
Energy: 0.35186817493520406
Energy: 0.7661923545451941
Energy: 0.35186817493394984
Energy: 0.42409920423279884
Energy: 0.35254949876918557
Energy: 0.7622999023424318
Energy: 0.35254949876918557
Energy: 0.42268279210065823
Energy: 0.42170900841189973
Energy: 0.7674446253839307
Energy: 0.4217090084137809
Energy: 0.4216372923351621
Energy: 0.3516287474715462
Energy: 0.6430116202612571
Energy: 0.3516287474715462
Energy: 0.5785686838774569
Energy: 0.4687936854047039
Energy: 0.6411480510930125
Energy: 0.4687936854040768
Energy: 0.5750464806711943
Energy: 0.4701388250147614
Energy: 0.7024105896230747
Energy: 0.47013882500849064
Energy: 0.5764759190545767
Energy: 0.4723386686356582
Energy: 0.6429162664371705
Energy: 0.4723386686344041
Energy: 0.7018961229881915
Energy: 0.5777598039577184
Energy: 0.6370562958141954
Energy: 0.5777598039570914
Energy: 0.5737012092741175
Energy: 0.472334848684173
Energy: 0.576699213339232
Energy: 0.47233484868605424
Energy: 0.7032703308394896
Energy: 0.47016325346216603
Energy: 0.4908740309234804
Energy: 0.47016325345965776
Energy: 0.702365933807152
Energy: 0.4694246188936024
Energy: 0.5746854024831287
Energy: 0.4694246188936024
Energy: 0.700588466804128
Energy: 0.3516416547971174
Energy: 0.4411701372676396
Energy: 0.3516416547952362
Energy: 0.7668987136717996
Energy: 0.42127296940349185
Energy: 0.42340654851140164
Energy: 0.4212729694009836
Energy: 0.7004887738204894
Energy: 0.3523218011668772
Energy: 0.43417308201890187
Energy: 0.35232180116875844
Energy: 0.7037000528492467
Energy: 0.35229654610026334
Energy: 0.35190160373022045
Energy: 0.35229654610026334
Energy: 0.7673987224220776
Energy: 0.3517665141344837
Energy: 0.35276502742579563
Energy: 0.3517665141338566
Energy: 0.7623942217765552
Energy: 0.35241047339389137
Energy: 0.3515844213236627
Energy: 0.3524104733957725

minimum gb energy = 0.35110792159425847 eV
minimum distance =  2.54122280185823 Angstroms
sigma value = 15


