Model name: model_name=EAM_IMD_BrommerGaehler_2006B_AlNiCo__MO_128037485276_003
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=6.400107890367508
cohesive_energy=0.4239253082373245
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[5.39491324907016e-21, 3.41316494870922e-21, -1.9136397716495997e-21, -3.42514922993154e-21, -3.41558423542656e-21, -2.0277467915230798e-21, 9.90556919206938e-22, 5.5207802454372e-21, 1.1061075002276518e-20, 1.70147954177532e-20, 2.30950557437832e-20, 2.9274170368130995e-20, 3.5325591514749e-20, 4.1061383864468997e-20, 4.6349047409659193e-20, 5.11075120126392e-20, 5.52832649738334e-20, 5.88497101611174e-20, 6.18001184326284e-20, 6.41397769712586e-20, 6.58821440607336e-20, 6.70520534388804e-20, 6.770862542349359e-20, 6.79149857739528e-20, 6.77044597642452e-20, 6.70474071266418e-20, 6.59028121393122e-20, 6.4224852550524e-20, 6.1961778054999e-20, 5.90504628933576e-20, 5.53882075433604e-20, 5.083738503214679e-20, 4.5283599948049195e-20, 3.91277168848944e-20, 3.2304046600688395e-20, 2.4468601772111396e-20, 1.5239279293720737e-20, 4.17195580257162e-21, -9.390789839565179e-21, -2.62098473379426e-20, -4.66816592788776e-20, -7.09237132749414e-20, -9.75679106983614e-20, -1.2321939947935499e-19, -1.435156128612036e-19, -1.567749062488608e-19, -1.65442361403474e-19, -1.7229326869045797e-19, -1.7092821419829e-19, -1.6135200445687198e-19, -1.6748193225855598e-19, -2.1142322862264e-19, -3.28050472341402e-19, -6.94114187501088e-19]
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: -3.6476901029332 eV

========================================
theta = 0.0
========================================

Energy: 0.0005215938017010296
Energy: 0.1954117370235569
Energy: 0.16212364933428833
Energy: 0.001259221757006034
Energy: 0.9141023599004054
Energy: 0.12129504981603625
Energy: 0.1954117370235569
Energy: 0.7897499265308477
Energy: 0.8635767706183366
Energy: 1.1378324954276635
Energy: 0.7319827245670151
Energy: 0.9413139740591178
Energy: 0.16212364933428833
Energy: 0.8635767706183366
Energy: 1.0123438341173758
Energy: 0.17090246976365947
Energy: 0.7311183362568027
Energy: 1.1478772495504113
Energy: 0.001259221757006034
Energy: 1.1378324954276635
Energy: 0.17090246976365947
Energy: 0.02173469918936813
Energy: 0.9031585653664816
Energy: 0.13008916254358247
Energy: 0.9141023599004054
Energy: 0.7319827245670151
Energy: 0.7311183362568027
Energy: 0.9031585653664816
Energy: 0.7513317116950131
Energy: 0.7610297178997116
Energy: 0.12129504981603625
Energy: 0.9413139740591178
Energy: 1.1478772495504113
Energy: 0.13008916254358247
Energy: 0.7610297178997116
Energy: 0.2116841739726797

minimum gb energy = 0.0005215938017010296 eV
minimum distance =  3.63004698160931 Angstroms
sigma value = 1


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

Energy: 0.2477436886164576
Energy: 0.4964556958462695
Energy: 0.34379043420748434
Energy: 0.24598288747808925
Energy: 0.5093338414402958
Energy: 0.37339261039667726
Energy: 0.4899909294830646
Energy: 0.3837214523191989
Energy: 0.4169389233636959
Energy: 0.5900070143086007
Energy: 0.36236397316015456
Energy: 0.46053677977656404
Energy: 0.3750101472206027
Energy: 0.371167592577392
Energy: 0.41946802342006734
Energy: 0.3677121833851047
Energy: 0.3353502515219222
Energy: 0.4748013893758803
Energy: 0.4483139940226789
Energy: 0.5023501971586052
Energy: 0.35299925126156534
Energy: 0.4419526898502931
Energy: 0.43466213172793633
Energy: 0.376289025326088
Energy: 0.42093231381901997
Energy: 0.3291443334758377
Energy: 0.32728183142738254
Energy: 0.4119394850358074
Energy: 0.33686696908121905
Energy: 0.33946078449833667
Energy: 0.4316157563762808
Energy: 0.3170754272067715
Energy: 0.3288646155556073
Energy: 0.4234169632290205
Energy: 0.3127044407921482
Energy: 0.3487652051068143
Energy: 0.44783588261100515
Energy: 0.3602097398370893
Energy: 0.3663154919309999
Energy: 0.4400402712669201
Energy: 0.3598454714853592
Energy: 0.37864166382536013
Energy: 0.36353898714588806
Energy: 0.3221488110281963
Energy: 0.3122312466850817
Energy: 0.36504923442210385
Energy: 0.3329307179653273
Energy: 0.39779399835153323
Energy: 0.29213468448808655
Energy: 0.3920792598513744
Energy: 0.35852296327338484
Energy: 0.29372558953370953
Energy: 0.4222893148883814
Energy: 0.33057774489899044
Energy: 0.3244106851106208
Energy: 0.41303930676541184
Energy: 0.3771373224592078
Energy: 0.3246418345789401
Energy: 0.4466613695616867
Energy: 0.3489383562926856
Energy: 0.4024645436242724
Energy: 0.30308148384185524
Energy: 0.29169283469057394
Energy: 0.42449321363376236
Energy: 0.3131832906565484
Energy: 0.47988061893478356
Energy: 0.3242429562876623
Energy: 0.507159562586508
Energy: 0.4582520088423365
Energy: 0.33088989438013794
Energy: 0.4269338548535803
Energy: 0.4123407153547927
Energy: 0.3467606903767135
Energy: 0.6141090735259832
Energy: 0.5507141934588515
Energy: 0.35763986043321716
Energy: 0.422017712682733
Energy: 0.48814496764957277
Energy: 0.4437561586092753
Energy: 0.3070523734948177
Energy: 0.2911257191400798
Energy: 0.47704829178394714
Energy: 0.32078937781262773
Energy: 0.4774203813765929
Energy: 0.3476591920469973
Energy: 0.4622997554255202
Energy: 0.41946518922297094
Energy: 0.34846252008297507
Energy: 0.5001856708686581
Energy: 0.38402693180217684
Energy: 0.29428357103102726
Energy: 0.4806462521516392
Energy: 0.43200764844898437
Energy: 0.30014289174667536
Energy: 0.5206029811126209
Energy: 0.38601174587570225
Energy: 0.36539946053063377
Energy: 0.31002403697523734
Energy: 0.29961097770120254
Energy: 0.37324811782913236
Energy: 0.320243382354983
Energy: 0.4700025762783841
Energy: 0.3844789939411375
Energy: 0.35074483175401644
Energy: 0.3424502262087269
Energy: 0.378555433264082
Energy: 0.3621814166788908
Energy: 0.3412732441532722
Energy: 0.3634743607050395
Energy: 0.32565249963081816
Energy: 0.3196971927080261
Energy: 0.35870937380584755
Energy: 0.33547557275347467
Energy: 0.3215906297888202
Energy: 0.3915440396638401
Energy: 0.33102791092007205
Energy: 0.3237613156104285
Energy: 0.3845719784430021
Energy: 0.3428100620764018
Energy: 0.32903337219205486
Energy: 0.449980437499244
Energy: 0.4362289159186659
Energy: 0.3686311210617259
Energy: 0.4448860304649599
Energy: 0.398341365033408
Energy: 0.3881903617844882
Energy: 0.39579870857515104
Energy: 0.3264688976826071
Energy: 0.3552243450301842
Energy: 0.38698351435291245
Energy: 0.3067479230572677
Energy: 0.39265045022696254
Energy: 0.5010674572454568
Energy: 0.3825621826850094
Energy: 0.42068176381653155
Energy: 0.4905706862895798
Energy: 0.35675298541586986
Energy: 0.4681820122576398

minimum gb energy = 0.24598288747808925 eV
minimum distance =  1.88533949954839 Angstroms
sigma value = 33


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

Energy: 0.5608462167715472
Energy: 0.35395917684454326
Energy: 0.3955836037054474
Energy: 0.5454046120757944
Energy: 0.43078267793599784
Energy: 0.43746035983659326
Energy: 0.3532929757455762
Energy: 0.35012176142529045
Energy: 0.3556896464337512
Energy: 0.4716301643194017
Energy: 0.3403768630965705
Energy: 0.3983199620978526
Energy: 0.25980634928108093
Energy: 0.4016348254615381
Energy: 0.4615779560522384
Energy: 0.25683774453983643
Energy: 0.35249492430458973
Energy: 0.5321938535518594
Energy: 0.24914191279714934
Energy: 0.5452785913303215
Energy: 0.6492404902892649
Energy: 0.2475976232069018
Energy: 0.4646946565012274
Energy: 0.2405474225350054
Energy: 0.4239544820080721
Energy: 0.37526878927646923
Energy: 0.36632807969428555
Energy: 0.41831464835650445
Energy: 0.3839282637031735
Energy: 0.3695650488503247
Energy: 0.45086943547968716
Energy: 0.35390513765277826
Energy: 0.3592760944315154
Energy: 0.4445162920471224
Energy: 0.3498370540506397
Energy: 0.37556920797591253
Energy: 0.47475164838428074
Energy: 0.36076269747135686
Energy: 0.36940916201324525
Energy: 0.4669707980754888
Energy: 0.35605464605426324
Energy: 0.3885450344174557
Energy: 0.38141689408211354
Energy: 0.25923006614525557
Energy: 0.26360438536101166
Energy: 0.38397234986746814
Energy: 0.26089880755087475
Energy: 0.27452975765590426
Energy: 0.2932856673168245
Energy: 0.26366440395302143
Energy: 0.38933571381652066
Energy: 0.29527134566728014
Energy: 0.2777402243312802
Energy: 0.3545740131742237
Energy: 0.3107723425589768
Energy: 0.35468530132364307
Energy: 0.3254169209013823
Energy: 0.3058597098269977
Energy: 0.3846071918017842
Energy: 0.3043267492976225
Energy: 0.3537538300668453
Energy: 0.4917503077633455
Energy: 0.4495662396950161
Energy: 0.3659809464623656
Energy: 0.5242439316175158
Energy: 0.4076178167573218
Energy: 0.3087848535653678
Energy: 0.33830613361665035
Energy: 0.3715391480614216
Energy: 0.312080229108649
Energy: 0.3627517656239778
Energy: 0.34402191976049906
Energy: 0.3249732202057345
Energy: 0.5661855582883698
Energy: 0.5076098968220808
Energy: 0.33349661128569397
Energy: 0.6124675382573961
Energy: 0.45002624884569525
Energy: 0.42383700432327387
Energy: 0.24268136310299776
Energy: 0.2408315736451172
Energy: 0.4506171176051147
Energy: 0.24556468113327082
Energy: 0.24249624934181913
Energy: 0.37265788559758933
Energy: 0.4333178623465278
Energy: 0.4050740401525812
Energy: 0.3753549814940352
Energy: 0.4566797374495262
Energy: 0.3851440813606087
Energy: 0.35022073474664644
Energy: 0.4015302288055098
Energy: 0.377302130320895
Energy: 0.3522257070953806
Energy: 0.42224627307124507
Energy: 0.36029600001250867
Energy: 0.34971332760001517
Energy: 0.44431181847851997
Energy: 0.41012251664448274
Energy: 0.351417135666869
Energy: 0.47539251634587193
Energy: 0.38287442633416285
Energy: 0.27052331362832577
Energy: 0.39007336245459756
Energy: 0.4092893936436061
Energy: 0.26654972410859956
Energy: 0.379303261472618
Energy: 0.26548202637389084
Energy: 0.2850783578568238
Energy: 0.3231225419370169
Energy: 0.3534848231972242
Energy: 0.27879659956015285
Energy: 0.3047701983383172
Energy: 0.3891796451987459
Energy: 0.42930876054305894
Energy: 0.3066300984491147
Energy: 0.3105223079895957
Energy: 0.417492606075884
Energy: 0.3156837550053099
Energy: 0.3294324825562479
Energy: 0.5440723432566307
Energy: 0.4867417577192002
Energy: 0.3851760074397517
Energy: 0.5343115748254867
Energy: 0.4268941855023939
Energy: 0.42583994188732366
Energy: 0.4054466919901285
Energy: 0.3668914656118809
Energy: 0.40174117114841074
Energy: 0.3966331363512313
Energy: 0.33865224360451934
Energy: 0.4457833821907184
Energy: 0.5844015845042846
Energy: 0.3684852586932043
Energy: 0.4031391223658839
Energy: 0.5717212560365145
Energy: 0.34340792879723836
Energy: 0.4465222181397609
Energy: 0.2463075204108668
Energy: 0.5606379465670682
Energy: 0.6682465671588766
Energy: 0.24547682091558368
Energy: 0.4766081010721642
Energy: 0.2399596743499213
Energy: 0.5252058681219934
Energy: 0.3831025444541452
Energy: 0.40030232970836765
Energy: 0.5169529918194867
Energy: 0.37016292503939163
Energy: 0.42715307213964265
Energy: 0.41348600242595246
Energy: 0.358831407096979
Energy: 0.35595908257887715
Energy: 0.407800858479513
Energy: 0.3605621844024942
Energy: 0.36201673527526024
Energy: 0.5085047872486367
Energy: 0.3618471335019817
Energy: 0.37963949861746776
Energy: 0.4977537214567418
Energy: 0.3511089484374772
Energy: 0.4053479701806659
Energy: 0.3705930342005022
Energy: 0.2564739382680183
Energy: 0.2577367722090273
Energy: 0.37040048928329233
Energy: 0.2638966529826797
Energy: 0.40148303843344907
Energy: 0.312432368067579
Energy: 0.2486134204561684
Energy: 0.24333043954201153
Energy: 0.3153063946953539
Energy: 0.25915246294629535
Energy: 0.38161890123607073
Energy: 0.31477972597426224
Energy: 0.33902484938383026
Energy: 0.31255474421045054
Energy: 0.30763400688194886
Energy: 0.3668616625346027
Energy: 0.29454844401858893
Energy: 0.3512091669704041
Energy: 0.4704310834457384
Energy: 0.4299322854983325
Energy: 0.3625271063208336
Energy: 0.5021227730344675
Energy: 0.3911156607189157
Energy: 0.29647166960108146
Energy: 0.38746079502103264
Energy: 0.3516820127953598
Energy: 0.30580011539677443
Energy: 0.41771515429260175
Energy: 0.3848545004834147
Energy: 0.32635763862809597
Energy: 0.4617561982113563
Energy: 0.42000072521317794
Energy: 0.3323169585354979
Energy: 0.49698371843769173
Energy: 0.38416230869978857
Energy: 0.4218895426492494
Energy: 0.2400680161345513
Energy: 0.23783679863455182
Energy: 0.4492372734220681
Energy: 0.24370714043446434
Energy: 0.23965551210200886
Energy: 0.3558480894976414
Energy: 0.5300783597046613
Energy: 0.4830602868642607
Energy: 0.36158738501075033
Energy: 0.5665985048862062
Energy: 0.43934697696082
Energy: 0.3715245630509155
Energy: 0.36802045511236087
Energy: 0.3567312334798788
Energy: 0.37112583491895135
Energy: 0.3812299521552681
Energy: 0.35264964124258014
Energy: 0.3433331079669667
Energy: 0.462551987138442
Energy: 0.4251224404719392
Energy: 0.3458266573570967
Energy: 0.49561959729497856
Energy: 0.39350477868325967
Energy: 0.27922982274415065
Energy: 0.3679002042802756
Energy: 0.37889618280810444
Energy: 0.2733423801806033
Energy: 0.3646252935352115
Energy: 0.3955869723954416
Energy: 0.267118149529065
Energy: 0.3503387095044224
Energy: 0.3811445891943784
Energy: 0.2610401022713066
Energy: 0.3305508467498646
Energy: 0.24591759875207683
Energy: 0.4173383116090459
Energy: 0.3091577965533534
Energy: 0.30538833113371144
Energy: 0.3946643400439271
Energy: 0.31684836775062086
Energy: 0.3252041970075564
Energy: 0.5118430593730449
Energy: 0.48596738454064714
Energy: 0.36398071033549056
Energy: 0.49876826169650573
Energy: 0.4117746986129776
Energy: 0.39642747159221886

minimum gb energy = 0.23783679863455182 eV
minimum distance =  2.17319901409294 Angstroms
sigma value = 51


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

Energy: 0.31832697753586736
Energy: 0.4653357464034878
Energy: 0.5433285716024486
Energy: 0.31385087891802155
Energy: 0.5161924310794618
Energy: 0.27670523972003125
Energy: 0.461599907894232
Energy: 0.38564046139323216
Energy: 0.4183397477519539
Energy: 0.5959118965892657
Energy: 0.36570491950988854
Energy: 0.46229687921308843
Energy: 0.3146223578480364
Energy: 0.36468796472290244
Energy: 0.40958058433794237
Energy: 0.594673432071128
Energy: 0.331609578353491
Energy: 0.45894134442257195
Energy: 0.32350634856035604
Energy: 0.48062419161570036
Energy: 0.5472372066850046
Energy: 0.32014309596929114
Energy: 0.4250426249610888
Energy: 0.29370676716305905
Energy: 0.4098959480767443
Energy: 0.3694956115382437
Energy: 0.35556437648266087
Energy: 0.40161032637581134
Energy: 0.3850127790253946
Energy: 0.3542580625797722
Energy: 0.3550681482219435
Energy: 0.3679992331002756
Energy: 0.35042748741174096
Energy: 0.3499891820127888
Energy: 0.3833601816940745
Energy: 0.3396803635516213
Energy: 0.37143820419429224
Energy: 0.36665193402121193
Energy: 0.34678456379439826
Energy: 0.3640696157147048
Energy: 0.3857107595426067
Energy: 0.33599578420718373
Energy: 0.3971845861454074
Energy: 0.4472243385451952
Energy: 0.4145360061325016
Energy: 0.4109098014295788
Energy: 0.47263872070116053
Energy: 0.3836604231390469
Energy: 0.31756139009877976
Energy: 0.39965015549504734
Energy: 0.3639378398014919
Energy: 0.3287995051488767
Energy: 0.4274150980705968
Energy: 0.4657313552265581
Energy: 0.36488508413643533
Energy: 0.4836424503435568
Energy: 0.44184600922489004
Energy: 0.3662444667488587
Energy: 0.5189468780758146
Energy: 0.4055402547076233
Energy: 0.44944362248057307
Energy: 0.47525865865538947
Energy: 0.43652258609564915
Energy: 0.4807807363519067
Energy: 0.5056427815924812
Energy: 0.3968856961197842
Energy: 0.3562128169473668
Energy: 0.5940352689732782
Energy: 0.5335569262151447
Energy: 0.36453044978461424
Energy: 0.3531930672758347
Energy: 0.4759399461361982
Energy: 0.3331655657502527
Energy: 0.39645752010577745
Energy: 0.366104127842277
Energy: 0.33314059578201377
Energy: 0.4216695055457978
Energy: 0.3429090326641585
Energy: 0.3796043084958931
Energy: 0.4873755764672929
Energy: 0.4548425992261597
Energy: 0.3796333365502034
Energy: 0.5154476747301371
Energy: 0.4257018077380234
Energy: 0.32737634900810353
Energy: 0.3730753664657614
Energy: 0.3823720417628736
Energy: 0.32337095835421004
Energy: 0.3693936059754248
Energy: 0.3979019034620057
Energy: 0.33665546494700543
Energy: 0.362430018182455
Energy: 0.3953291880834161
Energy: 0.3288998289033619
Energy: 0.33587361753287054
Energy: 0.28373372994913293
Energy: 0.41810923652084697
Energy: 0.33054352924961267
Energy: 0.32150323787310575
Energy: 0.40618725069363193
Energy: 0.34740843635980484
Energy: 0.32931116232571134
Energy: 0.30640135973599925
Energy: 0.5581068655953959
Energy: 0.48376004914396437
Energy: 0.3021733535863368
Energy: 0.4675440779655251
Energy: 0.5517716947038794

minimum gb energy = 0.27670523972003125 eV
minimum distance =  1.63348086208327 Angstroms
sigma value = 19


