Model name: model_name=EAM_Dynamo_BonnyPasianotMalerba_2009_FeNi__MO_267721408934_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.520000994205475
cohesive_energy=4.414156524791696
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=[1.78964732194434e-19, 2.7050188982475597e-19, 3.3921283695047995e-19, 3.9445909164406796e-19, 4.404383566866e-19, 4.79493014316984e-19, 5.13098669215134e-19, 5.42258283953934e-19, 5.67694440195318e-19, 5.89947071464944e-19, 6.094327436876519e-19, 6.264863117799479e-19, 6.413753392397099e-19, 6.543209264424299e-19, 6.65508925877652e-19, 6.75094748678874e-19, 6.8321618203662e-19, 6.89986980491904e-19, 6.95508081172668e-19, 6.9987080814704995e-19, 7.03150463716848e-19, 7.054207480072259e-19, 7.06740941553642e-19, 7.0717032489155395e-19, 7.067121023742299e-19, 7.05233293341048e-19, 7.025656692454379e-19, 6.9850094712498e-19, 6.92798800484574e-19, 6.851740418833679e-19, 6.752806011684179e-19, 6.6270511676815195e-19, 6.4695091392603005e-19, 6.274107676977659e-19, 6.03341268125184e-19, 5.73829174526904e-19, 5.377433501993219e-19, 4.936626644680799e-19, 4.39794281679732e-19, 3.7385189577756e-19, 2.92884297401736e-19, 1.9303985392412399e-19, 6.92056992703032e-20, -8.54935871492106e-20, -2.8048505243121e-19, -5.2895060483193e-19, -8.497848736137959e-19, -1.27081446255612e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: -0.0364522165523 eV

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

Energy: 0.017954769015571363
Energy: 0.5413996788599926
Energy: 0.018289033291813337
Energy: 0.018246784807981354
Energy: 0.5408917249502495
Energy: 0.018487851185902033
Energy: 0.5413996788586697
Energy: 0.15278962211938152
Energy: 0.15285543320005412
Energy: 0.1528488434248304
Energy: 0.15284468798973433
Energy: 0.1543198759966626
Energy: 0.018289033287292897
Energy: 0.1528554332003481
Energy: 0.15443330665144564
Energy: 0.018331227283867907
Energy: 0.152771047546987
Energy: 0.1539764770454232
Energy: 0.018246784808312117
Energy: 0.15284884342516117
Energy: 0.01833122728324313
Energy: 0.018489938018887517
Energy: 0.1528755514564397
Energy: 0.018522040417861634
Energy: 0.5408917249502495
Energy: 0.15284468798940357
Energy: 0.15277104754665624
Energy: 0.15287555145677045
Energy: 0.15284487527472002
Energy: 0.15274903268989395
Energy: 0.018487851185571266
Energy: 0.1543198759966626
Energy: 0.1539764770454232
Energy: 0.018522040418523157
Energy: 0.152749032690188
Energy: 0.018824400352772903

minimum gb energy = 0.017954769015571363 eV
minimum distance =  2.4841156912338 Angstroms
sigma value = 1


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

Energy: 1.6422255344313916
Energy: 1.6399662682959293
Energy: 1.1352444991648325
Energy: 1.0531117864376383
Energy: 1.6408004005448167
Energy: 1.1354740939552304
Energy: 1.5104083351470317
Energy: 1.0905069810317223
Energy: 1.0189238853576192
Energy: 1.0818155565338823
Energy: 1.0918316978809897
Energy: 1.0464309756659909
Energy: 1.5329817434490873
Energy: 1.0394998310291317
Energy: 1.038967566685377
Energy: 1.055658681073231
Energy: 1.0665075212036894
Energy: 1.0711373324350553
Energy: 1.6334661352018616
Energy: 1.0421389906587761
Energy: 1.0376977472650508
Energy: 1.050874639539933
Energy: 1.0632752547775715
Energy: 1.0375534992777249
Energy: 1.512308236403155
Energy: 1.0769123586446714
Energy: 1.0935510663531998
Energy: 1.081312265541869
Energy: 1.0595039990074056
Energy: 1.093771393048333
Energy: 1.4941596658503913
Energy: 1.0944101364594938
Energy: 1.0936551565101125
Energy: 1.0736883332072877
Energy: 1.0472033514798018
Energy: 1.094887580661396
Energy: 1.4955837626218955
Energy: 1.0780956291203705
Energy: 1.0944070895077278
Energy: 1.074104589620783
Energy: 1.046278536250504
Energy: 1.093087487877485
Energy: 1.4264454447066908
Energy: 1.0473964476695707
Energy: 1.0956340543178371
Energy: 1.0019524891876452
Energy: 1.0471108852376225
Energy: 1.093739536915478
Energy: 1.2261911956324756
Energy: 1.0723841926638384
Energy: 1.0937773236542707
Energy: 1.110441800320939
Energy: 1.0567109276770543
Energy: 1.0914759406315293
Energy: 1.2205630048986031
Energy: 1.0817871992979389
Energy: 1.0898740935499727
Energy: 1.055671338529373
Energy: 1.0823342929450486
Energy: 1.0677868531789465
Energy: 1.2309833889643818
Energy: 1.017221263945092
Energy: 1.0162046285003103
Energy: 1.0962954375789313
Energy: 1.0808123611073486
Energy: 1.0569212397893823
Energy: 1.1090841177415192
Energy: 1.0523424331527598
Energy: 1.0710793927125652
Energy: 1.0627466899570313
Energy: 1.0640453856880336
Energy: 1.0389159259017324
Energy: 1.1065385541614006
Energy: 1.0738649827022333
Energy: 1.0938785437506504
Energy: 1.0924794818705243
Energy: 1.0991662963870485
Energy: 1.0192950836212757
Energy: 1.2386949828087215
Energy: 1.037732793623598
Energy: 1.0366859232027568
Energy: 1.0701096581862577
Energy: 1.0711023015484304
Energy: 1.0646809706727451
Energy: 1.1444453613277263
Energy: 1.0809918128979523
Energy: 1.0737364379889691
Energy: 1.0781309846538347
Energy: 1.0807034371861108
Energy: 1.019155860942586
Energy: 1.144329119101598
Energy: 1.0714033525945672
Energy: 1.071093398069821
Energy: 1.0876751466305945
Energy: 1.0366155617437982
Energy: 1.0713162666575344
Energy: 1.3552775725348223
Energy: 1.0753803015221481
Energy: 1.0916558187209902
Energy: 1.0386684013108547
Energy: 1.074796833711643
Energy: 1.0722088320083552
Energy: 1.3557304933604015
Energy: 1.0624212285952657
Energy: 1.1005491314447344
Energy: 1.0600326511486906
Energy: 1.0596236424709575
Energy: 1.1000098142591712
Energy: 1.3558619622215458
Energy: 1.100897080559203
Energy: 1.100300596189443
Energy: 1.0583275691176284
Energy: 1.0788462210709084
Energy: 1.0996872799063575
Energy: 1.4599750526562039
Energy: 1.101618029751407
Energy: 1.1004393688242893
Energy: 1.0575898856747716
Energy: 1.0616949195639027
Energy: 1.0993441602698897
Energy: 1.5551654627806764
Energy: 1.0392041217967776
Energy: 1.0172721920521937
Energy: 1.0785169540585275
Energy: 1.0403435405429173
Energy: 1.017387140557275
Energy: 1.5574444434693622
Energy: 1.0729315240447646
Energy: 1.0729905745629629
Energy: 1.046011065830265
Energy: 1.0711881864158699
Energy: 1.0714175487830373
Energy: 1.580737159092428
Energy: 1.0760586404367005
Energy: 1.0189939671019155
Energy: 1.0984388800738527
Energy: 1.0762852500815947
Energy: 1.0449200079924046

minimum gb energy = 1.0019524891876452 eV
minimum distance =  2.33442745905777 Angstroms
sigma value = 33


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

Energy: 1.9488301190538468
Energy: 1.1231241296698928
Energy: 1.1224770930179448
Energy: 1.1207644638742735
Energy: 1.1065232377840521
Energy: 1.2246929144985093
Energy: 1.321175521731762
Energy: 1.0749241650013666
Energy: 1.074853688870435
Energy: 1.1339420854763373
Energy: 1.0748248934865325
Energy: 1.0462530797226675
Energy: 1.2205319958631702
Energy: 1.0940310485184368
Energy: 1.1228173372975156
Energy: 1.188948428951134
Energy: 1.0919790555600704
Energy: 1.0468439156341298
Energy: 1.5799639540041845
Energy: 1.2218281070710963
Energy: 1.1203980851146529
Energy: 1.1585141261459866
Energy: 1.2145883802758104
Energy: 1.1438122283966266
Energy: 1.3222945285166194
Energy: 1.1081246716850324
Energy: 1.1189315206643684
Energy: 1.1232520586797312
Energy: 1.1077173507227058
Energy: 1.1514616097888164
Energy: 1.535915202448823
Energy: 1.2591143106145701
Energy: 1.1036537037582266
Energy: 1.127884863465428
Energy: 1.2413894250354776
Energy: 1.1664559764477556
Energy: 1.5341313236350709
Energy: 1.2543857762680404
Energy: 1.2655312131111014
Energy: 1.1932614149583955
Energy: 1.149795103185404
Energy: 1.1846015858411634
Energy: 1.2398615908310715
Energy: 1.1937826565017273
Energy: 1.1950802438886072
Energy: 1.1360534982790202
Energy: 1.1936364244633073
Energy: 1.197049475684621
Energy: 1.2986023715986714
Energy: 1.19416426377352
Energy: 1.204085806155732
Energy: 1.2083077150174681
Energy: 1.1411693743196438
Energy: 1.201446935289642
Energy: 1.2979397073600267
Energy: 1.1961959100530555
Energy: 1.20962000703474
Energy: 1.1571660034727382
Energy: 1.166524044772615
Energy: 1.1738669366929766
Energy: 1.259717443715695
Energy: 1.083453364962408
Energy: 1.0832728429549565
Energy: 1.1810382049886374
Energy: 1.034870037716571
Energy: 1.0344190290724917
Energy: 1.1928578562132963
Energy: 1.1079651538580504
Energy: 1.156437061553306
Energy: 1.1597049860580912
Energy: 1.0678248079687345
Energy: 1.143937054573209
Energy: 1.1998722203142322
Energy: 1.2943398408489868
Energy: 1.194431346818459
Energy: 1.1889653919504741
Energy: 1.2115821478340607
Energy: 1.1401704659643133
Energy: 1.1984789732047072
Energy: 1.1431947318085922
Energy: 1.1432522150122477
Energy: 1.2244991798546212
Energy: 1.1429475792703891
Energy: 1.1590728520721632
Energy: 1.2214021635498842
Energy: 1.1949213950029232
Energy: 1.1639568581283457
Energy: 1.1974425078349593
Energy: 1.1961108336880149
Energy: 1.2149262661324731
Energy: 1.252696683035687
Energy: 1.2564112835226486
Energy: 1.2572142826538661
Energy: 1.1865430214632884
Energy: 1.1852433067585157
Energy: 1.186567283279905
Energy: 1.2760192235545869
Energy: 1.2396287640946573
Energy: 1.238083423090469
Energy: 1.2405415401532183
Energy: 1.241404231067323
Energy: 1.2381743261149467
Energy: 1.409099434045784
Energy: 1.1926905118120494
Energy: 1.2326473347463123
Energy: 1.1928342532829883
Energy: 1.145456674306479
Energy: 1.1964862772689067
Energy: 1.1880032140303232
Energy: 1.2925349096533043
Energy: 1.288966465924148
Energy: 1.138959265451551
Energy: 1.294014368247205
Energy: 1.2818881308856251
Energy: 1.2527752471380829
Energy: 1.2901280273175306
Energy: 1.2842662249000443
Energy: 1.2335113722933664
Energy: 1.291081319482593
Energy: 1.2740428171009892
Energy: 1.6589080801146536
Energy: 1.173332043814991
Energy: 1.033588212772169
Energy: 1.035608103346878
Energy: 1.1670875973442474
Energy: 1.0336934954538135
Energy: 1.1161413064400991
Energy: 1.2375646616240499
Energy: 1.2371502931249017
Energy: 1.0679478736117034
Energy: 1.245667636390992
Energy: 1.2192025168648986
Energy: 1.4090450734299838
Energy: 1.2764297767552493
Energy: 1.2757599280926737
Energy: 1.2972593707950353
Energy: 1.2765705437949868
Energy: 1.2213248884941523
Energy: 1.6492951857912275
Energy: 1.2599624564672192
Energy: 1.3089589681956353
Energy: 1.1412171981053043
Energy: 1.261860243220317
Energy: 1.206764114028014
Energy: 1.4215846300177768
Energy: 1.2881904012332626
Energy: 1.288716306837906
Energy: 1.2794622158267261
Energy: 1.287314378285821
Energy: 1.241459516399199
Energy: 1.1575294700864631
Energy: 1.252686259654025
Energy: 1.2554791771586709
Energy: 1.2499318078644546
Energy: 1.2535241876932257
Energy: 1.2554812031122862
Energy: 1.2163035357885557
Energy: 1.154093709698326
Energy: 1.1539800260464503
Energy: 1.182565850427334
Energy: 1.2496245238664951
Energy: 1.1595773989119629
Energy: 1.1805866386234285
Energy: 1.1938488729635945
Energy: 1.1964008665490284
Energy: 1.1508253822774432
Energy: 1.1928797741601456
Energy: 1.2837592880310889
Energy: 1.2943972290614394
Energy: 1.1940183403081337
Energy: 1.1948694246726852
Energy: 1.2261440902370027
Energy: 1.1935893959356985
Energy: 1.1913242063679028
Energy: 1.293523451497065
Energy: 1.2121020215296674
Energy: 1.1877148792534733
Energy: 1.2156542336128078
Energy: 1.2605070992356668
Energy: 1.1934430690341558
Energy: 1.2905205815952892
Energy: 1.033645920256996
Energy: 1.0334830814349714
Energy: 1.1585321680970122
Energy: 1.0840722147303268
Energy: 1.082262882041242
Energy: 1.2060078141645194
Energy: 1.0190942270247945
Energy: 1.025485676831977
Energy: 1.1734528434993228
Energy: 1.070217947842167
Energy: 1.1374201736012064
Energy: 1.2035936878014475
Energy: 1.1870030904989528
Energy: 1.131610413565733
Energy: 1.2038492073235143
Energy: 1.3029651199936747
Energy: 1.187053480666642
Energy: 1.2118410582961119
Energy: 1.141206756433048
Energy: 1.126049986075099
Energy: 1.2121420165345977
Energy: 1.1414915578698128
Energy: 1.1658053476066297
Energy: 1.2370113217027365
Energy: 1.2077199584739697
Energy: 1.2174530886379609
Energy: 1.1753256603947015
Energy: 1.2059711527505095
Energy: 1.222606762822006
Energy: 1.3280954714084907
Energy: 1.1911168612848355
Energy: 1.192437166690912
Energy: 1.257864710727117
Energy: 1.2441767495764475
Energy: 1.2596108112211304
Energy: 1.1820948532877964
Energy: 1.17704432048679
Energy: 1.0779830066657015
Energy: 1.097390841719976
Energy: 1.0930883552964168
Energy: 1.2634263486573887
Energy: 1.1902480532535937
Energy: 1.2239806255973702
Energy: 1.1157706807951921
Energy: 1.1391909049135318
Energy: 1.0634604999694612
Energy: 1.2789001568913612
Energy: 1.4061609509023454
Energy: 1.1194068176197687
Energy: 1.1179569766796211
Energy: 1.193120924927602
Energy: 1.1102767745965296
Energy: 1.1956054543278176
Energy: 1.298381661002003
Energy: 1.1386010039384729
Energy: 1.1076630884144343
Energy: 1.1234089229911868
Energy: 1.139124237157528
Energy: 1.1007440454891706
Energy: 1.1947066640161805
Energy: 1.0543809872466157
Energy: 1.0333716014848353
Energy: 1.0353328656021032
Energy: 1.0747067284461007
Energy: 1.1316294229755244

minimum gb energy = 1.0190942270247945 eV
minimum distance =  2.2877880272267 Angstroms
sigma value = 51


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

Energy: 1.7100635062051321
Energy: 1.1399405488776322
Energy: 1.0830308368276467
Energy: 1.0824897105715323
Energy: 1.1396485930424254
Energy: 1.136172586510628
Energy: 1.318230279819633
Energy: 1.0860995604022854
Energy: 1.0858653611900941
Energy: 1.090731137955295
Energy: 1.1179259507743762
Energy: 1.0856328788430283
Energy: 1.5323935307627525
Energy: 1.085055536839455
Energy: 1.0712190668867343
Energy: 1.0892165751397704
Energy: 1.087222369851383
Energy: 1.0718624835415365
Energy: 1.531550830463192
Energy: 1.0718194678690343
Energy: 1.0711389965962281
Energy: 1.0890571818662738
Energy: 1.0840301718253351
Energy: 1.087589211163081
Energy: 1.318133778084131
Energy: 1.1200271185038837
Energy: 1.11871829995437
Energy: 1.086832484803801
Energy: 1.1407599644184547
Energy: 1.1181835494031311
Energy: 1.3182845190496393
Energy: 1.1202083997996202
Energy: 1.118110829944901
Energy: 1.1217649235471396
Energy: 1.1201969108709904
Energy: 1.1175245811067998
Energy: 1.3175634964171479
Energy: 1.1213783904705625
Energy: 1.1189480874344198
Energy: 1.1429762310107092
Energy: 1.087922266181095
Energy: 1.1181345775962177
Energy: 1.3306511767988218
Energy: 1.0633183275370672
Energy: 1.062972191404397
Energy: 1.0838847115391153
Energy: 1.0633888126272792
Energy: 1.0625317501947014
Energy: 1.1364169163604767
Energy: 1.063401538367554
Energy: 1.0633129654530986
Energy: 1.0863614384106506
Energy: 1.0633136290387135
Energy: 1.0707200822742018
Energy: 1.137084208839602
Energy: 1.0957180935171125
Energy: 1.0622407553257316
Energy: 1.1186177049641477
Energy: 1.066355699163268
Energy: 1.0861003498524149
Energy: 1.1660315478883976
Energy: 1.0442222103483978
Energy: 1.0619452408945913
Energy: 1.0680660589642876
Energy: 1.0426705167773547
Energy: 1.0687743531046854
Energy: 1.1796324262741333
Energy: 1.119869129293955
Energy: 1.082081447537601
Energy: 1.1040352705896264
Energy: 1.1089463140886942
Energy: 1.0607884306941953
Energy: 1.1784209549910547
Energy: 1.0899373572740552
Energy: 1.0892809312247311
Energy: 1.1046482892116931
Energy: 1.0901408190456976
Energy: 1.0903438268849133
Energy: 1.1800442008424414
Energy: 1.0969022702491724
Energy: 1.0468530678016474
Energy: 1.1068574653461598
Energy: 1.0971068691645007
Energy: 1.0431358822669021
Energy: 1.4044705641773803
Energy: 1.0913156814004306
Energy: 1.0891310566681296
Energy: 1.1039554805233711
Energy: 1.0906487770335342
Energy: 1.0892469265563263
Energy: 1.41020771568364
Energy: 1.1093317313146513
Energy: 1.092067101806625
Energy: 1.1093550786324318
Energy: 1.108361543996974
Energy: 1.1084647974638238
Energy: 1.4375873778093158
Energy: 1.1075867420421028
Energy: 1.107170490908363
Energy: 1.1150929265340788
Energy: 1.1071259785867273
Energy: 1.0920243739826323
Energy: 1.65616851411987
Energy: 1.1050394734131885
Energy: 1.0658077162700146
Energy: 1.0610996708493043
Energy: 1.1050302080338883
Energy: 1.041529381033661

minimum gb energy = 1.041529381033661 eV
minimum distance =  2.33867713702455 Angstroms
sigma value = 19