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

Energy: 0.7295823799644842
Energy: 0.3305906451917523
Energy: 0.330669223543396
Energy: 0.3305906451949396
Energy: 0.7977822897148031
Energy: 0.3277749628537119
Energy: 0.39201504462484943
Energy: 0.3277749628537119
Energy: 0.7982476268643343
Energy: 0.32798269499485344
Energy: 0.39115647913435353
Energy: 0.32798269499485344
Energy: 0.6851478244624609
Energy: 0.3282060008322234
Energy: 0.51191611461053
Energy: 0.32820600083541074
Energy: 0.6915753616388668
Energy: 0.32895308625155806
Energy: 0.5150396066619082
Energy: 0.32895308624996444
Energy: 0.6877232710097005
Energy: 0.430646573038349
Energy: 0.5194284749978926
Energy: 0.4306465730378178
Energy: 0.5784182997810816
Energy: 0.5395981231869486
Energy: 0.6339707496114313
Energy: 0.5395981231874797
Energy: 0.6327779845068644
Energy: 0.3509378893999009
Energy: 0.5131439430494014
Energy: 0.35093788939936976
Energy: 0.576075638711586
Energy: 0.5301538117987235
Energy: 0.6309036100989408
Energy: 0.5301538118003172
Energy: 0.5753110879006232
Energy: 0.5371099897811159
Energy: 0.7408395133910513
Energy: 0.5371099897843032
Energy: 0.5124249048697114
Energy: 0.3292877878922476
Energy: 0.6546501823692321
Energy: 0.32928778789171637
Energy: 0.4458487952177721
Energy: 0.4333723292929382
Energy: 0.7406481847796047
Energy: 0.4333723292908134
Energy: 0.5211175677290238
Energy: 0.3295762098104239
Energy: 0.7420047546667113
Energy: 0.32957620980617425
Energy: 0.38574413081134645
Energy: 0.328050612199374
Energy: 0.6362985934674971
Energy: 0.32805061220096765
Energy: 0.38867301808155
Energy: 0.32857067155348707
Energy: 0.7991953399396048
Energy: 0.32857067155295583
Energy: 0.3857632400351404
Energy: 0.32856671820335076
Energy: 0.7432798451208242
Energy: 0.32856671820335076
Energy: 0.32785210651598806
Energy: 0.32885710045070343
Energy: 0.7394364573155658
Energy: 0.3288571004517658
Energy: 0.32775335936182376
Energy: 0.32758615799563856
Energy: 0.7970025168352584
Energy: 0.32758615799563856
Energy: 0.327709462889409
Energy: 0.3285588001545103
Energy: 0.6903513158320278
Energy: 0.32855880015557265
Energy: 0.38621097239087865
Energy: 0.3287558423747868
Energy: 0.7996539599311909
Energy: 0.32875584237213074
Energy: 0.38566941172945923
Energy: 0.3290722781943366
Energy: 0.7985081015039304
Energy: 0.3290722781911493
Energy: 0.38562425872470957
Energy: 0.3283232247604618
Energy: 0.6849960258334706
Energy: 0.32832322475939935
Energy: 0.5219189729841599
Energy: 0.32907188480635774
Energy: 0.6859716925579786
Energy: 0.3290718848047641
Energy: 0.5140282489270587
Energy: 0.4304840089046983
Energy: 0.741835802699546
Energy: 0.43048400890363586
Energy: 0.5126694101399623
Energy: 0.32914534269064316
Energy: 0.5826970717916007
Energy: 0.32914534268639345
Energy: 0.6318888218358003
Energy: 0.5367846916794579
Energy: 0.7421885970152367
Energy: 0.5367846916805202
Energy: 0.5130719618172085
Energy: 0.5305075733799656
Energy: 0.6322239212439908
Energy: 0.5305075733810279
Energy: 0.6325896550277313
Energy: 0.5339000663565694
Energy: 0.5830560908795255
Energy: 0.533900066356038
Energy: 0.6355776086435264
Energy: 0.5388245164668283
Energy: 0.6337316700201476
Energy: 0.5388245164662971
Energy: 0.631734167163818
Energy: 0.3286778500637794
Energy: 0.5140578233251336
Energy: 0.32867785006431066
Energy: 0.7452632370811281
Energy: 0.3293605086566324
Energy: 0.4458711455730895
Energy: 0.3293605086598197
Energy: 0.6364658631918071
Energy: 0.3304149582709222
Energy: 0.5120780693690966
Energy: 0.3304149582746406
Energy: 0.7425252590204041
Energy: 0.32789762989401144
Energy: 0.39496139632619776
Energy: 0.32789762989454263
Energy: 0.7404986319532713
Energy: 0.327908237290238
Energy: 0.396171195013921
Energy: 0.3279082372939565
Energy: 0.810050968975455
Energy: 0.328897494132393
Energy: 0.35796842310351223
Energy: 0.32889749413398667
Energy: 0.7978603704037037
Energy: 0.328197474798969
Energy: 0.33100248792161363
Energy: 0.328197474798969
Energy: 0.7960967337934916
Energy: 0.3283621218598241
Energy: 0.3317764169078257
Energy: 0.3283621218598241

minimum gb energy = 0.32758615799563856 eV
minimum distance =  2.54139783805778 Angstroms
sigma value = 85