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

Energy: 0.2487494833899578
Energy: 0.2958940376671414
Energy: 0.2700398206840617
Energy: 0.24757366906890688
Energy: 0.5337830143594755
Energy: 0.25439762907971886
Energy: 0.3102861473583676
Energy: 0.4186363234564478
Energy: 0.43620809717299336
Energy: 0.5607814025885896
Energy: 0.409903712759868
Energy: 0.46314415730268865
Energy: 0.7882622910355626
Energy: 0.3911612627165208
Energy: 0.4696720845765854
Energy: 0.766589392633031
Energy: 0.33247389538792965
Energy: 0.5527342208318448
Energy: 0.2780786969599429
Energy: 0.5323851554337637
Energy: 0.6625422568460861
Energy: 0.2746260833961953
Energy: 0.4261434304813131
Energy: 0.7899429864500311
Energy: 0.39397140122703067
Energy: 0.4993512827485074
Energy: 0.4643000691154966
Energy: 0.394380157696424
Energy: 0.5324222813482243
Energy: 0.43634277575293967
Energy: 0.30789215962519206
Energy: 0.2712582828491263
Energy: 0.4889440737371788
Energy: 0.31738265483096956
Energy: 0.29149225384489463
Energy: 0.43677219708097126
Energy: 0.3406274467056126
Energy: 0.3870165281684833
Energy: 0.3556865292586173
Energy: 0.3388158342086477
Energy: 0.42443660266009936
Energy: 0.3372267737026206
Energy: 0.45683411595802625
Energy: 0.25249736661162325
Energy: 0.26033947765392135
Energy: 0.4614372013213869
Energy: 0.24987662867461108
Energy: 0.27343235321703346
Energy: 0.3896772007149766
Energy: 0.28051906740349314
Energy: 0.2760874839218752
Energy: 0.39276452561314207
Energy: 0.28476971720533206
Energy: 0.2760875319878594
Energy: 0.33021712254772584
Energy: 0.4537540612746158
Energy: 0.4025726966533339
Energy: 0.3314907867101564
Energy: 0.5018885493582583
Energy: 0.36298359463809393
Energy: 0.37452673173355305
Energy: 0.25282464460625625
Energy: 0.24103707721177067
Energy: 0.4092367558034689
Energy: 0.2638170799121598
Energy: 0.7583767279319225
Energy: 0.40666161885051944
Energy: 0.5271521732440849
Energy: 0.4830653269672031
Energy: 0.40950269551709767
Energy: 0.5639513800428033
Energy: 0.44767234591018334
Energy: 0.30737903824496937
Energy: 0.42052321310744556
Energy: 0.4745257774924519
Energy: 0.3018037135768317
Energy: 0.37622477664987264
Energy: 0.5292105750999476
Energy: 0.483814738780055
Energy: 0.30629134523762286
Energy: 0.3186345753721787
Energy: 0.4677721064116254
Energy: 0.3027289700729779
Energy: 0.3454743452504276
Energy: 0.2875489577524834
Energy: 0.426508932188245
Energy: 0.4507793392351356
Energy: 0.2869082273200441
Energy: 0.4159341685911316
Energy: 0.2800357958242591
Energy: 0.24770508761050117
Energy: 0.4569265282219269
Energy: 0.2682147164413298
Energy: 0.24673043365380143
Energy: 0.43520188719911757
Energy: 0.2551111397780397
Energy: 0.4352859285953173
Energy: 0.3516405413925291
Energy: 0.3449435053454688
Energy: 0.42374072076400354
Energy: 0.36553817937365185
Energy: 0.35238134581746017
Energy: 0.2629259133177638
Energy: 0.4786216318487277
Energy: 0.5997101937770942
Energy: 0.2582645550110533
Energy: 0.3816239503151755
Energy: 0.7180896536774795
Energy: 0.26744790590995554
Energy: 0.45664660156637155
Energy: 0.5493001929583078
Energy: 0.2643434211175864
Energy: 0.3851903128881318
Energy: 0.6415893394041247
Energy: 0.35399325263744136
Energy: 0.3001990040200381
Energy: 0.5298501644385086
Energy: 0.3622817107924624
Energy: 0.3164081024598897
Energy: 0.4771788553663296
Energy: 0.2818781266799915
Energy: 0.47539454694077116
Energy: 0.42225217023643785
Energy: 0.28691043289279766
Energy: 0.5263659223085533
Energy: 0.3751983582348489
Energy: 0.3714806239364458
Energy: 0.4357838509121381
Energy: 0.40366831816117743
Energy: 0.37021893963284586
Energy: 0.46946876076115707
Energy: 0.38194531845624563
Energy: 0.4562817283976537
Energy: 0.23634789043721965
Energy: 0.24337725864926635
Energy: 0.4615822002944438
Energy: 0.23480872534926844
Energy: 0.2579175492486654
Energy: 0.3850193391339631
Energy: 0.4581520059022566
Energy: 0.4293815445400311
Energy: 0.38491920649416883
Energy: 0.3028834911754373
Energy: 0.4064485099179238
Energy: 0.3027406648512335
Energy: 0.6354230165013105
Energy: 0.5546045053656937
Energy: 0.31459840965006014
Energy: 0.7031683823949232
Energy: 0.47625466710572345
Energy: 0.37088323861255795
Energy: 0.2591833403153777
Energy: 0.2446327532439812
Energy: 0.40164110615417165
Energy: 0.2714774622395903
Energy: 0.7316030282269638
Energy: 0.531091622099859
Energy: 0.4136911032707533
Energy: 0.4259832929884272
Energy: 0.5228978171482329
Energy: 0.40869375505693417
Energy: 0.44450334771630373
Energy: 0.31001856089381813
Energy: 0.3713217826381368
Energy: 0.42248040148877836
Energy: 0.3015322607283165
Energy: 0.3311916512240094
Energy: 0.4756193210091797
Energy: 0.4783796684595235
Energy: 0.34262892228619285
Energy: 0.34460012576802346
Energy: 0.4620635334358158
Energy: 0.3483219437350519
Energy: 0.36019260975831285
Energy: 0.26229651014226707
Energy: 0.560348159923249
Energy: 0.28148045369942926
Energy: 0.2615603217903242
Energy: 0.5206682108966387
Energy: 0.26928681161650364

minimum gb energy = 0.23480872534926844 eV
minimum distance =  2.75137974197226 Angstroms
sigma value = 27


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

Energy: 0.1929542913844092
Energy: 0.4032018012560271
Energy: 0.461339078695224
Energy: 0.19408843579664004
Energy: 0.524802453034541
Energy: 0.5171926333352124
Energy: 0.3961856762213938
Energy: 0.3936700175596189
Energy: 0.42279784236200346
Energy: 0.5952333882008299
Energy: 0.3742185047564923
Energy: 0.4635550209194009
Energy: 0.5695907927739509
Energy: 0.36703700880459134
Energy: 0.3961246361082749
Energy: 0.5576787574990061
Energy: 0.34590056831096566
Energy: 0.4352103431220805
Energy: 0.45431705076264417
Energy: 0.43703194655874916
Energy: 0.4749628391943566
Energy: 0.6351835923822203
Energy: 0.40964526043370314
Energy: 0.5163583150613911
Energy: 0.40571701820259964
Energy: 0.2853540219292853
Energy: 0.4900908570971729
Energy: 0.40779303764869257
Energy: 0.30126122719125803
Energy: 0.4583966002502359
Energy: 0.3372907397786492
Energy: 0.2943562089821663
Energy: 0.2768222177109367
Energy: 0.3532478157679518
Energy: 0.3113208833928687
Energy: 0.2654626830078301
Energy: 0.3838379675043187
Energy: 0.4169559243803675
Energy: 0.3867632677033469
Energy: 0.38276570085176337
Energy: 0.4456611385626401
Energy: 0.36832259737652906
Energy: 0.4131410018634743
Energy: 0.29090569213072354
Energy: 0.2738252835567234
Energy: 0.4463954225700969
Energy: 0.30776177604528154
Energy: 0.26229581885960385
Energy: 0.40865677702553244
Energy: 0.2735500038117282
Energy: 0.6854462638483994
Energy: 0.42336608184059493
Energy: 0.28681153420983635
Energy: 0.6063573018343764
Energy: 0.2979988225642519
Energy: 0.3937165165739578
Energy: 0.3983966586261223
Energy: 0.4810047164442344
Energy: 0.39386305906206165
Energy: 0.4093558305752551
Energy: 0.4691473069616061
Energy: 0.3547196697111556
Energy: 0.36234568761525177
Energy: 0.46085961262880887
Energy: 0.3513661427578592
Energy: 0.37997550069385955
Energy: 0.39618567590009945
Energy: 0.3942061848640532
Energy: 0.42346652689326036
Energy: 0.606113315772117
Energy: 0.37527212614492467
Energy: 0.4646482418415766

minimum gb energy = 0.1929542913844092 eV
minimum distance =  1.91432880311023 Angstroms
sigma value = 9


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

Energy: 0.4309258607431586
Energy: 0.49185843518321337
Energy: 0.32720498018645255
Energy: 0.42388015159644016
Energy: 0.5142571110124275
Energy: 0.35327887758118953
Energy: 0.47805165932387533
Energy: 0.38461238339228726
Energy: 0.416179981647891
Energy: 0.5843090284101945
Energy: 0.3638291885207795
Energy: 0.4574707497234767
Energy: 0.4338147235722549
Energy: 0.3097883952285807
Energy: 0.3219203767073761
Energy: 0.4256958663999907
Energy: 0.30416376937390593
Energy: 0.34447117938765837
Energy: 0.4342799925531336
Energy: 0.36813298063824623
Energy: 0.3688836231112699
Energy: 0.42742616689104657
Energy: 0.3733394866685347
Energy: 0.37677003632366274
Energy: 0.3691861586091545
Energy: 0.4363776816111244
Energy: 0.4011253094274432
Energy: 0.3781466147690352
Energy: 0.46817375888673207
Energy: 0.4886065207170327
Energy: 0.35975500601925636
Energy: 0.2726760503061162
Energy: 0.4821272093786154
Energy: 0.38097430536160015
Energy: 0.2827465919817156
Energy: 0.43315706717144514
Energy: 0.3530230711314872
Energy: 0.3548706464326804
Energy: 0.33336031729330023
Energy: 0.34760174896463225
Energy: 0.3776959592423923
Energy: 0.3210659858172753
Energy: 0.314204081105391
Energy: 0.2809858503499363
Energy: 0.48883307487980243
Energy: 0.32404300131986147
Energy: 0.2956840621584737
Energy: 0.4374406132183815
Energy: 0.37820297684814275
Energy: 0.4515603162629215
Energy: 0.42090818909577865
Energy: 0.37785011467546026
Energy: 0.48097677320974663
Energy: 0.3984295485385362
Energy: 0.41017452003677135
Energy: 0.4262840593870255
Energy: 0.4633612358409978
Energy: 0.4058281035218566
Energy: 0.40002940360469236
Energy: 0.36106259335403956
Energy: 0.3980907552992211
Energy: 0.33898311051403657
Energy: 0.3776700422869187
Energy: 0.39083224088204593
Energy: 0.31085280967659534
Energy: 0.42388351417378894
Energy: 0.49571003824559984
Energy: 0.34929912314557726
Energy: 0.3657758422803946
Energy: 0.48586380226074366
Energy: 0.3413842758480672
Energy: 0.39304216697290456
Energy: 0.4270291647709017
Energy: 0.5038865716375203
Energy: 0.3355715954454389
Energy: 0.42079622664182925
Energy: 0.4342660891859596
Energy: 0.35782886489987215
Energy: 0.49656367341485563
Energy: 0.3711593260779432
Energy: 0.3785149575791033
Energy: 0.48563580671793755
Energy: 0.3705725963836511
Energy: 0.39732773743043526
Energy: 0.35262643609841954
Energy: 0.2891547468538554
Energy: 0.2845482596741401
Energy: 0.35568810338613605
Energy: 0.2971223941478817
Energy: 0.3876524284647272
Energy: 0.32969831291362883
Energy: 0.36635988279850673
Energy: 0.34012413406758346
Energy: 0.3250031899996757
Energy: 0.3930994105119712
Energy: 0.3209506886154462
Energy: 0.37284065727796734
Energy: 0.4384270006356786
Energy: 0.4019732272616221
Energy: 0.3923246930732132
Energy: 0.46782839317036096
Energy: 0.5980853053571047
Energy: 0.4350500079949902
Energy: 0.2796296963043916
Energy: 0.4877072054897312
Energy: 0.4661285444717638
Energy: 0.28934212201399034
Energy: 0.44068094913709227
Energy: 0.3781567145754213
Energy: 0.38895953059751537
Energy: 0.36257884025242343
Energy: 0.3731107902175418
Energy: 0.4161246871851386
Energy: 0.34797684932069345
Energy: 0.362556752634955
Energy: 0.3218313553105162
Energy: 0.3183936715339465
Energy: 0.3586817229841596
Energy: 0.3299201584328832
Energy: 0.3222050324560993
Energy: 0.42773641842241994
Energy: 0.33897567380366656
Energy: 0.33403831627015024
Energy: 0.41863802893653135
Energy: 0.3516015531069718
Energy: 0.34442785022217726
Energy: 0.40703826414942473
Energy: 0.5818652670406501
Energy: 0.5402849579578032
Energy: 0.40055636382874277
Energy: 0.4883956971597968
Energy: 0.3362519239441128
Energy: 0.36471202052836454
Energy: 0.4805243589381544
Energy: 0.567399393490773
Energy: 0.35913665102657527
Energy: 0.41241127536096744
Energy: 0.5130825168013522
Energy: 0.3928002713837061
Energy: 0.318441353343162
Energy: 0.3129405397547004
Energy: 0.3850771059966854
Energy: 0.33143278536557086
Energy: 0.3217928516317958
Energy: 0.4373529956865246
Energy: 0.3560532584806002
Energy: 0.3655222998736247
Energy: 0.4320997079580966
Energy: 0.352951873996976
Energy: 0.37964942666234314
Energy: 0.36058305308747796
Energy: 0.43957210846631933
Energy: 0.40340100010910623
Energy: 0.3590682439179714
Energy: 0.47310111430659035
Energy: 0.37629801382112804
Energy: 0.4030057669374847
Energy: 0.2745152583911156
Energy: 0.2674935044562874
Energy: 0.4256311087009118
Energy: 0.2813223006734951
Energy: 0.46603294155312586
Energy: 0.33691847173300976
Energy: 0.4636688902130304
Energy: 0.4247983466819014
Energy: 0.33908022936053916
Energy: 0.49562821614307107
Energy: 0.3890915641068295
Energy: 0.29804725386577835
Energy: 0.465646485373495
Energy: 0.42194908209022464
Energy: 0.3039718502382921
Energy: 0.5023654139671463
Energy: 0.38104601462912246
Energy: 0.382354373344484
Energy: 0.2894259507265202
Energy: 0.5010794273230791
Energy: 0.38847167667775967
Energy: 0.29581843717197875
Energy: 0.46305051741651965
Energy: 0.37783185811056214
Energy: 0.38278783741211403
Energy: 0.3950471968859799
Energy: 0.3707496011544013
Energy: 0.37724012462080586
Energy: 0.4165883805193492
Energy: 0.4216725489168553
Energy: 0.3789455751545386
Energy: 0.43274222620138103
Energy: 0.41419401936224526
Energy: 0.3398032226447406
Energy: 0.3406558295342241
Energy: 0.3922880284963066
Energy: 0.32520168749038536
Energy: 0.31972847566349216
Energy: 0.38571032194532995
Energy: 0.3385760082557352
Energy: 0.3283521864805799
Energy: 0.41464792645636944
Energy: 0.4522074689410773
Energy: 0.5362259967623584
Energy: 0.40722795922498123
Energy: 0.38760120804259646
Energy: 0.33349827164733936
Energy: 0.373741719073606
Energy: 0.4246366695902185
Energy: 0.4707996869098894
Energy: 0.36761712671751773
Energy: 0.39084239679153365
Energy: 0.5235926621908215
Energy: 0.3793886206630044
Energy: 0.3021519370128166
Energy: 0.39869475221920586
Energy: 0.3785918056879492
Energy: 0.31145231024707215
Energy: 0.38407860842438396
Energy: 0.2843706793537886
Energy: 0.40537793539419936
Energy: 0.36986295904996236
Energy: 0.28824745987998196
Energy: 0.4376681450327936
Energy: 0.3390012551608148
Energy: 0.35722685644484276
Energy: 0.5172184421222172
Energy: 0.4684940888444035
Energy: 0.360071480130143
Energy: 0.5577107412166833
Energy: 0.4245758117433388
Energy: 0.4495682290240449
Energy: 0.28332860927610104
Energy: 0.27124753480476393
Energy: 0.4843813947905656
Energy: 0.2941275549914877
Energy: 0.464524609558123
Energy: 0.36003189537009384
Energy: 0.5516257256552637
Energy: 0.4970881141797794
Energy: 0.36433819789287863
Energy: 0.5972240167246597
Energy: 0.44702934331435573
Energy: 0.3566668606369403
Energy: 0.34946553143629594
Energy: 0.34035430744531864
Energy: 0.3549413812571774
Energy: 0.36169139148829105
Energy: 0.33712291321048027
Energy: 0.39210402628330226
Energy: 0.3278765389419015
Energy: 0.3206371176658288
Energy: 0.385218155690245
Energy: 0.34044707850589195
Energy: 0.3266903216614267
Energy: 0.3542553436747126
Energy: 0.4695112313515656
Energy: 0.5445605330023018
Energy: 0.3487343132367324
Energy: 0.4114594060196305
Energy: 0.48675143838150825

minimum gb energy = 0.2674935044562874 eV
minimum distance =  1.76283953026429 Angstroms
sigma value = 57


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

Energy: 0.09803585248776822
Energy: 0.1528899486099196
Energy: 0.15281822132566397
Energy: 0.09112819299866731
Energy: 0.4892754117667922
Energy: 0.13874783339383173
Energy: 0.28937763639027764
Energy: 0.43295280455851404
Energy: 0.47049291914150276
Energy: 0.6800540265242668
Energy: 0.3764669849975313
Energy: 0.5654691269052696
Energy: 0.716805136427184
Energy: 0.6270922599893005
Energy: 0.5929790369493886
Energy: 0.6980353704940125
Energy: 0.6487810064979197
Energy: 0.6015044387486215
Energy: 0.7830216021875165
Energy: 0.5269099558775514
Energy: 0.5277824805224354
Energy: 0.7583857190064637
Energy: 0.5359317105500636
Energy: 0.5580526431444621
Energy: 0.3712203062392721
Energy: 0.2286584559082927
Energy: 0.22358287255824752
Energy: 0.39608384870889435
Energy: 0.23356597692209527
Energy: 0.6462529904924872
Energy: 0.354900636161967
Energy: 0.14248809533207887
Energy: 0.15746149086052627
Energy: 0.3950408176037999
Energy: 0.12910319456783392
Energy: 0.1666567362592613
Energy: 0.4806351960797696
Energy: 0.44876138546618816
Energy: 0.4141414971618997
Energy: 0.4658897572137537
Energy: 0.48771078504911175
Energy: 0.3988115866322898
Energy: 0.6755967597406665
Energy: 0.7742154542313627
Energy: 0.7125719817262024
Energy: 0.6748115527213949
Energy: 0.828564711991222
Energy: 0.6721603639378697
Energy: 0.549441114004038
Energy: 0.5004776900985584
Energy: 0.46096557006692807
Energy: 0.5373254888129115
Energy: 0.5482932045925216
Energy: 0.44989457567122204
Energy: 0.13843980440911594
Energy: 0.5949636188040264
Energy: 0.18774573947112524
Energy: 0.14259633464849633
Energy: 0.48947033748842605
Energy: 0.18070149568788085
Energy: 0.2130952054845206
Energy: 0.47037007779966256
Energy: 0.5936425457466333
Energy: 0.21346457573628416
Energy: 0.3672818177135711
Energy: 0.2059577870579509
Energy: 0.49358122145441874
Energy: 0.5022202829024778
Energy: 0.45469592540519144
Energy: 0.4859112627152346
Energy: 0.5640719693234116
Energy: 0.4363686531934892
Energy: 0.8903493459564904
Energy: 0.6465058604616745
Energy: 0.656677516333004
Energy: 0.8722165026186712
Energy: 0.6448522333539096
Energy: 0.6945573578196568
Energy: 0.40867805387933004
Energy: 0.5891017376989812
Energy: 0.5269049823966825
Energy: 0.41152621062322553
Energy: 0.6551198575712168
Energy: 0.47967006027488124
Energy: 0.41495137069523336
Energy: 0.11603336540226038
Energy: 0.135829661191537
Energy: 0.453470500474557
Energy: 0.09823846720923077
Energy: 0.15104590417661556
Energy: 0.3284803069906174
Energy: 0.6594216599738333
Energy: 0.5906839859651634
Energy: 0.34391818296592386
Energy: 0.2695850236599772
Energy: 0.5207581057278032
Energy: 0.6555973616603762
Energy: 0.6038461857279308
Energy: 0.5707461822900673
Energy: 0.6488991394429107
Energy: 0.6408977408025919
Energy: 0.5601640412632863
Energy: 0.5645576787210791
Energy: 0.7006282014235504
Energy: 0.6141260141108704
Energy: 0.554889262225195
Energy: 0.771047972333834
Energy: 0.5713611752435038
Energy: 0.255298379851212
Energy: 0.5168383778889579
Energy: 0.5790023277459779
Energy: 0.25257106532340146
Energy: 0.41480074537706635
Energy: 0.7321819120261223

minimum gb energy = 0.09112819299866731 eV
minimum distance =  1.60927089854708 Angstroms
sigma value = 11