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

Energy: 1.4411559568886776
Energy: 1.0380925001585464
Energy: 1.0292365220007815
Energy: 1.1792286704248456
Energy: 1.0561824265656252
Energy: 1.031813740029624
Energy: 1.245342964122174
Energy: 1.0577079764840818
Energy: 1.047617774594837
Energy: 1.0502500761238511
Energy: 1.0569994347814093
Energy: 1.033334939043746
Energy: 1.554899151801382
Energy: 1.0579750188334553
Energy: 1.0578128559349165
Energy: 1.074675881006114
Energy: 1.0565381547842803
Energy: 1.0570644521211037
Energy: 1.234109935885884
Energy: 1.056647767205146
Energy: 1.056928671179152
Energy: 1.0608404686256243
Energy: 1.0566446705343124
Energy: 1.0515318066937842
Energy: 1.243861496052999
Energy: 1.056309770573842
Energy: 1.0804528188619085
Energy: 1.077781189558273
Energy: 1.0561376387523553
Energy: 1.0823164245343313
Energy: 1.2441365841041194
Energy: 0.9659059262992659
Energy: 1.0715825313324479
Energy: 1.0755734099732976
Energy: 0.997717144396526
Energy: 1.0698806834641983
Energy: 1.2436907204610173
Energy: 1.073211921453201
Energy: 1.0721804528973575
Energy: 1.0739697795439556
Energy: 1.007312871895912
Energy: 1.0709565331661433
Energy: 1.1984349791076816
Energy: 0.9657825161319841
Energy: 0.9657113404773803
Energy: 1.1973185366325771
Energy: 0.9661057195827597
Energy: 0.9655142803388133
Energy: 1.0575313112911777
Energy: 0.965707780337967
Energy: 0.9654508263556285
Energy: 1.057355812841295
Energy: 0.9653874270405727
Energy: 0.9656079209794696
Energy: 1.0565157625493262
Energy: 1.038721254253557
Energy: 1.0338359363254175
Energy: 1.0566469889386751
Energy: 1.0761285757678896
Energy: 1.0569974876279977
Energy: 1.0568199787860415
Energy: 1.0257365206301567
Energy: 1.0266609727425886
Energy: 1.0568701045068434
Energy: 1.0253922454522248
Energy: 1.0500174326958478
Energy: 1.2429190019046712
Energy: 1.0763898412756008
Energy: 1.0735945140422558
Energy: 1.0570041647726696
Energy: 1.0759599835964961
Energy: 1.0569067913461034
Energy: 1.0217654511083771
Energy: 1.0737897808487709
Energy: 1.0606657931348875
Energy: 1.0218365295769622
Energy: 1.0744910259244198
Energy: 1.0437831328648508
Energy: 1.2441829825342996
Energy: 1.0766167555715525
Energy: 1.0761155048891378
Energy: 1.057030501174118
Energy: 1.0755469735414445
Energy: 1.0755705008422474
Energy: 1.4506149935700647
Energy: 1.0340036408784936
Energy: 1.0339056432388625
Energy: 0.9655739437423284
Energy: 1.0337578439560609
Energy: 0.9657468092568865
Energy: 1.4480903308168012
Energy: 1.0581082340678842
Energy: 0.9655042119989025
Energy: 0.9670613242970068
Energy: 1.0573506797352452
Energy: 0.965763141640843
Energy: 1.2425190594945257
Energy: 1.0569208196559567
Energy: 1.0567211780238175
Energy: 1.0748648716021327
Energy: 1.0565017040535387
Energy: 1.0397227219833658
Energy: 1.2303142070518085
Energy: 1.056870314850294
Energy: 1.0565317894848136
Energy: 1.025475640095166
Energy: 1.0565436792996208
Energy: 1.0562183734537618
Energy: 1.230308195114459
Energy: 1.0568879098039743
Energy: 1.0569157678727539
Energy: 1.0268888404643193
Energy: 1.0567102145825493
Energy: 1.0526720195641703
Energy: 1.2445097632866866
Energy: 0.9656521153105853
Energy: 1.0794164220226876
Energy: 1.0619229263392984
Energy: 0.9984220820421517
Energy: 1.0764620182204896
Energy: 1.2385596730565993
Energy: 1.0674541949706422
Energy: 1.0743162304348308
Energy: 1.0768067640563772
Energy: 1.0565008046812305
Energy: 1.0759060562861251
Energy: 1.2432534240937163
Energy: 1.0617023462833832
Energy: 1.0713335389953553
Energy: 1.0734522930533017
Energy: 1.0764441935718612
Energy: 1.072590342387304
Energy: 1.1996805688510352
Energy: 0.9682100283381533
Energy: 0.9665942791736167
Energy: 1.200054634274526
Energy: 0.9666583635339913
Energy: 1.028782856281695
Energy: 1.0570916229216833
Energy: 1.024221431127645
Energy: 1.0340294763352504
Energy: 1.0572460814454134
Energy: 1.017683899937458
Energy: 1.0408121724896453
Energy: 1.0575084188499932
Energy: 1.0304513860545403
Energy: 1.0332852160376942
Energy: 1.0569225290291695
Energy: 1.076655868696889
Energy: 1.0574148434786401
Energy: 1.2021524443312779
Energy: 1.0252355515690748
Energy: 1.0257347618346297
Energy: 1.2022444386986417
Energy: 1.0282933497704627
Energy: 1.0564983402670391
Energy: 1.243129396202845
Energy: 1.075225770692229
Energy: 1.0741451534911408
Energy: 1.0734970665668095
Energy: 1.0771889205189942
Energy: 1.0858221271341304
Energy: 1.0225951613166961
Energy: 1.0736598710894623
Energy: 1.0702661640354831
Energy: 1.0215753283188764
Energy: 1.0748087009882938
Energy: 1.0708280980719527
Energy: 1.2010507588303918
Energy: 1.0734011584988572
Energy: 1.0715127089018153
Energy: 1.0116242428773468
Energy: 1.0740551647951233
Energy: 1.070605700217973
Energy: 1.4488510731806172
Energy: 1.0335795959736425
Energy: 0.9653568934775283
Energy: 0.9664430326618788
Energy: 1.0329034730863247
Energy: 0.9656254752082544

minimum gb energy = 0.9653568934775283 eV
minimum distance =  2.38473212815 Angstroms
sigma value = 27


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

Energy: 1.2364026178563827
Energy: 1.115945675493621
Energy: 1.346747946715151
Energy: 1.0586240125443087
Energy: 1.0639415069521059
Energy: 1.227034360416738
Energy: 1.232029148055753
Energy: 1.042026052081343
Energy: 1.041214525521235
Energy: 0.9691722745374945
Energy: 1.0367934176128142
Energy: 0.9665584402709395
Energy: 1.1145595689060943
Energy: 1.0606807907508926
Energy: 1.0376227908055846
Energy: 0.9675030929837483
Energy: 1.0624344929970357
Energy: 0.9685140786623824
Energy: 1.116491956920604
Energy: 1.03625050544547
Energy: 1.0016718229537587
Energy: 0.9690226217604
Energy: 1.0206847558995769
Energy: 0.9700139440245483
Energy: 1.2327781991415885
Energy: 0.9218838047515189
Energy: 0.9660590577926259
Energy: 1.0350370525112231
Energy: 0.9215387534390291
Energy: 0.9662356856950101
Energy: 1.0617477461222564
Energy: 0.9219300079405278
Energy: 0.921274956444627
Energy: 1.034179485681879
Energy: 0.921641937929144
Energy: 0.921475214093869
Energy: 1.06696492748823
Energy: 0.9668197561453629
Energy: 0.9678258401427674
Energy: 1.0671662606952927
Energy: 0.9666864297767331
Energy: 0.9667122577798235
Energy: 1.0685755865811415
Energy: 0.963387206720621
Energy: 0.9625305108229529
Energy: 1.0684694822829248
Energy: 0.9626135949690012
Energy: 0.9650888984790986
Energy: 1.1150154380179573
Energy: 0.9630102648178167
Energy: 0.9583417681812967
Energy: 1.0663397928045208
Energy: 0.9614924775798842
Energy: 0.9664511186942756
Energy: 0.9816991216636498
Energy: 0.9741136971344625
Energy: 0.9709156978573734
Energy: 0.9780222799924371
Energy: 0.9683064446458645
Energy: 0.9720330956383154
Energy: 1.1147472768971738
Energy: 1.034639846174286
Energy: 0.9683604426908746
Energy: 0.9759157012002243
Energy: 1.044764146670726
Energy: 0.9754013109898841
Energy: 1.1115990182911935
Energy: 0.9672221019804979
Energy: 0.9663387743601252
Energy: 0.9675468169287141
Energy: 1.0370506442514944
Energy: 0.966308991173555

minimum gb energy = 0.921274956444627 eV
minimum distance =  2.33656887965384 Angstroms
sigma value = 9


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

Energy: 2.0088112429526697
Energy: 0.985917526431843
Energy: 0.8681781590208263
Energy: 1.0131342950250826
Energy: 0.9858519643251271
Energy: 0.9105561957300744
Energy: 1.0185528018925927
Energy: 0.9069036082516141
Energy: 0.9038126103671796
Energy: 0.886849454909067
Energy: 0.9054635296959952
Energy: 0.8828412240169679
Energy: 0.9491320238031846
Energy: 0.9054692354087982
Energy: 0.884996132422711
Energy: 0.8999175423553449
Energy: 0.9242000507520369
Energy: 0.8845771405493152
Energy: 0.9494815046185042
Energy: 0.8852196479991638
Energy: 0.8680270526662102
Energy: 0.8997158022580316
Energy: 0.932555182001965
Energy: 0.8664974587975173
Energy: 1.0131311825297056
Energy: 0.9104582038732639
Energy: 0.8845454660149421
Energy: 0.9359177020295095
Energy: 0.9091661760385676
Energy: 0.9031183184122303
Energy: 0.9521692924385096
Energy: 0.8850618937020844
Energy: 0.9024660560323168
Energy: 0.9516118122441313
Energy: 0.8755446542151842
Energy: 0.8430248369582751
Energy: 0.954240931454491
Energy: 0.8688691934132009
Energy: 0.8685922197158268
Energy: 0.9551986722263162
Energy: 0.9131972135355163
Energy: 0.9267284625976233
Energy: 0.933344807230261
Energy: 0.9175823444986588
Energy: 0.9276028246956952
Energy: 0.9332243856000566
Energy: 0.8959835885313538
Energy: 0.8638535179132205
Energy: 0.9217945888266568
Energy: 0.9311205322902688
Energy: 0.8686124383170059
Energy: 0.9420584613709069
Energy: 0.9310019098920304
Energy: 0.8686080313052604
Energy: 0.8746436615416162
Energy: 0.9117823734239674
Energy: 0.8678846262097567
Energy: 0.8714533749866821
Energy: 0.9393941876640228
Energy: 0.8846033917991397
Energy: 0.8749975036607165
Energy: 0.9567650895696814
Energy: 0.9527154255712021
Energy: 0.8734093062724664
Energy: 0.9601005576901627
Energy: 0.9048228876480492
Energy: 0.9220337306977007
Energy: 0.9545480974186641
Energy: 0.9544190195850767
Energy: 0.8846468050870384
Energy: 0.9541417555670816
Energy: 0.8692796323696454
Energy: 1.7536559956082614
Energy: 1.0632227956636875
Energy: 0.8925186997105962
Energy: 0.8662764835603947
Energy: 0.9486303208460249
Energy: 0.9493661771317079
Energy: 1.0279813438463523
Energy: 0.954518650054801
Energy: 0.8928260368393687
Energy: 0.8845428616569597
Energy: 0.954788669771808
Energy: 0.9055319440341957
Energy: 0.925302322720095
Energy: 0.911620690088288
Energy: 0.9141191581298621
Energy: 0.9072495465000697
Energy: 0.9155682271054354
Energy: 0.870497102389223
Energy: 0.9247747786631145
Energy: 0.8731509549709489
Energy: 0.8826959703571369
Energy: 0.923420259591384
Energy: 0.9231834134048001
Energy: 0.8995726166114981
Energy: 0.9229835096363203
Energy: 0.8821604213188987
Energy: 0.8667091393603276
Energy: 0.9044366699556962
Energy: 0.8818893256346968
Energy: 0.8872361737463802
Energy: 0.9490443659620668
Energy: 0.916015268374153
Energy: 0.8872449688732483
Energy: 0.9040026232085135
Energy: 0.8911764688347862
Energy: 0.9051415569036262
Energy: 0.9498151298885842
Energy: 0.8879767572607125
Energy: 0.88581423512978
Energy: 0.9051850255420285
Energy: 0.8881641962324743
Energy: 0.8756036484948329
Energy: 0.948132523743656
Energy: 0.8810543663505578
Energy: 0.8873729215472975
Energy: 0.8820665671851533
Energy: 0.8803644703371674
Energy: 0.8805650809034052
Energy: 0.9482980319595329
Energy: 0.8749192488950271
Energy: 0.875181060693663
Energy: 0.8941821397174252
Energy: 0.8729665700725543
Energy: 0.8743472484380806
Energy: 0.998227476995421
Energy: 0.9059959350340909
Energy: 0.9598568784274192
Energy: 0.9104159804096961
Energy: 0.9040217191681257
Energy: 0.897760391189268
Energy: 0.9932563518774796
Energy: 0.9046077971179975
Energy: 0.9068618922771196
Energy: 0.9099387514612662
Energy: 0.923634175020682
Energy: 0.8415080516405761
Energy: 0.9485236894727547
Energy: 0.9064867944312726
Energy: 0.896393082102944
Energy: 0.9368533989146377
Energy: 0.9070839009838095
Energy: 0.9005060465949938
Energy: 1.2589993078442905
Energy: 0.8633388291818449
Energy: 0.8830607246952276
Energy: 0.8667048883020001
Energy: 0.9036990712790525
Energy: 0.9269439082540619
Energy: 0.9477025514950496
Energy: 0.8855875283229644
Energy: 0.869511645419511
Energy: 0.9556304972549191
Energy: 0.8855143578608591
Energy: 0.9075931487716974
Energy: 0.8870284141551834
Energy: 0.8742455465711138
Energy: 0.8845841512642177
Energy: 0.8868128167720745
Energy: 0.8740908783258075
Energy: 0.9086408433292006
Energy: 0.9559892073458787
Energy: 0.8682080600271561
Energy: 0.8695529790981964
Energy: 0.9544127672068591
Energy: 0.8854026851376148
Energy: 0.9217765363052591
Energy: 0.9547153046111192
Energy: 0.9032019743324933
Energy: 0.8689945662966413
Energy: 0.9549699976525947
Energy: 0.9029853029090071
Energy: 0.958416099823356
Energy: 0.9214500314409099
Energy: 0.8891543979949871
Energy: 0.8685961349165672
Energy: 0.9709944502742867
Energy: 0.894948002864194
Energy: 0.86749637580259
Energy: 0.8752185934830521
Energy: 0.9322102350528815
Energy: 0.8706973996552086
Energy: 0.907389256896467
Energy: 0.9313998307619568
Energy: 0.9047793219272504
Energy: 0.8815683272186656
Energy: 0.9030295293894025
Energy: 0.8880721018213134
Energy: 0.8724785061159326
Energy: 0.9368745653148984
Energy: 0.8835593618696634
Energy: 0.9407821528194023
Energy: 0.9553042898549183
Energy: 0.9542072073202
Energy: 0.9405746914633513
Energy: 0.9551111937197492
Energy: 0.8692257296212306
Energy: 0.9402435900442091
Energy: 0.9541986370349019
Energy: 0.9539691378191935
Energy: 0.9001365359320526
Energy: 0.9540658357772316
Energy: 0.8658660763257997
Energy: 0.935493753708866
Energy: 0.9196470948064583
Energy: 0.9081615001523548
Energy: 0.8992222836035568
Energy: 0.9542671984454322
Energy: 0.9018483603054274
Energy: 0.9388368086430332
Energy: 0.9171913298229855
Energy: 0.8672202808124343
Energy: 0.95087604981789
Energy: 0.9154276455859137
Energy: 0.8660483285397171
Energy: 0.9234643853394189
Energy: 0.9192561966204232
Energy: 0.8842131061580198
Energy: 0.9052608324040372
Energy: 0.9177357259448757
Energy: 0.8975599461975295
Energy: 0.9230207568774655
Energy: 0.8857168467104599
Energy: 0.883491825116269
Energy: 0.9071068426956214
Energy: 0.884417588765575
Energy: 0.8974447528247289
Energy: 0.9694677258803402
Energy: 0.867496752801072
Energy: 0.9041311912792677
Energy: 1.0007344548951516
Energy: 0.8683810134903338
Energy: 0.8909983682819549
Energy: 0.947292321652377
Energy: 0.8844415129069643
Energy: 0.8833565659869719
Energy: 0.9063922403620953
Energy: 0.8845610788220432
Energy: 0.8738436184833167
Energy: 0.9470956354902205
Energy: 0.8848060869342051
Energy: 0.8768317555768018
Energy: 0.8778307855726477
Energy: 0.8850132150067572
Energy: 0.8810659117581042
Energy: 0.9501981770013416
Energy: 0.8814391592333529
Energy: 0.8754401439228034
Energy: 0.8971288241678809
Energy: 0.9047949254583822
Energy: 0.8705145059602691
Energy: 0.9937124762889274
Energy: 0.9046639609734946
Energy: 0.894734198674523
Energy: 0.9100324312202305
Energy: 0.9040613899981229
Energy: 0.8416323202805636

minimum gb energy = 0.8415080516405761 eV
minimum distance =  2.32666659517828 Angstroms
sigma value = 57


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

Energy: 0.42785790956731007
Energy: 0.4906094816943945
Energy: 0.4440191959207073
Energy: 0.43049152040212507
Energy: 0.4903142445939335
Energy: 0.4303720240487632
Energy: 0.5486602675924946
Energy: 0.4551398247733609
Energy: 0.4559666395348305
Energy: 0.48746752970063817
Energy: 0.4904039188694771
Energy: 0.47308811574038045
Energy: 0.5527957578930918
Energy: 0.4922732763318829
Energy: 0.504977638213382
Energy: 0.4900561446615271
Energy: 0.49145472453351574
Energy: 0.4563884448005439
Energy: 0.5531244785762237
Energy: 0.4930630104273993
Energy: 0.5029564668560851
Energy: 0.49076206589387733
Energy: 0.5532620481689888
Energy: 0.4559393677883743
Energy: 0.5476358681063375
Energy: 0.431343803163967
Energy: 0.4664095900056297
Energy: 0.5506883378398105
Energy: 0.42960015489215236
Energy: 0.4564941696292718
Energy: 0.4912993345123363
Energy: 0.42995752140404003
Energy: 0.43130196298103657
Energy: 0.4538071558670312
Energy: 0.4291516423033286
Energy: 0.46352767362222713
Energy: 0.4846587251329517
Energy: 0.4548749139543266
Energy: 0.4556394684192633
Energy: 0.48606006630838866
Energy: 0.4536408911922108
Energy: 0.47567427925388106
Energy: 0.49158923295648577
Energy: 0.5039431553722244
Energy: 0.4992571028670761
Energy: 0.49187066033981786
Energy: 0.45538600639978805
Energy: 0.5028721183036229
Energy: 0.5469647682558548
Energy: 0.49314658254737925
Energy: 0.45951066890047165
Energy: 0.4908000912015171
Energy: 0.4896264685978943
Energy: 0.4574062733683863
Energy: 0.4286809050478544
Energy: 0.4935461985756861
Energy: 0.47579178410118617
Energy: 0.42899404640652233
Energy: 0.4894367621626467
Energy: 0.4638085505204029
Energy: 0.4287810038143938
Energy: 0.4547943460097333
Energy: 0.4555756844118747
Energy: 0.4291196980373958
Energy: 0.4534050529581469
Energy: 0.4658997079499744
Energy: 0.5502071794774381
Energy: 0.4919800321006655
Energy: 0.45706651162267553
Energy: 0.4884958311433592
Energy: 0.4897923750210702
Energy: 0.45870774970444855
Energy: 0.5530537374913811
Energy: 0.5536133812579305
Energy: 0.5500754548305274
Energy: 0.4941617342087812
Energy: 0.5532700897219981
Energy: 0.550197603827204
Energy: 0.5483235431569794
Energy: 0.4917211598538811
Energy: 0.4985388779717842
Energy: 0.49083560631775613
Energy: 0.48969003951809653
Energy: 0.4558103995051721
Energy: 0.552694163505452
Energy: 0.4295303508698028
Energy: 0.42998453060133307
Energy: 0.49142748500861533
Energy: 0.43372214356643046
Energy: 0.4310789178079552
Energy: 0.48852462628486226
Energy: 0.45680530328183633
Energy: 0.475834110347082
Energy: 0.48953445538605955
Energy: 0.430039795226341
Energy: 0.4563375470780171
Energy: 0.49078823556076706
Energy: 0.5003050397937135
Energy: 0.47596117865834037
Energy: 0.49096230394318463
Energy: 0.4907412642217076
Energy: 0.4588514233933736
Energy: 0.5518025438726751
Energy: 0.5031769872027132
Energy: 0.4982337920935444
Energy: 0.5521839745948747
Energy: 0.49267486475211436
Energy: 0.45703009042859194
Energy: 0.42874142146127653
Energy: 0.4554194515413947
Energy: 0.45581774522723717
Energy: 0.4291693559528553
Energy: 0.4938875488983047
Energy: 0.4575682622563306

minimum gb energy = 0.42785790956731007 eV
minimum distance =  2.37129803332468 Angstroms
sigma value = 11


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

Energy: 1.647360394923689
Energy: 0.9237801747876051
Energy: 0.8809874688520429
Energy: 0.7957601180900793
Energy: 0.9234963477523277
Energy: 0.8833470254709752
Energy: 0.7323108120465616
Energy: 0.7811769276668866
Energy: 0.7636323149260305
Energy: 0.7502901184609491
Energy: 0.739482357682182
Energy: 0.7369653225739788
Energy: 0.737277496494347
Energy: 0.7552842868413574
Energy: 0.7446055241617083
Energy: 0.7390552364937992
Energy: 0.7498423770425634
Energy: 0.7450697606072526
Energy: 0.7365873763000745
Energy: 0.7671152106925999
Energy: 0.7714694677500235
Energy: 0.7378397924550221
Energy: 0.7383420922406699
Energy: 0.7459130752192709
Energy: 0.7321475642201035
Energy: 0.8493687907037135
Energy: 0.7928392695990815
Energy: 0.7586814660193008
Energy: 0.76601308274681
Energy: 0.7448629497477116
Energy: 0.7936769025567162
Energy: 0.817862890115102
Energy: 0.8037697282318103
Energy: 0.762556135028083
Energy: 0.7569158437589181
Energy: 0.8042782882837993
Energy: 0.7950155349038579
Energy: 0.7476499964673625
Energy: 0.7530435115967783
Energy: 0.7338664861262476
Energy: 0.7516223578639795
Energy: 0.7494541668245921
Energy: 0.754986621867851
Energy: 0.7599090935646562
Energy: 0.760101681243722
Energy: 0.7539187408521956
Energy: 0.758029731659872
Energy: 0.7684540315494742
Energy: 0.796218958755746
Energy: 0.7595755347675852
Energy: 0.7406361558518549
Energy: 0.7818286235053896
Energy: 0.7379624121046385
Energy: 0.750010812967699
Energy: 1.0149351150845773
Energy: 0.7982791662624937
Energy: 0.7883448016462924
Energy: 0.7443299111142935
Energy: 0.7816656549212113
Energy: 0.8038977586702761
Energy: 0.8447114411423914
Energy: 0.7951238548695362
Energy: 0.7886068100491989
Energy: 0.7615418048457434
Energy: 0.8109058718471952
Energy: 0.7934878636257287
Energy: 0.9209886491315545
Energy: 0.7200657975316007
Energy: 0.7380456428996569
Energy: 0.8334680922971818
Energy: 0.7165558326009641
Energy: 0.7668987298134345
Energy: 0.8697358001386176
Energy: 0.709929791566653
Energy: 0.7861226846154643
Energy: 0.7629628055949933
Energy: 0.7188995647834395
Energy: 0.759820896481567
Energy: 0.8698920780593034
Energy: 0.8515812398671082
Energy: 0.852921489774752
Energy: 0.7639577068958385
Energy: 0.8023584164078023
Energy: 0.8520438360059928
Energy: 0.8742793902836677
Energy: 0.7711354732926963
Energy: 0.7918237249901848
Energy: 0.8018692861913548
Energy: 0.7533275880578248
Energy: 0.8116159502899227
Energy: 1.0927641950312443
Energy: 0.8536671611225006
Energy: 0.8522654313435535
Energy: 0.8025259821079044
Energy: 0.8053209799429194
Energy: 0.8535643265094162
Energy: 1.1568829477376452
Energy: 0.812212971052516
Energy: 0.7679180927157191
Energy: 1.0230836086034985
Energy: 0.8274573061398014
Energy: 0.7342090418116003
Energy: 1.3706743721262347
Energy: 0.8060025120296695
Energy: 0.7911297514582346
Energy: 0.7605802975612954
Energy: 0.8025019698780017
Energy: 0.8533169799883481
Energy: 1.1022678601727272
Energy: 0.7686844030051229
Energy: 0.7603888874728985
Energy: 0.7370835275093452
Energy: 0.761162246100347
Energy: 0.8064432181585488
Energy: 0.9552683531185785
Energy: 0.905655314024144
Energy: 0.7632408470592791
Energy: 0.9388280884410524
Energy: 0.7645071613510735
Energy: 0.7613512307314197
Energy: 1.093271849687479
Energy: 0.8192902612927003
Energy: 0.7943737067322539
Energy: 0.8050635363016425
Energy: 0.8498945958604688
Energy: 0.8042305757578484
Energy: 1.0492711484604578
Energy: 0.7360852165053475
Energy: 0.7685234257673329
Energy: 1.1128880721462127
Energy: 0.7335970157836501
Energy: 0.8610772984961236
Energy: 0.7362110590555
Energy: 0.8082680568368562
Energy: 0.7946476642663707
Energy: 0.7376562936449951
Energy: 0.7631901420008629
Energy: 0.8027137839585169
Energy: 0.7351960989771997
Energy: 0.7344531065323096
Energy: 0.7450406459375347
Energy: 0.735228716216691
Energy: 0.7418519980519982
Energy: 0.7461528456267974
Energy: 0.8596997899070739
Energy: 0.7436881799834296
Energy: 0.7461224657799727
Energy: 0.8036108596041981
Energy: 0.7378414654807247
Energy: 0.7609403132066058
Energy: 0.8382985077634799
Energy: 0.7577260865776496
Energy: 0.7420015640159883
Energy: 0.7613106981478184
Energy: 0.7617017101575636
Energy: 0.7139133630990033

minimum gb energy = 0.709929791566653 eV
minimum distance =  2.33656131351142 Angstroms
sigma value = 41


