Model name: model_name=EAM_Dynamo_SturgeonLaird_2000_Al__MO_120808805541_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050010219216347
cohesive_energy=3.3902685453001857
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.010440620216526733
Energy: 0.010997592131849792
Energy: 0.010659534622691594
Energy: 0.010997592131849792
Energy: 0.010997592131849792
Energy: 0.4744453055128581
Energy: 0.010997592131849792
Energy: 0.4744453055128581
Energy: 0.010659534623163545
Energy: 0.010997592131849792
Energy: 0.010440620216526733
Energy: 0.010997592131849792
Energy: 0.010997592131849792
Energy: 0.4744453055128581
Energy: 0.010997592131849792
Energy: 0.4744453055128581

minimum gb energy = 0.010440620216526733 eV
minimum distance =  2.77518441635934 Angstroms
sigma value = 1


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

Energy: 0.571518743014688
Energy: 0.5721550548024521
Energy: 0.517061965103209
Energy: 0.5721550548030581
Energy: 0.545925198813289
Energy: 0.5676132811592038
Energy: 0.5465736203783845
Energy: 0.5676132811592038
Energy: 0.5216432293521546
Energy: 0.5654700585328668
Energy: 0.5391095181919471
Energy: 0.5654700585328668
Energy: 0.5343819271170248
Energy: 0.5783274595202024
Energy: 0.528721149588294
Energy: 0.5783274595208083
Energy: 0.5365958004440755
Energy: 0.5735187275493167
Energy: 0.5418134399812992
Energy: 0.5735187275487106
Energy: 0.5192998045116684
Energy: 0.5721032910838998
Energy: 0.5110179938795429
Energy: 0.5721032910838998
Energy: 0.5482807123385459
Energy: 0.5653061229343103
Energy: 0.5200411336358939
Energy: 0.5653061229349164
Energy: 0.49162301299805233
Energy: 0.5730418634870362
Energy: 0.5095645496759493
Energy: 0.5730418634882483
Energy: 0.5296371723958054
Energy: 0.5408942604223134
Energy: 0.5499673569478953
Energy: 0.5408942604235253
Energy: 0.5080439161540234
Energy: 0.565245071790258
Energy: 0.48835158451475014
Energy: 0.565245071790258
Energy: 0.5435184260904286
Energy: 0.5678327832707799
Energy: 0.5298400006223724
Energy: 0.567832783271386
Energy: 0.5288844314881255
Energy: 0.5731363161468774
Energy: 0.5142179707535973
Energy: 0.5731363161468774
Energy: 0.539390640332873
Energy: 0.5651513255287952
Energy: 0.5477659807365297
Energy: 0.5651513255294013
Energy: 0.5428160133084717
Energy: 0.5696719723387674
Energy: 0.52400250051055
Energy: 0.5696719723387674
Energy: 0.5457296934385851
Energy: 0.5734393966292657
Energy: 0.5389759103218669
Energy: 0.5734393966286597
Energy: 0.5431094612551847
Energy: 0.5721271146789354
Energy: 0.5389992824219906
Energy: 0.5721271146795414
Energy: 0.5390825711177774
Energy: 0.5655405550476914
Energy: 0.5093128944126825
Energy: 0.5655405550476914
Energy: 0.5464560265004451
Energy: 0.5660683981760042
Energy: 0.5464117590505161
Energy: 0.5660683981766101
Energy: 0.5037528192039218
Energy: 0.5727663686290214
Energy: 0.5138055223069382
Energy: 0.5727663686284153
Energy: 0.5461549501882849
Energy: 0.5407995620868202
Energy: 0.5317551794576005
Energy: 0.5407995620874263
Energy: 0.509140639254054
Energy: 0.5652239578327224
Energy: 0.49788861772988935
Energy: 0.5652239578339345
Energy: 0.5288421587479434
Energy: 0.5723799420668743
Energy: 0.5393933983137988
Energy: 0.5723799420668743
Energy: 0.5338155093963992
Energy: 0.5738465219158064
Energy: 0.5134668152888476
Energy: 0.5738465219164125
Energy: 0.5275389563363835
Energy: 0.5664321062392899
Energy: 0.5194533731868671
Energy: 0.5664321062392899
Energy: 0.5200522551101788
Energy: 0.5711061774351573
Energy: 0.5477830433331917
Energy: 0.5711061774351573
Energy: 0.5379203761297231
Energy: 0.5731957233359561
Energy: 0.513987731674673
Energy: 0.5731957233365622
Energy: 0.5445759623295473
Energy: 0.5762379400276173
Energy: 0.5294904001950951
Energy: 0.5762379400264052
Energy: 0.5120831839632001
Energy: 0.5649242303727388
Energy: 0.5611979428332977
Energy: 0.5649242303733447
Energy: 0.5453323700658206
Energy: 0.5839714254357798
Energy: 0.5387599433787708
Energy: 0.5839714254363858
Energy: 0.5696458500830883
Energy: 0.5724702123981633
Energy: 0.5306204008521797
Energy: 0.5724702123981633
Energy: 0.5444876192899856
Energy: 0.5700067077082991
Energy: 0.5393100442874332
Energy: 0.570006707708905
Energy: 0.5286565065824063
Energy: 0.5660865910685166
Energy: 0.5433728553321732
Energy: 0.5660865910685166
Energy: 0.5365885282060776
Energy: 0.577917793448435
Energy: 0.5290786896889773
Energy: 0.5779177934478291