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

Energy: 0.2875132952039879
Energy: 0.5111808967333167
Energy: 0.3767723163954692
Energy: 0.2843210444154735
Energy: 0.511248553937456
Energy: 0.41732528004114583
Energy: 0.496620914680148
Energy: 0.38228935704552175
Energy: 0.41414347631529863
Energy: 0.5833279529280673
Energy: 0.3613363441514275
Energy: 0.4554792358107319
Energy: 0.36731660939288346
Energy: 0.31772446512058705
Energy: 0.31534030946355307
Energy: 0.36201188914742377
Energy: 0.32286353656435796
Energy: 0.32092427594847134
Energy: 0.3338219181294232
Energy: 0.3476892209025934
Energy: 0.32445713422132005
Energy: 0.3283936051286138
Energy: 0.3711289012077032
Energy: 0.3105046397796704
Energy: 0.3753994207798084
Energy: 0.4780194912772596
Energy: 0.43594487762390266
Energy: 0.3927307589808764
Energy: 0.3187708684964786
Energy: 0.5883839499665032
Energy: 0.4361819989738976
Energy: 0.34231077747900607
Energy: 0.3224801060312339
Energy: 0.46738380516037803
Energy: 0.3592376197305253
Energy: 0.4899789632042025
Energy: 0.38238131075625786
Energy: 0.3949394519168797
Energy: 0.36884791271839446
Energy: 0.3779409132827578
Energy: 0.4217996215130624
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Energy: 0.346318861127154
Energy: 0.3817945946187437
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Energy: 0.3735036300474907
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Energy: 0.559095551414728
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Energy: 0.3258440595089745
Energy: 0.35021788682837185
Energy: 0.3458798875159679
Energy: 0.3261795990460024
Energy: 0.3648928847151047
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Energy: 0.39399915583576145
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Energy: 0.3902068300237162
Energy: 0.3903640355413159
Energy: 0.44146839365069723
Energy: 0.3762807203561086
Energy: 0.27521038813102594
Energy: 0.45271402446483994
Energy: 0.3933483278528131
Energy: 0.27481521059183533
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Energy: 0.42101264132832317
Energy: 0.404489117566812
Energy: 0.3440610903006335
Energy: 0.37609999533186034
Energy: 0.39831450261603185
Energy: 0.3208426818545315
Energy: 0.4145525737329833
Energy: 0.436048095358558
Energy: 0.3053543747542742
Energy: 0.32074648514858756
Energy: 0.42715079000707323
Energy: 0.2972775911328304
Energy: 0.3451463428447709
Energy: 0.28695176057766014
Energy: 0.3894059953003714
Energy: 0.4080279465517611
Energy: 0.2859365988737959
Energy: 0.3766556221503127
Energy: 0.43156021172497483
Energy: 0.3655798363290877
Energy: 0.49517575246511814
Energy: 0.4515237290169642
Energy: 0.3672422951606441
Energy: 0.4286714646030587
Energy: 0.4153030095789046
Energy: 0.3915856482776285
Energy: 0.3436034677810648
Energy: 0.32363892523381294
Energy: 0.4164205795277015
Energy: 0.36057102832990684
Energy: 0.5099922245254989
Energy: 0.335819401230357
Energy: 0.4178974389681499
Energy: 0.38465943626295407
Energy: 0.3358815619374833
Energy: 0.4474203096026365
Energy: 0.35752547230185916
Energy: 0.2879888044909249
Energy: 0.3667693671615531
Energy: 0.3381751548269903
Energy: 0.28868324833237713
Energy: 0.392204949155687
Energy: 0.314667297834084
Energy: 0.38717811333823327
Energy: 0.35870682083155797
Energy: 0.34486586252082146
Energy: 0.38081083145157923
Energy: 0.377563290752152
Energy: 0.3425316515414386
Energy: 0.42928509264718423
Energy: 0.505523873687543
Energy: 0.5929077162400888
Energy: 0.42197136118148043
Energy: 0.43719097538035245
Energy: 0.5524544649387646

minimum gb energy = 0.27481521059183533 eV
minimum distance =  1.60141197229556 Angstroms
sigma value = 41


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

Energy: 0.28360316946845354
Energy: 0.4536656827509383
Energy: 0.5300725080787015
Energy: 0.28102453256420634
Energy: 0.5157329483046147
Energy: 0.257179638040947
Energy: 0.4394731365055554
Energy: 0.38791865131393327
Energy: 0.418132508910283
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Energy: 0.3700445273670905
Energy: 0.4595834254395103
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Energy: 0.3569900453659851
Energy: 0.3491382049317995
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Energy: 0.3674344393520084
Energy: 0.3421239432162305
Energy: 0.34021577649531337
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Energy: 0.32690762129920015
Energy: 0.37919296967463967
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Energy: 0.3338347735567401
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Energy: 0.5962205617422411
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Energy: 0.3932527037292549
Energy: 0.47661873242557073
Energy: 0.44839015100937957
Energy: 0.3643099803677573
Energy: 0.4365765166847588
Energy: 0.4125880541593214
Energy: 0.39524844167798145
Energy: 0.43048883901187973
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Energy: 0.3905701889897097
Energy: 0.30356626936635034
Energy: 0.36458039822044574
Energy: 0.39840149843711126
Energy: 0.297575861293516
Energy: 0.33844547319125085
Energy: 0.26349587496677096
Energy: 0.39311730083407753
Energy: 0.3218626258935982
Energy: 0.31781935100902087
Energy: 0.38689771213385693
Energy: 0.3344957022105097
Energy: 0.32862591048965123
Energy: 0.30308307166878373
Energy: 0.4152248990370312
Energy: 0.48558797841346707
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Energy: 0.3597266485754894
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Energy: 0.30583499021823374
Energy: 0.42397141743694117
Energy: 0.45860010516922706
Energy: 0.3023325201356519
Energy: 0.40216398378331664
Energy: 0.49892002652033657
Energy: 0.40481106120312954
Energy: 0.3856467153684453
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Energy: 0.41442261748903864
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Energy: 0.46981857777637864
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Energy: 0.4428698718572826
Energy: 0.4073391278133551
Energy: 0.48606541437992534
Energy: 0.47167730679872066
Energy: 0.37326170086744914
Energy: 0.39226801034905445
Energy: 0.5016326572080644
Energy: 0.45762160964260207
Energy: 0.393580788053541
Energy: 0.5423489466872082
Energy: 0.4250904489350956
Energy: 0.2977863424118087
Energy: 0.39860136687133196
Energy: 0.42385264640046943
Energy: 0.29471875434464645
Energy: 0.37860223716835667
Energy: 0.28161566727843046
Energy: 0.44023272785373085
Energy: 0.31593458935267904
Energy: 0.3284901129071795
Energy: 0.43145926379790905
Energy: 0.3156553616152661
Energy: 0.3517046628097911
Energy: 0.30458391422875863
Energy: 0.3789298711417229
Energy: 0.43188128154094946
Energy: 0.2995432948004138
Energy: 0.3397786713823845
Energy: 0.48899393347593356
Energy: 0.29675513857214214
Energy: 0.46441147419147605
Energy: 0.518565399720433
Energy: 0.29457007092155923
Energy: 0.4219926482265133
Energy: 0.5758363556390043
Energy: 0.3914361301069496
Energy: 0.34312994533364266
Energy: 0.4683323763240171
Energy: 0.3947527613185263
Energy: 0.3656367832091567
Energy: 0.436676460470392
Energy: 0.36295350418352845
Energy: 0.4286276008681364
Energy: 0.3952209469440403
Energy: 0.38053125963101064
Energy: 0.45513788773667474
Energy: 0.36218641407122487
Energy: 0.3482144924782335
Energy: 0.37006589221372177
Energy: 0.34550928731474195
Energy: 0.34336289106302664
Energy: 0.3956647000460011
Energy: 0.33003241775573205
Energy: 0.3170688270304925
Energy: 0.44823380923510814
Energy: 0.4105333289767334
Energy: 0.31901978217827964
Energy: 0.4785592322804054
Energy: 0.37588100096882526
Energy: 0.4076517648461523
Energy: 0.3934516300533983
Energy: 0.3727285531546415
Energy: 0.40312722319655475
Energy: 0.4211871110995262
Energy: 0.36699346077686656
Energy: 0.28079082167213093
Energy: 0.5499463630913923
Energy: 0.46087952318221487
Energy: 0.27817927762028066
Energy: 0.4692506982071269
Energy: 0.5200984911364319

minimum gb energy = 0.2558603998017757 eV
minimum distance =  1.72511878103 Angstroms
sigma value = 33


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

Energy: 0.1922306464410843
Energy: 0.39111983386821225
Energy: 0.4475849351727459
Energy: 0.18889417498793143
Energy: 0.48171329870110674
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Energy: 0.3791244450815645
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Energy: 0.364265343909063
Energy: 0.44308785897654
Energy: 0.3712763664944837
Energy: 0.3986161812440909
Energy: 0.38061095251258176
Energy: 0.3679800447546843
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Energy: 0.3748190529960719
Energy: 0.3305575207469731
Energy: 0.4038251191513121
Energy: 0.36770785178176313
Energy: 0.32785011610228904
Energy: 0.4391889413657352
Energy: 0.3393189325019524
Energy: 0.3878422838565231
Energy: 0.2666316428598335
Energy: 0.6654812061346105
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Energy: 0.2752549944573095
Energy: 0.2665038364675442
Energy: 0.4705382806071635
Energy: 0.2851595583688425
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Energy: 0.4784621658069796
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Energy: 0.29003459073364546
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Energy: 0.28741153274874387
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Energy: 0.42100080590485606
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Energy: 0.339437625281831
Energy: 0.39761586643802743
Energy: 0.3278932739522305
Energy: 0.3520972189007238
Energy: 0.5660076855982893
Energy: 0.516484782712208
Energy: 0.3600254470731848
Energy: 0.6057975783188854
Energy: 0.47054478666365857
Energy: 0.4373344761718782
Energy: 0.4080547797563823
Energy: 0.38051781084169667
Energy: 0.41764450441839385
Energy: 0.4348810148876607
Energy: 0.38051477755710417
Energy: 0.6005701822609792
Energy: 0.5830242043111777
Energy: 0.4328614305144705
Energy: 0.5869742473436322
Energy: 0.48010390776668105
Energy: 0.4778528314288903

minimum gb energy = 0.18889417498793143 eV
minimum distance =  1.94566250872878 Angstroms
sigma value = 67


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

Energy: 0.21345055823481351
Energy: 0.266193082511919
Energy: 0.24300054751937997
Energy: 0.2134974997706172
Energy: 0.5889451159034812
Energy: 0.22856531025963395
Energy: 0.3403596458692373
Energy: 0.4100033289479238
Energy: 0.4623073287200893
Energy: 0.6923821285010386
Energy: 0.3719573903268833
Energy: 0.5217691401545439
Energy: 0.36737343521696847
Energy: 0.2680251840100067
Energy: 0.5655137565104315
Energy: 0.3763271055624318
Energy: 0.2832757304447387
Energy: 0.5088041251453025
Energy: 0.4088855049465489
Energy: 0.5483650631138434
Energy: 0.49552679202263283
Energy: 0.4081595567149305
Energy: 0.5989864611457145
Energy: 0.45336768049803056
Energy: 0.42211783255384466
Energy: 0.7928310215642205
Energy: 0.7050781720956755
Energy: 0.43534661668526636
Energy: 0.8647077731313172
Energy: 0.6192318432604395
Energy: 0.43257821654183304
Energy: 0.2135550474126685
Energy: 0.8487784143693446
Energy: 0.454187792885319
Energy: 0.22263486815832684
Energy: 0.7364965126916247
Energy: 0.334921944461587
Energy: 0.4679846677630732
Energy: 0.5174124033576127
Energy: 0.3260211318176417
Energy: 0.4353453551860151
Energy: 0.575581594862208

minimum gb energy = 0.21345055823481351 eV
minimum distance =  1.81940638211642 Angstroms
sigma value = 3


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

Energy: 0.27169859518699785
Energy: 0.4972601261776245
Energy: 0.3602124031290083
Energy: 0.26848233685435857
Energy: 0.4980475729037778
Energy: 0.4003576693814681
Energy: 0.4981143043531433
Energy: 0.3853197301922991
Energy: 0.4147866553752106
Energy: 0.5847741739943159
Energy: 0.3672201915042142
Energy: 0.45455174364670153
Energy: 0.36404965589857163
Energy: 0.34116700655153576
Energy: 0.3302762198695084
Energy: 0.36711903566694604
Energy: 0.3521853224477679
Energy: 0.4094956754364215
Energy: 0.28496332287931964
Energy: 0.404855415972657
Energy: 0.37121307961271693
Energy: 0.2883758418599638
Energy: 0.33386671414789626
Energy: 0.33981012096864355
Energy: 0.2787069749651282
Energy: 0.3431231179478345
Energy: 0.3160950025898556
Energy: 0.2784949669091859
Energy: 0.3673691279739648
Energy: 0.29437873339589
Energy: 0.3620944771666491
Energy: 0.3391845513714847
Energy: 0.329933939956027
Energy: 0.3576008418735867
Energy: 0.34940773375369905
Energy: 0.3283248821328167
Energy: 0.5381596420728229
Energy: 0.3566088504955671
Energy: 0.38352961745862324
Energy: 0.5270083610372379
Energy: 0.33936098432841294
Energy: 0.4189966778527826
Energy: 0.27003816451431095
Energy: 0.5074508478734117
Energy: 0.36698771369568234
Energy: 0.26752213177371387
Energy: 0.43232026255844547
Energy: 0.40251445329899366
Energy: 0.4808597767834219
Energy: 0.4003640462640956
Energy: 0.392109039964059
Energy: 0.4712972440350614
Energy: 0.41341382375829994
Energy: 0.3984032999314277
Energy: 0.40445697058070096
Energy: 0.32557108331868245
Energy: 0.3106613745600447
Energy: 0.42615388281674915
Energy: 0.3381715218110268
Energy: 0.4893106728118622
Energy: 0.3324663700099353
Energy: 0.4545930696127662
Energy: 0.4159675693327489
Energy: 0.34209735019229753
Energy: 0.4858796127563009
Energy: 0.4658178541317748
Energy: 0.36278310249128115
Energy: 0.33609039999262985
Energy: 0.3264022364249491
Energy: 0.35726914099400364
Energy: 0.34853005200017095
Energy: 0.3244247998740143
Energy: 0.3268053407369257
Energy: 0.28498767155878985
Energy: 0.30456916822892477
Energy: 0.32008468293273157
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Energy: 0.3307592180305061
Energy: 0.38257786097959434
Energy: 0.29986520360929103
Energy: 0.30422943377883066
Energy: 0.37599488843033674
Energy: 0.30121661394260046
Energy: 0.3183789592721426
Energy: 0.2815861024863546
Energy: 0.3639204215355001
Energy: 0.3869650227811166
Energy: 0.2792707287476345
Energy: 0.34735544203081986
Energy: 0.41429126434327684
Energy: 0.3669366492326363
Energy: 0.43047383493784613
Energy: 0.3928682164474458
Energy: 0.36480998295388023
Energy: 0.4667423052811482
Energy: 0.3670105840415701
Energy: 0.4235743768437045
Energy: 0.33197875309368424
Energy: 0.3094912789374659
Energy: 0.45726968597119627
Energy: 0.35095948316862297
Energy: 0.4875370878969312
Energy: 0.39070684267387495
Energy: 0.42619490659493336
Energy: 0.587794615942518
Energy: 0.3993774814076874
Energy: 0.4558877869545637
Energy: 0.5250526561426975
Energy: 0.44531281625465763
Energy: 0.42658473049504075
Energy: 0.45814224580327234
Energy: 0.4392351569913856
Energy: 0.4042052262062092
Energy: 0.37955600100507175
Energy: 0.27702418192891815
Energy: 0.3689630515140439
Energy: 0.423825729107164
Energy: 0.4475383235433203
Energy: 0.32630671325741034
Energy: 0.36240971419726126
Energy: 0.3431017711206737
Energy: 0.2890302263919844
Energy: 0.2832908840130527
Energy: 0.3363451521876373
Energy: 0.3013826247275463
Energy: 0.2884668960666996
Energy: 0.3030090079978069
Energy: 0.3338128269375126
Energy: 0.31396422037952115
Energy: 0.3011599878332326
Energy: 0.3530037992258138
Energy: 0.30116462828570756
Energy: 0.3178835127868488
Energy: 0.3445172124165421
Energy: 0.32179295208569847
Energy: 0.3152572199685857
Energy: 0.36623930164475105
Energy: 0.30643758221457107
Energy: 0.32272737108347954
Energy: 0.33334182020340053
Energy: 0.31050018402105223
Energy: 0.33737739843906817
Energy: 0.35343416839838704
Energy: 0.49182057129688406
Energy: 0.40878853153417594
Energy: 0.43014044189418454
Energy: 0.40199187579813267
Energy: 0.40408271941629775
Energy: 0.46095618701663515
Energy: 0.387157586097723
Energy: 0.2647696363988338
Energy: 0.5560880753780977
Energy: 0.5330407231111791
Energy: 0.44449958381442056
Energy: 0.4729347458169146
Energy: 0.3659828233925137
Energy: 0.43220242732947495
Energy: 0.515542214510184
Energy: 0.507328920839481
Energy: 0.4248937583740459
Energy: 0.43878709763886525
Energy: 0.3524426479275939
Energy: 0.38777893313200906
Energy: 0.387031071287443
Energy: 0.36651789342787827
Energy: 0.38248980762992385
Energy: 0.41160952998667644
Energy: 0.35817592431491313
Energy: 0.2844224584910104
Energy: 0.34307311314225203
Energy: 0.3175124583960672
Energy: 0.292308173391727
Energy: 0.3655108486923671
Energy: 0.38784641507693135
Energy: 0.31276364899493464
Energy: 0.30871787485615954
Energy: 0.2935420651983105
Energy: 0.3082856179260975
Energy: 0.3246686428759868
Energy: 0.28530527693493357
Energy: 0.30248761938828284
Energy: 0.3619156574911675
Energy: 0.3377951994710086
Energy: 0.30230392725867555
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Energy: 0.3194175935891416
Energy: 0.3774590140002918
Energy: 0.31149248876160446
Energy: 0.3042605503725388
Energy: 0.3693591264807723
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Energy: 0.3102283967868068
Energy: 0.2707943331760976
Energy: 0.4582274191126661
Energy: 0.5441070398613699
Energy: 0.26742628231708
Energy: 0.3898246727847975
Energy: 0.37074968043241174
Energy: 0.42446461228943994
Energy: 0.4536336923700133
Energy: 0.5038259124998308
Energy: 0.41730558313506916
Energy: 0.4164678593339176
Energy: 0.5591222605925797
Energy: 0.3930737442462577
Energy: 0.46255413102209725
Energy: 0.42672749869403975
Energy: 0.3992409045919376
Energy: 0.49533217912727723
Energy: 0.4930809643680998
Energy: 0.35858807482683036
Energy: 0.3197211823181386
Energy: 0.29942844651547545
Energy: 0.3817675679624521
Energy: 0.3369162740125584
Energy: 0.47169876741997524
Energy: 0.33705446224882835
Energy: 0.35384333767746473
Energy: 0.3294613062438205
Energy: 0.33240596309033643
Energy: 0.3788641989301311
Energy: 0.31485270296505896
Energy: 0.30160243712523555
Energy: 0.3127502575714083
Energy: 0.3238191328752725
Energy: 0.29731429255161507
Energy: 0.3069390937174
Energy: 0.3412438656868286
Energy: 0.3416910351811128
Energy: 0.29022614739447167
Energy: 0.2864587244678574
Energy: 0.33645631298092776
Energy: 0.3002304066190077
Energy: 0.2931256562643034
Energy: 0.30215566186639875
Energy: 0.3148987012410775
Energy: 0.35081231986809175
Energy: 0.29735110923655805
Energy: 0.2890638159134735
Energy: 0.3915355390093478
Energy: 0.4310722278819655
Energy: 0.365597313620108
Energy: 0.360295910696621
Energy: 0.42204192724134815
Energy: 0.3755536965980854
Energy: 0.3645995399619367
Energy: 0.3838260182525681
Energy: 0.4855083624035562
Energy: 0.4430533097376498
Energy: 0.4025097528751058
Energy: 0.31053725677735516
Energy: 0.6078668974758917
Energy: 0.4308698096456678
Energy: 0.32509049475935775
Energy: 0.3073945657249356
Energy: 0.460529196203274
Energy: 0.3400832464472553
Energy: 0.47280100212623
Energy: 0.45711494153507937
Energy: 0.40117149481333786
Energy: 0.3882803721362908
Energy: 0.44862915889948085
Energy: 0.41798964153110263
Energy: 0.38866284721275784
Energy: 0.2712356719718077
Energy: 0.4194867227508135
Energy: 0.36492599995915803
Energy: 0.26903153168573124
Energy: 0.3696743396938577
Energy: 0.4006368649949249
Energy: 0.41126936410905274
Energy: 0.31317735845487743
Energy: 0.31971848105836836
Energy: 0.4035634011234807
Energy: 0.3130835548401953
Energy: 0.336304002164793
Energy: 0.3551303050985748
Energy: 0.3025912938215738
Energy: 0.30021160546372944
Energy: 0.3495062263477039
Energy: 0.30792361893692105
Energy: 0.30598654729799507
Energy: 0.29843409570281026
Energy: 0.3243256832357699
Energy: 0.30260457399721696
Energy: 0.2942339925913403
Energy: 0.3461229862150467
Energy: 0.2875449673139636
Energy: 0.3007007305843777
Energy: 0.3093640777167528
Energy: 0.46841496687026424
Energy: 0.30971328305445883
Energy: 0.32763110372376114
Energy: 0.4176292130373934
Energy: 0.3893530344754958
Energy: 0.32534494544270603
Energy: 0.3142248659344943
Energy: 0.39616050179457724
Energy: 0.3357319502122057
Energy: 0.4824660528239114
Energy: 0.5428669189394052
Energy: 0.42025158257338063
Energy: 0.45894468742632455
Energy: 0.5307726479307828
Energy: 0.39444775049587866
Energy: 0.5064649780549683

minimum gb energy = 0.2647696363988338 eV
minimum distance =  1.79790137777831 Angstroms
sigma value = 81