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

Energy: 1.5773353834120387
Energy: 0.8973675822827121
Energy: 0.8607029096581431
Energy: 0.9364278337083647
Energy: 0.8968067709067435
Energy: 0.9355001342113717
Energy: 0.7995492724424524
Energy: 0.8251190621792307
Energy: 0.8241827053533556
Energy: 0.8094065244190581
Energy: 0.8013985967833606
Energy: 0.8047190368140112
Energy: 0.8016029076953525
Energy: 0.818531438453315
Energy: 0.8041025406623953
Energy: 0.80227341936257
Energy: 0.8025682532248393
Energy: 0.8043662612538243
Energy: 0.8012721095793597
Energy: 0.8253041260389877
Energy: 0.823112015020164
Energy: 0.8016559503184989
Energy: 0.8042679916341201
Energy: 0.8239230414265202
Energy: 0.7996810178374143
Energy: 0.841827351290476
Energy: 0.8396410779464687
Energy: 0.8340811204047638
Energy: 0.8179227921056942
Energy: 0.8221681956236985
Energy: 0.89494845803955
Energy: 0.8248273028678155
Energy: 0.840208497923053
Energy: 0.8338022493094253
Energy: 0.8263963243937216
Energy: 0.836558077267879
Energy: 0.8962542348106337
Energy: 0.8034115765703214
Energy: 0.8240156767820336
Energy: 0.8018458589215073
Energy: 0.829929164615282
Energy: 0.8231572716236629
Energy: 0.8330048755727982
Energy: 0.8552703276274537
Energy: 0.856881261863783
Energy: 0.8370651133589079
Energy: 0.8542590392005303
Energy: 0.7903218204788088
Energy: 0.89560623327456
Energy: 0.8233629994692234
Energy: 0.821919972547187
Energy: 0.8421353214684634
Energy: 0.8062606388224084
Energy: 0.8227897938088857
Energy: 1.1483935630173634
Energy: 0.8316555974922274
Energy: 0.8226999950548559
Energy: 1.0097896557901382
Energy: 0.8431697367673543
Energy: 0.8236195161287458
Energy: 0.8967999632418454
Energy: 0.8359718786791899
Energy: 0.8224488954627274
Energy: 0.8030792238470374
Energy: 0.8375604901631606
Energy: 0.8235600007203231
Energy: 0.9365368341892288
Energy: 0.7669003643307309
Energy: 0.7660597800952299
Energy: 0.8411166744835799
Energy: 0.7674036538745913
Energy: 0.8230291038811612
Energy: 0.8076692563048861
Energy: 0.767028120252414
Energy: 0.7652528036697376
Energy: 0.8428141843648485
Energy: 0.7669973400844464
Energy: 0.7684013131877482
Energy: 0.8080571387678039
Energy: 0.8385127301336518
Energy: 0.8234397143770893
Energy: 0.8091235485470213
Energy: 0.8493513959549404
Energy: 0.8214446938337
Energy: 0.8565662887668883
Energy: 0.8221022245874642
Energy: 0.8597686639036753
Energy: 0.856333277396961
Energy: 0.8225058392898048
Energy: 0.8591632887993597
Energy: 0.8000485654765648
Energy: 0.8254201233167923
Energy: 0.8230168418438419
Energy: 0.8335951724852312
Energy: 0.8024622114637845
Energy: 0.823108114064973
Energy: 1.4619460336500758
Energy: 0.8300302766580551
Energy: 0.8131190374670272
Energy: 1.2371895777230728
Energy: 0.8358662973856953
Energy: 0.8513425716264827
Energy: 0.8317028040613579
Energy: 0.8249412622119938
Energy: 0.8376719905894446
Energy: 0.8428914149993992
Energy: 0.8358294233920345
Energy: 0.808510968459234
Energy: 0.8033778682017361
Energy: 0.8042445022116143
Energy: 0.8188707779082285
Energy: 0.8046112776054162
Energy: 0.8023509826237541
Energy: 0.8060688284616837
Energy: 0.8012409597472036
Energy: 0.806712405928413
Energy: 0.8059123040860314
Energy: 0.8017370747365004
Energy: 0.8036373885451815
Energy: 0.8041730673329346
Energy: 0.7996725947782941
Energy: 0.8076857710793458
Energy: 0.8048352217699587
Energy: 0.8003327055122607
Energy: 0.8050402969402961
Energy: 0.8211157660418316
Energy: 0.9018503783122651
Energy: 0.82754407638026
Energy: 0.8820704844594636
Energy: 0.9016949218017479
Energy: 0.8273698620248489
Energy: 0.8939167975611153
Energy: 0.8957023135881619
Energy: 0.8053365452285711
Energy: 0.8220744284997579
Energy: 0.8007719986644439
Energy: 0.8023845857034082
Energy: 0.8212559791887679
Energy: 0.8326862706517615
Energy: 0.8568701513109973
Energy: 0.8132272241675065
Energy: 0.8358787123768306
Energy: 0.8566146887609939
Energy: 0.790956689769028
Energy: 0.8965464978118791
Energy: 0.8037873458516717
Energy: 0.8230223021190727
Energy: 0.8364658208332049
Energy: 0.8111469397476734
Energy: 0.8236199380355522
Energy: 0.8971443544392445
Energy: 0.8365715853721567
Energy: 0.8375563905327141
Energy: 0.8024718246636448
Energy: 0.8421724868760079
Energy: 0.8403125630262939
Energy: 1.1489443666975823
Energy: 0.8380970676329865
Energy: 0.8223368726662059
Energy: 0.8008625198778933
Energy: 0.8432061886132997
Energy: 0.8230618170873545
Energy: 0.8935318229783634
Energy: 0.824596706397187
Energy: 0.841853748469955
Energy: 0.84253634404381
Energy: 0.79969297485847
Energy: 0.8407734765571008
Energy: 0.8082137067789618
Energy: 0.8500849341328202
Energy: 0.8564167123042108
Energy: 0.8426611475641855
Energy: 0.8569063631103279
Energy: 0.8509057000228831
Energy: 0.9105390150892346
Energy: 0.8338475257782745
Energy: 0.825581882292077
Energy: 0.9106433806662704
Energy: 0.8454851593257927
Energy: 0.8423860743630166
Energy: 0.8076376545998963
Energy: 0.8052870169848871
Energy: 0.8037141981286726
Energy: 0.807730619185005
Energy: 0.8019399068943917
Energy: 0.8161802732863486
Energy: 0.8010820710922781
Energy: 0.8030540237502874
Energy: 0.8249917270934937
Energy: 0.8147141578100398
Energy: 0.8037200557245754
Energy: 0.8063147345584257
Energy: 1.4628014298246774
Energy: 0.833430603298165
Energy: 0.8117291887150835
Energy: 0.7687107358410945
Energy: 0.8235948542612356
Energy: 0.8101307028909426

minimum gb energy = 0.7652528036697376 eV
minimum distance =  2.34590226542846 Angstroms
sigma value = 33


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

Energy: 1.3551453981327806
Energy: 1.0427855612228127
Energy: 0.9886544837431706
Energy: 0.8817350375262291
Energy: 1.0430359066136279
Energy: 0.9997633707291905
Energy: 0.9969969895231249
Energy: 0.9010977373363067
Energy: 0.9303350792135847
Energy: 0.951554468120962
Energy: 0.8936186368663155
Energy: 0.9280935951905038
Energy: 0.9943559486935648
Energy: 0.9784379777102339
Energy: 0.9020626511112153
Energy: 1.0136928589745864
Energy: 0.890534961240391
Energy: 0.98138768662699
Energy: 1.0033460842321071
Energy: 0.9286825984562989
Energy: 0.9937901288375237
Energy: 1.0242961840918345
Energy: 0.9076786417930993
Energy: 0.9083567417755545
Energy: 0.9970774905606988
Energy: 0.9755506485806514
Energy: 0.8930892014968315
Energy: 1.0147411350222162
Energy: 0.9392824198596945
Energy: 0.8928106992079996
Energy: 1.1129198215173688
Energy: 0.9444830159372137
Energy: 0.937464114669679
Energy: 1.0815718685745652
Energy: 0.9387732066911985
Energy: 0.9367861101732944
Energy: 1.1318892998637264
Energy: 0.8908150214461358
Energy: 0.8886410094189957
Energy: 1.0449725602058841
Energy: 0.9249654402385777
Energy: 1.0288589645605386
Energy: 1.2061867128314365
Energy: 1.079665563590141
Energy: 0.9711985614612567
Energy: 0.98900280113022
Energy: 1.0788244148267119
Energy: 0.9677601303689876
Energy: 1.0473492450218131
Energy: 0.9687557081462836
Energy: 0.9870431011702424
Energy: 1.0444344465546536
Energy: 0.9693363142164448
Energy: 0.9873795534821026
Energy: 1.1425130539375703
Energy: 0.9951984481798675
Energy: 0.9944937940864779
Energy: 0.9819808584735882
Energy: 1.031478029711791
Energy: 0.9941046970906436
Energy: 1.0499618035359366
Energy: 0.9875441796339116
Energy: 0.9842960594519309
Energy: 0.9705121032823187
Energy: 1.0080178360955503
Energy: 0.9816863215081515
Energy: 1.0496106757690078
Energy: 0.9399436065646456
Energy: 0.938944406590923
Energy: 0.9686260771396085
Energy: 0.9590200280467316
Energy: 0.9373939352370739
Energy: 1.0764618938259067
Energy: 0.9384947928461602
Energy: 0.934877174313231
Energy: 1.0168725321923395
Energy: 0.9037661111949563
Energy: 0.932914265130186
Energy: 1.0112814798327234
Energy: 0.9883523814185146
Energy: 0.9865581904311944
Energy: 0.9915802641225753
Energy: 0.9964582202602834
Energy: 0.9801408662101603
Energy: 0.9173845053435515
Energy: 0.9904789374529928
Energy: 0.9900243327696268
Energy: 0.9842909498615011
Energy: 0.9897418734806465
Energy: 1.0143530659499254
Energy: 1.0460329370373216
Energy: 1.0360986726273973
Energy: 0.9948132750872992
Energy: 1.056233778685984
Energy: 1.0296888842035234
Energy: 0.9958321373472441
Energy: 1.6423019088758646
Energy: 1.035020123906168
Energy: 0.9403118091250506
Energy: 0.9869342284581804
Energy: 1.083124149061911
Energy: 0.9431705007659354
Energy: 1.0463105389619336
Energy: 1.0220147103019175
Energy: 1.0009200888508876
Energy: 0.9350783923096442
Energy: 1.0829253555009726
Energy: 1.003139685286439
Energy: 0.9996426302723409
Energy: 0.9343709178932514
Energy: 0.9342789919184333
Energy: 0.9641113352033581
Energy: 0.9776215179085131
Energy: 1.0355678287711156
Energy: 1.004964125394033
Energy: 0.930764674227352
Energy: 0.9298023117765557
Energy: 0.950117074483496
Energy: 0.9787183349695369
Energy: 0.9980408881027455
Energy: 0.9902506096334435
Energy: 0.9893242362866301
Energy: 0.9562650806301631
Energy: 0.9910493873454156
Energy: 1.0108597320299448
Energy: 1.0223386939966785
Energy: 1.0456324626915678
Energy: 0.9368122353770447
Energy: 0.937003986096238
Energy: 1.0766300780966018
Energy: 0.936723629671126
Energy: 0.9490237341955878
Energy: 1.0068604446565872
Energy: 0.9791476655885559
Energy: 0.9602732340906862
Energy: 0.9609029748220936
Energy: 0.9451539980693335
Energy: 0.982748786944695
Energy: 1.0562891366468932
Energy: 1.1442375974411763
Energy: 1.003659636967941
Energy: 0.9598147762196356
Energy: 1.1023066500055443
Energy: 0.9621046272332353
Energy: 1.008335790805588
Energy: 0.9645636980869389
Energy: 0.9601310737882756
Energy: 0.9623489115948813
Energy: 0.9444107343622882
Energy: 0.9320683316851286
Energy: 1.099648921460025
Energy: 0.938050787780688
Energy: 0.9373769969973434
Energy: 1.0908278771526279
Energy: 0.9378611651520278
Energy: 0.9450480530437261
Energy: 1.0374468560972838
Energy: 0.9677482429630233
Energy: 0.9775683365289058
Energy: 1.0190296002332986
Energy: 0.951216982217772
Energy: 0.9312335283204408
Energy: 1.0332916958549108
Energy: 0.9726997123995075
Energy: 0.9668160163115374
Energy: 1.0347326443706903
Energy: 0.9426990780270572
Energy: 0.995082901521775
Energy: 1.0944925368729725
Energy: 0.9426548439619232
Energy: 0.9372740882775259
Energy: 1.0902899676465303
Energy: 1.022660065616565
Energy: 1.0949144133116495
Energy: 1.146298423978211
Energy: 0.9759971368230326
Energy: 0.9683193021464644
Energy: 1.0607638236052237
Energy: 0.9777338259319088
Energy: 0.9669235367790385
Energy: 1.2069321325731948
Energy: 1.048202257567838
Energy: 0.9317038126676712
Energy: 0.9890547936858262
Energy: 1.0440966941654903
Energy: 0.9331811328958645
Energy: 1.1004448427997557
Energy: 0.9738547402940593
Energy: 0.9690794630166577
Energy: 1.057253072907264
Energy: 0.9835926441095819
Energy: 0.9690722485307608
Energy: 1.1326102461373415
Energy: 0.9899705553130133
Energy: 0.9933645605747643
Energy: 1.0013016858214308
Energy: 1.0271763620009242
Energy: 0.9941763829209606
Energy: 1.1320271684292207
Energy: 0.9930077855199094
Energy: 0.9895621621265422
Energy: 0.9997182964107316
Energy: 0.9744443236455642
Energy: 0.9944537551814631
Energy: 1.054237539733714
Energy: 0.9685277761366049
Energy: 0.967798292527782
Energy: 0.9858362271731316
Energy: 0.9622723523265726
Energy: 0.9764479248815986
Energy: 1.1769415556130474
Energy: 0.9252304700976333
Energy: 0.9233601601554512
Energy: 1.1299768941364745
Energy: 0.9226557506760933
Energy: 0.9131604021023132
Energy: 0.9998625327118482
Energy: 1.0191353179336495
Energy: 0.981649664788022
Energy: 0.9653060184471569
Energy: 0.9859814845534307
Energy: 0.97755887287013
Energy: 0.9805786122878649
Energy: 1.011777404421638
Energy: 1.0332417508237333
Energy: 0.9819862510755517
Energy: 1.06694988297138
Energy: 1.028244229893403
Energy: 1.0003924782003797
Energy: 1.0286441404540805
Energy: 0.9911001922206212
Energy: 0.9791839082404326
Energy: 1.02757013577205
Energy: 0.9772174451225313
Energy: 1.6409106134549905
Energy: 1.064266193186705
Energy: 1.0430127960445876
Energy: 0.9447923276065575
Energy: 1.0571936354280203
Energy: 0.9624632331170923
Energy: 1.1140622326557195
Energy: 0.9248766948290739
Energy: 0.8672746373833096
Energy: 0.9378692049679794
Energy: 0.9403338846968055
Energy: 0.9901531772030145
Energy: 1.062411505519533
Energy: 0.983862484574987
Energy: 0.9333907271391695
Energy: 0.9791202881818233
Energy: 0.9877337038612866
Energy: 0.9771256358253403
Energy: 0.9506396481110136
Energy: 0.9306001523718408
Energy: 0.935558071830302
Energy: 0.8914757469419868
Energy: 0.9739709364546707
Energy: 0.9106841397300932
Energy: 0.9445215834524527
Energy: 0.9490261133822316
Energy: 0.9940968325551041
Energy: 0.964031248554294
Energy: 0.9551081414973288
Energy: 0.9011795184654395
Energy: 1.0445443964144285
Energy: 1.009791960013333
Energy: 0.9325645033923726
Energy: 1.0659678957825862
Energy: 0.9096751151542097
Energy: 1.0043264831553669
Energy: 0.994462543186347
Energy: 0.9324979243216094
Energy: 0.9280714919331885
Energy: 0.8840125438457932
Energy: 0.8965540439685203
Energy: 0.9312710552374899
Energy: 1.047927051743288
Energy: 0.9796468008149709
Energy: 0.9098762135593614
Energy: 0.8727572906764656
Energy: 1.085778135934684
Energy: 0.9457562159387289

minimum gb energy = 0.8672746373833096 eV
minimum distance =  2.33489113360013 Angstroms
sigma value = 67


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

Energy: 1.2566861544730445
Energy: 0.9692214831106026
Energy: 0.9174858711889098
Energy: 0.9325170375079446
Energy: 0.9691024419728586
Energy: 0.9173512527835621
Energy: 0.9618302053890491
Energy: 0.9209221835384038
Energy: 0.9195471595346627
Energy: 0.9220586774533718
Energy: 0.9643168841839754
Energy: 0.9190999237078761
Energy: 0.9606216625963164
Energy: 0.8812645377628527
Energy: 0.9235070814274128
Energy: 0.9207751263331551
Energy: 0.8797379388044669
Energy: 0.9234642346642536
Energy: 0.9595611471534709
Energy: 0.9206177091116503
Energy: 0.9220618904154962
Energy: 0.9358629257384699
Energy: 0.9203504148498579
Energy: 0.9220630565265522
Energy: 0.955491221490577
Energy: 0.9219326020653962
Energy: 0.921407907859572
Energy: 0.9560503046264336
Energy: 0.9217607083071699
Energy: 0.9230062826298685
Energy: 0.9577358542606027
Energy: 0.9222359367398313
Energy: 0.9267858929090426
Energy: 0.9580411420965254
Energy: 0.9212732308794589
Energy: 0.9274914659655296
Energy: 1.0225871277846308
Energy: 0.9205822507154648
Energy: 0.9188254706329604
Energy: 0.8801431969177121
Energy: 0.9640896794496692
Energy: 0.9183410280774637

minimum gb energy = 0.8797379388044669 eV
minimum distance =  2.3724201029349 Angstroms
sigma value = 3