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

Energy: 0.7699689679351691
Energy: 0.2954315178552339
Energy: 0.29538647835632553
Energy: 0.29543151785569466
Energy: 0.8051322570399804
Energy: 0.29572245377065615
Energy: 0.34508031114130366
Energy: 0.2957224537692739
Energy: 0.7093161976842038
Energy: 0.2955753880417103
Energy: 0.3455883361020629
Energy: 0.29557538804124955
Energy: 0.6098536175422705
Energy: 0.2964124234494653
Energy: 0.4566559331756274
Energy: 0.2964124234494653
Energy: 0.7144574686724476
Energy: 0.2964597723715396
Energy: 0.4594108134966975
Energy: 0.2964597723706182
Energy: 0.6105246420798984
Energy: 0.29622219328475724
Energy: 0.4579841577380991
Energy: 0.29622219328429655
Energy: 0.6103438977053037
Energy: 0.4033954815806984
Energy: 0.5624294973753183
Energy: 0.4033954815802376
Energy: 0.6609619316318674
Energy: 0.4033120312249138
Energy: 0.45500328955485103
Energy: 0.4033120312239923
Energy: 0.6107123438723173
Energy: 0.40394193701367487
Energy: 0.5628671825611539
Energy: 0.4039419370122927
Energy: 0.6108494032508769
Energy: 0.49541587044216157
Energy: 0.661078385592549
Energy: 0.4954158704417008
Energy: 0.5623856605648192
Energy: 0.4036882429798888
Energy: 0.575031841538658
Energy: 0.40368824297898837
Energy: 0.5144288226900625
Energy: 0.484687694876666
Energy: 0.6615045021746683
Energy: 0.4846876948775875
Energy: 0.5620371387529898
Energy: 0.4032395171926255
Energy: 0.6603642169796355
Energy: 0.40323951719170403
Energy: 0.4568656813969603
Energy: 0.29622387562283575
Energy: 0.5615504336983755
Energy: 0.2962238756214536
Energy: 0.39533973068047756
Energy: 0.29650170933838677
Energy: 0.7592142072882364
Energy: 0.29650170934069037
Energy: 0.456200744952942
Energy: 0.2963700437181536
Energy: 0.6610631248141331
Energy: 0.2963700437181536
Energy: 0.3458116349917114
Energy: 0.29609788803201775
Energy: 0.659404432814356
Energy: 0.2960978880310963
Energy: 0.34526186350273036
Energy: 0.3459552322215743
Energy: 0.8092862991206208
Energy: 0.345955232222035
Energy: 0.345592230741387
Energy: 0.29675952375850284
Energy: 0.7563113928101747
Energy: 0.29675952375804215
Energy: 0.2956446433373075
Energy: 0.29687664352560394
Energy: 0.7555438851167574
Energy: 0.2968766435265254
Energy: 0.2960349713112602
Energy: 0.29574913826313637
Energy: 0.8094560574555277
Energy: 0.2957491382617542
Energy: 0.295488578693477
Energy: 0.296253946249329
Energy: 0.7078427377707307
Energy: 0.29625394624886825
Energy: 0.3455598919403347
Energy: 0.2962456597324325
Energy: 0.80168611438061
Energy: 0.2962456597328932
Energy: 0.3469892139193314
Energy: 0.29540777144004077
Energy: 0.8058064987329249
Energy: 0.29540777143911934
Energy: 0.3458408271766392
Energy: 0.29606166819582586
Energy: 0.6374495169112051
Energy: 0.2960616681949044
Energy: 0.457528794044545
Energy: 0.29641458487998956
Energy: 0.8041390568073372
Energy: 0.2964145848790681
Energy: 0.45662563973010617
Energy: 0.29610510100415516
Energy: 0.7096121826588011
Energy: 0.29610510100415516
Energy: 0.530919731448731
Energy: 0.2962772419450691
Energy: 0.6388195633640847
Energy: 0.2962772419455299
Energy: 0.5625827677286267
Energy: 0.4031649367858517
Energy: 0.7144632740503899
Energy: 0.40316493678631243
Energy: 0.5623878798935552
Energy: 0.4857026803445148
Energy: 0.6107357566456467
Energy: 0.48570268034589703
Energy: 0.660740553875186
Energy: 0.4943763321371118
Energy: 0.512964316408233
Energy: 0.49437633213619037
Energy: 0.5699986992278626
Energy: 0.49439585523364743
Energy: 0.6222048506946052
Energy: 0.49439585523272606
Energy: 0.6612505895931536
Energy: 0.48496059437086847
Energy: 0.5125441067706751
Energy: 0.48496059437040767
Energy: 0.7622996004104379
Energy: 0.40335230446552717
Energy: 0.51275780486912
Energy: 0.40335230446598785
Energy: 0.5737538212680979
Energy: 0.2962938250264752
Energy: 0.4571384689258179
Energy: 0.2962938250306217
Energy: 0.7589018482179926
Energy: 0.29640576670291596
Energy: 0.45933494446006184
Energy: 0.29640576670061236
Energy: 0.7572504243082064
Energy: 0.29631310066992395
Energy: 0.46140369316005553
Energy: 0.2963131006703847
Energy: 0.659432826974852
Energy: 0.29592958240416356
Energy: 0.34582128772894244
Energy: 0.29592958240416356
Energy: 0.8067159589406345
Energy: 0.29541262458986184
Energy: 0.3482157493276906
Energy: 0.295412624591244
Energy: 0.7550704435162092
Energy: 0.29641352564582885
Energy: 0.34528686998415814
Energy: 0.29641352564536816
Energy: 0.6591697416776626
Energy: 0.29588182268218305
Energy: 0.2955863089304652
Energy: 0.2958818226812616
Energy: 0.8093634911570063
Energy: 0.29569550473987055
Energy: 0.29577669309618626
Energy: 0.29569550473987055
Energy: 0.7076169430119574
Energy: 0.2969295819783773
Energy: 0.2955203765346392
Energy: 0.29692958197653446

minimum gb energy = 0.29538647835632553 eV
minimum distance =  2.54340978705732 Angstroms
sigma value = 113


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

Energy: 0.011885014641187555
Energy: 0.27678523384929843
Energy: 0.6423308398617882
Energy: 0.2767852338503414
Energy: 0.4252397245941297
Energy: 0.062422773049663226
Energy: 0.4251369378290273
Energy: 0.062422773051040596
Energy: 0.012157663550444744
Energy: 0.06242652626028253
Energy: 0.4254161212796372
Energy: 0.06242652626028253
Energy: 0.013246036699454808
Energy: 0.06185569593592535
Energy: 0.42452392513453086
Energy: 0.061855695936968214
Energy: 0.42468548183819715
Energy: 0.06168333695757565
Energy: 0.4246832254352714
Energy: 0.06168333695653279
Energy: 0.012140097880295707
Energy: 0.06189217116626427
Energy: 0.4248366599673495
Energy: 0.06189217116661845

minimum gb energy = 0.011885014641187555 eV
minimum distance =  2.82421092646494 Angstroms
sigma value = 1