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

Energy: 0.4519125701226702
Energy: 0.2973013660041911
Energy: 0.32635081934587873
Energy: 0.4258061138496998
Energy: 0.3501025352329943
Energy: 0.34951697047519714
Energy: 0.29735367282419506
Energy: 0.3527539089789114
Energy: 0.32467537843138716
Energy: 0.36353200482734344
Energy: 0.34146610527356713
Energy: 0.38903205645164424
Energy: 0.36246115162824194
Energy: 0.2649941034908829
Energy: 0.25831713594059863
Energy: 0.3591444923673197
Energy: 0.25842156260082
Energy: 0.4303438661154868
Energy: 0.31073381247597154
Energy: 0.2903382849259811
Energy: 0.4308865062530397
Energy: 0.32168932028814673
Energy: 0.2918109288477283
Energy: 0.39728933377810793
Energy: 0.28830650300490535
Energy: 0.34942834845254694
Energy: 0.31723299183034454
Energy: 0.28696449838744315
Energy: 0.3803637207656487
Energy: 0.2933387093220057
Energy: 0.3924628794302076
Energy: 0.3632993968900626
Energy: 0.3527233529463183
Energy: 0.3882083636802068
Energy: 0.3737559495617133
Energy: 0.3513268804392374
Energy: 0.6230328736183556
Energy: 0.39338506621441205
Energy: 0.43550469273706954
Energy: 0.6110121065198424
Energy: 0.362745167508267
Energy: 0.48293065301694527
Energy: 0.2519678330405967
Energy: 0.563576758751278
Energy: 0.6765318787523503
Energy: 0.24881772178824743
Energy: 0.4699102336375758
Energy: 0.23107796916489495
Energy: 0.5279171920202147
Energy: 0.3932374508827555
Energy: 0.40007319017173026
Energy: 0.5141545160380668
Energy: 0.3565360466690509
Energy: 0.40327027165485335
Energy: 0.3609031003930518
Energy: 0.38732915125856027
Energy: 0.35777171140250225
Energy: 0.36248688155007924
Energy: 0.4043021272414489
Energy: 0.33903885541722056
Energy: 0.32017911504812924
Energy: 0.3079695110145673
Energy: 0.2896210537476438
Energy: 0.3179990643062448
Energy: 0.3274882858412208
Energy: 0.3449431641342092
Energy: 0.2693313144327663
Energy: 0.38343612960422263
Energy: 0.3994284015534328
Energy: 0.26777847261665155
Energy: 0.35943714868270155
Energy: 0.40749941640135917
Energy: 0.2984244785645538
Energy: 0.3613249525652315
Energy: 0.40461117259323115
Energy: 0.29716230691286316
Energy: 0.3284381321005559
Energy: 0.27865991158085857
Energy: 0.36714796012418527
Energy: 0.28252920052539787
Energy: 0.2816541611563757
Energy: 0.35819175165210326
Energy: 0.2916875254202461
Energy: 0.29311062753528005
Energy: 0.41295310410635544
Energy: 0.36503631180127
Energy: 0.3618024908681182
Energy: 0.40908908340474154
Energy: 0.36765813261474845
Energy: 0.3677596056516726
Energy: 0.3325738597012859
Energy: 0.41476752641174275
Energy: 0.37572834027890667
Energy: 0.3320929929034973
Energy: 0.4544737383312002
Energy: 0.3467798281209575
Energy: 0.4023232440597428
Energy: 0.24572942057663594
Energy: 0.23788255910435352
Energy: 0.43106427687000193
Energy: 0.2532064857227597
Energy: 0.23313691872767894
Energy: 0.36339738038857883
Energy: 0.6089340015770703
Energy: 0.5602085859875386
Energy: 0.3878812173991361
Energy: 0.6573073358516154
Energy: 0.49553151856971517
Energy: 0.38090970086200565
Energy: 0.3790756845800332
Energy: 0.3058279661072492
Energy: 0.3774608939302786
Energy: 0.3942894397554446
Energy: 0.3242576926886269
Energy: 0.39126891090940596
Energy: 0.34322327822938226
Energy: 0.29645959117190146
Energy: 0.39058717139556565
Energy: 0.34810201793560835
Energy: 0.3178670877232686
Energy: 0.3274923184239085
Energy: 0.39293029560782916
Energy: 0.37942555380236914
Energy: 0.34864501390442043
Energy: 0.4143070720966028
Energy: 0.3521411636577067
Energy: 0.3199627613333737
Energy: 0.2681528828498656
Energy: 0.26174287046088535
Energy: 0.32901984421746383
Energy: 0.27580899326220426
Energy: 0.2598582342405681
Energy: 0.3168606347290348
Energy: 0.34742931610216804
Energy: 0.32723291831810625
Energy: 0.3135834448052212
Energy: 0.3676716942549232
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Energy: 0.31973434392208155
Energy: 0.3995560726815805
Energy: 0.371118568711617
Energy: 0.3223750628114888
Energy: 0.4231066516901267
Energy: 0.34856564873218693
Energy: 0.40812412638076906
Energy: 0.3091112662214494
Energy: 0.30430555732708897
Energy: 0.3966224811173675
Energy: 0.3251486785330139
Energy: 0.31531166536348587
Energy: 0.2602556934511469
Energy: 0.5171907671649814
Energy: 0.611913991976135
Energy: 0.25876596060258966
Energy: 0.43531228469836086
Energy: 0.7036399918776409
Energy: 0.24531594569895848
Energy: 0.5054554630658333
Energy: 0.5832520078327937
Energy: 0.24437906957604605
Energy: 0.44776293300371334
Energy: 0.6685733882371511
Energy: 0.3883112570367822
Energy: 0.3061887793214898
Energy: 0.3694042482704862
Energy: 0.38956028675323146
Energy: 0.32020472293736385
Energy: 0.4083001737563249
Energy: 0.3216283479181952
Energy: 0.386735578301351
Energy: 0.35713069681393883
Energy: 0.3491677077441919
Energy: 0.42075443890472825
Energy: 0.32576832080972296
Energy: 0.3780390871755404
Energy: 0.32728655765636067
Energy: 0.3223025168270992
Energy: 0.3723081012022402
Energy: 0.3787598605711002
Energy: 0.3461284296220996
Energy: 0.2663408796194589
Energy: 0.3790897901976567
Energy: 0.4124151280013538
Energy: 0.2639608528146226
Energy: 0.35960600026080003
Energy: 0.26151581858247097
Energy: 0.4401316812382003
Energy: 0.3394353898677771
Energy: 0.35706647772896705
Energy: 0.43477064889253386
Energy: 0.3256586126886002
Energy: 0.3775898469516403
Energy: 0.42264528079826913
Energy: 0.29983149975699047
Energy: 0.3090931768969972
Energy: 0.41336223306249964
Energy: 0.29534450762371506
Energy: 0.3302617834716389
Energy: 0.3622823736903841
Energy: 0.35710864762630345
Energy: 0.33478211429492744
Energy: 0.35662798846221366
Energy: 0.38045393184457493
Energy: 0.3240151148565406
Energy: 0.3639439497366755
Energy: 0.6675147296813834
Energy: 0.6073379189499613
Energy: 0.38005399587414346
Energy: 0.2602623663111269
Energy: 0.5414443627810711
Energy: 0.42259266436852694
Energy: 0.237687112731968
Energy: 0.2328519061454416
Energy: 0.44130660051646664
Energy: 0.24372765793906884
Energy: 0.7044874162098421
Energy: 0.46110022880929147
Energy: 0.4152570361578971
Energy: 0.37098568756387973
Energy: 0.36890156355894066
Energy: 0.4298251329790603
Energy: 0.404121295213866
Energy: 0.44930459376809617
Energy: 0.4814666507365066
Energy: 0.3295554609463373
Energy: 0.4237915614067413
Energy: 0.359008695437703
Energy: 0.34952934340750225

minimum gb energy = 0.23107796916489495 eV
minimum distance =  2.22211140606767 Angstroms
sigma value = 43


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

Energy: 0.34014304271244444
Energy: 0.5089405646813004
Energy: 0.4039744941511989
Energy: 0.33480587459947825
Energy: 0.4926864629089511
Energy: 0.2831969395066102
Energy: 0.5134343986236428
Energy: 0.3857923320057332
Energy: 0.41378297293730715
Energy: 0.5837025169137634
Energy: 0.36932837251174555
Energy: 0.4528174585233257
Energy: 0.3678622395697312
Energy: 0.39407607562955493
Energy: 0.37432166395689576
Energy: 0.37315666812899917
Energy: 0.41070569679212304
Energy: 0.4406457629642315
Energy: 0.28735014912633694
Energy: 0.3536404617669239
Energy: 0.4047481001421373
Energy: 0.2934827386390795
Energy: 0.3738762439690652
Energy: 0.3672207590978738
Energy: 0.2885262989745045
Energy: 0.3099052776327257
Energy: 0.29026900124332866
Energy: 0.28560146732961533
Energy: 0.329876169604641
Energy: 0.27774764200146224
Energy: 0.3637757944859139
Energy: 0.27955717406956254
Energy: 0.28448552025354507
Energy: 0.3567338556854717
Energy: 0.27970098397111
Energy: 0.29730454374903814
Energy: 0.39192923470585084
Energy: 0.30256065616085515
Energy: 0.3094013972072459
Energy: 0.38578243704699877
Energy: 0.30187395813892887
Energy: 0.32574755382860276
Energy: 0.34282546319735546
Energy: 0.3772615553899446
Energy: 0.418480931702614
Energy: 0.337792737165188
Energy: 0.3461572587856795
Energy: 0.46300712756317464
Energy: 0.3858900330568588
Energy: 0.40112648528210904
Energy: 0.37181445095394133
Energy: 0.3810256578225344
Energy: 0.43131950426701865
Energy: 0.35616071226973656
Energy: 0.4158082308320838
Energy: 0.39120865788921483
Energy: 0.3595314386164953
Energy: 0.44770328243915014
Energy: 0.4172320253982865
Energy: 0.3290715647668975
Energy: 0.39594242384975953
Energy: 0.4912909340980585
Energy: 0.44978320825398005
Energy: 0.4090841497930555
Energy: 0.3455983351060491
Energy: 0.56821767517342
Energy: 0.3121366822683548
Energy: 0.4207291740130877
Energy: 0.44983017499825667
Energy: 0.4682631961458842
Energy: 0.4010575685378809
Energy: 0.4854479238333627
Energy: 0.3289747811667831
Energy: 0.3999699330379516
Energy: 0.37648737419199624
Energy: 0.3240334093353638
Energy: 0.34608720969984724
Energy: 0.4230064517625325
Energy: 0.35124773362071227
Energy: 0.29433359115131946
Energy: 0.2882190107809948
Energy: 0.3440952204216839
Energy: 0.3072531795554228
Energy: 0.2935557952351001
Energy: 0.28630204932049075
Energy: 0.3544058858093221
Energy: 0.32906137134449104
Energy: 0.28641833438989756
Energy: 0.297106311407922
Energy: 0.3089695366833332
Energy: 0.3024971799390215
Energy: 0.2988535254649187
Energy: 0.28490628322447364
Energy: 0.2980068569918475
Energy: 0.3127354975799557
Energy: 0.2770560715306224
Energy: 0.2731858813524542
Energy: 0.41804238852573206
Energy: 0.37989593286608625
Energy: 0.2770590499876721
Energy: 0.29127011752744386
Energy: 0.34385759676988337
Energy: 0.3649684889493609
Energy: 0.3354533031365883
Energy: 0.3219616412307278
Energy: 0.35912460823945447
Energy: 0.35399798010005057
Energy: 0.32010840846458116
Energy: 0.3090501565836379
Energy: 0.4392347080377315
Energy: 0.5132160628988258
Energy: 0.30467838676966325
Energy: 0.38050299386288977
Energy: 0.38899601617706775
Energy: 0.31421911961853993
Energy: 0.4955336779027399
Energy: 0.5689984880250231
Energy: 0.31136052300626804
Energy: 0.43713799255875263
Energy: 0.4268525648120774
Energy: 0.39287732654459245
Energy: 0.5049439980480981
Energy: 0.46146727225062506
Energy: 0.3930293641659029
Energy: 0.45261546284548493
Energy: 0.42813908102100734
Energy: 0.3768323192430565
Energy: 0.3969889040336302
Energy: 0.36542649623097273
Energy: 0.40260469651221786
Energy: 0.2603218481543503
Energy: 0.3343009069063551
Energy: 0.3308439366777611
Energy: 0.4211867177743311
Energy: 0.38401420639695666
Energy: 0.33114627608516956
Energy: 0.4557537264905958
Energy: 0.35531376120348784
Energy: 0.34017360935415125
Energy: 0.34730959868193073
Energy: 0.360598202196945
Energy: 0.33557730074277997
Energy: 0.33914823588021464
Energy: 0.3789593753982317
Energy: 0.3916567280560092
Energy: 0.291549568893783
Energy: 0.3031020586545626
Energy: 0.3851809168035675
Energy: 0.2857866825309599
Energy: 0.321909332229848
Energy: 0.37721543087903947
Energy: 0.27267656114934985
Energy: 0.2822712680164082
Energy: 0.3694345090759695
Energy: 0.26876826243993907
Energy: 0.3005435806270935
Energy: 0.32335902665357963
Energy: 0.3256370308211009
Energy: 0.31019975435835667
Energy: 0.320414549989665
Energy: 0.34171099712094155
Energy: 0.3032847200777211
Energy: 0.3120936176898411
Energy: 0.4529978798921288
Energy: 0.413906201337672
Energy: 0.3159366789268218
Energy: 0.4845802846538589
Energy: 0.37737345754246215
Energy: 0.3679172677710703
Energy: 0.39791314759617974
Energy: 0.3710386849579698
Energy: 0.3834620873826512
Energy: 0.2623687454106154
Energy: 0.3463810950457736
Energy: 0.48846401317827837
Energy: 0.3925366580637928
Energy: 0.3855324648866922
Energy: 0.4780264096314834
Energy: 0.4050232307477118
Energy: 0.39515911525939257
Energy: 0.33492856125924514
Energy: 0.5955252552354788
Energy: 0.3986855468295302
Energy: 0.32979732438587306
Energy: 0.4932211311629789
Energy: 0.44853047947380625

minimum gb energy = 0.2603218481543503 eV
minimum distance =  1.62589553527609 Angstroms
sigma value = 57


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

Energy: 0.19780530875101437
Energy: 0.3657171414285843
Energy: 0.4212978267579115
Energy: 0.19795780949116065
Energy: 0.49560497701511297
Energy: 0.4768054056730165
Energy: 0.3858211025641619
Energy: 0.3986076177676991
Energy: 0.4252818831293184
Energy: 0.593586170913338
Energy: 0.38302180641194733
Energy: 0.4647908381595352
Energy: 0.3945205976812116
Energy: 0.2745995812997688
Energy: 0.26956044368310905
Energy: 0.40491115963209906
Energy: 0.280825624381562
Energy: 0.27140666825387044
Energy: 0.33047822618565187
Energy: 0.2773921641733186
Energy: 0.2710906992194111
Energy: 0.33920451132973467
Energy: 0.2842941231457269
Energy: 0.44384611222037357
Energy: 0.37565868146945686
Energy: 0.341699901254993
Energy: 0.32797872818302354
Energy: 0.3676783387358393
Energy: 0.35554037683397627
Energy: 0.3238637893674773
Energy: 0.3123452042697469
Energy: 0.33104048345597514
Energy: 0.35974360535888494
Energy: 0.5010283792311635
Energy: 0.3107670074432659
Energy: 0.3932215016425691
Energy: 0.45841280353019626
Energy: 0.33454305397515954
Energy: 0.3418499177673757
Energy: 0.45045474236565236
Energy: 0.3334995974126506
Energy: 0.36407504117408085
Energy: 0.2391192005196772
Energy: 0.4123765775389958
Energy: 0.4583768597667815
Energy: 0.23874187490600715
Energy: 0.3772878377463133
Energy: 0.5067863608417578
Energy: 0.40311086939577473
Energy: 0.4064117326348079
Energy: 0.3757332191068978
Energy: 0.3977135938734467
Energy: 0.4415183453927527
Energy: 0.3616229218429596
Energy: 0.41290047984579425
Energy: 0.26559928800784105
Energy: 0.25079113183546736
Energy: 0.44780920949913283
Energy: 0.2793921898553691
Energy: 0.24049405740953592
Energy: 0.4267191331182389
Energy: 0.2393153321540388
Energy: 0.6467336440247631
Energy: 0.43388811596944377
Energy: 0.2439930263108732
Energy: 0.5774201852437684
Energy: 0.4854865112010323
Energy: 0.5173698072614143
Energy: 0.5867372415187977
Energy: 0.4765757164709481
Energy: 0.4615426889828025
Energy: 0.3889886427391707
Energy: 0.5730568575101995
Energy: 0.5624853521382545
Energy: 0.40978361350689146
Energy: 0.5632533350120276
Energy: 0.4636940021273433
Energy: 0.45588629098945144
Energy: 0.43820338860202157
Energy: 0.40578083065694664
Energy: 0.3881964793648541
Energy: 0.43121031505915847
Energy: 0.42856349175015596
Energy: 0.38537684848391524
Energy: 0.3508224246381724
Energy: 0.27341754188239353
Energy: 0.2625988197583724
Energy: 0.3679892917084612
Energy: 0.28500267129223755
Energy: 0.2572535382920527
Energy: 0.3450949437486939
Energy: 0.40164475749031464
Energy: 0.37360967994835104
Energy: 0.3410790050393408
Energy: 0.429392310955581
Energy: 0.35194854360928063
Energy: 0.41722062843776875
Energy: 0.36359028332600046
Energy: 0.3635261968919877
Energy: 0.41271393463704087
Energy: 0.3663660335438165
Energy: 0.3689960689460241
Energy: 0.46942883135185154
Energy: 0.31959096117961416
Energy: 0.33560690909408786
Energy: 0.4560537768299821
Energy: 0.3115832308051682
Energy: 0.3598762816185866
Energy: 0.5718366288815268
Energy: 0.350683625914185
Energy: 0.38798657433712
Energy: 0.5577630311149184
Energy: 0.3236389062635546
Energy: 0.4311610873860098
Energy: 0.567539110674657
Energy: 0.42155075989500823
Energy: 0.44417112503582823
Energy: 0.55980002655202
Energy: 0.4057769431303534
Energy: 0.47166739507565314
Energy: 0.38579574086028345
Energy: 0.5727040716951791
Energy: 0.5156862748358115
Energy: 0.3869209972269602
Energy: 0.6242970267001573
Energy: 0.4654648132375529
Energy: 0.4321898285838544
Energy: 0.2638196212653339
Energy: 0.24907269718757935
Energy: 0.46880624435078466
Energy: 0.2787194112741477
Energy: 0.23921235276724057
Energy: 0.4595152787197844
Energy: 0.5099241112673453
Energy: 0.4705205751701297
Energy: 0.45592546545896134
Energy: 0.5512387907502904
Energy: 0.44722009073082863
Energy: 0.576173456515635
Energy: 0.5969588935743292
Energy: 0.4110623440000005
Energy: 0.5662384460443483
Energy: 0.5025206098651271
Energy: 0.4577994136836006

minimum gb energy = 0.19780530875101437 eV
minimum distance =  1.94486245168989 Angstroms
sigma value = 17