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

Energy: 1.6244107096022602
Energy: 1.1835791041201829
Energy: 1.0537127656190315
Energy: 1.0236065306832542
Energy: 1.1838835007706092
Energy: 1.0445376014857672
Energy: 0.9947700218205915
Energy: 1.0460497306167755
Energy: 1.0168851953148927
Energy: 1.0709650893071516
Energy: 1.0762906432323462
Energy: 1.0169578611301218
Energy: 1.0091402017599236
Energy: 0.997107529209492
Energy: 0.9963630240644817
Energy: 1.0095651303849669
Energy: 0.9980223838015341
Energy: 1.0025552258416839
Energy: 1.0000088537772356
Energy: 0.9987697681123829
Energy: 0.9994576185723669
Energy: 1.0013908706041421
Energy: 0.9970998095841057
Energy: 0.9998969754995095
Energy: 1.0089434778603257
Energy: 0.9955426475444523
Energy: 0.995435925057316
Energy: 1.0104214551377535
Energy: 1.0070721663772275
Energy: 0.996526811968301
Energy: 0.9951959921265937
Energy: 0.9949629650027937
Energy: 0.9961478299849235
Energy: 0.9959016063049394
Energy: 1.007003627404922
Energy: 0.9964854714392729
Energy: 0.9948265817515038
Energy: 1.0595944200131773
Energy: 1.0629521174100618
Energy: 1.0270773899791643
Energy: 1.0656574623912476
Energy: 1.0603228877461346
Energy: 1.298551240472204
Energy: 1.0242740795715148
Energy: 1.0374231595671148
Energy: 1.0015192459028175
Energy: 1.0846464763099593
Energy: 1.044506162339078
Energy: 0.9974388238007758
Energy: 0.9975805760752802
Energy: 1.044883492531218
Energy: 1.0318424568844409
Energy: 1.0221689665096678
Energy: 1.0236946201437214
Energy: 0.9960029045471562
Energy: 1.0011665142781154
Energy: 1.000847580146435
Energy: 1.0832313731893493
Energy: 1.000374830763557
Energy: 1.0387298322296232
Energy: 1.0961257889018596
Energy: 1.0376454020276795
Energy: 1.0386752667684074
Energy: 1.0974990451983528
Energy: 1.008451642760913
Energy: 1.0719033423221689
Energy: 1.089386069731298
Energy: 0.9978873390603605
Energy: 0.9970592265946331
Energy: 1.0759919572406986
Energy: 1.0113303749944238
Energy: 0.9962473045339335
Energy: 1.0402826950682715
Energy: 0.9963351588787456
Energy: 0.9972430810084886
Energy: 1.061980497723037
Energy: 0.9961836254126778
Energy: 0.9965578294006568
Energy: 1.0332564865933396
Energy: 0.9990320203288989
Energy: 0.99779645111163
Energy: 1.0577506463748163
Energy: 0.9983798356077844
Energy: 0.9976978096300874
Energy: 1.0911300688748933
Energy: 1.0081412036315254
Energy: 1.0093569458113525
Energy: 1.0029078182386877
Energy: 1.012171518983349
Energy: 1.0063787935705832
Energy: 1.0295874322824226
Energy: 1.0168565092752984
Energy: 0.9958847432031093
Energy: 1.0058740557772299
Energy: 1.0165921771522965
Energy: 0.9967345254473192
Energy: 1.1904243590851467
Energy: 1.0012044064306593
Energy: 1.0010908044400115
Energy: 1.1908224347566554
Energy: 1.0002181706778477
Energy: 1.0801562421524205
Energy: 1.076022080036935
Energy: 1.0438317743717491
Energy: 1.0383486046267552
Energy: 1.0845283467397866
Energy: 1.0194231630879005
Energy: 1.0265341387198024
Energy: 1.2322673037232619
Energy: 1.0016800170702853
Energy: 1.0009840567438444
Energy: 1.002179361219157
Energy: 1.000823665906283
Energy: 0.9993732335363626
Energy: 1.135791832264975
Energy: 1.0238483794296886
Energy: 1.0026326678419777
Energy: 0.9986576755686755
Energy: 1.0232177815789063
Energy: 1.0008757411712246
Energy: 1.0188465170141041
Energy: 1.0447613177079853
Energy: 1.0326975704082944
Energy: 1.0292442579535412
Energy: 1.0190829355229893
Energy: 1.0236294543743711
Energy: 1.0197194065476787
Energy: 1.0226694165505397
Energy: 1.021261008827401
Energy: 1.0321941212132852
Energy: 1.023255457480492
Energy: 1.0217853673758324
Energy: 1.0214031863818274
Energy: 1.0226559808820894
Energy: 1.0272778089008332
Energy: 1.0227666844568493
Energy: 1.0437077447507384
Energy: 1.0392758786260934
Energy: 1.0270897000385424
Energy: 1.0055817316387816
Energy: 1.0048608631561873
Energy: 1.027866741030559
Energy: 1.0053980753392935
Energy: 1.0268809253279045
Energy: 1.0025156515714848
Energy: 0.9970868602566333
Energy: 0.9953264398378316
Energy: 1.0269110633969185
Energy: 1.0020013396231717
Energy: 0.9976402270552692
Energy: 1.236854472362534
Energy: 1.0558521325513368
Energy: 1.0315247698803032
Energy: 0.9959141936079899
Energy: 1.0846011893012673
Energy: 1.0349727810033382
Energy: 0.995368538435638
Energy: 1.055139401571206
Energy: 1.1081705231598296
Energy: 1.0319739594660424
Energy: 1.0823663581670544
Energy: 1.035818452930941
Energy: 1.0055928325321493
Energy: 0.9982400073373076
Energy: 0.9959405011651797
Energy: 1.0442094610699566
Energy: 1.0455065727322164
Energy: 0.9981485675877888
Energy: 1.0054341308965742
Energy: 0.9984627998769231
Energy: 0.9977453753647405
Energy: 1.0056450099313123
Energy: 1.000357035725146
Energy: 1.0049071514238779
Energy: 0.9969224402828669
Energy: 0.99500882892317
Energy: 0.9947579640018598
Energy: 0.9987209430400404
Energy: 1.037882296543719
Energy: 0.9955576704698808
Energy: 0.9963632688902616
Energy: 1.0006578212984707
Energy: 0.9993242677110505
Energy: 0.9967673325253104
Energy: 1.000572635388005
Energy: 0.9982750526307687
Energy: 1.0045557901931923
Energy: 1.0608215953279727
Energy: 1.0429307697417438
Energy: 1.0164965142971945
Energy: 1.078931257975343
Energy: 0.9973641258118073
Energy: 1.1880979976222803
Energy: 1.0681746773933096
Energy: 1.0502985131726275
Energy: 0.9978464776584826
Energy: 1.0919885385701409
Energy: 1.0002545782477688
Energy: 1.1455399231400896
Energy: 0.99814185638603
Energy: 0.9978069804296419
Energy: 1.0254216603359472
Energy: 1.0030853427383881
Energy: 0.9966937401456982
Energy: 0.9952705707139162
Energy: 0.9963488639617704
Energy: 0.9961359817541714
Energy: 1.0155457005302921
Energy: 1.0277110329470058
Energy: 0.9963345423736284
Energy: 1.088068978616846
Energy: 1.000777470375257
Energy: 1.0005534477036595
Energy: 1.089333646549704
Energy: 1.0000104819709579
Energy: 1.0588123363439406
Energy: 1.0346726913112754
Energy: 0.9972743391944844
Energy: 0.9966925306696026
Energy: 1.033540733999373
Energy: 1.0290781945995187
Energy: 1.040444899307097
Energy: 1.040062292948102
Energy: 0.9993825499468256
Energy: 0.9999131063690151
Energy: 0.9947772072969208
Energy: 0.9990562933560019
Energy: 1.000080993868828
Energy: 1.0440141006452135
Energy: 0.9968732594731371
Energy: 0.9970819286755305
Energy: 1.0424801339011232
Energy: 0.9983820042087845
Energy: 0.995676439763083
Energy: 1.0918260746998467
Energy: 1.004206400537574
Energy: 1.0042408965697314
Energy: 1.004254932891055
Energy: 1.0040590850119415
Energy: 1.0032451084000094
Energy: 1.0891077716329456
Energy: 1.0021820633298348
Energy: 0.9991381164512386
Energy: 1.0307243134492348
Energy: 1.060745843434832
Energy: 0.9973584822998182
Energy: 1.1828300589102403
Energy: 1.041825480687155
Energy: 1.0434554571230594
Energy: 1.183861327121596
Energy: 0.9960659225783122
Energy: 1.0286354392040702
Energy: 1.1458162913197962
Energy: 0.9970768352951874
Energy: 1.0327765933162014
Energy: 1.169925192222441
Energy: 0.9969778577993402
Energy: 1.049299375027532
Energy: 1.0262853095785243
Energy: 0.9999995696567372
Energy: 0.9977707359580392
Energy: 1.0043204860291688
Energy: 1.030321344906516
Energy: 0.9978628415293006
Energy: 1.4300877272288663
Energy: 1.0272295053316747
Energy: 1.0865233528304754
Energy: 1.0410863360932892
Energy: 1.0280172360735889
Energy: 1.0863532646145373
Energy: 1.0238919687199608
Energy: 1.03366527129596
Energy: 1.0365564992405456
Energy: 1.0404561567984916
Energy: 1.0240594226533357
Energy: 1.0402428035502642
Energy: 1.0202909902320834
Energy: 1.0213146495991845
Energy: 1.0213953629903192
Energy: 1.0313488818895231
Energy: 1.0324638664176138
Energy: 1.0214953997350307
Energy: 1.0200343012163868
Energy: 1.0254533602180904
Energy: 1.0259188043541707
Energy: 1.0195617785717
Energy: 1.0305733778750663
Energy: 1.0246267565515612
Energy: 1.0189059974941717
Energy: 0.9973549206793572
Energy: 1.0020732082934558
Energy: 1.020442120917771
Energy: 0.9973667008126138
Energy: 1.036062697740883
Energy: 1.006166599993308
Energy: 0.999009644954521
Energy: 0.9984613625072978
Energy: 1.0231720688053674
Energy: 0.9990858458520473
Energy: 1.0017768547828736
Energy: 0.9944673652776206
Energy: 0.9949084882217832
Energy: 1.0261364405669173
Energy: 1.0472099073934342
Energy: 1.0035671589431412
Energy: 1.044334136194611

minimum gb energy = 0.9944673652776206 eV
minimum distance =  2.32540157521249 Angstroms
sigma value = 81


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

Energy: 1.74654829306672
Energy: 1.0809899721580156
Energy: 0.9571597125317273
Energy: 0.9606916108383209
Energy: 1.0806697984057627
Energy: 1.0232312036234021
Energy: 1.0534186241971437
Energy: 0.973545357926542
Energy: 0.9739241113262732
Energy: 1.001157009174432
Energy: 0.994586554752264
Energy: 0.9740186345421945
Energy: 1.0556232957709093
Energy: 1.0356104186539286
Energy: 1.032280587989962
Energy: 0.9858862713304638
Energy: 1.0122926842421827
Energy: 0.9722616091120981
Energy: 1.055551367010868
Energy: 1.0238746483724641
Energy: 1.0925828235354433
Energy: 1.0602962145118218
Energy: 1.0065418793541672
Energy: 0.9757650496166173
Energy: 1.0569982078991742
Energy: 1.0750244806465636
Energy: 1.085762404208139
Energy: 1.0613786287447393
Energy: 1.0789578296961577
Energy: 1.078125889249675
Energy: 1.0589722710312162
Energy: 1.0805519969962374
Energy: 1.0777592033091365
Energy: 0.9750733012690788
Energy: 1.0789154415836573
Energy: 1.079948223842183
Energy: 1.0531324798421546
Energy: 1.0573316359122875
Energy: 1.0894912416976947
Energy: 1.1290165157988306
Energy: 1.0608870110518487
Energy: 1.0809854487816923
Energy: 1.2681282256689994
Energy: 1.1748244889323498
Energy: 1.1705792748591863
Energy: 0.9900817426592315
Energy: 1.1834082768459757
Energy: 1.0648250105798234
Energy: 1.0536641979157901
Energy: 1.0780441421512905
Energy: 1.110102025750892
Energy: 1.0632419622486389
Energy: 1.082287788185618
Energy: 1.0382412050777265
Energy: 1.1022043277980358
Energy: 0.9430250527800624
Energy: 0.944863313386612
Energy: 1.0827534124126557
Energy: 0.9432850276759883
Energy: 0.9447062184420881
Energy: 1.067061520667817
Energy: 0.9404374073443699
Energy: 0.9402292492197654
Energy: 1.0662189143932728
Energy: 0.9759782066326879
Energy: 1.0634034255881835
Energy: 1.0055807428926304
Energy: 1.0833954857829378
Energy: 1.0819613410311633
Energy: 1.0057125255913666
Energy: 1.088213651538317
Energy: 1.129541901360784
Energy: 1.006180243297241
Energy: 1.060277205562613
Energy: 1.0607281579325023
Energy: 1.0072717115439416
Energy: 1.0611218095264916
Energy: 1.0346870225046856
Energy: 1.063135287842933
Energy: 1.0588569080217016
Energy: 1.0764935354398038
Energy: 1.0674970812406792
Energy: 1.0579157444183611
Energy: 1.0776358962955426
Energy: 1.2141073248595842
Energy: 1.110452192415324
Energy: 1.1009301201414916
Energy: 1.073645770044627
Energy: 1.084958936714074
Energy: 1.0764469422101302
Energy: 1.0646539155582064
Energy: 1.051751015097774
Energy: 1.0785082259746024
Energy: 1.064012848059076
Energy: 1.0801225644326495
Energy: 1.0777017482218365
Energy: 1.2119463849688756
Energy: 1.0070703794557283
Energy: 1.001540798866488
Energy: 1.2125508898288027
Energy: 1.009021202718656
Energy: 1.0303260522367639
Energy: 1.03883525077971
Energy: 1.037409540580657
Energy: 1.1213438175630905
Energy: 1.0948888798145473
Energy: 1.0626792359332784
Energy: 1.1248044658154124
Energy: 0.9412867479764133
Energy: 1.0625948663246976
Energy: 0.9411088863377055
Energy: 0.9413185287680436
Energy: 1.0657587718779205
Energy: 0.9413296070834166
Energy: 1.1376390022156937
Energy: 1.0633045887145802
Energy: 0.94213199141556
Energy: 0.9406502078601063
Energy: 1.0662492320024957
Energy: 0.9424880813600307
Energy: 1.0386616907467234
Energy: 1.0388353570115434
Energy: 1.0791744841747226
Energy: 1.0938766017729944
Energy: 1.064464165603279
Energy: 1.0860958487509
Energy: 1.060510670532404
Energy: 1.0011858501579203
Energy: 1.0018042991411433
Energy: 1.060575009208942
Energy: 1.0352690164648208
Energy: 1.045436453433207
Energy: 1.0570735447084956
Energy: 1.0503542054059787
Energy: 1.0770396309038348
Energy: 1.0577476618578583
Energy: 1.051221552890864
Energy: 1.077804506959155
Energy: 1.0643047575300377
Energy: 1.071386506033963
Energy: 1.0716543799511686
Energy: 1.0816704112865636
Energy: 1.0889211744280372
Energy: 1.0716283193002436
Energy: 1.0628859482845912
Energy: 1.0893673218832312
Energy: 1.0774697042879648
Energy: 1.0690803161827154
Energy: 1.0609799475532768
Energy: 1.0777208015873363
Energy: 1.1620082926625392
Energy: 1.1521818397752013
Energy: 1.1523003145371973
Energy: 1.0489628752910236
Energy: 1.166481574323595
Energy: 1.1512606944564239
Energy: 1.0193443333682282
Energy: 1.17216368196328
Energy: 1.1715219072536216
Energy: 1.0474645177700102
Energy: 1.1746819975777285
Energy: 1.1194460537063842
Energy: 1.0654813097633204
Energy: 0.9402225651227705
Energy: 1.0629728195359158
Energy: 1.0648092301703376
Energy: 1.019474989652483
Energy: 1.062902377888194
Energy: 1.063779027679957
Energy: 0.9438631351901933
Energy: 0.9459025897294018
Energy: 1.0477269445501654
Energy: 0.9438020647284334
Energy: 0.9457552523911977
Energy: 1.0588941433877714
Energy: 1.0775783252607882
Energy: 1.1113276628361723
Energy: 1.062744843091299
Energy: 1.0812426739611194
Energy: 1.054451869460398
Energy: 1.0071775367877809
Energy: 1.094910508606943
Energy: 1.0752577823010683
Energy: 1.0113007686407394
Energy: 1.1058637603106467
Energy: 1.033161751742115
Energy: 1.0597975491291405
Energy: 1.0525172943174097
Energy: 0.9854199172521703
Energy: 1.0743940474275484
Energy: 1.0531992247254254
Energy: 1.0677920608307438
Energy: 1.210333054824269
Energy: 1.049569282331146
Energy: 1.0489428234345943
Energy: 0.972150446948049
Energy: 1.061047820791732
Energy: 1.0509345117169067
Energy: 1.0623938136700066
Energy: 0.9748981641618496
Energy: 1.0859266886326788
Energy: 1.1068443183871974
Energy: 1.0547784312677426
Energy: 1.0789039315911308
Energy: 1.0617286622619881
Energy: 1.0279428832096538
Energy: 1.0948247882336557
Energy: 1.0669934123255507
Energy: 1.0494137580660587
Energy: 1.0104203501889755
Energy: 1.2201403162333717
Energy: 1.0107316800994282
Energy: 1.0069438409447264
Energy: 1.132427312044918
Energy: 0.9930650260190558
Energy: 1.0679273194782117
Energy: 1.0547886279213494
Energy: 0.9738394880554717
Energy: 0.9747952889061742
Energy: 1.0007461172542607
Energy: 0.99286390884155
Energy: 1.0072355929608008
Energy: 1.3529181896176237
Energy: 1.0048319454689638
Energy: 0.962624723134548
Energy: 0.9442508045602447
Energy: 1.0033269436917713
Energy: 1.0245747490185086

minimum gb energy = 0.9402225651227705 eV
minimum distance =  2.34541706538497 Angstroms
sigma value = 43


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

Energy: 1.7752097309161687
Energy: 1.2019594967506906
Energy: 1.0863686882646832
Energy: 1.022332785352443
Energy: 1.2014715206030058
Energy: 1.0160962753199865
Energy: 0.9905625001770534
Energy: 0.9968063129826443
Energy: 0.9808591033520229
Energy: 1.0440145431424157
Energy: 0.9926623503845755
Energy: 0.9895678786700352
Energy: 0.9978935127865842
Energy: 0.9725543307590997
Energy: 0.9725981825624828
Energy: 1.0406763034995792
Energy: 0.9725249585835176
Energy: 0.9916684429710851
Energy: 0.9896652608893783
Energy: 0.9728494314854779
Energy: 0.9899348317343732
Energy: 0.9900460809172636
Energy: 1.0400376493046937
Energy: 0.9900793491584314
Energy: 0.9907546715077405
Energy: 0.9910680783854068
Energy: 1.0235202130151384
Energy: 0.9913359726529999
Energy: 1.0175694476516959
Energy: 1.030554795020177
Energy: 0.9915675390634812
Energy: 1.0188640681591967
Energy: 1.034939827840526
Energy: 1.016695944940383
Energy: 0.992294373152965
Energy: 1.0309653244631594
Energy: 0.9916398875723584
Energy: 0.990686895684686
Energy: 0.9905468049106152
Energy: 0.9915520989137757
Energy: 0.9909086671267726
Energy: 0.9914971750579075
Energy: 1.1235799578898638
Energy: 0.9952989750685748
Energy: 0.9948470880399652
Energy: 0.9770940787283239
Energy: 0.9960463492651181
Energy: 0.9911028889495407
Energy: 0.9889455852067495
Energy: 0.9908254738684318
Energy: 0.991032126934807
Energy: 0.9894448298430597
Energy: 0.9908728267044731
Energy: 0.9904178276933774
Energy: 1.2043518959889115
Energy: 0.9910928742695797
Energy: 0.9910333596258565
Energy: 1.2041531683974185
Energy: 0.9916084728909459
Energy: 0.9914567023462135
Energy: 0.9775223710022571
Energy: 0.9784368860624715
Energy: 1.02168600290123
Energy: 0.9896287957925667
Energy: 1.0043464012969523
Energy: 0.9824858206511158
Energy: 1.0084778048280882
Energy: 0.9909123122272389
Energy: 0.9901265128968352
Energy: 0.9888185418118832
Energy: 0.9911555771928584
Energy: 0.990093494825717
Energy: 1.1580213252937142
Energy: 0.9920629320336902
Energy: 1.0061480404645051
Energy: 0.9731778837538578
Energy: 1.0548969228734757
Energy: 1.0060497191763258
Energy: 0.977852998201716
Energy: 0.9909131869640214
Energy: 1.0369615005187605
Energy: 0.989870393430451
Energy: 0.9909693452224067
Energy: 0.9805336999417571
Energy: 0.9782213883696634
Energy: 0.989843625303157
Energy: 0.9876742955942299
Energy: 0.9780194241227066
Energy: 0.9959874842518766
Energy: 0.9876441273506511
Energy: 0.978598288773376
Energy: 1.04591558828192
Energy: 0.9783937237159908
Energy: 0.9769125116800558
Energy: 0.9904561524304283
Energy: 0.9774095436441461
Energy: 0.9832756624098851
Energy: 0.979831036580701
Energy: 0.9800119094793829
Energy: 0.9832512438863468
Energy: 0.9889205200065468
Energy: 0.9803218137620904
Energy: 0.981054221625085
Energy: 0.9781910086016502
Energy: 0.9782535007754072
Energy: 1.0257830995607715
Energy: 0.9795834697930494
Energy: 0.9779008430225851
Energy: 0.9911123460236504
Energy: 0.9793126440201292
Energy: 0.9789899316894786
Energy: 1.0049596072056313
Energy: 0.979232300716548
Energy: 0.9898891398063301
Energy: 0.9904518626935547
Energy: 0.9793947885111135
Energy: 0.9790255911580671
Energy: 0.9932896637785622
Energy: 0.9791049660083742
Energy: 0.9899933006362084
Energy: 0.981084701680311
Energy: 0.9996107214375207
Energy: 1.0350837061273037
Energy: 1.0262524388526317
Energy: 1.0102270464249326
Energy: 0.9784718654608471
Energy: 1.1290224551368635
Energy: 1.00866430591658
Energy: 1.0094430186021341
Energy: 1.1293527426286283
Energy: 0.9746756578854361
Energy: 1.1304885060761907
Energy: 1.0284917468528787
Energy: 0.9785502093721143
Energy: 0.9795124367316529
Energy: 1.0031683488842758
Energy: 1.006675888301722
Energy: 0.995456781336238
Energy: 1.0834936330667944
Energy: 0.980926292200291
Energy: 0.980372301678349
Energy: 0.9814082913362314
Energy: 0.9794372251774615
Energy: 0.9794056217552886
Energy: 1.029922395788028
Energy: 0.9774186486020111
Energy: 0.9775649009497122
Energy: 1.002598040461447
Energy: 0.9774562431974718
Energy: 0.9772472290390427
Energy: 1.0437674374890946
Energy: 0.9777574405290788
Energy: 0.9896814225898528
Energy: 1.0367053022218393
Energy: 0.9776283830698227
Energy: 0.99051393412878
Energy: 1.043953579361776
Energy: 0.9772916444130786
Energy: 0.9776970393163121
Energy: 0.9905819978615934
Energy: 0.9967008844782481
Energy: 0.9898416803580106
Energy: 1.0502953762772178
Energy: 0.9940654312840966
Energy: 1.005489212103298
Energy: 0.9909916128485459
Energy: 1.0041832148098062
Energy: 0.9903477477360495
Energy: 1.003487933583469
Energy: 0.9903400256110269
Energy: 0.9909188441830722
Energy: 1.0035621669593793
Energy: 0.9764067157093838
Energy: 0.9924215637450864
Energy: 0.9899089192663109
Energy: 0.9970981086753851
Energy: 0.9817460870679646
Energy: 1.0453777101972799
Energy: 0.9898638672129014
Energy: 0.9905760757526134
Energy: 1.1326540319375258
Energy: 1.0633025281307358
Energy: 1.042116348848404
Energy: 1.0068520050419958
Energy: 1.1432152916959304
Energy: 1.0416073184460575

minimum gb energy = 0.9725249585835176 eV
minimum distance =  2.3073139665653 Angstroms
sigma value = 57