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

Energy: 0.2787719833723359
Energy: 0.4264692094302129
Energy: 0.503151072210123
Energy: 0.2746260054787379
Energy: 0.485451784041587
Energy: 0.23809549166905722
Energy: 0.45011263099661114
Energy: 0.3907175868859177
Energy: 0.41413416854598234
Energy: 0.5891603083732104
Energy: 0.3797109072157674
Energy: 0.4523471099066086
Energy: 0.391495976931377
Energy: 0.3987796030420687
Energy: 0.37477020022192276
Energy: 0.4040803928351802
Energy: 0.4173519471117578
Energy: 0.3534587912128384
Energy: 0.32129589818314214
Energy: 0.3725805815725932
Energy: 0.34531510219616696
Energy: 0.334540182809397
Energy: 0.39465706252224403
Energy: 0.46696163963249715
Energy: 0.39832905246289046
Energy: 0.33199311535292697
Energy: 0.32651466047845246
Energy: 0.389469585374269
Energy: 0.34435410395902194
Energy: 0.3312687977969388
Energy: 0.3202735900527891
Energy: 0.33198288834581585
Energy: 0.3755292665523956
Energy: 0.31413404117615107
Energy: 0.2975084338281663
Energy: 0.26160342300467615
Energy: 0.34006639323522647
Energy: 0.2885029743746546
Energy: 0.2806798560938866
Energy: 0.3335941273966099
Energy: 0.30330346396481556
Energy: 0.2858568039904986
Energy: 0.3429948834896306
Energy: 0.3522517304576336
Energy: 0.3355378022958462
Energy: 0.3383073576804505
Energy: 0.3672464859393447
Energy: 0.3262611010434692
Energy: 0.3038769722092011
Energy: 0.32429847887375257
Energy: 0.3041205081517127
Energy: 0.300371086078888
Energy: 0.3451035438037615
Energy: 0.2908554458018232
Energy: 0.28693942561647695
Energy: 0.44196549692409126
Energy: 0.39931489527659775
Energy: 0.28991135166521864
Energy: 0.47785462398157114
Energy: 0.3595856133186398
Energy: 0.37564254023167887
Energy: 0.3467186044119741
Energy: 0.33480618676837576
Energy: 0.3712289364065687
Energy: 0.3613756207400081
Energy: 0.3335852543305647
Energy: 0.2706213404838201
Energy: 0.3724594332861924
Energy: 0.4175786731654826
Energy: 0.2684519062864313
Energy: 0.3397091544032631
Energy: 0.46631822835007936
Energy: 0.28343304981985346
Energy: 0.45039244720742483
Energy: 0.5059515669282354
Energy: 0.27960897874699264
Energy: 0.4050279955094276
Energy: 0.5639603064844138
Energy: 0.37538865692327167
Energy: 0.4868978639157963
Energy: 0.44187503985861404
Energy: 0.37600196597531566
Energy: 0.5300849650626632
Energy: 0.4078961202934273
Energy: 0.41970331814395406
Energy: 0.4238786055268821
Energy: 0.3852637979393918
Energy: 0.4512113290536148
Energy: 0.4541337297833218
Energy: 0.3463856175774569
Energy: 0.41439635725815405
Energy: 0.5782958122622264
Energy: 0.5254172350703628
Energy: 0.4179275654249441
Energy: 0.6287097807495136
Energy: 0.4827399659779846
Energy: 0.2544436427548296
Energy: 0.5521828962747983
Energy: 0.4571678586330873
Energy: 0.25178579848091465
Energy: 0.4747318580193684
Energy: 0.5123719901759899

minimum gb energy = 0.23809549166905722 eV
minimum distance =  1.71174895367895 Angstroms
sigma value = 17


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

Energy: 0.40152494848793574
Energy: 0.4558153947903253
Energy: 0.29066120266802986
Energy: 0.39423757914428526
Energy: 0.4787093668160794
Energy: 0.31949467625818495
Energy: 0.48252843038236964
Energy: 0.3926707774208396
Energy: 0.4162677615662381
Energy: 0.5857959258781262
Energy: 0.38019702141963346
Energy: 0.4522902577004914
Energy: 0.391361258430509
Energy: 0.25166118704489127
Energy: 0.45052711868249185
Energy: 0.4075925872223021
Energy: 0.2565603740732542
Energy: 0.41635650901557764
Energy: 0.3278694108763308
Energy: 0.45070380049047304
Energy: 0.41326483743089293
Energy: 0.34282371648701676
Energy: 0.4806043192303565
Energy: 0.3772669193242735
Energy: 0.4306547722221062
Energy: 0.34908983877854943
Energy: 0.34769722959856963
Energy: 0.4217327995566915
Energy: 0.355025694081628
Energy: 0.356344951256325
Energy: 0.41056776093147324
Energy: 0.3604938310040695
Energy: 0.3000552752267369
Energy: 0.40391839351268194
Energy: 0.31604697083614847
Energy: 0.32901205181871823
Energy: 0.3562509158087766
Energy: 0.2869439866548415
Energy: 0.28338982269881846
Energy: 0.3488153319595397
Energy: 0.29677244208023484
Energy: 0.2915819434561859
Energy: 0.3072653323352891
Energy: 0.2721932816288251
Energy: 0.3659587412870796
Energy: 0.30992252484653354
Energy: 0.28594378166973705
Energy: 0.3437128330316142
Energy: 0.2901392787267713
Energy: 0.3399294767483818
Energy: 0.31943421846505266
Energy: 0.2893475916260023
Energy: 0.3571620818374776
Energy: 0.3021751192021363
Energy: 0.2905040807184432
Energy: 0.32051795409640377
Energy: 0.2983712917332758
Energy: 0.2894843411174775
Energy: 0.3422233487961797
Energy: 0.2847968867817823
Energy: 0.38214219549876804
Energy: 0.2727671647306662
Energy: 0.2844178164449073
Energy: 0.3739557498165663
Energy: 0.26916979760343496
Energy: 0.30355472965846697
Energy: 0.3693042836677346
Energy: 0.28414013026295704
Energy: 0.28944086631836485
Energy: 0.3624183583305381
Energy: 0.28465353824595796
Energy: 0.30382466907165795
Energy: 0.39380501692741365
Energy: 0.3254716022991702
Energy: 0.32788291607954156
Energy: 0.38812489379347026
Energy: 0.32849886035167175
Energy: 0.3376747916965012
Energy: 0.30551992298161007
Energy: 0.32821006933217706
Energy: 0.3063122908576037
Energy: 0.3020294936302888
Energy: 0.35061625824143045
Energy: 0.2922032952913584
Energy: 0.29309402436650234
Energy: 0.27131033400262405
Energy: 0.2546380194423625
Energy: 0.30483681017984693
Energy: 0.28718302229665327
Energy: 0.43208694092281924
Energy: 0.368441750385592
Energy: 0.3553117244592865
Energy: 0.3370447564471921
Energy: 0.36238588113629233
Energy: 0.3785534490903851
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Energy: 0.36684227683383647
Energy: 0.41579872283414665
Energy: 0.48509598233041595
Energy: 0.3609793307229155
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Energy: 0.30316718139917676
Energy: 0.36102480490537453
Energy: 0.4539378048350705
Energy: 0.508315520950902
Energy: 0.35651279374276196
Energy: 0.41260012579770966
Energy: 0.3126982632543028
Energy: 0.37337412905182066
Energy: 0.5724054638703026
Energy: 0.5142821099902181
Energy: 0.3772937602321221
Energy: 0.3762502146997426
Energy: 0.4627191381353457
Energy: 0.41828007953485224
Energy: 0.259486878876929
Energy: 0.2438017989365288
Energy: 0.45240956198668025
Energy: 0.2731187349001036
Energy: 0.42563481071013093
Energy: 0.4382607401986367
Energy: 0.4946221505162731
Energy: 0.454260569405475
Energy: 0.4338330628064506
Energy: 0.5343755416691915
Energy: 0.42898315504085915
Energy: 0.37411652505789283
Energy: 0.5707599682736877
Energy: 0.5203242057695772
Energy: 0.36767420394378597
Energy: 0.48142984822838475
Energy: 0.3054009949586318
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Energy: 0.5600823800611743
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Energy: 0.41744797353680624
Energy: 0.5041025125617706
Energy: 0.39311667679096796
Energy: 0.3974258377992772
Energy: 0.4900369824562226
Energy: 0.39587880718084945
Energy: 0.4207234691386737
Energy: 0.45330511121142564
Energy: 0.3398843775022976
Energy: 0.2529778248613132
Energy: 0.4692179521663596
Energy: 0.3622310338608425
Energy: 0.26488550243066294
Energy: 0.41916668454235084
Energy: 0.3453869333304917
Energy: 0.36337883288683137
Energy: 0.33786255454906633
Energy: 0.3416880080728472
Energy: 0.38986374833205806
Energy: 0.32335767492404943
Energy: 0.4001888355739706
Energy: 0.38068952489321684
Energy: 0.4288289826804673
Energy: 0.39365179076271023
Energy: 0.3455847422997292
Energy: 0.33010519732968346
Energy: 0.3271633204786726
Energy: 0.3179451606347988
Energy: 0.33526537757095876
Energy: 0.3225218489296309
Energy: 0.30651838961309297
Energy: 0.36039613538425364
Energy: 0.3375767444427877
Energy: 0.34154072703886273
Energy: 0.3279189399081816
Energy: 0.3347682133182448
Energy: 0.3570332170297357
Energy: 0.3215703783473056
Energy: 0.2651627169218925
Energy: 0.280054103552548
Energy: 0.36443542205061763
Energy: 0.2710044246488633
Energy: 0.2967430322739513
Energy: 0.3316881566095065
Energy: 0.2841876275667788
Energy: 0.2958115785679967
Energy: 0.2774870799043405
Energy: 0.2815019512296612
Energy: 0.31431795282469027
Energy: 0.26673936021985034
Energy: 0.37545601389197486
Energy: 0.2907960458230363
Energy: 0.2970213564468325
Energy: 0.3696746559633076
Energy: 0.29154302765686896
Energy: 0.3107573033467803
Energy: 0.3202476246731002
Energy: 0.28044880619794804
Energy: 0.27292142144039966
Energy: 0.31594854831152147
Energy: 0.2915809485676661
Energy: 0.2769132447066793
Energy: 0.4415095366790643
Energy: 0.2983173584574087
Energy: 0.32070925048415533
Energy: 0.4334988030831085
Energy: 0.285683446770753
Energy: 0.3489542017652678
Energy: 0.30781669154225066
Energy: 0.30996382714684284
Energy: 0.2903835786799413
Energy: 0.3032827286181642
Energy: 0.33071218040743633
Energy: 0.280295867379686
Energy: 0.2880157378131171
Energy: 0.2612480403542471
Energy: 0.4449833340429177
Energy: 0.2973581655300185
Energy: 0.27454458700551465
Energy: 0.3984344799513689
Energy: 0.361101629067698
Energy: 0.44839975971626417
Energy: 0.41978743488987
Energy: 0.3624352683707865
Energy: 0.47339746063366744
Energy: 0.3962487211480081
Energy: 0.3156847858393399
Energy: 0.35529255742259075
Energy: 0.38465881124574136
Energy: 0.5388560824772036
Energy: 0.33581548923434085
Energy: 0.42267411539968114
Energy: 0.40061271892333156
Energy: 0.46876165265836306
Energy: 0.30411412851677366
Energy: 0.3941191456689046
Energy: 0.40279415506072136
Energy: 0.327836399312001
Energy: 0.43071498050514945
Energy: 0.4097451199053619
Energy: 0.385286798918734
Energy: 0.4238675739122638
Energy: 0.43606311092920147
Energy: 0.37651373449553066
Energy: 0.40529194822323045
Energy: 0.2522648485629883
Energy: 0.46184820133487836
Energy: 0.43776750827842736
Energy: 0.26520825963986916
Energy: 0.41268774668851055
Energy: 0.409626056288124
Energy: 0.3986133252943503
Energy: 0.37155309041780915
Energy: 0.42193887998655133
Energy: 0.4218681559272383
Energy: 0.5721402461697889
Energy: 0.3159808327270281
Energy: 0.48421733545795675
Energy: 0.5492883463343969
Energy: 0.3117088957313921
Energy: 0.43477187972872605
Energy: 0.4795388911801469

minimum gb energy = 0.2438017989365288 eV
minimum distance =  1.7628395302643 Angstroms
sigma value = 57


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

Energy: 0.278233586233832
Energy: 0.47765509084104524
Energy: 0.34647767517406614
Energy: 0.27391453535851584
Energy: 0.47611082834158214
Energy: 0.39065932716354623
Energy: 0.5045815185265781
Energy: 0.3936802911197033
Energy: 0.4166014931946428
Energy: 0.5851276915322278
Energy: 0.382299577394492
Energy: 0.45194953544304106
Energy: 0.3923737466124111
Energy: 0.31121886855985736
Energy: 0.29662439620613595
Energy: 0.41005523911670755
Energy: 0.32372898792871396
Energy: 0.45978120461563493
Energy: 0.33639770743056224
Energy: 0.2941783203273395
Energy: 0.4650127321398152
Energy: 0.3519847582904212
Energy: 0.3091598617458825
Energy: 0.4185505863652449
Energy: 0.3570699754229425
Energy: 0.36026183961611963
Energy: 0.3634373390191064
Energy: 0.3513764554220693
Energy: 0.36296413613202716
Energy: 0.37674655495295567
Energy: 0.27717802797137536
Energy: 0.39033850802179126
Energy: 0.3513366285860506
Energy: 0.2735505992094629
Energy: 0.33616040436043276
Energy: 0.3934472112941741
Energy: 0.38209751165757294
Energy: 0.29555358419871175
Energy: 0.29464376787759533
Energy: 0.37309579000706916
Energy: 0.30253913708066943
Energy: 0.30579540413201983
Energy: 0.3143019883937656
Energy: 0.32907476556734977
Energy: 0.3101766271917791
Energy: 0.31989579061717627
Energy: 0.34751948905344054
Energy: 0.3850086515754193
Energy: 0.28733473734770726
Energy: 0.37900910045631453
Energy: 0.35168338541757665
Energy: 0.289516510648326
Energy: 0.3076975484299264
Energy: 0.32668678157455433
Energy: 0.31991697340324904
Energy: 0.3054936471158025
Energy: 0.2936759266428112
Energy: 0.3163508584330474
Energy: 0.3199464743915006
Energy: 0.2903362362315613
Energy: 0.3146701675958646
Energy: 0.2778964295823547
Energy: 0.30035361426453927
Energy: 0.3083156983768101
Energy: 0.2624241784559434
Energy: 0.3287929110455634
Energy: 0.3111249006279821
Energy: 0.2619729155880752
Energy: 0.25750902018195243
Energy: 0.3054040640442351
Energy: 0.27151829656418
Energy: 0.2629710361822107
Energy: 0.29937034473726565
Energy: 0.31628586333375036
Energy: 0.29857062515507465
Energy: 0.29694787394396727
Energy: 0.3340735683718753
Energy: 0.288879233428934
Energy: 0.2892340962518714
Energy: 0.2834189843357417
Energy: 0.27063276556098287
Energy: 0.2846833443958109
Energy: 0.2961391391642279
Energy: 0.2635813519133612
Energy: 0.2657911771880427
Energy: 0.3653519012025621
Energy: 0.3336441167548163
Energy: 0.2675996033070682
Energy: 0.39337749093119306
Energy: 0.30673657834866774
Energy: 0.335786446381304
Energy: 0.2741410984321043
Energy: 0.27022942491450264
Energy: 0.3289154604347102
Energy: 0.2837429637264237
Energy: 0.27691576049323474
Energy: 0.27709910696983725
Energy: 0.3051501388447442
Energy: 0.3313986822183858
Energy: 0.2733504121542391
Energy: 0.28646775123049406
Energy: 0.36302438621661354
Energy: 0.43625088270910833
Energy: 0.34267068075067797
Energy: 0.3526262439887442
Energy: 0.43013687939204387
Energy: 0.3382602249765436
Energy: 0.36902511757770706
Energy: 0.305798981361424
Energy: 0.38760493130228774
Energy: 0.35564410826440346
Energy: 0.30552348058955464
Energy: 0.4163767078159637
Energy: 0.32970942044295976
Energy: 0.31709055747152504
Energy: 0.3362270511391931
Energy: 0.3118685317218125
Energy: 0.3321939418683978
Energy: 0.3573215726998012
Energy: 0.487330421022352
Energy: 0.38586963717605066
Energy: 0.35192169295056347
Energy: 0.3347918122443307
Energy: 0.37907679474354095
Energy: 0.3736822311504172
Energy: 0.33182992078092705
Energy: 0.2677126053065715
Energy: 0.45263937430022627
Energy: 0.33732117308595616
Energy: 0.2639549786612941
Energy: 0.38351875846611794
Energy: 0.3727635205412872
Energy: 0.406616105618183
Energy: 0.4426455331105721
Energy: 0.4890925545878456
Energy: 0.40060094477872626
Energy: 0.40884588960885854
Energy: 0.5413522723719328
Energy: 0.37584547238997157
Energy: 0.42990704934968005
Energy: 0.5908510718854678
Energy: 0.3856156257332178
Energy: 0.4613713342777487
Energy: 0.5236390823300732
Energy: 0.42062927610771755
Energy: 0.32677761530424165
Energy: 0.3023934734136632
Energy: 0.45340292799646886
Energy: 0.34712248261016954
Energy: 0.475537866093345
Energy: 0.4788975907751686
Energy: 0.4428996339900774
Energy: 0.4192979394411963
Energy: 0.47082712674004645
Energy: 0.46950417286034135
Energy: 0.41354390548587444
Energy: 0.2710761864598199
Energy: 0.5812407084850618
Energy: 0.342120601047954
Energy: 0.26708126727503056
Energy: 0.48193951946496444
Energy: 0.3813519568738378

minimum gb energy = 0.25750902018195243 eV
minimum distance =  1.77338323587527 Angstroms
sigma value = 43