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

Energy: 1.189211572950436
Energy: 1.1861037036319089
Energy: 1.0222341906503754
Energy: 0.978430237269254
Energy: 1.185923716805354
Energy: 1.0225879824086912
Energy: 0.9809234774452776
Energy: 0.9851040870452656
Energy: 0.9830483066543743
Energy: 0.9974473255486103
Energy: 0.9983271375707697
Energy: 0.9748529681289813
Energy: 0.9893098849922376
Energy: 0.9377990148153191
Energy: 0.9381822093284128
Energy: 0.9986870678826288
Energy: 0.9248071408749212
Energy: 0.923149166321365
Energy: 0.9813113758332671
Energy: 0.9221094758506696
Energy: 0.9241263996806692
Energy: 0.9815312216448724
Energy: 0.9237600905280698
Energy: 0.982463714161182
Energy: 0.9834608672986866
Energy: 0.9773392034431195
Energy: 0.9805801113967219
Energy: 0.9841009032733954
Energy: 0.963682410641223
Energy: 0.978875538026344
Energy: 0.950919607107059
Energy: 0.9662182986295197
Energy: 0.9639238450390257
Energy: 0.9816991470702051
Energy: 0.9774175578726351
Energy: 0.9645870186300716
Energy: 0.9980794736309577
Energy: 0.9814376957023222
Energy: 0.9818936950742435
Energy: 0.9980165336478617
Energy: 0.9826174788939678
Energy: 0.9787499061486087
Energy: 0.9799537616232467
Energy: 0.979060843704069
Energy: 0.9753275566088241
Energy: 0.9717103958378873
Energy: 0.9791861638750903
Energy: 0.9784654654258655
Energy: 0.9973933485826806
Energy: 0.9838586718580304
Energy: 0.9846160273351123
Energy: 0.9968008392791666
Energy: 0.9847290796547509
Energy: 0.9745813804056819
Energy: 1.0915738002678048
Energy: 0.9747488867999784
Energy: 0.9741661270845654
Energy: 1.0912799325320923
Energy: 0.9787766649581161
Energy: 0.9786269753058566
Energy: 0.9908339631797586
Energy: 0.9733659295510724
Energy: 0.9782267957090071
Energy: 0.999490330462551
Energy: 0.9823790181484897
Energy: 0.9824032353722636
Energy: 0.9227698276242452
Energy: 0.9830314537164757
Energy: 0.9820079610720783
Energy: 0.9259151870267718
Energy: 1.0006666185062612
Energy: 1.026586339547727
Energy: 0.9220962156516649
Energy: 0.9861097404844776
Energy: 1.0260823917335804
Energy: 0.9542330916799384
Energy: 0.9993856399139752
Energy: 1.0258093261793504
Energy: 0.9853227523705113
Energy: 0.9869101796082951
Energy: 0.9752311904989808
Energy: 0.9966015342474283
Energy: 0.9973416551289441
Energy: 0.9833500772741743
Energy: 0.9932797079217501
Energy: 0.9250304730281088
Energy: 0.9295030898707951
Energy: 0.9939067699109423
Energy: 0.9242586630013597
Energy: 0.9288195476064665
Energy: 0.9828727712855103
Energy: 0.9760053967311358
Energy: 0.97591314326387
Energy: 0.9835477181763255
Energy: 1.0160686403377621
Energy: 0.9789161585352455
Energy: 0.9833072655658159
Energy: 0.968369154472152
Energy: 0.9774000735860247
Energy: 0.9649415849101425
Energy: 0.9648319918362014
Energy: 0.9780580285151629
Energy: 0.9842304064386663
Energy: 0.9763666816705852
Energy: 0.9638474781061455
Energy: 0.9669031420393671
Energy: 0.984335686797276
Energy: 0.9746071901377583
Energy: 0.9986948023890332
Energy: 0.9829603624636575
Energy: 0.9834663060547143
Energy: 0.9773761629901931
Energy: 0.9818737430701872
Energy: 0.9934208015034552
Energy: 0.9981530756202647
Energy: 0.9835833652398248
Energy: 0.9998329237848645
Energy: 0.9779038755771251
Energy: 0.9837153514835387
Energy: 0.9912456614508188
Energy: 0.99693311839523
Energy: 1.0066479481282085
Energy: 0.9668206900891383
Energy: 0.9978247130222437
Energy: 0.9866899205231396
Energy: 0.9782171557696723
Energy: 1.0851761955278392
Energy: 0.9741949460586234
Energy: 0.9896885009332062
Energy: 1.0857415650773703
Energy: 0.9737983280345633
Energy: 0.9773929132037042
Energy: 0.9854527109697846
Energy: 0.985539825187169
Energy: 0.9838608554914744
Energy: 0.9976239998275053
Energy: 0.997463892713636
Energy: 0.9778640410809198
Energy: 0.922236084574659
Energy: 0.9855160332174193
Energy: 1.026138436770144
Energy: 0.9532980674657496
Energy: 0.9980546133106064
Energy: 1.0258148806142426

minimum gb energy = 0.9220962156516649 eV
minimum distance =  2.32055453649959 Angstroms
sigma value = 17


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

Energy: 1.5552161862374598
Energy: 1.012486209752951
Energy: 1.084003254992089
Energy: 0.9524575027577453
Energy: 1.0100582787827859
Energy: 0.9348610170063183
Energy: 1.1393727685483266
Energy: 1.0375754058328073
Energy: 1.0360541849515328
Energy: 1.062456642458148
Energy: 1.0373733773326255
Energy: 0.9822571685999741
Energy: 1.0273109214899319
Energy: 0.949950555417673
Energy: 0.929902958292453
Energy: 1.0194777324940436
Energy: 0.9301378348561539
Energy: 0.9296801736351077
Energy: 1.024510799491818
Energy: 0.9297553509615104
Energy: 0.92946224147219
Energy: 1.0248099510734465
Energy: 0.9494628999427596
Energy: 1.020122185806561
Energy: 0.9144447780528172
Energy: 0.9391024394796544
Energy: 0.9481015736090049
Energy: 0.9153563579624993
Energy: 0.9418992737793649
Energy: 0.9475024474653191
Energy: 0.9791250723248476
Energy: 0.9021017332908057
Energy: 0.9469849749706101
Energy: 0.9370936676992249
Energy: 0.9102214779610983
Energy: 0.9418471060986638
Energy: 0.901325874650352
Energy: 0.900007213190881
Energy: 0.9001786072259451
Energy: 0.9016562995455225
Energy: 0.9012147248728163
Energy: 0.9195244744021598
Energy: 0.9456548615821224
Energy: 0.9382816182507937
Energy: 0.9379523133358327
Energy: 0.9371899447595219
Energy: 0.9364677464643464
Energy: 0.937557210581735
Energy: 0.9033637118980472
Energy: 0.9339198193074303
Energy: 0.935340670971412
Energy: 0.9053342820631394
Energy: 0.9385846350754826
Energy: 0.9013888371624954
Energy: 0.9071148611652383
Energy: 0.9448654259059609
Energy: 0.9539459233927983
Energy: 0.9069836966559135
Energy: 0.9462196362008918
Energy: 0.946959743125093
Energy: 0.9149520018889706
Energy: 0.9407570920384312
Energy: 0.9410835532827453
Energy: 0.941313233466247
Energy: 1.036882030786147
Energy: 0.9406319236413705
Energy: 0.9163968990864877
Energy: 1.0343723026008034
Energy: 1.032937726767805
Energy: 1.031840871474204
Energy: 1.0349299403381556
Energy: 1.0211199291460529
Energy: 1.0311874096681648
Energy: 1.0187350491207687
Energy: 1.0338064301657959
Energy: 0.9419691188449519
Energy: 1.018663274386231
Energy: 1.0345169797008322
Energy: 1.0469098448347214
Energy: 1.037449294792723
Energy: 1.037686895508684
Energy: 1.0491693365641745
Energy: 1.0384966742290902
Energy: 0.9728695120563251
Energy: 1.0071552293360422
Energy: 1.0370354580079721
Energy: 1.0497308365855282
Energy: 1.02048508970295
Energy: 1.0378834970646795
Energy: 1.0358130771577518
Energy: 1.0140499453119682
Energy: 1.0628415357356402
Energy: 0.9827225995811617
Energy: 1.0414807538221946
Energy: 1.0491954298901518
Energy: 1.0349716317383295
Energy: 1.0188497998171329
Energy: 1.0201715646888616
Energy: 1.0875014676468078
Energy: 0.9293633649768057
Energy: 1.0097130296271357
Energy: 1.0874396055987015

minimum gb energy = 0.900007213190881 eV
minimum distance =  2.31148967035432 Angstroms
sigma value = 17


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

Energy: 1.6416057604023924
Energy: 1.0388398651372872
Energy: 0.9768165905972114
Energy: 0.9267913310946024
Energy: 1.0386531552920621
Energy: 0.9765790581939289
Energy: 1.1019201230906002
Energy: 1.0230280669063883
Energy: 0.9040265020662603
Energy: 1.0218354268024992
Energy: 1.0251787549649678
Energy: 0.9499154318413048
Energy: 1.2181304779909097
Energy: 0.8399379756517896
Energy: 0.925324056031181
Energy: 1.0232200501886435
Energy: 0.8397734102573493
Energy: 0.9278187374417849
Energy: 1.0275035315711383
Energy: 0.9273062086200752
Energy: 0.9272780032915858
Energy: 1.0290610057662668
Energy: 0.8443302234708211
Energy: 0.9259531696323506
Energy: 0.8946553611550949
Energy: 0.9235951468390984
Energy: 0.9070264645652353
Energy: 0.8954187189916881
Energy: 0.8825077254814736
Energy: 0.9050570409908644
Energy: 0.9291961267373847
Energy: 0.8809456164175626
Energy: 0.8451336302357194
Energy: 0.843232718120577
Energy: 0.881149730190084
Energy: 0.8448965157422454
Energy: 0.81979397534356
Energy: 0.8816115138373252
Energy: 0.8807942842175835
Energy: 0.8264121636080354
Energy: 0.8849739076132931
Energy: 0.8726170070938309
Energy: 0.820359110479494
Energy: 0.8536582637566499
Energy: 0.862353732965655
Energy: 0.860069477078318
Energy: 0.8532645633889189
Energy: 0.8621689353427012
Energy: 0.8211618207885102
Energy: 0.8509613721528828
Energy: 0.8208008154900633
Energy: 0.8227514700243079
Energy: 0.8458700627112732
Energy: 0.8209083672326205
Energy: 0.819922183737525
Energy: 0.8589190083957325
Energy: 0.8593316010956211
Energy: 0.8200068949279514
Energy: 0.8582627611643067
Energy: 0.8592495080444914
Energy: 0.8205510516217736
Energy: 0.8204565287263631
Energy: 0.8576496792693525
Energy: 0.857490603819144
Energy: 0.8204891625185766
Energy: 0.8577220428799976
Energy: 0.824126894596469
Energy: 0.8212985155471095
Energy: 0.8207023945027824
Energy: 0.825544827069478
Energy: 0.8264580108237413
Energy: 0.8521094482084556
Energy: 0.838185474364951
Energy: 0.8545231904517644
Energy: 0.868747436165455
Energy: 0.8641806419406001
Energy: 0.8547730931323184
Energy: 0.8627193133214303
Energy: 0.882536706309921
Energy: 0.8618127486865746
Energy: 0.8688204176456022
Energy: 0.8834012541198082
Energy: 0.8660159149700545
Energy: 0.880994710928504
Energy: 0.8806657118856953
Energy: 0.8759086054332863
Energy: 0.874411322577381
Energy: 0.8806616576392667
Energy: 0.8742171308155027
Energy: 0.9034489454150787
Energy: 1.0159792488570152
Energy: 0.933377008244844
Energy: 0.9068603382375531
Energy: 0.8917289588728884
Energy: 0.8962276794005275
Energy: 0.9056256740685448
Energy: 0.820305553211617
Energy: 1.0247780459525788
Energy: 1.024849833646148
Energy: 0.8236272028793624
Energy: 1.0250170876590112
Energy: 0.8803502221069636
Energy: 0.8983146771091935
Energy: 1.0240372192720475
Energy: 1.0223706524634988
Energy: 0.8978442681441584
Energy: 1.0231111911720179
Energy: 0.904711180565196
Energy: 1.1319270440332372
Energy: 1.023843877916674
Energy: 0.9618609479293933
Energy: 1.0225211638297966
Energy: 0.9096010106401543
Energy: 0.905871795804379
Energy: 1.234686272626827
Energy: 0.8993142100919216
Energy: 0.8986610552994133
Energy: 1.0109436360289847
Energy: 0.8989823726179471
Energy: 1.010519859661496
Energy: 1.20076846759771
Energy: 1.023172742941964
Energy: 0.99389077030223
Energy: 1.0255787314394593
Energy: 1.0257634448462891
Energy: 1.02205970294138
Energy: 0.8337127456768337
Energy: 1.032233664254826
Energy: 1.118102075867695
Energy: 0.9262319367035466
Energy: 1.0293430282940044
Energy: 0.9269975256980153
Energy: 0.8378559038426898
Energy: 1.0249652354305019
Energy: 1.0230126596864273
Energy: 0.8402946847416458
Energy: 1.0282634964583117
Energy: 1.1151939033926115
Energy: 1.1965295318316147
Energy: 0.9252114621464728
Energy: 1.0221882719000717
Energy: 1.025494206819879
Energy: 0.8329241994974803
Energy: 0.9919319243586076
Energy: 1.024352417087897
Energy: 0.84195492421792
Energy: 0.9261497851783017
Energy: 1.0239769371813388
Energy: 0.8407381546996539
Energy: 0.9291744898431219
Energy: 0.8973118404555538
Energy: 0.9145902651558896
Energy: 0.9082574914141198
Energy: 0.8981379083446855
Energy: 0.8832744356056285
Energy: 0.9074138338682464
Energy: 0.9289597033997397
Energy: 0.9133043724691173
Energy: 0.91269902751638
Energy: 0.8755696919687967
Energy: 0.9122663192204594
Energy: 0.843365339161211
Energy: 0.8115765135635171
Energy: 0.8815259979385063
Energy: 0.8814150737114997
Energy: 0.8069392962034925
Energy: 0.883557535877059
Energy: 0.8812605953841054
Energy: 0.8216669424129925
Energy: 0.8659708622325923
Energy: 0.8667831452187404
Energy: 0.8511037421552683
Energy: 0.881390788903042
Energy: 0.8668209511349845
Energy: 0.8206654544363243
Energy: 0.8535213437529537
Energy: 0.8636720568879606
Energy: 0.8207674242582149
Energy: 0.8533902335817538
Energy: 0.8622152696628878
Energy: 0.8266708759194359
Energy: 0.8574330383739596
Energy: 0.8557399290749783
Energy: 0.8278833911814989
Energy: 0.8560130693089412
Energy: 0.8428019276906915
Energy: 0.8202894914399502
Energy: 0.8559908365040747
Energy: 0.8575848262156182
Energy: 0.8570384589504708
Energy: 0.8611836477390491
Energy: 0.8580647607847154
Energy: 0.8334869519186986
Energy: 0.8208412107656975
Energy: 0.8212293622975357
Energy: 0.8339333274562108
Energy: 0.8215027549160706
Energy: 0.8208236008893648
Energy: 0.900065417987079
Energy: 0.8743328476703758
Energy: 0.8661474733513789
Energy: 0.8647347822381575
Energy: 0.8518549638542492
Energy: 0.8661351196627389
Energy: 0.8902458264130363
Energy: 0.8735511968775643
Energy: 0.8645581920420377
Energy: 0.8810231722828059
Energy: 0.8515227887215778
Energy: 0.8647089507703223
Energy: 0.8814991035707332
Energy: 0.8654834416797993
Energy: 0.9063473100178623
Energy: 0.8816076679652202
Energy: 0.8650424081556531
Energy: 0.8811416077877898
Energy: 1.1274508603816735
Energy: 0.9028564187711844
Energy: 0.9033408809088249
Energy: 0.8842460686059118
Energy: 0.8976911522074059
Energy: 0.9065649530267643
Energy: 0.8297373441917026
Energy: 1.0225222467604913
Energy: 1.02382779971978
Energy: 0.8816797150620823
Energy: 1.025156086289352
Energy: 0.9062708625623019
Energy: 0.8806458633375677
Energy: 1.0139345572712972
Energy: 0.9122585551365086
Energy: 0.8825190731510194
Energy: 1.025872721779577
Energy: 0.9116342025353642
Energy: 0.8818139700765549
Energy: 1.0220768258618773
Energy: 1.024261556332606
Energy: 0.8962380829380905
Energy: 1.0276771170645147
Energy: 0.9583628301907128
Energy: 1.1410646864839575
Energy: 0.885225080897239
Energy: 1.011321851455998
Energy: 1.0264285601690855
Energy: 0.8855238852103818
Energy: 1.0094655089602682
Energy: 1.195133541574379
Energy: 0.960305305761814
Energy: 0.9047019266866279
Energy: 1.0268846941423044
Energy: 0.9169997810153763
Energy: 0.9992418919077231
Energy: 0.8399089967724352
Energy: 1.0250987900262998
Energy: 1.0223143934565897
Energy: 0.8419604305477737
Energy: 1.0277452519549182
Energy: 1.0015184685851348

minimum gb energy = 0.8069392962034925 eV
minimum distance =  2.30979082317404 Angstroms
sigma value = 57


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

Energy: 0.7674289251424056
Energy: 1.273905318942833
Energy: 0.9390196773136849
Energy: 0.8346152239035343
Energy: 1.3112452058823114
Energy: 0.9217751328547646
Energy: 1.0571636604090024
Energy: 0.871725600452113
Energy: 0.8694470601361322
Energy: 0.9642173722985511
Energy: 0.8706026792463339
Energy: 0.925639598177976
Energy: 1.1503154234335207
Energy: 0.8251107957107023
Energy: 0.8270645330111552
Energy: 1.000487203548425
Energy: 0.8249084273152189
Energy: 0.9007635651940542
Energy: 0.979117571959522
Energy: 0.8252306162838409
Energy: 0.9010377225951922
Energy: 0.8647721175050533
Energy: 0.8303088728196542
Energy: 0.9054455447193821
Energy: 0.8493510332117159
Energy: 0.8665954369319864
Energy: 0.8539846367553806
Energy: 0.8501105025793511
Energy: 0.8627850366994081
Energy: 0.8531703359868165
Energy: 0.8241649450101387
Energy: 0.8599852905794788
Energy: 0.8232615904516241
Energy: 0.8057316815891986
Energy: 0.8600159522123534
Energy: 0.8249360389276482
Energy: 0.7880384658747028
Energy: 0.8682435543462235
Energy: 0.8596297266668997
Energy: 0.8012278754819018
Energy: 0.8666716623619871
Energy: 0.8133647751621312
Energy: 1.0309584274519126
Energy: 0.7927550868219636
Energy: 0.7931109861309078
Energy: 0.792165434208114
Energy: 0.7926540668794243
Energy: 0.8090572442176496
Energy: 0.7914031359971647
Energy: 0.809050057297959
Energy: 0.788259680651203
Energy: 0.7936121423493148
Energy: 0.7966285704183339
Energy: 0.7883719520612393
Energy: 0.7877848051973407
Energy: 0.7954659858926963
Energy: 0.7927763052902133
Energy: 0.7877198534449549
Energy: 0.7955510507364664
Energy: 0.7931540994368415
Energy: 0.7814363518382257
Energy: 0.7555699716417169
Energy: 0.7879367648586515
Energy: 0.7945078336790045
Energy: 0.7566732319417161
Energy: 0.7880609505594325
Energy: 0.793311227700759
Energy: 0.7660238300792902
Energy: 0.7557671096816121
Energy: 0.794135034990591
Energy: 0.7624675235782916
Energy: 0.7859708827635837
Energy: 0.75481884827849
Energy: 0.8249577192961111
Energy: 0.7955612858692729
Energy: 0.793321459072307
Energy: 0.7983502773416762
Energy: 0.7954966837727834
Energy: 0.7563178817678938
Energy: 0.790190598125019
Energy: 0.7565401741376709
Energy: 0.7584532721565805
Energy: 0.792597025857619
Energy: 0.7562709408080037
Energy: 0.755618393010911
Energy: 0.7904789678644473
Energy: 0.7888730014194621
Energy: 0.7556701521478608
Energy: 0.795704658916594
Energy: 0.7883165486317817
Energy: 0.8075597281753382
Energy: 0.7880256596413627
Energy: 0.7948247081603992
Energy: 0.7938478028641531
Energy: 0.8011532848223216
Energy: 0.7941478096116179
Energy: 0.8297644793871513
Energy: 0.7883381558237352
Energy: 0.7878786494971802
Energy: 0.7940687185057042
Energy: 0.7970825704774819
Energy: 0.8124825833669668
Energy: 0.7603504510958536
Energy: 0.8135920535709977
Energy: 0.8218759043356845
Energy: 0.7608475229349113
Energy: 0.8128655566917691
Energy: 0.8170516118715774
Energy: 0.8595307134409438
Energy: 0.8154585194553526
Energy: 0.8405691065768534
Energy: 0.8615345653146278
Energy: 0.8043982835994089
Energy: 0.8600534447256368
Energy: 0.9744037095765757
Energy: 0.828581947332654
Energy: 0.8283273238998614
Energy: 0.8580637449222861
Energy: 0.8242785869348868
Energy: 0.8544236301668291
Energy: 1.079026061189406
Energy: 0.8737668722288715
Energy: 0.872465507579253
Energy: 0.8614018864976121
Energy: 0.8637690308697504
Energy: 0.8720646766964949
Energy: 0.7562008341140305
Energy: 0.9916624127827952
Energy: 0.8594793424104173
Energy: 0.8115137153960132
Energy: 1.003433170755244
Energy: 0.8720807596044368
Energy: 0.7932271007699654
Energy: 0.9994519363495258
Energy: 0.9428725139163352
Energy: 0.7948848920146426
Energy: 0.9973874021718417
Energy: 0.9417314866620544
Energy: 1.070863514107408
Energy: 0.8602515849656696
Energy: 0.853575779603723
Energy: 0.8663115614746457
Energy: 0.8517928081652263
Energy: 0.8728842265183214
Energy: 1.1618397543357009
Energy: 0.8476652802613852
Energy: 0.8557191232262008
Energy: 0.9925661761390302
Energy: 0.8519417308179998
Energy: 0.9527390633283304
Energy: 1.1412621384381965
Energy: 0.9677946440871253
Energy: 0.9509630041100102
Energy: 0.9951159085149377
Energy: 0.9964102079492061
Energy: 0.9336379978268604
Energy: 0.7632259197681561
Energy: 0.975310681371114
Energy: 0.9066979429495795
Energy: 0.8299462291453344
Energy: 1.000267787610969
Energy: 0.9069016817786755

minimum gb energy = 0.75481884827849 eV
minimum distance =  2.29976177695125 Angstroms
sigma value = 43


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

Energy: 0.6623641232713159
Energy: 0.988729467173352
Energy: 0.8275114963009932
Energy: 0.7104194340183092
Energy: 1.0264382339442328
Energy: 0.789636319646435
Energy: 0.9243273839204615
Energy: 0.7672648952526886
Energy: 0.72865405907549
Energy: 0.8550198069792507
Energy: 0.8181710012419088
Energy: 0.721960112237118
Energy: 1.0015483413560193
Energy: 0.6936894446419334
Energy: 0.7144408008146149
Energy: 0.8444732166461839
Energy: 0.6928723537885159
Energy: 0.7321284155876634
Energy: 0.8696442096650862
Energy: 0.6900823712062485
Energy: 0.7290639940843929
Energy: 0.7791007325221648
Energy: 0.7407222200945003
Energy: 0.7929705838298471
Energy: 0.7773067763296362
Energy: 0.7453476299070434
Energy: 0.7295832886783866
Energy: 0.7779072759172475
Energy: 0.7795377695798344
Energy: 0.7206076875698384
Energy: 0.6407381598855555
Energy: 0.7758071876087049
Energy: 0.7095495498758758
Energy: 0.6775239723497395
Energy: 0.7758802316797162
Energy: 0.6855205281696356
Energy: 0.9095835260842504
Energy: 0.7755796352426996
Energy: 0.7756857281746201
Energy: 0.7113251286475094
Energy: 0.7804316666676242
Energy: 0.6907137455083624
Energy: 0.9054663426542233
Energy: 0.6690422763524206
Energy: 0.6793761383200203
Energy: 0.711734847076197
Energy: 0.6698497955869331
Energy: 0.6782910330379752
Energy: 0.7151089175980414
Energy: 0.6790932905155656
Energy: 0.7122380588284098
Energy: 0.7171322889171728
Energy: 0.6563051489688152
Energy: 0.7119285524504237
Energy: 0.6996170256521428
Energy: 0.671382309694098
Energy: 0.671548027058591
Energy: 0.7135503752124328
Energy: 0.6703954906273863
Energy: 0.6708187763283553
Energy: 0.6354030532604668
Energy: 0.6722548909134349
Energy: 0.6675951618145086
Energy: 0.6550100736206494
Energy: 0.6726345839538591
Energy: 0.662404199220244
Energy: 0.7171180921737738
Energy: 0.6723917926536975
Energy: 0.6721696268071506
Energy: 0.7123310059274512
Energy: 0.6724822029018466
Energy: 0.6651862573216605
Energy: 0.865725565810253
Energy: 0.7057148367730737
Energy: 0.7143453329713473
Energy: 0.7127241276384784
Energy: 0.6815897300569316
Energy: 0.7147809353372825
Energy: 0.6490516576145362
Energy: 0.6629405455961692
Energy: 0.6488577385982051
Energy: 0.6509434087611865
Energy: 0.6381984487181056
Energy: 0.648941368016771
Energy: 0.64845286022333
Energy: 0.6561824505244437
Energy: 0.6558689736523314
Energy: 0.6483788009099383
Energy: 0.6551186297040725
Energy: 0.6549474788008737
Energy: 0.642266460028583
Energy: 0.6380213358337196
Energy: 0.6388690224690308
Energy: 0.6795634920620452
Energy: 0.6385360707480763
Energy: 0.6527914064416602
Energy: 0.6531393932935687
Energy: 0.6384336219100123
Energy: 0.637702620642399
Energy: 0.6803917447594329
Energy: 0.6385429715724409
Energy: 0.6591109323642794
Energy: 0.6374362044744291
Energy: 0.6592594491274695
Energy: 0.6594032435925178
Energy: 0.6383439732056826
Energy: 0.7012963390391929
Energy: 0.6597503159604143
Energy: 0.6382787012564746
Energy: 0.6581465084086424
Energy: 0.6380135231840849
Energy: 0.6403809490770472
Energy: 0.7651894238989002
Energy: 0.6382172120775063
Energy: 0.6381482844211972
Energy: 0.6663931821064029
Energy: 0.666256074245057
Energy: 0.6381992262681068
Energy: 0.7024279637074807
Energy: 0.6668058748692196
Energy: 0.6766564717267411
Energy: 0.6492649934699882
Energy: 0.6487818752205098
Energy: 0.7015187977279915
Energy: 0.6493677303469295
Energy: 0.6660928758336772
Energy: 0.6432161310841118
Energy: 0.6490232424943042
Energy: 0.6495497755320018
Energy: 0.6597342263752909
Energy: 0.6493439215604201
Energy: 0.6557040049658028
Energy: 0.6719998798837955
Energy: 0.659932385579357
Energy: 0.6597094144532887
Energy: 0.6721112859522522
Energy: 0.6588621770378583
Energy: 0.6591294910411142
Energy: 0.6725245022860773
Energy: 0.685339934317447
Energy: 0.6723704924098637
Energy: 0.6746656384278158
Energy: 0.6488551400324744
Energy: 0.672379250641491
Energy: 0.881582357079981
Energy: 0.6883393207117829
Energy: 0.7012416389783891
Energy: 0.7010860495871523
Energy: 0.687859892641252
Energy: 0.7013980130327054
Energy: 0.8169839926422013
Energy: 0.7120680566642119
Energy: 0.7121452553106269
Energy: 0.7020006578008552
Energy: 0.7122877898267044
Energy: 0.6681961204858046
Energy: 0.6386077441963859
Energy: 0.7121603469822005
Energy: 0.7126581003071406
Energy: 0.6693099327192548
Energy: 0.7119644902450023
Energy: 0.6736149027588321
Energy: 0.6762115308123778
Energy: 0.7117588011976099
Energy: 0.6929649864996046
Energy: 0.7367457666670943
Energy: 0.7121061833577059
Energy: 0.6914519000610286
Energy: 0.7793036515293628
Energy: 0.6992898114171026
Energy: 0.7756910949655471
Energy: 0.7814728715708722
Energy: 0.6764043336461647
Energy: 0.775514184626671
Energy: 0.9428449293871562
Energy: 0.6812293143761571
Energy: 0.6965432480187171
Energy: 0.7777251101036735
Energy: 0.6817795806225904
Energy: 0.6977739639283623
Energy: 0.9394099096108625
Energy: 0.7669043170707561
Energy: 0.7635643335078465
Energy: 0.7771596412242044
Energy: 0.7669508348294326
Energy: 0.7632431683442503
Energy: 0.6503143515214167
Energy: 0.8357775014624089
Energy: 0.7587701470656555
Energy: 0.6906484616852976
Energy: 0.8788904801882622
Energy: 0.7555965528489366
Energy: 0.8661700280609321
Energy: 0.8052188920190487
Energy: 0.7887270170522667
Energy: 0.7762322386292667
Energy: 0.88317126917745
Energy: 0.7820561080911362
Energy: 0.9411875355941529
Energy: 0.7407111230966402
Energy: 0.7569385053804608
Energy: 0.7792623257726502
Energy: 0.8333397393625341
Energy: 0.8394307833811288
Energy: 0.9878429825593543
Energy: 0.701072796518256
Energy: 0.7588467670559151
Energy: 0.8441890794259015
Energy: 0.7011301804345097
Energy: 0.7584414579914109
Energy: 0.9251433869699133
Energy: 0.8429743123864845
Energy: 0.7885923401000781
Energy: 0.8564513210037585
Energy: 0.8825636151156075
Energy: 0.7269302540948601

minimum gb energy = 0.6354030532604668 eV
minimum distance =  2.34665874066713 Angstroms
sigma value = 81


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

Energy: 0.04868430449101881
Energy: 0.051265855981092054
Energy: 0.04889069580737926
Energy: 0.051532537940714454
Energy: 0.05057471054866992
Energy: 0.04920238819223433
Energy: 0.10167037381028754
Energy: 0.05057561674639929
Energy: 0.051007130032050006
Energy: 0.09988617107399614
Energy: 0.05584206337690989
Energy: 0.05055114051221918
Energy: 0.09968097829540781
Energy: 0.04940500477285813
Energy: 0.04917842572806019
Energy: 0.09917724109380363
Energy: 0.04907098596486707
Energy: 0.09986643355456559
Energy: 0.0543461954340418
Energy: 0.049319151677001086
Energy: 0.04969063372432672
Energy: 0.05197230933585722
Energy: 0.04915737771166374
Energy: 0.1001873177847723
Energy: 0.09966590857381498
Energy: 0.10023565592583737
Energy: 0.09935499784800483
Energy: 0.10081609985401059
Energy: 0.09953206482122262
Energy: 0.10091005905965318
Energy: 0.04998396739285861
Energy: 0.0508360166692707
Energy: 0.04909930981593749
Energy: 0.05191675009234134
Energy: 0.05077381480019456
Energy: 0.049381775528285335
Energy: 0.10006415248694195
Energy: 0.05065660928433955
Energy: 0.05071819178799267
Energy: 0.10003308422100499
Energy: 0.05235827365792116
Energy: 0.050702097466682076
Energy: 0.09995728688487515
Energy: 0.04936788400141076
Energy: 0.04977206610037768
Energy: 0.09995793982310573
Energy: 0.049068804262626345
Energy: 0.10149258749905539
Energy: 0.05163895712628958
Energy: 0.04910227547968834
Energy: 0.10110727166573864
Energy: 0.05339856428885049
Energy: 0.0495506823992997
Energy: 0.10224371680618094
Energy: 0.048876090490159965
Energy: 0.09933092446358102
Energy: 0.09930302623976518
Energy: 0.04886401185521532
Energy: 0.09937682266075318
Energy: 0.099466732619529

minimum gb energy = 0.04868430449101881 eV
minimum distance =  2.46719484604358 Angstroms
sigma value = 3


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

Energy: 0.8162648016718177
Energy: 0.7838720996898104
Energy: 0.8033840269560847
Energy: 0.7106601607610817
Energy: 0.7816286910683983
Energy: 0.7118618692252924
Energy: 0.808978431507402
Energy: 0.7830736176662059
Energy: 0.7833613926687963
Energy: 0.7833808117680179
Energy: 0.7849609315880937
Energy: 0.7283921983047151
Energy: 0.8250338600204005
Energy: 0.736890942258657
Energy: 0.7376121992759239
Energy: 0.7822352441446349
Energy: 0.7365287540614015
Energy: 0.7821808676567197
Energy: 0.7497018998767444
Energy: 0.7372789322878559
Energy: 0.7358687069763582
Energy: 0.7493058978528434
Energy: 0.6700970423407133
Energy: 0.7875166048099097
Energy: 0.6824062406204969
Energy: 0.7832566285942961
Energy: 0.727041085346073
Energy: 0.6826389803039388
Energy: 0.7830149738473386
Energy: 0.7275723712034927
Energy: 0.7650432473955928
Energy: 0.727390929705945
Energy: 0.7337662279331656
Energy: 0.6322721994086948
Energy: 0.7269754040709
Energy: 0.67342470694016
Energy: 0.7504915405030591
Energy: 0.6956336016475557
Energy: 0.6966030731323594
Energy: 0.7499504834076063
Energy: 0.6994754031545053
Energy: 0.760166803488566
Energy: 0.7492827032809014
Energy: 0.6427074371949251
Energy: 0.683784257475982
Energy: 0.7492683074286653
Energy: 0.6057548734004723
Energy: 0.6849531623886911
Energy: 0.7161673147603759
Energy: 0.6844881329831126
Energy: 0.7635255446483149
Energy: 0.6454157367620339
Energy: 0.6386761268820764
Energy: 0.7620389206237435
Energy: 0.647414207081585
Energy: 0.6945702818312897
Energy: 0.6937238689713086
Energy: 0.6484025410252534
Energy: 0.6996347913189296
Energy: 0.6968061176499009
Energy: 0.6118782996980172
Energy: 0.6992194597688557
Energy: 0.7000082608329535
Energy: 0.6151483517520109
Energy: 0.6159947516663157
Energy: 0.6413191514129786
Energy: 0.6469106068366025
Energy: 0.773062642519153
Energy: 0.6949038644736404
Energy: 0.6468728674044132
Energy: 0.6462640155085843
Energy: 0.6461961772219253
Energy: 0.6479052413275461
Energy: 0.7194990857789466
Energy: 0.6504982364122737
Energy: 0.6487066521516616
Energy: 0.5950623159499702
Energy: 0.6499920034079429
Energy: 0.5995276441220607
Energy: 0.6184069562679376
Energy: 0.6458780093310728
Energy: 0.6522382859323514
Energy: 0.6151884272717839
Energy: 0.7431487084840775
Energy: 0.7473794122014746
Energy: 0.6155012651496848
Energy: 0.615120825428671
Energy: 0.746866047334293
Energy: 0.6194063558535439
Energy: 0.6148243692587108
Energy: 0.7474464075261834
Energy: 0.6171358753580176
Energy: 0.6185033151131168
Energy: 0.6767686136916561
Energy: 0.741136467245346
Energy: 0.7222229640416957
Energy: 0.5993017390086534
Energy: 0.61737949447587
Energy: 0.7211528561537741
Energy: 0.599356268550764
Energy: 0.6192906813559409
Energy: 0.5987108566133328
Energy: 0.59849086651518
Energy: 0.7133722505985168
Energy: 0.7136212017288175
Energy: 0.5988536401493126
Energy: 0.6010178380488834
Energy: 0.6701937952048775
Energy: 0.7479018616068053
Energy: 0.6025553865898465
Energy: 0.7212696458142953
Energy: 0.6012461465819904
Energy: 0.5985622308492202
Energy: 0.715913478693068
Energy: 0.7405792407371651
Energy: 0.5985726072109573
Energy: 0.5981362778690849
Energy: 0.7414062750067036
Energy: 0.6054117044779435
Energy: 0.5983706927460357
Energy: 0.7392719355223144
Energy: 0.7221975809065345
Energy: 0.7230637298599092
Energy: 0.74115668881567
Energy: 0.7253017569349288
Energy: 0.72136792816301
Energy: 0.618498855895157
Energy: 0.7229225286346191
Energy: 0.618642514394938
Energy: 0.6168225290216236
Energy: 0.7239984568262608
Energy: 0.6155255412680402
Energy: 0.6145711814629251
Energy: 0.7492773331389847
Energy: 0.7492034161280715
Energy: 0.6147075746250501
Energy: 0.6520018850600529
Energy: 0.6524858814688276
Energy: 0.7497659994498849
Energy: 0.6526103506173473
Energy: 0.6505941205372268
Energy: 0.6755379679866759
Energy: 0.6501707257158931
Energy: 0.628993468430911
Energy: 0.616744864922846
Energy: 0.6474264207528679
Energy: 0.6471460632471758
Energy: 0.6902061667541773
Energy: 0.6521668501019576
Energy: 0.6470068045749925
Energy: 0.6166846781045646
Energy: 0.6668392718289797
Energy: 0.6631806223806374
Energy: 0.6175000998246869
Energy: 0.7217289815903738
Energy: 0.6972906294624753
Energy: 0.6983884300215722
Energy: 0.664516949907975
Energy: 0.6655725508858529
Energy: 0.6978955038924367
Energy: 0.6241926372751887
Energy: 0.6947501068861486
Energy: 0.661942271614604
Energy: 0.6911331603074351
Energy: 0.7943917854985417
Energy: 0.6619609790752986
Energy: 0.7243433484228503
Energy: 0.7941033126423791
Energy: 0.7673628418101567
Energy: 0.7494103284851507
Energy: 0.718481944882727
Energy: 0.6180896036937419
Energy: 0.7486591371412212
Energy: 0.6576012561887147
Energy: 0.6946090590348251
Energy: 0.7644579663446885
Energy: 0.7667859256102936
Energy: 0.6947433756294153
Energy: 0.750682963681669
Energy: 0.7915075974056417
Energy: 0.7657450473373245
Energy: 0.6584054409268242
Energy: 0.7043171337911452
Energy: 0.7655196793896281
Energy: 0.6120413923968206
Energy: 0.7050044576868173
Energy: 0.8300243294148077
Energy: 0.6965239150314857
Energy: 0.8001737308615186
Energy: 0.7780476014889396
Energy: 0.6535730085566995
Energy: 0.7529931898719227
Energy: 0.7009143713396716
Energy: 0.7488069625203886
Energy: 0.7479103709827631
Energy: 0.7007728695235285
Energy: 0.7556271096985219
Energy: 0.7471727029912587

minimum gb energy = 0.5950623159499702 eV
minimum distance =  2.30411862203189 Angstroms
sigma value = 67


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

Energy: 0.9794117385685922
Energy: 0.9687142648300989
Energy: 0.929824898463942
Energy: 0.7804433812454087
Energy: 1.0868651826065514
Energy: 0.9629040459621255
Energy: 0.9753300189191944
Energy: 0.9560530067955221
Energy: 0.9431955492269484
Energy: 0.9378101601446936
Energy: 0.953301812563957
Energy: 0.8651712736356028
Energy: 0.9571566934637494
Energy: 0.875014164953449
Energy: 0.9516536089305698
Energy: 0.9306820136722318
Energy: 0.8757732190055684
Energy: 0.9557500333641542
Energy: 0.8847127016734265
Energy: 0.951312541482234
Energy: 0.9491506872806297
Energy: 0.8854611533836783
Energy: 0.8850969498845589
Energy: 0.9513144431571195
Energy: 0.8743889693671003
Energy: 0.9566420962467356
Energy: 0.8705562790634346
Energy: 0.8744518204932814
Energy: 0.9512747321327356
Energy: 0.8639322439271224
Energy: 0.9179222575726017
Energy: 0.866906241502118
Energy: 0.8713498907064795
Energy: 0.808071440381714
Energy: 0.8653382149234016
Energy: 0.8817920753290265
Energy: 0.8877343601683116
Energy: 0.8962856991217215
Energy: 0.8096497346744224
Energy: 0.8886686736471082
Energy: 0.8093438721220989
Energy: 0.8181870595570024
Energy: 0.8790633286871645
Energy: 0.772637461378717
Energy: 0.8019052690622734
Energy: 0.8784809660689283
Energy: 0.7651116990739099
Energy: 0.8131928323711493
Energy: 0.7756895982518431
Energy: 0.8140850447383722
Energy: 0.8104885471445246
Energy: 0.9281250050525729
Energy: 0.8054467595378436
Energy: 0.8103333566389533
Energy: 0.7629144592248425
Energy: 0.8121926020477768
Energy: 0.8072324068590584
Energy: 0.7640981077004966
Energy: 0.8094586461790195
Energy: 0.8078759663757777
Energy: 0.7637023046464875
Energy: 0.8061189537046872
Energy: 0.806033280069958
Energy: 0.7667905465887953
Energy: 0.9106599481414823
Energy: 0.807794339353161
Energy: 0.7722102941911374
Energy: 0.8127177781645133
Energy: 0.9017549277940663
Energy: 0.7730496930636668
Energy: 0.8100866882541221
Energy: 0.7641970981627116
Energy: 0.7646727968528101
Energy: 0.7765861892517496
Energy: 0.890551166003003
Energy: 0.7645476746027394
Energy: 0.7691873221962575
Energy: 0.7637862353128054
Energy: 0.9095015140373589
Energy: 0.8418306110420509
Energy: 0.8435841034918056
Energy: 0.7663395474071216
Energy: 0.8397870816197947
Energy: 0.891626216224106
Energy: 0.904322636596539
Energy: 0.7698508663661467
Energy: 0.765604118403941
Energy: 0.9057051424153965
Energy: 0.7670563609179626
Energy: 0.7658482030177649
Energy: 0.9030629103792176
Energy: 0.8497876825599131
Energy: 0.903696439149899
Energy: 0.8473960773046538
Energy: 0.7635702219766863
Energy: 0.9009156938570385
Energy: 0.8137388504987544
Energy: 0.7631837902917256
Energy: 0.774300735909638
Energy: 0.8142382075642715
Energy: 0.7562667193235452
Energy: 0.8049129983428662
Energy: 0.8064879213727437
Energy: 0.9283299260193404
Energy: 0.932774926477137
Energy: 0.8066428939480559
Energy: 0.8105583445857885
Energy: 0.8074130036282612
Energy: 0.9020277249816203
Energy: 0.7687039303894025
Energy: 0.8348830591539019
Energy: 0.7800091418817809
Energy: 0.7694390216029656
Energy: 0.8327253135529279
Energy: 0.8069621236780421
Energy: 0.8840414608692142
Energy: 0.820763807188547
Energy: 0.808328075296254
Energy: 0.8823327769344702
Energy: 0.8147800327588192
Energy: 0.8947619372583314
Energy: 0.9088419054514886
Energy: 0.7726571772918326
Energy: 0.8958048081016855
Energy: 0.9141431600675093
Energy: 0.7811638730731651
Energy: 0.956095527614514
Energy: 0.7703882068008276
Energy: 0.7805275326866996
Energy: 0.9322819567058229
Energy: 0.848370769881171
Energy: 0.7788625276123439
Energy: 0.9107514373827336
Energy: 0.8883488407090091
Energy: 0.8787995148311384
Energy: 0.9110836654377075
Energy: 0.8840101643111702
Energy: 0.8113923449637805

minimum gb energy = 0.7562667193235452 eV
minimum distance =  2.30199508466274 Angstroms
sigma value = 33