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

Energy: 0.27417331959966135
Energy: 0.5030641056481743
Energy: 0.4293386702227061
Energy: 0.26988648267422366
Energy: 0.47257718649160974
Energy: 0.3255816138488951
Energy: 0.530012610395375
Energy: 0.39584025934480405
Energy: 0.4173086995822901
Energy: 0.584116099926349
Energy: 0.38578740434856923
Energy: 0.4515711411827228
Energy: 0.393532900887081
Energy: 0.28039022400620356
Energy: 0.3897352533772742
Energy: 0.4132888341429272
Energy: 0.29166513580586134
Energy: 0.3603110188535308
Energy: 0.3491674053256594
Energy: 0.3936906713485981
Energy: 0.36272313365902986
Energy: 0.36645448166728695
Energy: 0.27874773603304936
Energy: 0.47357446581611146
Energy: 0.42532592131734387
Energy: 0.3742152166032142
Energy: 0.3845303103190815
Energy: 0.41674675869894023
Energy: 0.37157471657563107
Energy: 0.40455724955664396
Energy: 0.26653599801264416
Energy: 0.431013914727274
Energy: 0.4290504153360175
Energy: 0.2627316044332476
Energy: 0.3642799298154196
Energy: 0.32370606532598956
Energy: 0.41974623938756367
Energy: 0.31407344247474095
Energy: 0.31534273511335326
Energy: 0.40945499770303895
Energy: 0.3188507325537735
Energy: 0.32939208739678444
Energy: 0.33258400770773033
Energy: 0.29115400780341055
Energy: 0.4076787325356626
Energy: 0.34300565567878605
Energy: 0.30387686238723577
Energy: 0.3749450632647219
Energy: 0.29342367251117435
Energy: 0.374800065574395
Energy: 0.4124735760030083
Energy: 0.29907944266353725
Energy: 0.3977000594109606
Energy: 0.3737174256297651
Energy: 0.38858929592514785
Energy: 0.3258912711129292
Energy: 0.32469549827259775
Energy: 0.38205483227053244
Energy: 0.3312026502648509
Energy: 0.3319793335769554
Energy: 0.27740649656815874
Energy: 0.31622801839614756
Energy: 0.35880481861920815
Energy: 0.273646079974623
Energy: 0.2840669972076494
Energy: 0.32714272117717386
Energy: 0.3193610910904323
Energy: 0.26657815867668416
Energy: 0.2614209057758588
Energy: 0.31261029085069764
Energy: 0.2776881250866415
Energy: 0.2664095723278477
Energy: 0.2780778692092415
Energy: 0.3092741292574115
Energy: 0.3546844578741755
Energy: 0.2808516508944783
Energy: 0.32922910964709934
Energy: 0.32700217627582623
Energy: 0.27872654595595714
Energy: 0.3057593350175708
Energy: 0.28927394230657555
Energy: 0.2769679118504073
Energy: 0.3201608408753169
Energy: 0.2769288649010582
Energy: 0.29876243131695884
Energy: 0.2953032671772124
Energy: 0.28219735584386935
Energy: 0.2956925670967843
Energy: 0.30990333283948124
Energy: 0.2769031584333481
Energy: 0.3010468857075459
Energy: 0.2595970359003674
Energy: 0.2721891089197323
Energy: 0.3574888558805648
Energy: 0.25235285523674866
Energy: 0.29160608340360994
Energy: 0.3107427196850601
Energy: 0.2504726732109279
Energy: 0.2499352429016341
Energy: 0.3046806760806958
Energy: 0.2557870259577164
Energy: 0.25826738870935895
Energy: 0.2732690026476325
Energy: 0.3063223923207981
Energy: 0.2857926855249293
Energy: 0.27158391324905967
Energy: 0.3263070224645171
Energy: 0.27250082535222114
Energy: 0.279705312144587
Energy: 0.26850954847458397
Energy: 0.2584430337150749
Energy: 0.2755175889280508
Energy: 0.27860238635958323
Energy: 0.2534425005845179
Energy: 0.26584067749981555
Energy: 0.3298647690706364
Energy: 0.3042516119007508
Energy: 0.26573086511190486
Energy: 0.353506554185753
Energy: 0.28454997688097183
Energy: 0.31016588903921233
Energy: 0.25417523734092845
Energy: 0.25167189649367366
Energy: 0.3037594422717581
Energy: 0.26248382022810307
Energy: 0.25836446717591477
Energy: 0.41298432848415995
Energy: 0.276210031702936
Energy: 0.29791512511473645
Energy: 0.40492513808200975
Energy: 0.2614412339293821
Energy: 0.3253907268130981
Energy: 0.33941881929215695
Energy: 0.30877498610476456
Energy: 0.30163642773005894
Energy: 0.3351670586735146
Energy: 0.3185765017015301
Energy: 0.30262281619937076
Energy: 0.28442834592548716
Energy: 0.3473936908061192
Energy: 0.32318719970081
Energy: 0.2844888931419478
Energy: 0.36767979194501793
Energy: 0.3030635585219843
Energy: 0.29454140167966003
Energy: 0.302963041596894
Energy: 0.41930587621883453
Energy: 0.3007019850030226
Energy: 0.3205283328152564
Energy: 0.3804298124066451
Energy: 0.34972615741980867
Energy: 0.2863132404365698
Energy: 0.28018443096138235
Energy: 0.34180711664735347
Energy: 0.2979444825365933
Energy: 0.28582819172385815
Energy: 0.2703379360495216
Energy: 0.36058452904480587
Energy: 0.419478203226294
Energy: 0.266542116545945
Energy: 0.3146352059704972
Energy: 0.32207958419630156
Energy: 0.384188779225347
Energy: 0.3540042239108608
Energy: 0.36219416799786736
Energy: 0.4509200826978013
Energy: 0.3521053668242753
Energy: 0.3788435528775149
Energy: 0.31564503541964267
Energy: 0.3725245795471981
Energy: 0.4841430355004927
Energy: 0.324144790372237
Energy: 0.3956743578106868
Energy: 0.43230516607113983
Energy: 0.3588420250085761
Energy: 0.28988083089170186
Energy: 0.40616757529619874
Energy: 0.3750755565228178
Energy: 0.30270037625367524
Energy: 0.37282084697491913
Energy: 0.47313280373579636
Energy: 0.3475757087281552
Energy: 0.3498171901917884
Energy: 0.46130429474126583
Energy: 0.35256813819781985
Energy: 0.36677188331147303
Energy: 0.269672830566642
Energy: 0.4983667010517522
Energy: 0.42898135607232163
Energy: 0.26567319594423705
Energy: 0.4126342148977003
Energy: 0.32439531754354084
Energy: 0.4280052548110876
Energy: 0.40604904632081334
Energy: 0.427689686227606
Energy: 0.4189400646404469
Energy: 0.39487485663246213
Energy: 0.4594150120226156
Energy: 0.3903260693489747
Energy: 0.3928069113508085
Energy: 0.36233364152699127
Energy: 0.4126248209142195
Energy: 0.2775756139560228
Energy: 0.4738415317814671
Energy: 0.41491589336463325
Energy: 0.2766649713350712
Energy: 0.3835959001834634
Energy: 0.44142675108204354
Energy: 0.2900511472666283
Energy: 0.351544571902039
Energy: 0.6067282784600192
Energy: 0.4148007852648991
Energy: 0.43160918810370624
Energy: 0.5911112966642756
Energy: 0.4089771917647454
Energy: 0.4619601600046783

minimum gb energy = 0.2499352429016341 eV
minimum distance =  1.91432880311027 Angstroms
sigma value = 81


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

Energy: 0.02447174934511967
Energy: 0.14831988993832063
Energy: 0.14415161300045193
Energy: 0.011056109976553059
Energy: 0.8121884449049954
Energy: 0.1044364261579133
Energy: 0.1542644823883567
Energy: 0.6173454904192536
Energy: 0.6739381186804179
Energy: 1.0354123751733342
Energy: 0.521351901219806
Energy: 0.8428265373375372
Energy: 0.6626440552233392
Energy: 0.10526483566663784
Energy: 0.13764709860442095
Energy: 0.7129091044109002
Energy: 0.07861536597243259
Energy: 0.16639767368048883
Energy: 0.48772146746006323
Energy: 0.11828492856072335
Energy: 0.14069784127010684
Energy: 0.5516608843201458
Energy: 0.10130562015737336
Energy: 0.15998100480297675
Energy: 0.15577442088981042
Energy: 0.6990922267313034
Energy: 0.7894167257897511
Energy: 0.15722257498410122
Energy: 0.6261000593776375
Energy: 0.8766898919178555
Energy: 0.0010877991428612393
Energy: 0.9883399512904824
Energy: 0.1441851193106607
Energy: 0.014404901646279103
Energy: 0.7794645883056887
Energy: 0.11334710473210605
Energy: 0.9369472920305251
Energy: 0.5947567608018803
Energy: 0.6380648669131693
Energy: 0.9167623800172163
Energy: 0.5639912118453849
Energy: 0.6986428014167726
Energy: 0.6674778653992859
Energy: 0.08942960943652088
Energy: 0.1258278664571909
Energy: 0.737263344280819
Energy: 0.05851313812438162
Energy: 0.15745503434898414
Energy: 0.4698570686056565
Energy: 0.1341221716928983
Energy: 0.15087775669753078
Energy: 0.5069611424325989
Energy: 0.12305680235583781
Energy: 0.16669767636685048
Energy: 0.1252919681928672
Energy: 0.8093151310741545
Energy: 0.8790999696962931
Energy: 0.14294361037620368
Energy: 0.6558511664607294
Energy: 1.1083688737556072

minimum gb energy = 0.0010877991428612393 eV
minimum distance =  1.65368498282659 Angstroms
sigma value = 3


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

Energy: 0.370163372488074
Energy: 0.4958134450422686
Energy: 0.40543076573998954
Energy: 0.36324173619029687
Energy: 0.47273697234909795
Energy: 0.29430917678003815
Energy: 0.5192843095730133
Energy: 0.4155387608275721
Energy: 0.43253913404443334
Energy: 0.5923818514487549
Energy: 0.4094314886780859
Energy: 0.46292271153056447
Energy: 0.40862934351292046
Energy: 0.38170521495714116
Energy: 0.3511697580270211
Energy: 0.4354249755552252
Energy: 0.40676680756750827
Energy: 0.4854582881405057
Energy: 0.40571736792209157
Energy: 0.3628424961674413
Energy: 0.3384550752838329
Energy: 0.42735129387298143
Energy: 0.3829639783997269
Energy: 0.4645267825864919
Energy: 0.41931671624665395
Energy: 0.3861765874961945
Energy: 0.41323370218313565
Energy: 0.40975401306802284
Energy: 0.3707802039805187
Energy: 0.4507715704554982
Energy: 0.36503389324490576
Energy: 0.49583398465334
Energy: 0.4093688198409675
Energy: 0.35880642282139263
Energy: 0.4127979740456832
Energy: 0.2966729860403964
Energy: 0.44343165305434745
Energy: 0.3647370674208044
Energy: 0.35691265028029423
Energy: 0.4339037962551378
Energy: 0.37789430260835083
Energy: 0.3630885094153004
Energy: 0.32815465214629336
Energy: 0.4021143466044754
Energy: 0.3688161018264479
Energy: 0.3445956241572828
Energy: 0.27129129370297483
Energy: 0.3360470253114994
Energy: 0.35547448642310847
Energy: 0.3468112361364053
Energy: 0.4751059877736289
Energy: 0.3603917699634278
Energy: 0.36282062882417715
Energy: 0.435714532568186
Energy: 0.44745419124144364
Energy: 0.314068385767819
Energy: 0.329842060981653
Energy: 0.43808188809506565
Energy: 0.3059407577249817
Energy: 0.3541602327141869
Energy: 0.3660731382601468
Energy: 0.35681493822023286
Energy: 0.40621756364509876
Energy: 0.3595615070888676
Energy: 0.3191831297439985
Energy: 0.2993802257747524
Energy: 0.3093309672957146
Energy: 0.30015166534111654
Energy: 0.28325068808279114
Energy: 0.3038753518141076
Energy: 0.31959194940572283
Energy: 0.2760328442269986
Energy: 0.2694961503796099
Energy: 0.27751137631018674
Energy: 0.38819106648024826
Energy: 0.2755220086454246
Energy: 0.29207577414555
Energy: 0.3507802187370926
Energy: 0.3294751275625352
Energy: 0.3256399679330069
Energy: 0.3116370300187809
Energy: 0.32565818817253317
Energy: 0.3400990538279908
Energy: 0.30551569064862427
Energy: 0.3174008235544528
Energy: 0.2741570419060761
Energy: 0.27245651528076664
Energy: 0.31369786877935607
Energy: 0.27960596128887766
Energy: 0.27913504963918945
Energy: 0.3821733631322805
Energy: 0.28543852766929134
Energy: 0.29352169412665957
Energy: 0.3743385811421541
Energy: 0.28301023418939575
Energy: 0.3091130326582163
Energy: 0.26916987438834084
Energy: 0.2762031161712236
Energy: 0.2618137113054631
Energy: 0.265496529282916
Energy: 0.29135692671885594
Energy: 0.25288908196222604
Energy: 0.2558516775575709
Energy: 0.3085457558801859
Energy: 0.2853655575819047
Energy: 0.2555984395287449
Energy: 0.3304003589648505
Energy: 0.2674122941468738
Energy: 0.36437312182012727
Energy: 0.26339991374206795
Energy: 0.27277532659291787
Energy: 0.35641859013787575
Energy: 0.2594632824692144
Energy: 0.2895992498336147
Energy: 0.28263802635597324
Energy: 0.25836223322790686
Energy: 0.2509702584224911
Energy: 0.2787506319745811
Energy: 0.2696335748384152
Energy: 0.2519646843364332
Energy: 0.30131528282588105
Energy: 0.3276969730889148
Energy: 0.3088231647244449
Energy: 0.2992890003941083
Energy: 0.3467767175188048
Energy: 0.2970338027064541
Energy: 0.2749715106013822
Energy: 0.328822216596043
Energy: 0.3095163614293979
Energy: 0.27546152112243677
Energy: 0.3448026486449831
Energy: 0.2929749745700351
Energy: 0.3179650879100732
Energy: 0.29817444871764953
Energy: 0.28600786814842705
Energy: 0.31306480352830524
Energy: 0.31269153244964526
Energy: 0.2828077292434936
Energy: 0.38451960969435595
Energy: 0.3091896313064393
Energy: 0.34759699354078777
Energy: 0.3774755976155642
Energy: 0.2807400845567805
Energy: 0.30721159416938565
Energy: 0.3419417542361853
Energy: 0.2760973744400706
Energy: 0.2730869261109246
Energy: 0.33417608387865216
Energy: 0.2846451121396357
Energy: 0.2802921182845396
Energy: 0.31652736236508433
Energy: 0.39550284360218413
Energy: 0.3669432732433039
Energy: 0.32452398878775873
Energy: 0.2703916600392068
Energy: 0.416743233614517
Energy: 0.3018652853843731
Energy: 0.3644936776800473
Energy: 0.33780283643637704
Energy: 0.30749186405350254
Energy: 0.38626692167559684
Energy: 0.38197451638618674
Energy: 0.4085069695271077
Energy: 0.36286859766837554
Energy: 0.37577710531731034
Energy: 0.40154159655301686
Energy: 0.3573520306771567
Energy: 0.39729359172724515
Energy: 0.3599832318169779
Energy: 0.42325450341949966
Energy: 0.4062325060762052
Energy: 0.35372832984864316
Energy: 0.36177455152555904
Energy: 0.29325367717500067
Energy: 0.42443167782175656
Energy: 0.34824169030118324
Energy: 0.33968747944099126
Energy: 0.4152878160832825
Energy: 0.36164711784345915
Energy: 0.3453589090870601
Energy: 0.37157181217860746
Energy: 0.40535834842164276
Energy: 0.37266694112932536
Energy: 0.39536852486306145
Energy: 0.2712607331349164
Energy: 0.3406543957553508
Energy: 0.36280254313560806
Energy: 0.3412237779286089
Energy: 0.46698919530232086
Energy: 0.3720904842885114
Energy: 0.36185800837456134
Energy: 0.4965467165137986
Energy: 0.44006139381934667
Energy: 0.46723091106559733
Energy: 0.5276171803055175
Energy: 0.4321336878565958
Energy: 0.4220118187184231
Energy: 0.5104814314187062

minimum gb energy = 0.2509702584224911 eV
minimum distance =  1.67854260366843 Angstroms
sigma value = 67


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

Energy: 0.2341844537719472
Energy: 0.464552615872287
Energy: 0.3107830412710209
Energy: 0.23149060633736884
Energy: 0.4774218389927659
Energy: 0.3439938706999535
Energy: 0.4869217953413742
Energy: 0.42087514120456193
Energy: 0.43741866991197204
Energy: 0.597189115853278
Energy: 0.41531619688844257
Energy: 0.4675176117930939
Energy: 0.4128546283317519
Energy: 0.26314982601986525
Energy: 0.4561784173831835
Energy: 0.4396737300644068
Energy: 0.2765158282068508
Energy: 0.40983152385322524
Energy: 0.40930558410471296
Energy: 0.4711536225976906
Energy: 0.4330185338218274
Energy: 0.43066414954012444
Energy: 0.2650021641444181
Energy: 0.39711884515366436
Energy: 0.5737114592674815
Energy: 0.3755433619862219
Energy: 0.39889845824633136
Energy: 0.5584572490093642
Energy: 0.36314432601883834
Energy: 0.43311414882772203
Energy: 0.23699967968004615
Energy: 0.4654437848131239
Energy: 0.3191495046305916
Energy: 0.42886384238430536
Energy: 0.39200280685954497
Energy: 0.34973313253111216
Energy: 0.41252339682483524
Energy: 0.3504587556297453
Energy: 0.33911682704496354
Energy: 0.40296756731586314
Energy: 0.3660681234934313
Energy: 0.3413774965591633
Energy: 0.31053929842434097
Energy: 0.28310959487715515
Energy: 0.26678044636856174
Energy: 0.3212806057526173
Energy: 0.29667571431842754
Energy: 0.43660929386446445
Energy: 0.3465889672197051
Energy: 0.4335724483749758
Energy: 0.40363736877277484
Energy: 0.3473865177752602
Energy: 0.45949658637047613
Energy: 0.3791424096971832
Energy: 0.3597650982321501
Energy: 0.29181118906999776
Energy: 0.2931332770807193
Energy: 0.35390896504443803
Energy: 0.29592227601164917
Energy: 0.30393014512189215
Energy: 0.4576511389799201
Energy: 0.3070968149398029
Energy: 0.3304136549092817
Energy: 0.4485469791041858
Energy: 0.2921953430808059
Energy: 0.35934361678724774
Energy: 0.28256849262154415
Energy: 0.3025168239369048
Energy: 0.28289713656883053
Energy: 0.2781126603410408
Energy: 0.3227533642319506
Energy: 0.2697673705465173
Energy: 0.27145796140591194
Energy: 0.3209353875980139
Energy: 0.2970380261841061
Energy: 0.2697931444265848
Energy: 0.34274025780415457
Energy: 0.27839273211519766
Energy: 0.39250270376287794
Energy: 0.28685488926945657
Energy: 0.2972532919735678
Energy: 0.38492173109548017
Energy: 0.28251069979298354
Energy: 0.3148568347871475
Energy: 0.305094765775291
Energy: 0.27592907845385556
Energy: 0.2705598897652677
Energy: 0.301323500366422
Energy: 0.28623888279936455
Energy: 0.2734807653786239
Energy: 0.324681593158711
Energy: 0.3555920093003833
Energy: 0.3356265951116116
Energy: 0.32281518843727647
Energy: 0.3755064053400938
Energy: 0.3228595853853713
Energy: 0.2850954864172325
Energy: 0.29210643432960315
Energy: 0.27616419259820363
Energy: 0.2905233161662294
Energy: 0.30504175697193087
Energy: 0.3505487589788926
Energy: 0.35081580194510875
Energy: 0.31602661589702713
Energy: 0.3032678064203563
Energy: 0.34291191556615125
Energy: 0.33193571193835714
Energy: 0.30085196606333336
Energy: 0.2404230207481896
Energy: 0.3781120881874389
Energy: 0.32236801163297896
Energy: 0.43340447272004745
Energy: 0.3307239199933341
Energy: 0.3534038964791574
Energy: 0.4511159237668136
Energy: 0.32041325568243373
Energy: 0.33113196451191385
Energy: 0.4399725953666594
Energy: 0.3169034056914209
Energy: 0.35191482244808003
Energy: 0.3693564148984222
Energy: 0.4823056716405444
Energy: 0.444799618140523
Energy: 0.3830480574381949
Energy: 0.2705280228096537
Energy: 0.4092838723416863
Energy: 0.3600941353601735
Energy: 0.2675042872901107
Energy: 0.45850691378506914
Energy: 0.3768109344314813
Energy: 0.2794555901420605
Energy: 0.414370271026132
Energy: 0.4971623055598137
Energy: 0.41602622450874793
Energy: 0.43546828423009687
Energy: 0.4850933329402697
Energy: 0.4070369958029925
Energy: 0.46638273067583136

minimum gb energy = 0.23149060633736884 eV
minimum distance =  1.88533949954839 Angstroms
sigma value = 33