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

Energy: 1.1196891630881085
Energy: 0.998609294114113
Energy: 1.122582208851398
Energy: 0.9119742865081797
Energy: 0.9986277161776246
Energy: 1.0390813501649239
Energy: 1.1067105311771825
Energy: 0.9643067861043545
Energy: 0.9636638814973466
Energy: 0.9633020701649876
Energy: 0.962439758720091
Energy: 0.893371695716488
Energy: 1.083445414447897
Energy: 0.9595835096590413
Energy: 1.0174068614486187
Energy: 0.9692751268565465
Energy: 0.956085379677702
Energy: 1.0429378918944563
Energy: 0.9643895595246553
Energy: 1.0172666337076468
Energy: 1.0430668141852548
Energy: 0.9640122247046149
Energy: 1.0403651108464187
Energy: 1.0463293814128538
Energy: 0.9618561328890465
Energy: 0.9651510960702226
Energy: 0.8924535658181804
Energy: 0.961915019676059
Energy: 1.058276147118944
Energy: 0.8924549369709323
Energy: 0.9652191462579253
Energy: 0.8851884471763736
Energy: 0.8878745807875886
Energy: 0.8853239087540412
Energy: 0.8829497059228327
Energy: 0.9579641226615128
Energy: 0.9624075906790106
Energy: 0.8846199008401064
Energy: 0.8858215251016608
Energy: 0.9627942547844549
Energy: 0.8836414054429952
Energy: 0.8906484218391222
Energy: 0.9638413240263275
Energy: 0.8808564436601662
Energy: 0.9315759862389021
Energy: 0.9637573820261713
Energy: 0.8882784325919728
Energy: 0.9634409901650681
Energy: 0.9517160490258495
Energy: 0.9740973001852637
Energy: 0.9039790346333759
Energy: 0.893877135451107
Energy: 0.882156841951805
Energy: 0.8935272490271318
Energy: 0.9503985638473503
Energy: 0.8827308549652118
Energy: 0.8824169864564052
Energy: 0.9505625377449133
Energy: 0.8835774118166749
Energy: 0.88317671441745
Energy: 0.944509757049381
Energy: 0.8837171131845943
Energy: 0.8830773498921618
Energy: 0.8857691617383702
Energy: 0.8828965621489359
Energy: 0.8875763472453492
Energy: 0.8825671924739201
Energy: 0.8834838185434427
Energy: 0.8833506886440462
Energy: 0.8826398691863079
Energy: 0.8997481801870159
Energy: 0.8840985410900464
Energy: 0.8818055971405687
Energy: 0.8937258385825337
Energy: 0.8821983376268825
Energy: 0.8815193629416962
Energy: 0.893891166668886
Energy: 0.8824345855053585
Energy: 0.8580622027270661
Energy: 0.8922729717854468
Energy: 0.891744299554281
Energy: 0.8619713996224264
Energy: 0.9454696275571728
Energy: 0.9010508679585588
Energy: 0.8599933067255564
Energy: 0.9633686822856166
Energy: 0.8952375723163245
Energy: 0.8592358060325975
Energy: 0.9636361479383038
Energy: 0.8905877859633202
Energy: 0.8955771839701497
Energy: 0.9871128771112389
Energy: 0.8573192306094032
Energy: 0.8954302896111122
Energy: 0.9012384970061281
Energy: 0.8908446773801312
Energy: 1.0842952236111514
Energy: 0.900175140435503
Energy: 0.900889174712337
Energy: 0.9708117241185733
Energy: 0.9069854587446551
Energy: 0.9468689747642696
Energy: 1.0822361805830716
Energy: 0.9616176085258343
Energy: 0.9620617411289769
Energy: 1.0540814934253167
Energy: 0.9675627616668617
Energy: 1.05413041132215
Energy: 1.058698395581578
Energy: 0.9716524397363082
Energy: 0.9040491967005337
Energy: 0.90727523410865
Energy: 0.9725400702541565
Energy: 1.007863227957518
Energy: 1.0087950218226025
Energy: 0.9649477608708363
Energy: 0.9647738660214134
Energy: 1.009738471704627
Energy: 0.9640407322019341
Energy: 0.8933510639207959
Energy: 1.0874062531503514
Energy: 1.0179477729619666
Energy: 1.019561706591045
Energy: 0.9672004632429363
Energy: 0.9707162261503698
Energy: 1.0441417911993187
Energy: 1.0506929743192408
Energy: 0.9585908329401635
Energy: 1.0210331189623576
Energy: 0.9655943720762697
Energy: 0.9772645544003313
Energy: 0.8796135557843152
Energy: 0.9621645970143101
Energy: 0.9646956342858267
Energy: 0.8933056703021254
Energy: 0.9624281466791053
Energy: 0.962882227513336
Energy: 0.8936701973921731
Energy: 0.9713388117098828
Energy: 0.8841204262337046
Energy: 0.8848405335042909
Energy: 0.8775273127887728
Energy: 0.8828079114733935
Energy: 0.9840481967023158
Energy: 0.9621143680611911
Energy: 0.8844331209176428
Energy: 0.8847275621497969
Energy: 0.9620854759892848
Energy: 0.8840943724619483
Energy: 0.8898407504421753
Energy: 0.9687323992958236
Energy: 0.8807143847431154
Energy: 0.931935208270646
Energy: 0.9701149673043356
Energy: 0.8874699048387654
Energy: 0.9605383617792393
Energy: 0.9496927244774718
Energy: 0.882534870970525
Energy: 0.9684815818188858
Energy: 0.9508264136942521
Energy: 0.9053101293965635
Energy: 0.8921111602361472
Energy: 0.9502720324281462
Energy: 0.8832695740217971
Energy: 0.8828153261181928
Energy: 0.9500796729628244
Energy: 0.8838293925340499
Energy: 0.8832362320740701
Energy: 0.9468961738884656
Energy: 0.8854724714249596
Energy: 0.8849557246150251
Energy: 0.8879306260281155
Energy: 0.8838992023806012
Energy: 0.8861115527384333
Energy: 0.8826805204729449
Energy: 0.8820824929205849
Energy: 0.9363265490982404
Energy: 0.8833597819007472
Energy: 0.9040039693156386
Energy: 0.88382424670763
Energy: 0.8843831769270276
Energy: 0.8932044861580342
Energy: 0.8820485389860864
Energy: 0.8841492994989051
Energy: 0.8935275710698584
Energy: 0.8828071025854456
Energy: 0.8590878662824024
Energy: 0.8927162817532139
Energy: 0.8923049448690195
Energy: 0.8615188452898564
Energy: 0.9501450887840255
Energy: 0.9089352691001955
Energy: 0.8605230919839253
Energy: 0.9637051404354049
Energy: 0.9590128541589911
Energy: 0.8600638705864708
Energy: 0.9646829969931318
Energy: 0.8947612995309866
Energy: 0.8931824247686634
Energy: 0.9875118793723265
Energy: 0.882208935506045
Energy: 0.8932830192838678
Energy: 0.9001676521977933
Energy: 0.8909080131296743
Energy: 1.1443184584270953
Energy: 0.90134010478961
Energy: 0.9015426176953358
Energy: 1.1431974547608665
Energy: 0.8625654294841142
Energy: 0.9459513153485961
Energy: 1.0871329543992898
Energy: 0.9613560702319729
Energy: 0.9598799816313643
Energy: 1.059005663725527
Energy: 0.9604859865607631
Energy: 0.8905515917513791
Energy: 1.060004980683354
Energy: 0.9716555306690422
Energy: 0.9046102702161084
Energy: 0.9027364363952572
Energy: 0.9707430599921655
Energy: 1.0090584728515573

minimum gb energy = 0.8573192306094032 eV
minimum distance =  2.30695229813348 Angstroms
sigma value = 41


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

Energy: 1.397464528012716
Energy: 1.0747533045803515
Energy: 1.1766068497184947
Energy: 1.0170005073628878
Energy: 1.0742366682954911
Energy: 1.1769245715462782
Energy: 1.241724797529538
Energy: 1.083790082773182
Energy: 1.0774859795162497
Energy: 1.0791687732563633
Energy: 1.1566971111746929
Energy: 1.1238353948880226
Energy: 1.2280074035163486
Energy: 1.0235771154422952
Energy: 1.0196661376305869
Energy: 1.0788212450051817
Energy: 1.0564598388240762
Energy: 1.0761251437923445
Energy: 1.0838258121460187
Energy: 1.0233782567963965
Energy: 1.0205933882988685
Energy: 1.084282079014035
Energy: 1.0238062119846383
Energy: 1.0576163597769108
Energy: 1.0555770757448786
Energy: 1.081564460655207
Energy: 1.080937024807834
Energy: 1.055727361166711
Energy: 1.0827011153026134
Energy: 1.0480732559204409
Energy: 1.091162603127798
Energy: 1.1273378591827246
Energy: 1.0251051016984045
Energy: 1.028717981043315
Energy: 1.1274041177513394
Energy: 1.0230190355494786
Energy: 1.0537962682711979
Energy: 1.047901320002526
Energy: 1.0433899863597331
Energy: 1.0537794426031608
Energy: 1.0226428798852112
Energy: 1.0278323559581384
Energy: 1.0573897547794187
Energy: 1.024664473819892
Energy: 1.0272300541754258
Energy: 1.0588713131932657
Energy: 1.0242560684365185
Energy: 1.0555490481758087
Energy: 1.1435853345811122
Energy: 1.023867772631103
Energy: 1.0223144107250606
Energy: 1.1462807617853459
Energy: 1.095322619899949
Energy: 1.0224301140969465
Energy: 1.0929262196906682
Energy: 1.0623909674306276
Energy: 1.0554615355706771
Energy: 1.07696777501063
Energy: 1.0563435262426035
Energy: 1.0231284426023999
Energy: 1.1716576517134207
Energy: 1.0577566664053115
Energy: 1.0249313039708128
Energy: 1.0222767541637052
Energy: 0.9975981426185758
Energy: 1.0272833488261466
Energy: 1.2291077813781124
Energy: 0.9977063350660619
Energy: 1.077162434564375
Energy: 1.2296053755100793
Energy: 0.997658310327131
Energy: 1.086019972520594
Energy: 1.2409067224152757
Energy: 1.0600143695653377
Energy: 1.0764405168400835
Energy: 1.0774140462739492
Energy: 1.058107114745244
Energy: 1.1251112381076422
Energy: 0.9972623440707018
Energy: 1.077666699652171
Energy: 0.9988366866207783
Energy: 1.0043062985402798
Energy: 1.0784892903591468
Energy: 0.9988689223033755

minimum gb energy = 0.9972623440707018 eV
minimum distance =  2.31869927916176 Angstroms
sigma value = 11


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

Energy: 1.773270527525765
Energy: 1.2917449686290745
Energy: 1.2483575394570658
Energy: 1.2425653428328438
Energy: 1.358417264600777
Energy: 1.21236605268338
Energy: 1.3767672439856888
Energy: 1.1733967966873569
Energy: 1.1727330492623935
Energy: 1.2346677554283518
Energy: 1.1735592647449478
Energy: 1.161076716019329
Energy: 1.397766557881444
Energy: 1.2002208519900937
Energy: 1.2191881713703587
Energy: 1.4007353719677864
Energy: 1.1592356991051864
Energy: 1.2045647959181558
Energy: 1.2333288983017952
Energy: 1.1577588855513214
Energy: 1.202997487876914
Energy: 1.1978280216200436
Energy: 1.1583403436176039
Energy: 1.2026226753065345
Energy: 1.2315027374199277
Energy: 1.1734981471933024
Energy: 1.1736235941690185
Energy: 1.1976066105049321
Energy: 1.1735513409292677
Energy: 1.1730931718153015
Energy: 1.2325679577375575
Energy: 1.1927810090454134
Energy: 1.203300957169209
Energy: 1.2085184651681773
Energy: 1.192628827495417
Energy: 1.2180395227324043
Energy: 1.1927055953278403
Energy: 1.2065756116719153
Energy: 1.2029994496827339
Energy: 1.192480046486158
Energy: 1.2261082651726503
Energy: 1.207145140666438
Energy: 1.1907555038930442
Energy: 1.193941684407426
Energy: 1.1736070501840818
Energy: 1.1746100915989697
Energy: 1.2321694614896443
Energy: 1.1738787862414268
Energy: 1.1939709257753266
Energy: 1.2170746789666946
Energy: 1.2061242382483506
Energy: 1.1701150706081043
Energy: 1.1836823509435885
Energy: 1.1634429387705472
Energy: 1.1937679804368604
Energy: 1.2171191472110863
Energy: 1.204640071884285
Energy: 1.1849779041187756
Energy: 1.2170417843895387
Energy: 1.1633213924479928
Energy: 1.1914232351833625
Energy: 1.1971436512254348
Energy: 1.1737394798078418
Energy: 1.1741660396622187
Energy: 1.1885310182083797
Energy: 1.172589182058793
Energy: 1.1770004561000702
Energy: 1.1568694191854758
Energy: 1.219326645655027
Energy: 1.1778466184984098
Energy: 1.2201888874319675
Energy: 1.2774427791623444
Energy: 1.1727583970952575
Energy: 1.2016395744044375
Energy: 1.1940414058582107
Energy: 1.1725876030782034
Energy: 1.2370978411032139
Energy: 1.1926954943452035
Energy: 1.1908252468914295
Energy: 1.283985885896524
Energy: 1.2281648775443597
Energy: 1.1977354510264042
Energy: 1.1850386647919895
Energy: 1.22382461862775
Energy: 1.1597494561839674
Energy: 1.1801042994271282
Energy: 1.2245279485600933
Energy: 1.1602548412115263
Energy: 1.180581234205071
Energy: 1.1603615471499782
Energy: 1.1606329230069345
Energy: 1.1810900065375003
Energy: 1.159979795701851
Energy: 1.1623535376533451
Energy: 1.1798340167618238
Energy: 1.159992352486148
Energy: 1.159411181279013
Energy: 1.216339664928745
Energy: 1.2291722876565772
Energy: 1.159571370284997
Energy: 1.1826038206253888
Energy: 1.188815229897664
Energy: 1.2035877064178528
Energy: 1.2420215674165342
Energy: 1.2442562352943236
Energy: 1.1900250188315598
Energy: 1.2724411324052407
Energy: 1.203621246130163
Energy: 1.190004559925901
Energy: 1.1809284533174345
Energy: 1.1806113364301873
Energy: 1.1903261391827997
Energy: 1.1924697511134756
Energy: 1.208256585345443
Energy: 1.2140756691791406
Energy: 1.2187399344401446
Energy: 1.1608121078610645
Energy: 1.1894102321718953
Energy: 1.1601364732841097
Energy: 1.2152834681526274
Energy: 1.2800899695622607
Energy: 1.1603440150970556
Energy: 1.2247487322101402
Energy: 1.1840595481185678
Energy: 1.1920786472629714
Energy: 1.201592367256029
Energy: 1.1905483066559404
Energy: 1.1831379420023842
Energy: 1.1832353197897618
Energy: 1.1703645463562786
Energy: 1.183920435512479
Energy: 1.2034331174539463
Energy: 1.2041655444166866
Energy: 1.1835051840191897
Energy: 1.2006368622155525
Energy: 1.1571422626810224
Energy: 1.1850747436955726
Energy: 1.2208526084471285
Energy: 1.2744168709850159
Energy: 1.1912440170832264
Energy: 1.1966603074254671
Energy: 1.1924138064710827
Energy: 1.1910095222332553
Energy: 1.1802232687599645
Energy: 1.2685816118624789
Energy: 1.2064168374838427
Energy: 1.2053270653008086
Energy: 1.2703720259810412
Energy: 1.1732292928309007
Energy: 1.2510398467500488
Energy: 1.2720715300357164
Energy: 1.1911019173698596
Energy: 1.1736122804016857
Energy: 1.1931144977218278
Energy: 1.1600123954848824
Energy: 1.205550872766177
Energy: 1.2678248745128333
Energy: 1.159498384026143
Energy: 1.1590801459627085
Energy: 1.180354268252323
Energy: 1.162850296794126
Energy: 1.1608335891775334
Energy: 1.2675907339029377
Energy: 1.1841371717906988
Energy: 1.160040667193865
Energy: 1.1818403369599282
Energy: 1.1605195452165842
Energy: 1.2259480884484377
Energy: 1.2853887503879315
Energy: 1.2122346030329423
Energy: 1.2133386758568547
Energy: 1.285108640033821
Energy: 1.170558006428073
Energy: 1.20590867018566
Energy: 1.390134697629154
Energy: 1.1732688174338397
Energy: 1.174390635157013
Energy: 1.2009635563821786
Energy: 1.172787235002923
Energy: 1.1803873088459285
Energy: 1.2382821850486556
Energy: 1.1737080237912123
Energy: 1.2177797122219434
Energy: 1.160280429536879
Energy: 1.1787222620484512
Energy: 1.2128422747052572

minimum gb energy = 1.1568694191854758 eV
minimum distance =  2.30544551740384 Angstroms
sigma value = 57


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

Energy: 1.6064256416489233
Energy: 1.1730611779589817
Energy: 1.3284766719531165
Energy: 1.329476055375448
Energy: 1.7470712777006268
Energy: 1.3262370272807162
Energy: 1.2461403882515105
Energy: 1.1820820235552603
Energy: 1.1823126278662393
Energy: 1.172470474933244
Energy: 1.1805199948293206
Energy: 1.1731986868897102
Energy: 1.25175084921568
Energy: 1.209726781782682
Energy: 1.1691969702100256
Energy: 1.2471321040924723
Energy: 1.1693312972207512
Energy: 1.1853694528952756
Energy: 1.1729989074339404
Energy: 1.1842251926603662
Energy: 1.1702723891399163
Energy: 1.174382735689548
Energy: 1.1693690419612341
Energy: 1.171491072455153
Energy: 1.1723252518346559
Energy: 1.1816835771190222
Energy: 1.1861924729199649
Energy: 1.1766436704300416
Energy: 1.1764058592516848
Energy: 1.1737249395435398
Energy: 1.1748790325215908
Energy: 1.2463886448521078
Energy: 1.2470376721287213
Energy: 1.1773695710160526
Energy: 1.2482698311282396
Energy: 1.179462382875389
Energy: 1.2463062283533188
Energy: 1.203840834015563
Energy: 1.2148492749380473
Energy: 1.2476786066524688
Energy: 1.2010549121445455
Energy: 1.24753164903763
Energy: 1.2999355107678063
Energy: 1.1820038686042975
Energy: 1.1828627985511209
Energy: 1.1777919631962335
Energy: 1.1727792800014634
Energy: 1.1711950394799462
Energy: 1.2079709567737742
Energy: 1.17766100963888
Energy: 1.2052477718259835
Energy: 1.138370181999309
Energy: 1.1735488778777312
Energy: 1.2106185088992722
Energy: 1.1378970076916601
Energy: 1.1754334109319635
Energy: 1.2062288330403952
Energy: 1.1384399722699703
Energy: 1.2469516748677496
Energy: 1.143298767474504
Energy: 1.2994470581466615
Energy: 1.1842768202688392
Energy: 1.1884039356417364
Energy: 1.1784698965769065
Energy: 1.1728491904488856
Energy: 1.1705730239630592
Energy: 1.233399161953006
Energy: 1.269630151429252
Energy: 1.2770443468239046
Energy: 1.2338651512785934
Energy: 1.2068918637995933
Energy: 1.1753605421662525
Energy: 1.1722986138346017
Energy: 1.179434675824908
Energy: 1.177948204791098
Energy: 1.173073092837388
Energy: 1.1750820813775242
Energy: 1.1716206157018718
Energy: 1.1750463887167224
Energy: 1.2483444252336278
Energy: 1.2490905777117622
Energy: 1.1792122031540757
Energy: 1.2493520572919445
Energy: 1.1735698671137187
Energy: 1.174248843219814
Energy: 1.199011543299051
Energy: 1.1825838734320948
Energy: 1.1733405147454574
Energy: 1.192489859223255
Energy: 1.1709226625166784
Energy: 1.2541199631210516
Energy: 1.20067659478035
Energy: 1.2080214318493976
Energy: 1.2492509078973377
Energy: 1.1944482586003007
Energy: 1.184466009360928
Energy: 1.1380257298944745
Energy: 1.1792010816164837
Energy: 1.1718688859886077
Energy: 1.1376779293347852
Energy: 1.1813512832407316
Energy: 1.1748968425466073

minimum gb energy = 1.1376779293347852 eV
minimum distance =  2.32198252920427 Angstroms
sigma value = 9