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

Energy: 0.3216330229552078
Energy: 0.4356453254017424
Energy: 0.5165647130286483
Energy: 0.31573347407278246
Energy: 0.48127577210184375
Energy: 0.2619438497523139
Energy: 0.4587475035112861
Energy: 0.4263763875629818
Energy: 0.44444745759081544
Energy: 0.6021547811097332
Energy: 0.41989788381623644
Energy: 0.4753383758552166
Energy: 0.4188013235921519
Energy: 0.4203504965169724
Energy: 0.38488771485067313
Energy: 0.444479805604345
Energy: 0.4484767260456112
Energy: 0.35008746445773326
Energy: 0.4136128651533353
Energy: 0.3964104603690001
Energy: 0.3674627641350998
Energy: 0.43298949043855006
Energy: 0.4201941781324129
Energy: 0.34196390309902064
Energy: 0.547539570905119
Energy: 0.36966607360171755
Energy: 0.3903711395995195
Energy: 0.5330316687730376
Energy: 0.3598089465724746
Energy: 0.41995464944197636
Energy: 0.3339747980011075
Energy: 0.4383135718669327
Energy: 0.5171795625549196
Energy: 0.3278276940527211
Energy: 0.3740052735100752
Energy: 0.27376544221362636
Energy: 0.3892990482807064
Energy: 0.340461566389022
Energy: 0.3275169699409414
Energy: 0.3807628864878077
Energy: 0.3575582090119854
Energy: 0.32751142024541136
Energy: 0.30707516058303524
Energy: 0.45806601776334527
Energy: 0.41962506395213706
Energy: 0.31087090499150194
Energy: 0.48892410682565535
Energy: 0.382456573109965
Energy: 0.36401910553032324
Energy: 0.3786492387011575
Energy: 0.3585476887372876
Energy: 0.35972754372221677
Energy: 0.3960811866647047
Energy: 0.3464517363153473
Energy: 0.31997967495416796
Energy: 0.292305785487478
Energy: 0.284667916300791
Energy: 0.31624830147245714
Energy: 0.3008299962124509
Energy: 0.2860317803349662
Energy: 0.38453452320394105
Energy: 0.3132671239978336
Energy: 0.3096681869547851
Energy: 0.37632393241683293
Energy: 0.31778713462433406
Energy: 0.31663199501072875
Energy: 0.28325983079334227
Energy: 0.37210840199505774
Energy: 0.3442248481656152
Energy: 0.28432618935294734
Energy: 0.26946381028152455
Energy: 0.31987202821161187
Energy: 0.31072636026305794
Energy: 0.2998643110070559
Energy: 0.28351883459099936
Energy: 0.3052969057736929
Energy: 0.3184317024660286
Energy: 0.27657764005791424
Energy: 0.3441372611438459
Energy: 0.3466929199314633
Energy: 0.38546945294457446
Energy: 0.33634355666675314
Energy: 0.31581832487049794
Energy: 0.27845637116266503
Energy: 0.2959706375621177
Energy: 0.3232501812273448
Energy: 0.3365730634231636
Energy: 0.2910079186366979
Energy: 0.31528539984581894
Energy: 0.3560301356870804
Energy: 0.36690107709523406
Energy: 0.38149631978126636
Energy: 0.357078140252154
Energy: 0.3724129168498119
Energy: 0.40250390099718125
Energy: 0.4582615776989651
Energy: 0.35803187565185807
Energy: 0.4429713643600637
Energy: 0.4075347978439953
Energy: 0.3745659614614856
Energy: 0.47060116024113896
Energy: 0.3717245189660145
Energy: 0.5141899858006014
Energy: 0.4054710636044492
Energy: 0.4035716938319602
Energy: 0.5030611568990259
Energy: 0.41418775475930764
Energy: 0.4164631524004128
Energy: 0.3195565286435326
Energy: 0.5863866273137815
Energy: 0.514593217624023
Energy: 0.313694054750577
Energy: 0.4804564812821465
Energy: 0.26114108439458594
Energy: 0.5035321568341717
Energy: 0.44048807963251424
Energy: 0.47900397479617707
Energy: 0.4921702601667352
Energy: 0.4162463102774511
Energy: 0.5255766119248102
Energy: 0.4132272854164983
Energy: 0.3981595438105352
Energy: 0.36595866492799495
Energy: 0.4340445307832479
Energy: 0.42418813807508154
Energy: 0.33584036635842773
Energy: 0.41646530796480924
Energy: 0.4194070926633014
Energy: 0.38683467603031674
Energy: 0.44096707979293165
Energy: 0.44536486515344786
Energy: 0.3558487058184527
Energy: 0.5073951447055707
Energy: 0.36481163534425926
Energy: 0.3723643213348231
Energy: 0.49374420714228107
Energy: 0.3668360750228252
Energy: 0.3928002531551554
Energy: 0.3351892898373259
Energy: 0.44066395287407795
Energy: 0.5223973969023266
Energy: 0.3294583016988
Energy: 0.3742338444587349
Energy: 0.27472121744959177
Energy: 0.4299159344803686
Energy: 0.35325698154094454
Energy: 0.34885021917949816
Energy: 0.420009173672908
Energy: 0.3633998791598974
Energy: 0.3561438478406965
Energy: 0.3141134239056021
Energy: 0.4412079331501322
Energy: 0.40633667697885617
Energy: 0.3159500618476611
Energy: 0.46855125498812245
Energy: 0.373086691758699
Energy: 0.3512873780982224
Energy: 0.40589983987138056
Energy: 0.37933330107349056
Energy: 0.34864454578741993
Energy: 0.42865925639164865
Energy: 0.35955814820101323
Energy: 0.32434345773065265
Energy: 0.28886060667888086
Energy: 0.28221950933349865
Energy: 0.3191235362924676
Energy: 0.29780328149405894
Energy: 0.284201119206326
Energy: 0.3910101692797173
Energy: 0.29923961197274473
Energy: 0.30017876670799004
Energy: 0.3826494483295729
Energy: 0.300684116750147
Energy: 0.3127009195617408
Energy: 0.27879983036061723
Energy: 0.3814583352697905
Energy: 0.3513441915008872
Energy: 0.2805437001740785
Energy: 0.2764241077202888
Energy: 0.3245325692275586
Energy: 0.30262141963523925
Energy: 0.2959876872833702
Energy: 0.278976327970919
Energy: 0.297389964377129
Energy: 0.31460357703585584
Energy: 0.2707786826750772
Energy: 0.3353988447861956
Energy: 0.3478995223211691
Energy: 0.3800399865187519
Energy: 0.3275593967380629
Energy: 0.32224032780243955
Energy: 0.2769676561818557
Energy: 0.29896233978785147
Energy: 0.33558364737651614
Energy: 0.35454368051053153
Energy: 0.294985220147147
Energy: 0.32082577633955695
Energy: 0.37875237566596837
Energy: 0.3675706931144699
Energy: 0.35717764361996135
Energy: 0.457885824401049
Energy: 0.36949627295099396
Energy: 0.3764235350583271
Energy: 0.4212902945617922
Energy: 0.3558963500887956
Energy: 0.45373599439237816
Energy: 0.41660888450083383
Energy: 0.373972736627825
Energy: 0.2227418930212865
Energy: 0.3784872371195427
Energy: 0.45121237932330643
Energy: 0.40723880287344766
Energy: 0.38868532507123255
Energy: 0.4437236858370593
Energy: 0.42870860993584275
Energy: 0.3865075171197886
Energy: 0.31337008076107975
Energy: 0.5807503670892619
Energy: 0.5085598154845868
Energy: 0.3077606629297817
Energy: 0.47960041682717874
Energy: 0.2589763004215005

minimum gb energy = 0.2227418930212865 eV
minimum distance =  2.28614311389298 Angstroms
sigma value = 41


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

Energy: 0.20499696982369398
Energy: 0.3850576755851179
Energy: 0.45095172079970225
Energy: 0.20348344254673958
Energy: 0.48849403146408416
Energy: 0.5162349050011397
Energy: 0.4076101917949167
Energy: 0.43888334974629845
Energy: 0.4536731861558985
Energy: 0.6092167599253456
Energy: 0.43081406785636245
Energy: 0.48197601859610906
Energy: 0.4232772807424957
Energy: 0.30637806938025774
Energy: 0.28581779003624574
Energy: 0.4537688564231868
Energy: 0.3225378468450863
Energy: 0.26816251571233884
Energy: 0.4121086828876903
Energy: 0.293713395272871
Energy: 0.27833918513162287
Energy: 0.4321792930699459
Energy: 0.3081127449930706
Energy: 0.6401710902013977
Energy: 0.508462655400989
Energy: 0.36222941684377435
Energy: 0.37101274190958833
Energy: 0.4942361129734473
Energy: 0.3605708599055211
Energy: 0.39236241889259577
Energy: 0.24925266669770652
Energy: 0.39904039691626525
Energy: 0.46249635538721673
Energy: 0.24527005609641409
Energy: 0.3527205108302885
Energy: 0.527537038391697
Energy: 0.3460436062905038
Energy: 0.3665607599859476
Energy: 0.34075459481932174
Energy: 0.34187752164617086
Energy: 0.39132641364219906
Energy: 0.32555611449545196
Energy: 0.3102905892260101
Energy: 0.36068267366394424
Energy: 0.3327174221107499
Energy: 0.30986003551048286
Energy: 0.3867052843990114
Energy: 0.3128365050407838
Energy: 0.28679534426232683
Energy: 0.3461134264785149
Energy: 0.35984082039320087
Energy: 0.2820776742520584
Energy: 0.33979765856365796
Energy: 0.3803214587858939
Energy: 0.40864571809235006
Energy: 0.3349475109885172
Energy: 0.3412167740256713
Energy: 0.4016583131473787
Energy: 0.3342231017044408
Energy: 0.35255911615859753
Energy: 0.3616500163829563
Energy: 0.43963352385073035
Energy: 0.405302604385043
Energy: 0.3590936394854526
Energy: 0.2994634570666521
Energy: 0.37927458966182276
Energy: 0.3420460074063086
Energy: 0.33234398129512566
Energy: 0.30998337210550736
Energy: 0.36267280545782055
Energy: 0.35013336960013436
Energy: 0.2910468827880869
Energy: 0.42898694082803784
Energy: 0.4169557410357323
Energy: 0.3934225957301363
Energy: 0.4215887361677064
Energy: 0.4421360931965028
Energy: 0.3837799413127726
Energy: 0.20594974398561566
Energy: 0.5806996872731751
Energy: 0.44181721020759024
Energy: 0.20413747611030805
Energy: 0.4841322944144717
Energy: 0.49874150542524864

minimum gb energy = 0.20348344254673958 eV
minimum distance =  1.77433687731657 Angstroms
sigma value = 11


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

Energy: 0.34007423817723026
Energy: 0.507441911744585
Energy: 0.40242973771117735
Energy: 0.3346916938466807
Energy: 0.4907338934517266
Energy: 0.28296841742487105
Energy: 0.5021351780518267
Energy: 0.41569650918423895
Energy: 0.4340517583599624
Energy: 0.5823199356058233
Energy: 0.40754148950813884
Energy: 0.46403066194846426
Energy: 0.3541558322372869
Energy: 0.38124881883785977
Energy: 0.35548539117874817
Energy: 0.3673081887466528
Energy: 0.4020284305227181
Energy: 0.5084194302765288
Energy: 0.351812134409939
Energy: 0.3433266862796093
Energy: 0.4891491438414408
Energy: 0.3584214621930906
Energy: 0.36139129070151993
Energy: 0.44595418491160155
Energy: 0.32721788730607443
Energy: 0.28548384038442104
Energy: 0.27896441418825585
Energy: 0.3211767627725352
Energy: 0.29572303823531537
Energy: 0.2816415515127795
Energy: 0.38998075191078846
Energy: 0.2849601305401348
Energy: 0.29439096268411
Energy: 0.38183483236100413
Energy: 0.28183631704000933
Energy: 0.31215694118582965
Energy: 0.27229217737405487
Energy: 0.3619782089488118
Energy: 0.33363133445687027
Energy: 0.2739784676187278
Energy: 0.30623794450330166
Energy: 0.3094320009477684
Energy: 0.30448954563955033
Energy: 0.30412600036042764
Energy: 0.2882272857386462
Energy: 0.299661679133905
Energy: 0.32273536389044716
Energy: 0.28000363428354763
Energy: 0.3188603476877407
Energy: 0.40812715279723716
Energy: 0.45993544934698666
Energy: 0.31493966102984833
Energy: 0.36783802750311206
Energy: 0.409764137717276
Energy: 0.3220864314263792
Energy: 0.41110125376066003
Energy: 0.4604057355860534
Energy: 0.3181648963302739
Energy: 0.3736811310293946
Energy: 0.40866399201297676
Energy: 0.40274982351453115
Energy: 0.43878425563109313
Energy: 0.5589206994344298
Energy: 0.40882949880585845
Energy: 0.47051635002155634
Energy: 0.5056962559040313
Energy: 0.42415833261999325
Energy: 0.40285617033417626
Energy: 0.3695379304919188
Energy: 0.45786833000091814
Energy: 0.26520536765226965
Energy: 0.3368035455407583
Energy: 0.40507807102159954
Energy: 0.43701270619056065
Energy: 0.4059045069165446
Energy: 0.4012369711923779
Energy: 0.4685957374445385
Energy: 0.38767996155803386
Energy: 0.33436010455189147
Energy: 0.3726707645290745
Energy: 0.41201438571503013
Energy: 0.33064187772198916
Energy: 0.3419093883903743
Energy: 0.4542068676737357
Energy: 0.4300539699754821
Energy: 0.3411811749904544
Energy: 0.34701588793395133
Energy: 0.42263446914814884
Energy: 0.34075306060509
Energy: 0.3605342833501703
Energy: 0.30337396990141324
Energy: 0.27858922285932625
Energy: 0.272118197391121
Energy: 0.29881503142406624
Energy: 0.28592814471981415
Energy: 0.27096723119918753
Energy: 0.3227860699164442
Energy: 0.3209316414619213
Energy: 0.30518557472355484
Energy: 0.3192547164064575
Energy: 0.3383140756341928
Energy: 0.2985931021412631
Energy: 0.35625836477164813
Energy: 0.31972646817002165
Energy: 0.3494217150824436
Energy: 0.3513281386795385
Energy: 0.29814168037477873
Energy: 0.3018246205703337
Energy: 0.38005612364507246
Energy: 0.32455741077037437
Energy: 0.31498214285629794
Energy: 0.3721443703547637
Energy: 0.3388987181452085
Energy: 0.31762780045204053
Energy: 0.37981047420522124
Energy: 0.3805487463073407
Energy: 0.3533009893010689
Energy: 0.40196966372416365
Energy: 0.4027029368429989
Energy: 0.5052251893470889
Energy: 0.3777852594039301
Energy: 0.341807021587893
Energy: 0.47570908463903894
Energy: 0.388481971686708
Energy: 0.3630864920584799
Energy: 0.5210688663159906
Energy: 0.460857266300716
Energy: 0.4259806510931909
Energy: 0.47342351892066464
Energy: 0.4506043387134735
Energy: 0.3919511705689685
Energy: 0.5273137744713161
Energy: 0.3298263013053569
Energy: 0.4961789010690001
Energy: 0.3919064197068383
Energy: 0.3253799211939357
Energy: 0.4216889047327304
Energy: 0.43827851478331004
Energy: 0.36748476107329564
Energy: 0.34058790131717437
Energy: 0.32373868093020736
Energy: 0.3606477158638626
Energy: 0.36050364831029436
Energy: 0.31964944014737046
Energy: 0.29121374924890514
Energy: 0.4151382235564319
Energy: 0.3832104209049883
Energy: 0.29515868977005855
Energy: 0.27961105598873837
Energy: 0.3527962124613681
Energy: 0.35767822022085194
Energy: 0.3121852543828401
Energy: 0.3060279604466067
Energy: 0.352040211367749
Energy: 0.32119623294134436
Energy: 0.3085028724353312
Energy: 0.2917507790872735
Energy: 0.2844805828085963
Energy: 0.2755206623348322
Energy: 0.28964664647924604
Energy: 0.2960030979814628
Energy: 0.2740160297982514
Energy: 0.34066447286265555
Energy: 0.3823877594785766
Energy: 0.3594763794600633
Energy: 0.3390240798957227
Energy: 0.4043121547220036
Energy: 0.3434049394836109
Energy: 0.3207967529289082
Energy: 0.4029237767912512
Energy: 0.3753180605099253
Energy: 0.3310075608184529
Energy: 0.2671789811902276
Energy: 0.3487178201913849
Energy: 0.4522118698371009
Energy: 0.38682350802565063
Energy: 0.3754354128983534
Energy: 0.4437493771339637
Energy: 0.4023715690939478
Energy: 0.3794534622519417
Energy: 0.33480091633542935
Energy: 0.5910317237987042
Energy: 0.3980412138268701
Energy: 0.32978423500938836
Energy: 0.48789858555591986
Energy: 0.44812312252622033

minimum gb energy = 0.26520536765226965 eV
minimum distance =  1.62589553527609 Angstroms
sigma value = 57


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

Energy: 0.3368050812316071
Energy: 0.2730807141908502
Energy: 0.2706839355715215
Energy: 0.3301058547847117
Energy: 0.5141155509833659
Energy: 0.2782534032936813
Energy: 0.27916376957623495
Energy: 0.4618096174861899
Energy: 0.4702159195091556
Energy: 0.5994135982344513
Energy: 0.46837440793623253
Energy: 0.49164590000053227
Energy: 0.4337718180863639
Energy: 0.25638299650350727
Energy: 0.25073834567743625
Energy: 0.4699078130381783
Energy: 0.26046802785099676
Energy: 0.8045440292425053
Energy: 0.4142949356539086
Energy: 0.840864367963811
Energy: 0.7523984025604173
Energy: 0.43336722102651687
Energy: 0.2896918181951006
Energy: 0.6614728458133474
Energy: 0.41881023746843216
Energy: 0.34726410590982354
Energy: 0.33018862980526237
Energy: 0.40573839211562424
Energy: 0.3724707291288921
Energy: 0.3309482323909697
Energy: 0.4161009748886382
Energy: 0.39537764140750625
Energy: 0.3699374517970201
Energy: 0.40988657082781105
Energy: 0.42191896576472354
Energy: 0.36282792878511383
Energy: 0.3220122434344127
Energy: 0.30259798452334047
Energy: 0.284222962018991
Energy: 0.34454756883580434
Energy: 0.3194050037217894
Energy: 0.5532068748880965
Energy: 0.36019654794216244
Energy: 0.5150026316874804
Energy: 0.4687990985604738
Energy: 0.3650039588008945
Energy: 0.5542149203761748
Energy: 0.42944463818276507
Energy: 0.3087447861485191
Energy: 0.558341664902547
Energy: 0.27599173061717375
Energy: 0.3048514256455883
Energy: 0.49992024084484865
Energy: 0.27503668110843416
Energy: 0.306535872253131
Energy: 0.5490430028502679
Energy: 0.2753973902666797
Energy: 0.3025456455447318
Energy: 0.4917282637907454
Energy: 0.27366185496038753
Energy: 0.42220092167320455
Energy: 0.7082301625974398
Energy: 0.6332753200017515
Energy: 0.431435952712813
Energy: 0.7702241292079365
Energy: 0.5642576900467876
Energy: 0.40535603356378996
Energy: 0.269220591647659
Energy: 0.25376637269004476
Energy: 0.4473354774822322
Energy: 0.2835013738800698
Energy: 0.8333153963128181
Energy: 0.424606318336544
Energy: 0.4569443613629738
Energy: 0.41536319332302835
Energy: 0.42034305639931374
Energy: 0.49995632419012265
Energy: 0.3941509096756278
Energy: 0.4221297491009817
Energy: 0.3481900450267508
Energy: 0.33446012155062
Energy: 0.4105956710787971
Energy: 0.36628787251442696
Energy: 0.3377562887743859
Energy: 0.34263330479208765
Energy: 0.31744164004519865
Energy: 0.5334497586230029
Energy: 0.35267739367387396
Energy: 0.33954627057914766
Energy: 0.4779436758285639
Energy: 0.3686775115910695
Energy: 0.2971478792848956
Energy: 0.29556372017539834
Energy: 0.3875195294022039
Energy: 0.29715267622160413
Energy: 0.5468924558428605
Energy: 0.27986035631388684
Energy: 0.4550067928426931
Energy: 0.46666615713791104
Energy: 0.27678228549848927
Energy: 0.45677795731735843
Energy: 0.48745743922661927

minimum gb energy = 0.25073834567743625 eV
minimum distance =  1.87513983593991 Angstroms
sigma value = 9


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

Energy: 0.4067805083197462
Energy: 0.47483282837388846
Energy: 0.3069362143977176
Energy: 0.4002934858858512
Energy: 0.4998089505391335
Energy: 0.33266717072410584
Energy: 0.46125591134082006
Energy: 0.41976523969285845
Energy: 0.4380964902389976
Energy: 0.5834956284105889
Energy: 0.4111424861085408
Energy: 0.46756166642990304
Energy: 0.3473521535875372
Energy: 0.2653785365190767
Energy: 0.4844260627744674
Energy: 0.3558577514032467
Energy: 0.2699196797764913
Energy: 0.4445458465274889
Energy: 0.3537272091755871
Energy: 0.43246349410049806
Energy: 0.40163169705567914
Energy: 0.3540074032946346
Energy: 0.46043160158491525
Energy: 0.3783356720424042
Energy: 0.34841788067496127
Energy: 0.30579097182047954
Energy: 0.3058946679462149
Energy: 0.3447385359513534
Energy: 0.3117059782429592
Energy: 0.312026388581875
Energy: 0.3696541048336195
Energy: 0.35942694292240457
Energy: 0.3410567517806807
Energy: 0.36427151846093886
Energy: 0.3812547288212925
Energy: 0.3337643366383934
Energy: 0.37025275675980474
Energy: 0.2542834591701712
Energy: 0.4830532436406973
Energy: 0.39249872485070053
Energy: 0.2615045201954098
Energy: 0.43384397037726435
Energy: 0.3803614753185485
Energy: 0.3913875797069633
Energy: 0.4785497743431279
Energy: 0.382541310019767
Energy: 0.41987195438371216
Energy: 0.43928872073954944
Energy: 0.3842209618172954
Energy: 0.4525925863001802
Energy: 0.5190430759080906
Energy: 0.37875488113049044
Energy: 0.40144256097389586
Energy: 0.32178681705506446
Energy: 0.3693458589900128
Energy: 0.4410321539828141
Energy: 0.49817922382575636
Energy: 0.36267520981612156
Energy: 0.3968243472967098
Energy: 0.5604178092791179
Energy: 0.3195932840102132
Energy: 0.311855481822396
Energy: 0.2968040820459435
Energy: 0.31517958954352193
Energy: 0.3304854971618941
Energy: 0.29058771282015894
Energy: 0.3112718456942332
Energy: 0.3246092569465705
Energy: 0.3048512872809245
Energy: 0.30820556620117556
Energy: 0.3457790590956362
Energy: 0.29402925390994983
Energy: 0.4006857177217046
Energy: 0.37221478425316845
Energy: 0.42066226615771063
Energy: 0.39337298559311445
Energy: 0.33740072682538264
Energy: 0.3249160753221155
Energy: 0.3916817723908442
Energy: 0.3665550519926733
Energy: 0.38872497934777916
Energy: 0.3819542466251038
Energy: 0.3528001411352182
Energy: 0.4196511334494006
Energy: 0.4171176507618778
Energy: 0.44026916251137366
Energy: 0.405503335930003
Energy: 0.4357288594558258
Energy: 0.46970908890806495
Energy: 0.631495034237156
Energy: 0.4288311698793386
Energy: 0.26123657413426704
Energy: 0.4597992717095815
Energy: 0.45863067681538555
Energy: 0.2696661964324911
Energy: 0.4157724680036252
Energy: 0.39963992685357963
Energy: 0.34574776674980734
Energy: 0.3323023526433242
Energy: 0.3913390385572516
Energy: 0.3640096380978483
Energy: 0.3328255301116056
Energy: 0.4334547939212361
Energy: 0.31300484414041924
Energy: 0.33078096550391267
Energy: 0.42610869749650765
Energy: 0.3041718858043357
Energy: 0.354420074295955
Energy: 0.3091031258406729
Energy: 0.4020118053864491
Energy: 0.36973332299531075
Energy: 0.3109733870652079
Energy: 0.3145269694856402
Energy: 0.34417617722822247
Energy: 0.332283190895676
Energy: 0.38610551317696584
Energy: 0.3641920449093577
Energy: 0.3327747493131502
Energy: 0.40614619062851803
Energy: 0.34760608737017573
Energy: 0.3241306052379908
Energy: 0.47418517645992014
Energy: 0.5273341559821006
Energy: 0.31936285354205196
Energy: 0.43369535296463035
Energy: 0.5859271256208589

minimum gb energy = 0.2542834591701712 eV
minimum distance =  1.63725051477253 Angstroms
sigma value = 27