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

Energy: 1.9636304430598168
Energy: 1.3289997507416105
Energy: 1.273867327864937
Energy: 1.2433143209872666
Energy: 1.326274237039905
Energy: 1.2857408370821828
Energy: 1.2649492767402428
Energy: 1.2588054727628237
Energy: 1.2536549737750478
Energy: 1.2695012885385064
Energy: 1.258701097089532
Energy: 1.2576441971460892
Energy: 1.297620758644388
Energy: 1.2493511592255495
Energy: 1.2545555317101618
Energy: 1.256640492721154
Energy: 1.2880328426310985
Energy: 1.2561880950802573
Energy: 1.24092444587908
Energy: 1.2521242514080269
Energy: 1.2779151409986087
Energy: 1.2410665684907032
Energy: 1.2508638313049871
Energy: 1.2537879012734878
Energy: 1.299226717061744
Energy: 1.243448362147455
Energy: 1.2154047997886197
Energy: 1.3000047788689273
Energy: 1.2591696701567623
Energy: 1.2133210810600263
Energy: 1.2518395823890653
Energy: 1.26024998790148
Energy: 1.2582807816830244
Energy: 1.2534318084951597
Energy: 1.2584785440209816
Energy: 1.2579551196476728
Energy: 1.2330005852719437
Energy: 1.2586312400394126
Energy: 1.2411942981403665
Energy: 1.2341410145960687
Energy: 1.2643125032905607
Energy: 1.2432254419993882
Energy: 1.2774938849137407
Energy: 1.2530313861060585
Energy: 1.264259274644736
Energy: 1.2339387314231414
Energy: 1.2535972748973971
Energy: 1.2659613666955927
Energy: 1.275993343678671
Energy: 1.2434200674579814
Energy: 1.2221549929453317
Energy: 1.2715253781683808
Energy: 1.2585555696740818
Energy: 1.2778864514566062
Energy: 1.2771479758005746
Energy: 1.23996219184492
Energy: 1.2202991373860068
Energy: 1.271008394263733
Energy: 1.2349346542076305
Energy: 1.2136602947326407
Energy: 1.2771936442369438
Energy: 1.2444914066421224
Energy: 1.2443477753029684
Energy: 1.23452920691065
Energy: 1.2619304569729775
Energy: 1.2146680692520262
Energy: 1.2776257360024246
Energy: 1.2527005591959286
Energy: 1.2540666055708267
Energy: 1.2591699178650302
Energy: 1.291169263135011
Energy: 1.2562872351709389
Energy: 1.4968430574135836
Energy: 1.2493727571937494
Energy: 1.2556075196910004
Energy: 1.2606195716119908
Energy: 1.2435134586414613
Energy: 1.2558105647754882
Energy: 1.2734983477701263
Energy: 1.2497357308230577
Energy: 1.2521005998710317
Energy: 1.2615672651366474
Energy: 1.214599195141157
Energy: 1.2537926834021769
Energy: 1.2771577502500018
Energy: 1.2114388191857508
Energy: 1.210665581444385
Energy: 1.2592427942283977
Energy: 1.2412348635783315
Energy: 1.21651010168493
Energy: 1.2576704086906625
Energy: 1.2475976987628863
Energy: 1.210276918765557
Energy: 1.2586545622057983
Energy: 1.282905216821228
Energy: 1.2105120255881685
Energy: 1.2590579974428846
Energy: 1.2518535231136094
Energy: 1.2837585811942451
Energy: 1.2600276402900301
Energy: 1.250620320421869
Energy: 1.2528941615911986
Energy: 1.4041048974313337
Energy: 1.2591873354224443
Energy: 1.2571494921140645
Energy: 1.291657257541231
Energy: 1.2666498618100472
Energy: 1.2164368410970616
Energy: 1.2578862579203927
Energy: 1.253361440859336
Energy: 1.2543043462891663
Energy: 1.2580330341975736
Energy: 1.2364614323149519
Energy: 1.2557497686524242
Energy: 1.2587515213312217
Energy: 1.2530576943442673
Energy: 1.2533592985969142
Energy: 1.2359021659072245
Energy: 1.2716864454267192
Energy: 1.253085654568092
Energy: 1.2601237978619408
Energy: 1.2647287468843063
Energy: 1.2779652598327849
Energy: 1.225116676084541
Energy: 1.2626306909946825
Energy: 1.2626482791793334

minimum gb energy = 1.210276918765557 eV
minimum distance =  2.2858997919162 Angstroms
sigma value = 27


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

Energy: 1.808706057818592
Energy: 1.3660756881741007
Energy: 1.222547705735897
Energy: 1.2209191172250606
Energy: 1.8073094553038818
Energy: 1.2258842496486841
Energy: 1.318913960817261
Energy: 1.223598370035331
Energy: 1.224932928994569
Energy: 1.2424759039153892
Energy: 1.2505473764181017
Energy: 1.2243497521758204
Energy: 1.2452229417584566
Energy: 1.2082588698835095
Energy: 1.2106935093457143
Energy: 1.234542923641121
Energy: 1.2378168517085293
Energy: 1.270470062464067
Energy: 1.2361083110542557
Energy: 1.2294412764587748
Energy: 1.2287092424076531
Energy: 1.2368743856180655
Energy: 1.2291464705429176
Energy: 1.2441973167069156
Energy: 1.2442431354506365
Energy: 1.2149982418159864
Energy: 1.2139218741547553
Energy: 1.2455685127263043
Energy: 1.2488018514629904
Energy: 1.2104921911285245
Energy: 1.2530685641533026
Energy: 1.2400994773418847
Energy: 1.2427534625503431
Energy: 1.2528679200811106
Energy: 1.237403257212893
Energy: 1.2481838845017463
Energy: 1.2243749176019119
Energy: 1.2100099662002268
Energy: 1.2096369117399826
Energy: 1.225039562448725
Energy: 1.266299938556667
Energy: 1.208594761295108
Energy: 1.2600605422997568
Energy: 1.2070055909685147
Energy: 1.2061534273448167
Energy: 1.248824624767965
Energy: 1.2198943778984246
Energy: 1.2080392525602255
Energy: 1.2613309522195153
Energy: 1.2590107399796373
Energy: 1.2286576855474607
Energy: 1.2705555480654633
Energy: 1.265900312665757
Energy: 1.2275439464595135
Energy: 1.2613821188889187
Energy: 1.2573368164236833
Energy: 1.260362248810152
Energy: 1.252502116391395
Energy: 1.2486995552896796
Energy: 1.2444152367197183
Energy: 1.2827353208703567
Energy: 1.2715102647166112
Energy: 1.2679562347841924
Energy: 1.284018536834013
Energy: 1.237910742296535
Energy: 1.2605036366527569
Energy: 1.266524528838762
Energy: 1.2569587266822282
Energy: 1.2579559501009134
Energy: 1.2598147548129466
Energy: 1.2623661066076077
Energy: 1.253038312729475
Energy: 1.3618721335623518
Energy: 1.2151021375029167
Energy: 1.258977815837931
Energy: 1.2675145676479609
Energy: 1.213247320692977
Energy: 1.2650288246100558
Energy: 1.3538630526184003
Energy: 1.2768581704435276
Energy: 1.252190841796381
Energy: 1.2683568702042305
Energy: 1.252645988330914
Energy: 1.252333219525203
Energy: 1.2664835137655566
Energy: 1.2609471705863418
Energy: 1.2636839722359587
Energy: 1.267630080505045
Energy: 1.2634825977073427
Energy: 1.2614730278998623
Energy: 1.2651864167708415
Energy: 1.2499093030345667
Energy: 1.2451645383368894
Energy: 1.2499844638581914
Energy: 1.2479092535491003
Energy: 1.2519274434987733
Energy: 1.2496720578478997
Energy: 1.2701851049299726
Energy: 1.2540545484158085
Energy: 1.2485877251466002
Energy: 1.2711893634056728
Energy: 1.2552744235380997
Energy: 1.263714852508799
Energy: 1.235774255595527
Energy: 1.2468665520836786
Energy: 1.2663353827904384
Energy: 1.2406420559555034
Energy: 1.2516506222018415
Energy: 1.2344255217503117
Energy: 1.2050940997315363
Energy: 1.2152319249429384
Energy: 1.2345913874215266
Energy: 1.2556324065858404
Energy: 1.2128351819174985
Energy: 1.2265087454820272
Energy: 1.2052203730119129
Energy: 1.2118691934738501
Energy: 1.2271744260153747
Energy: 1.2555444138902079
Energy: 1.2132609035646231
Energy: 1.2740390859494286
Energy: 1.2360781500792335
Energy: 1.2135012342624891
Energy: 1.2551044934958027
Energy: 1.2416482719139124
Energy: 1.2094869512872002
Energy: 1.2361387494046086
Energy: 1.2275986971258581
Energy: 1.2276143224402178
Energy: 1.2363953243272292
Energy: 1.3107760766312186
Energy: 1.2248120726470164
Energy: 1.2710365463835145
Energy: 1.2086752060590085
Energy: 1.2081563934852784
Energy: 1.2550647889715711
Energy: 1.2086191652659983
Energy: 1.243584847806468
Energy: 1.2262685821425119
Energy: 1.2304940719043957
Energy: 1.2463386067704234
Energy: 1.2168942289940867
Energy: 1.241497025434986
Energy: 1.2493151554180377
Energy: 1.3645153337057716
Energy: 1.2858015312775148
Energy: 1.2774032910177051
Energy: 1.2359301541336873
Energy: 1.287857292583258
Energy: 1.2200288781782147

minimum gb energy = 1.2050940997315363 eV
minimum distance =  2.28115599907259 Angstroms
sigma value = 19


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

Energy: 1.2802659514454062
Energy: 1.2107324055316728
Energy: 1.2105707521006461
Energy: 1.2378812810394795
Energy: 1.2095871836538408
Energy: 1.2097652740998708
Energy: 1.2461347644086858
Energy: 1.2124729243422414
Energy: 1.2131504516523042
Energy: 1.2655075705280776
Energy: 1.2122824283299218
Energy: 1.203742894668436
Energy: 1.245801541780724
Energy: 1.2176932456437202
Energy: 1.2154675568669473
Energy: 1.24051172773298
Energy: 1.2242805618858021
Energy: 1.2043296149221119
Energy: 1.2429498074591183
Energy: 1.2154525145043333
Energy: 1.218605939929927
Energy: 1.216512334200752
Energy: 1.2042030376800756
Energy: 1.2041386481226488
Energy: 1.2353953105847075
Energy: 1.2257317706478252
Energy: 1.2139774639648238
Energy: 1.2411216625389465
Energy: 1.2417421283554357
Energy: 1.2064111736374377
Energy: 1.2629430375666613
Energy: 1.2733899738937842
Energy: 1.221973369307281
Energy: 1.215486360313787
Energy: 1.2128148432964747
Energy: 1.2045341722223275
Energy: 1.232697860449815
Energy: 1.2268813624636608
Energy: 1.2214325746642947
Energy: 1.2381409654646673
Energy: 1.228706482100471
Energy: 1.2164335177115815
Energy: 1.2420889140074145
Energy: 1.2123283620878667
Energy: 1.2048081846076182
Energy: 1.211987810068971
Energy: 1.234551529281204
Energy: 1.2135065666221727
Energy: 1.215062234710759
Energy: 1.2079476095121948
Energy: 1.2173423091646915
Energy: 1.2236707704649812
Energy: 1.2196412657775966
Energy: 1.221365614910918
Energy: 1.2155582730344958
Energy: 1.2305287163053549
Energy: 1.232520152078647
Energy: 1.2164846379964154
Energy: 1.231621672183511
Energy: 1.2138391998170144
Energy: 1.242541930415132
Energy: 1.2006607190117178
Energy: 1.1774203022542973
Energy: 1.2414720506654333
Energy: 1.2067889201575326
Energy: 1.1775429990414277
Energy: 1.2307979087291898
Energy: 1.2381969740053929
Energy: 1.1836450162444625
Energy: 1.2213738885723089
Energy: 1.2480531620454103
Energy: 1.16935631872298
Energy: 1.2554193586527964
Energy: 1.2178659350525856
Energy: 1.2171719690812013
Energy: 1.216188722952755
Energy: 1.2200588383035442
Energy: 1.215695744845436
Energy: 1.3014126268554764
Energy: 1.236938036668028
Energy: 1.2344303360296367
Energy: 1.2020981961446604
Energy: 1.2330442293603923
Energy: 1.2298850773082108
Energy: 1.2304634913235277
Energy: 1.208017160480725
Energy: 1.1836757409660503
Energy: 1.1978707154590145
Energy: 1.188526587309501
Energy: 1.182580778983053
Energy: 1.23063993731559
Energy: 1.2089026649413277
Energy: 1.1702784512892306
Energy: 1.199544174749878
Energy: 1.2004083589422954
Energy: 1.1699864466152192
Energy: 1.2294833925911726
Energy: 1.2303395100874217
Energy: 1.2252393668002908
Energy: 1.191148120505481
Energy: 1.2332790857117184
Energy: 1.2250466424434667
Energy: 1.2636603308380434
Energy: 1.1998348558317113
Energy: 1.1758031803394662
Energy: 1.1940355052673606
Energy: 1.1905660270187488
Energy: 1.170840251475713
Energy: 1.2504804429256362
Energy: 1.2081458706225225
Energy: 1.1944821729587816
Energy: 1.2147863049982348
Energy: 1.2089482423259506
Energy: 1.1892952688180187
Energy: 1.2205601034458535
Energy: 1.2091876084524227
Energy: 1.1943646636178256
Energy: 1.2017751800663958
Energy: 1.2092026077149294
Energy: 1.189154249430176
Energy: 1.1956347001375083
Energy: 1.2132100600483975
Energy: 1.1751264038680886
Energy: 1.1930731973527033
Energy: 1.215463891866551
Energy: 1.1701571918557674
Energy: 1.1897685459432534
Energy: 1.1711708392432418
Energy: 1.1692618874674496
Energy: 1.18745008551904
Energy: 1.1768282433681538
Energy: 1.183467821064691
Energy: 1.2327665748563224
Energy: 1.2329720120971197
Energy: 1.2227671252018664
Energy: 1.2337682490992223
Energy: 1.2316280408818818
Energy: 1.2080694927807223
Energy: 1.267256804528176
Energy: 1.2025490095558535
Energy: 1.213771079319475
Energy: 1.2520084762829244
Energy: 1.1849277840673085
Energy: 1.212526525438382
Energy: 1.260672869416324
Energy: 1.1781584612072595
Energy: 1.1689784293179055
Energy: 1.1983790163259853
Energy: 1.1996963402319583
Energy: 1.1834833862507057
Energy: 1.2336116923185723
Energy: 1.2039840992218023
Energy: 1.2047258248178914
Energy: 1.2188559572126392
Energy: 1.2121593763332925
Energy: 1.204654412688096
Energy: 1.2470158633971329
Energy: 1.2052814746137097
Energy: 1.2210718637551354
Energy: 1.2304579347319937
Energy: 1.2267087705369417
Energy: 1.2304571971640275
Energy: 1.2456806296935174
Energy: 1.2262016516826784
Energy: 1.2229989405986867
Energy: 1.2199759991797459
Energy: 1.2217720800774243
Energy: 1.2150900633766144
Energy: 1.2766382124694242
Energy: 1.2620532959084916
Energy: 1.2629058676072837
Energy: 1.1788780924642694
Energy: 1.2617871620271874
Energy: 1.2242823922337374

minimum gb energy = 1.1689784293179055 eV
minimum distance =  2.27314228423026 Angstroms
sigma value = 101


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

Energy: 1.7655379381807332
Energy: 1.1958232430967846
Energy: 1.2047258531740992
Energy: 1.182760157135235
Energy: 1.1794679048236807
Energy: 1.1466470059300329
Energy: 1.2269645718773843
Energy: 1.1725712986654322
Energy: 1.193292182759798
Energy: 1.165173133398969
Energy: 1.17374273005423
Energy: 1.1920024138998646
Energy: 1.2286187064904144
Energy: 1.1640396092081047
Energy: 1.1739890323664413
Energy: 1.1759667193653485
Energy: 1.1608630164692846
Energy: 1.1747367794237453
Energy: 1.2147762708043166
Energy: 1.1885217200163385
Energy: 1.194747586969089
Energy: 1.1727778009341963
Energy: 1.187612604692141
Energy: 1.196647515348394
Energy: 1.1747953075061532
Energy: 1.174627216593357
Energy: 1.1776511316960694
Energy: 1.1789294540136839
Energy: 1.2141760456122404
Energy: 1.1954537989713074
Energy: 1.1808043214426436
Energy: 1.1922713468047135
Energy: 1.1912512646494395
Energy: 1.1824294247255396
Energy: 1.1936018897051892
Energy: 1.1919916446260177
Energy: 1.224707326881375
Energy: 1.1603027880018981
Energy: 1.171892256941587
Energy: 1.214552419856228
Energy: 1.1560170002082724
Energy: 1.1688306085127989
Energy: 1.20252262941834
Energy: 1.164449278281201
Energy: 1.1662792690399644
Energy: 1.197147392232768
Energy: 1.2015333663939167
Energy: 1.1898182258308019
Energy: 1.154257326975715
Energy: 1.1712654211366778
Energy: 1.1874261076484827
Energy: 1.1558171851265857
Energy: 1.178025519141441
Energy: 1.1767331932323988
Energy: 1.1522844954351643
Energy: 1.2086062331655905
Energy: 1.2056448544673575
Energy: 1.1610867693800246
Energy: 1.2129196131415814
Energy: 1.180591753108824
Energy: 1.2185699861647814
Energy: 1.118904224034381
Energy: 1.1328196010040619
Energy: 1.210864221371699
Energy: 1.1274714381500042
Energy: 1.1602428778759213
Energy: 1.230086680209312
Energy: 1.1693284679648213
Energy: 1.182503137610153
Energy: 1.1782174907893777
Energy: 1.1610776138545718
Energy: 1.1856200550871743
Energy: 1.1822651001725968
Energy: 1.1708551836053975
Energy: 1.172528277821261
Energy: 1.149743789998876
Energy: 1.1703265039820654
Energy: 1.1714309571318504
Energy: 1.1803205049921517
Energy: 1.1766963555890344
Energy: 1.1947686789658036
Energy: 1.156572493688162
Energy: 1.145379371741418
Energy: 1.1912673733391426
Energy: 1.2258366623374266
Energy: 1.1657684666698966
Energy: 1.1777877613752041
Energy: 1.1780305236086317
Energy: 1.1618377904745039
Energy: 1.1859509625409774
Energy: 1.226636225177172
Energy: 1.1675875775660867
Energy: 1.193261565177352
Energy: 1.1755014434338233
Energy: 1.1673666465653694
Energy: 1.1965826128847186
Energy: 1.1803926737627093
Energy: 1.279155530130453
Energy: 1.198215562637115
Energy: 1.1193360062418736
Energy: 1.2051344371237178
Energy: 1.1748710302705396
Energy: 1.2923450129497296
Energy: 1.1727445149333533
Energy: 1.1728432292216504
Energy: 1.1975886954445742
Energy: 1.172434490487573
Energy: 1.1949275331591656
Energy: 1.2261922842266646
Energy: 1.1624214090297114
Energy: 1.165462231844362
Energy: 1.1705403705093829
Energy: 1.1607565723735578
Energy: 1.188393323033327
Energy: 1.212777022509491
Energy: 1.1627927598195782
Energy: 1.1662431616783224
Energy: 1.172244704294315
Energy: 1.1614770764199074
Energy: 1.1898139153660248
Energy: 1.178560869619936
Energy: 1.1725256227718592
Energy: 1.1737722905406933
Energy: 1.178330745162845
Energy: 1.1736977182989448
Energy: 1.1898805789782065
Energy: 1.2082849757269236
Energy: 1.1770829017687712
Energy: 1.1694440787743776
Energy: 1.2096115619878713
Energy: 1.17113896802241
Energy: 1.1680376584488124
Energy: 1.1966149021329235
Energy: 1.1617940638473274
Energy: 1.157797795384481
Energy: 1.198095422962668
Energy: 1.1590610656101792
Energy: 1.1691706360353793
Energy: 1.2103259640133712
Energy: 1.1769250533443
Energy: 1.1707029287116266
Energy: 1.1969511844727194
Energy: 1.175327864262317
Energy: 1.1978849263394913
Energy: 1.163161187870303
Energy: 1.1729917932279714
Energy: 1.1904653210338032
Energy: 1.1662131770610835
Energy: 1.1702869082963998
Energy: 1.167345332839062
Energy: 1.1547926553343868
Energy: 1.1969723539841652
Energy: 1.1942703656130529
Energy: 1.1600076211348704
Energy: 1.1848220310690598
Energy: 1.1797108253101045
Energy: 1.2144848397153563
Energy: 1.1196196386858008
Energy: 1.1202924607846878
Energy: 1.1725568426264592
Energy: 1.1243470291639779
Energy: 1.1757483700839642
Energy: 1.2288343480252404
Energy: 1.121218623364905
Energy: 1.1219943537519448
Energy: 1.1781100612014521
Energy: 1.1203699214215783
Energy: 1.191694065967863
Energy: 1.1801207017453086
Energy: 1.1427415126083624
Energy: 1.1761939461781705
Energy: 1.1475754414671246
Energy: 1.1875541572974828
Energy: 1.1862310505547613
Energy: 1.1833491742817437
Energy: 1.1799164042892167
Energy: 1.1715886039597043
Energy: 1.1561581743985918
Energy: 1.1726921147119664
Energy: 1.19822175249949
Energy: 1.2280666488026042
Energy: 1.1615460429785853
Energy: 1.1865175896876672
Energy: 1.1785939448739675
Energy: 1.1604924077348222
Energy: 1.1901635011116554
Energy: 1.22610910601235
Energy: 1.1619940753812728
Energy: 1.165945831084392
Energy: 1.1702519687602144
Energy: 1.1660887050870636
Energy: 1.1712312274324417
Energy: 1.1822875055670012
Energy: 1.1616252822740845
Energy: 1.1223800924345348
Energy: 1.1204533891947206
Energy: 1.1545624147415199
Energy: 1.1220999895553767

minimum gb energy = 1.118904224034381 eV
minimum distance =  2.27761602884674 Angstroms
sigma value = 33


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

Energy: 0.020313502294484743
Energy: 1.094405965301604
Energy: 0.021188958428915165
Energy: 0.02290611959861624
Energy: 1.0964755262551569
Energy: 0.021095874934723806
Energy: 0.6202841775190217
Energy: 0.16802971825633947
Energy: 0.16545084096602405
Energy: 0.16668503283491334
Energy: 0.1668618064917397
Energy: 0.16502436152206354
Energy: 1.5569825031614755
Energy: 1.096981600973532
Energy: 1.0951218898812545
Energy: 1.0917776477140553
Energy: 1.0962122323632006
Energy: 1.09467331584705
Energy: 0.021113628615887618
Energy: 0.16802971825727503
Energy: 0.1654508409669596
Energy: 0.16668503283449754
Energy: 0.1668618064926752
Energy: 0.16502436152112798

minimum gb energy = 0.020313502294484743 eV
minimum distance =  2.45747536552481 Angstroms
sigma value = 1