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

Energy: 0.2291253804138144
Energy: 0.2630073423430412
Energy: 0.2507072055826591
Energy: 0.21998243558105404
Energy: 0.37039809036389443
Energy: 0.23675533992890385
Energy: 0.35487756049722147
Energy: 0.3380512018114247
Energy: 0.3459620512807033
Energy: 0.4626910224663114
Energy: 0.311783468750398
Energy: 0.4008129105555719
Energy: 0.3340690972202571
Energy: 0.7081450673613826
Energy: 0.6292158214630524
Energy: 0.34537268865593035
Energy: 0.20230813388996313
Energy: 0.5552190223385577
Energy: 0.37501835825626145
Energy: 0.501073352674742
Energy: 0.46002253484879635
Energy: 0.37966608452670014
Energy: 0.5354393182950997
Energy: 0.42425678105459586
Energy: 0.2615746557934181
Energy: 0.316341466605956
Energy: 0.3404410082557065
Energy: 0.26165226100416206
Energy: 0.2968880947235304
Energy: 0.3655444630474148
Energy: 0.2662515536138164
Energy: 0.3291571007611254
Energy: 0.3075431124925955
Energy: 0.26806481033196533
Energy: 0.3468316741808038
Energy: 0.2907095724421218
Energy: 0.32441695983094665
Energy: 0.225170297053511
Energy: 0.23178358817730105
Energy: 0.3236187944057493
Energy: 0.22139670059544142
Energy: 0.2415690785162485
Energy: 0.280658664829952
Energy: 0.3132045264855206
Energy: 0.34818481057863054
Energy: 0.28550282243492536
Energy: 0.3349713779051377
Energy: 0.326484260444285
Energy: 0.7069028281583478
Energy: 0.40521796147103617
Energy: 0.4721874279513963
Energy: 0.6926975643963253
Energy: 0.35431249456060854
Energy: 0.5387338557676415
Energy: 0.6658054357997013
Energy: 0.39741690601355084
Energy: 0.44929110688412943
Energy: 0.6526065331239546
Energy: 0.35957467617754374
Energy: 0.5056936958194383
Energy: 0.2710595500748805
Energy: 0.4233650196980441
Energy: 0.3864082449066861
Energy: 0.2782473416331631
Energy: 0.2897327042372558
Energy: 0.3528277983932762
Energy: 0.31288797408653074
Energy: 0.2593068682927109
Energy: 0.26257683169536455
Energy: 0.3094168116245919
Energy: 0.2577437018661686
Energy: 0.27014499593649294
Energy: 0.23399629384410747
Energy: 0.27650556940878274
Energy: 0.26154967528998674
Energy: 0.2351113109863497
Energy: 0.2903773437655519
Energy: 0.25084917829880443
Energy: 0.3214687323083551
Energy: 0.27777860018350276
Energy: 0.2784638687861016
Energy: 0.3168326414376064
Energy: 0.27629345862590327
Energy: 0.2832610746621366
Energy: 0.3329166412332455
Energy: 0.5365758976659951
Energy: 0.48677829285679686
Energy: 0.3396525321604881
Energy: 0.5754659342992757
Energy: 0.4380622324498054
Energy: 0.32079945467717536
Energy: 0.6727314322370116
Energy: 0.5978419267019273
Energy: 0.33484927153810795
Energy: 0.7321547521025926
Energy: 0.5205489561179721
Energy: 0.330209301926634
Energy: 0.30940300891117706
Energy: 0.34001276609567493
Energy: 0.3202273778296241
Energy: 0.2845443370116907
Energy: 0.37279021140419394
Energy: 0.2800039306311264
Energy: 0.29124328528632576
Energy: 0.2791565243126579
Energy: 0.27869105699845964
Energy: 0.30418936952044945
Energy: 0.2735330685990421
Energy: 0.31964778620322754
Energy: 0.26911267225902724
Energy: 0.27314007611518715
Energy: 0.32339126143509095
Energy: 0.265797033442123
Energy: 0.2787209241415966
Energy: 0.31271962310882495
Energy: 0.27900829108627906
Energy: 0.2792546288742426
Energy: 0.3165068653764496
Energy: 0.27833256924041383
Energy: 0.2809336703233427
Energy: 0.49880538579500394
Energy: 0.36944756751766483
Energy: 0.3815062222557192
Energy: 0.490201039127911
Energy: 0.3622339198003857
Energy: 0.40478214545888885
Energy: 0.22881942054541674
Energy: 0.4248887886961666
Energy: 0.5181560709088412
Energy: 0.2258308793202698
Energy: 0.34913381630648815
Energy: 0.6086972024967989
Energy: 0.28838969321969266
Energy: 0.4250465890012431
Energy: 0.3873447143401074
Energy: 0.2937869137492539
Energy: 0.46363802447244595
Energy: 0.35316861231566526
Energy: 0.31860194342752113
Energy: 0.30302039107835965
Energy: 0.29064720907594954
Energy: 0.3063957284934315
Energy: 0.307085280020649
Energy: 0.2958147289099171
Energy: 0.2948152037464201
Energy: 0.395412493567283
Energy: 0.38999252659415773
Energy: 0.2904466717693675
Energy: 0.3479947185040751
Energy: 0.2798667442973204

minimum gb energy = 0.20230813388996313 eV
minimum distance =  3.20760498713176 Angstroms
sigma value = 19


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

Energy: 0.33058355449684335
Energy: 0.5162329708894307
Energy: 0.40211726434170303
Energy: 0.3258987467224144
Energy: 0.5039413175503732
Energy: 0.45241955468434
Energy: 0.48891162738257765
Energy: 0.4161844245854401
Energy: 0.4347047184624581
Energy: 0.5739818184488569
Energy: 0.40740558507710717
Energy: 0.46386490550394344
Energy: 0.3318410780907934
Energy: 0.3997781804778875
Energy: 0.3787230794220164
Energy: 0.33291957236587405
Energy: 0.4165287109208831
Energy: 0.3599730877682735
Energy: 0.35516668486198516
Energy: 0.3528638732281241
Energy: 0.33624610158647805
Energy: 0.3515254746084695
Energy: 0.37125592613701497
Energy: 0.3290613271090674
Energy: 0.3241480402833957
Energy: 0.3440749525032831
Energy: 0.3625870877832653
Energy: 0.32200551383151504
Energy: 0.32980057334977336
Energy: 0.3848132203252986
Energy: 0.4118166548997146
Energy: 0.4312225111095034
Energy: 0.404327939204496
Energy: 0.4078017709823739
Energy: 0.4579569294873975
Energy: 0.3890463594896582
Energy: 0.4366930488215536
Energy: 0.3936323016583549
Energy: 0.36338142598608847
Energy: 0.4704887606842366
Energy: 0.41847250782205264
Energy: 0.3345736239431336
Energy: 0.41170024497801316
Energy: 0.43616635849363256
Energy: 0.5769137237391047
Energy: 0.41884581911759494
Energy: 0.4630145863863006
Energy: 0.5236406266494229
Energy: 0.34297456265788784
Energy: 0.3159870067621096
Energy: 0.309475964404574
Energy: 0.3395531502315752
Energy: 0.32480858466364576
Energy: 0.31094576015562875
Energy: 0.37354551841750466
Energy: 0.3246511767707595
Energy: 0.31687730129350067
Energy: 0.36697369151677267
Energy: 0.33492499485247995
Energy: 0.3192553579067817
Energy: 0.31943315944381706
Energy: 0.3941505421045316
Energy: 0.3667227614165361
Energy: 0.32936734884344415
Energy: 0.4159141752685874
Energy: 0.3405422913915463
Energy: 0.37688579062852456
Energy: 0.4056241068141717
Energy: 0.37768979503152156
Energy: 0.3732786992993861
Energy: 0.43420905213379873
Energy: 0.3618534209981811
Energy: 0.31830032025149246
Energy: 0.5023417775208473
Energy: 0.3912697891395713
Energy: 0.31475779333957093
Energy: 0.43097682147145433
Energy: 0.4324594382636715
Energy: 0.44507335245619645
Energy: 0.4435450551570102
Energy: 0.4929270284672897
Energy: 0.4374282399583999
Energy: 0.40614725529549084
Energy: 0.5468334337704204
Energy: 0.3200120151961762
Energy: 0.296127823022729
Energy: 0.2864703901794732
Energy: 0.3150051257611483
Energy: 0.3084776258979409
Energy: 0.28435774467375735
Energy: 0.3362546395643683
Energy: 0.3253071006189961
Energy: 0.309134611339898
Energy: 0.33144512915975227
Energy: 0.3438995706464955
Energy: 0.30313668291294515
Energy: 0.3170793323312679
Energy: 0.42913761683411555
Energy: 0.3940546845610296
Energy: 0.3136773701792754
Energy: 0.3758216896515375
Energy: 0.43814317385787943
Energy: 0.45263211705700157
Energy: 0.3800617528073171
Energy: 0.406094781392341
Energy: 0.44194273323744926
Energy: 0.36395059614508285
Energy: 0.44030640020880607
Energy: 0.35170706052487244
Energy: 0.3692621538124654
Energy: 0.3445520123498993
Energy: 0.3619095964600019
Energy: 0.3901767420053082
Energy: 0.4825953984060836
Energy: 0.3477171498288729
Energy: 0.3573007170545988
Energy: 0.33305021662638307
Energy: 0.3570741499507299
Energy: 0.3789715403539942
Energy: 0.4677599673360225
Energy: 0.3402918978261134
Energy: 0.28995249566268283
Energy: 0.287292917351863
Energy: 0.333930318702432
Energy: 0.29769863233661825
Energy: 0.29238869459417616
Energy: 0.34903000466548795
Energy: 0.3065559016333971
Energy: 0.29724635440384867
Energy: 0.34211440235876195
Energy: 0.32117600908472704
Energy: 0.2980862057508506
Energy: 0.3866988244589805
Energy: 0.3679359472396473
Energy: 0.34359947354441195
Energy: 0.4070564326817626
Energy: 0.3878313624771544
Energy: 0.4922161789416508
Energy: 0.3836612662653382
Energy: 0.345529745259579
Energy: 0.49349092259720084
Energy: 0.3973025907028051
Energy: 0.3654844725908005
Energy: 0.4463781234739738
Energy: 0.49868071392046776
Energy: 0.3493002083686117
Energy: 0.36693616501648174
Energy: 0.4871900288421378
Energy: 0.3396485906852965
Energy: 0.39270884855793314
Energy: 0.3319687307007822
Energy: 0.3514127854740367
Energy: 0.38815649140381997
Energy: 0.3267741991335511
Energy: 0.3249158578453694
Energy: 0.4300050288793697
Energy: 0.2943502257026424
Energy: 0.35014254479740164
Energy: 0.3260595288699997
Energy: 0.2938963129156213
Energy: 0.37384154762466026
Energy: 0.30806067983612795
Energy: 0.33146961758911253
Energy: 0.33739720987547167
Energy: 0.3183757033606076
Energy: 0.32692479099258276
Energy: 0.35977741413164077
Energy: 0.30864748141984694
Energy: 0.30323605884724725
Energy: 0.5366596387306007
Energy: 0.6251798991692868
Energy: 0.30006384062110447
Energy: 0.46584994344286446
Energy: 0.38879716160881844

minimum gb energy = 0.28435774467375735 eV
minimum distance =  1.87888442425483 Angstroms
sigma value = 101


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

Energy: 0.28584083341876865
Energy: 0.4461848531482909
Energy: 0.5226764175755728
Energy: 0.2824539602500772
Energy: 0.5083666803038775
Energy: 0.25354655160246375
Energy: 0.42755170590425373
Energy: 0.4200064724688873
Energy: 0.4378190295106564
Energy: 0.5854047094725587
Energy: 0.4137755899665479
Energy: 0.46867906312393043
Energy: 0.3534129717935079
Energy: 0.446899523135115
Energy: 0.41951614584844005
Energy: 0.35380047734028236
Energy: 0.46812257270328766
Energy: 0.3936982626100987
Energy: 0.39852328702756573
Energy: 0.3832819647560615
Energy: 0.36874254475402246
Energy: 0.3960548252548945
Energy: 0.40276373514139585
Energy: 0.3658877551431916
Energy: 0.2946888522368506
Energy: 0.3868610919246947
Energy: 0.4192791086248017
Energy: 0.29371591979277867
Energy: 0.35957758792776606
Energy: 0.28187735631199035
Energy: 0.44479206531287047
Energy: 0.4489166517943544
Energy: 0.42457203949942507
Energy: 0.4404868343729828
Energy: 0.4751412045770035
Energy: 0.41355446217785313
Energy: 0.4426582636486529
Energy: 0.4377023859810245
Energy: 0.4025676762481372
Energy: 0.4752120643650927
Energy: 0.4656174243358769
Energy: 0.3673205585255783
Energy: 0.4156631626529265
Energy: 0.630868895891343
Energy: 0.5752849778727573
Energy: 0.4242247144742355
Energy: 0.3400476798644187
Energy: 0.5249913568739437
Energy: 0.34988633025426547
Energy: 0.3302776823415036
Energy: 0.31953760520065005
Energy: 0.34635298318466856
Energy: 0.3417592094261746
Energy: 0.31829716388013374
Energy: 0.380282935641616
Energy: 0.37666220738052913
Energy: 0.35759395505903613
Energy: 0.37628152405221177
Energy: 0.39986179788479675
Energy: 0.3503702180106828
Energy: 0.3705534964038093
Energy: 0.4321514088409123
Energy: 0.40014550169565016
Energy: 0.38845954319225917
Energy: 0.45729375981767945
Energy: 0.36735514248287426
Energy: 0.38774248136107947
Energy: 0.482375194883161
Energy: 0.4441152105956033
Energy: 0.38933979772002913
Energy: 0.519356941765224
Energy: 0.41689509674023184
Energy: 0.2939531772186236
Energy: 0.4547413351654576
Energy: 0.5196497457338519
Energy: 0.2916398925304073
Energy: 0.40198253286442404
Energy: 0.5873596703032242
Energy: 0.2954214157953001
Energy: 0.406993678988945
Energy: 0.4381980976478931
Energy: 0.29337682582898283
Energy: 0.3882428169749424
Energy: 0.47603373808308913
Energy: 0.33876610120017353
Energy: 0.3596722299611876
Energy: 0.34450699491121406
Energy: 0.3349520923763319
Energy: 0.3750754084417186
Energy: 0.33385921293892906
Energy: 0.42258293226018456
Energy: 0.37153206077413264
Energy: 0.35812330083187516
Energy: 0.41531553838282964
Energy: 0.38889316211475883
Energy: 0.3595921859582727
Energy: 0.2845530595968269
Energy: 0.6024188817081562
Energy: 0.5096982722990174
Energy: 0.2813426407263787
Energy: 0.5015870298077612
Energy: 0.255398704791119
Energy: 0.5478806358926948
Energy: 0.48074797887189086
Energy: 0.5418869739405884
Energy: 0.5380618454681335
Energy: 0.43795726945699165
Energy: 0.43865382498938776
Energy: 0.3513798969277948
Energy: 0.4256837575732411
Energy: 0.39521387801801466
Energy: 0.35006681271564216
Energy: 0.45358602928064723
Energy: 0.37104453239073965
Energy: 0.33896379648016534
Energy: 0.4191803065296607
Energy: 0.3857576426010069
Energy: 0.3392639328699157
Energy: 0.4501935911375381
Energy: 0.36074016513908863
Energy: 0.31069234365262827
Energy: 0.3641937249022679
Energy: 0.39958302879664215
Energy: 0.3068955771022113
Energy: 0.33665198120744
Energy: 0.27286390726613485
Energy: 0.483244464262998
Energy: 0.3688445567799784
Energy: 0.37234150323701914
Energy: 0.47254360957870206
Energy: 0.37496246035963243
Energy: 0.3877901246417779
Energy: 0.4324849992486822
Energy: 0.4112453576641982
Energy: 0.3791430503500415
Energy: 0.46093991622968244
Energy: 0.43707062793037016
Energy: 0.3486498220962082
Energy: 0.4243241810535154
Energy: 0.3733693276951631
Energy: 0.3471054951455707
Energy: 0.4455193664887995
Energy: 0.39724320000800223
Energy: 0.649731211663273
Energy: 0.37695736982257894
Energy: 0.31932700663607877
Energy: 0.3108912813890505
Energy: 0.36878726268013595
Energy: 0.3329490085959886
Energy: 0.314174179855982
Energy: 0.3790039424149381
Energy: 0.31757086803078954
Energy: 0.3086435988469045
Energy: 0.3705509230711045
Energy: 0.33193034854215886
Energy: 0.31282536217413504
Energy: 0.3615890575068734
Energy: 0.4164673491339629
Energy: 0.38396290587653475
Energy: 0.37759739089429806
Energy: 0.44216994015166655
Energy: 0.3524017681129869
Energy: 0.3667325193585212
Energy: 0.3721506813895974
Energy: 0.3436771079885409
Energy: 0.3761295874889617
Energy: 0.40048811749533963
Energy: 0.4763905610993194
Energy: 0.30893892945582846
Energy: 0.41780084846003557
Energy: 0.4668945761835496
Energy: 0.3049099562651197
Energy: 0.3828063387358788
Energy: 0.5207572709127112
Energy: 0.30229545239606503
Energy: 0.42834295450165155
Energy: 0.4860184513973072
Energy: 0.2976834000323383
Energy: 0.3843048233770373
Energy: 0.5479477721142729
Energy: 0.3209130861521078
Energy: 0.37173946079857073
Energy: 0.3483564863928827
Energy: 0.31872930165310065
Energy: 0.39566602170606885
Energy: 0.33061511349396194
Energy: 0.3499686790107601
Energy: 0.34869751011445277
Energy: 0.3293465317135341
Energy: 0.34444838367091024
Energy: 0.37248015337625556
Energy: 0.3200124218508817
Energy: 0.2800638115540515
Energy: 0.5552713734517994
Energy: 0.46812575644975934
Energy: 0.2780763320394533
Energy: 0.47693189744693887
Energy: 0.5252976191356913

minimum gb energy = 0.25354655160246375 eV
minimum distance =  1.72511878103 Angstroms
sigma value = 33


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

Energy: 0.0005901160226609334
Energy: 0.16687090070767854
Energy: 0.13999572190330734
Energy: 0.007634715718608092
Energy: 0.6892784822524319
Energy: 0.10660608887379348
Energy: 0.31718561964795106
Energy: 0.6047050798385667
Energy: 0.651066901518636
Energy: 0.9427028461022305
Energy: 0.5794681618462418
Energy: 0.7107859352352033
Energy: 0.7147208491478203
Energy: 0.6952707929376292
Energy: 0.6300197895608246
Energy: 0.6982414908931013
Energy: 0.7598658906407657
Energy: 0.5970774000009517
Energy: 0.31718561964795106
Energy: 0.6047050798385667
Energy: 0.651066901518636
Energy: 0.9427028461022305
Energy: 0.5794681618462418
Energy: 0.7107859352352033

minimum gb energy = 0.0005901160226609334 eV
minimum distance =  1.91432880311025 Angstroms
sigma value = 1