minimum gb energy = 0.48835158451475014 eV
minimum distance =  2.56543225230563 Angstroms
sigma value = 1


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

Energy: 0.6085501235412907
Energy: 0.6093172840270262
Energy: 0.5429920390651342
Energy: 0.6093172840270262
Energy: 0.5600221476933378
Energy: 0.5959658851518029
Energy: 0.5694123043090015
Energy: 0.5959658851538444
Energy: 0.5416440085541608
Energy: 0.6095838788626519
Energy: 0.5583580488099684
Energy: 0.6095838788674575
Energy: 0.544017540201089
Energy: 0.5797898878873479
Energy: 0.5381441491134469
Energy: 0.5797898878887298
Energy: 0.5438540356945166
Energy: 0.5984136404605366
Energy: 0.5689874158738353
Energy: 0.5984136404619186
Energy: 0.5660622095096178
Energy: 0.5984274216740756
Energy: 0.5437009591077309
Energy: 0.5984274216740756
Energy: 0.5596106167553082
Energy: 0.5556395644021819
Energy: 0.5543504149264145
Energy: 0.5556395643980359
Energy: 0.5092087020847036
Energy: 0.609147462733557
Energy: 0.5241759221572801
Energy: 0.6091474627314841
Energy: 0.5426790004949199
Energy: 0.5713312960462879
Energy: 0.562029299898729
Energy: 0.5713312960483609
Energy: 0.5365098883148729
Energy: 0.6091980454807095
Energy: 0.5428963485879343
Energy: 0.6091980454793274
Energy: 0.5596695375439558
Energy: 0.5861290930768175
Energy: 0.5587786472818739
Energy: 0.5861290930768175
Energy: 0.5270561307944092
Energy: 0.6035042727135781
Energy: 0.5634598686480542
Energy: 0.603504272715651
Energy: 0.5721660191731655
Energy: 0.5977895227109865
Energy: 0.5512323987460674
Energy: 0.5977895227137506
Energy: 0.5720880867912717
Energy: 0.5979306371334046
Energy: 0.567770213387551
Energy: 0.5979306371361687
Energy: 0.5270269790959865
Energy: 0.6035192741233404
Energy: 0.5581944619115009
Energy: 0.6035192741247225
Energy: 0.5597116199771927
Energy: 0.5860691222251309
Energy: 0.5544493253884509
Energy: 0.5860691222237487
Energy: 0.5365045635936498
Energy: 0.6092886450550936
Energy: 0.5284618444689159
Energy: 0.6092886450557845
Energy: 0.5427376971473018
Energy: 0.5713167777758853
Energy: 0.5619459122963895
Energy: 0.5713167777758853
Energy: 0.5091892703563102
Energy: 0.6092528088954002
Energy: 0.5320164000957845
Energy: 0.6092528088954002
Energy: 0.5595405145819747
Energy: 0.5560860782604534
Energy: 0.5424322397465284
Energy: 0.5560860782618355
Energy: 0.566011421701708
Energy: 0.5984631804362832
Energy: 0.5539360908309189
Energy: 0.5984631804369741
Energy: 0.54385220749923
Energy: 0.5983794334657768
Energy: 0.5563439814765423
Energy: 0.5983794334643947
Energy: 0.5440253866733604
Energy: 0.5797197062105858
Energy: 0.5543106622354826
Energy: 0.5797197062078219
Energy: 0.5416888951669763
Energy: 0.6097055623398917
Energy: 0.5583706156567335
Energy: 0.6097055623412737
Energy: 0.5600631772441375
Energy: 0.5958370724998413
Energy: 0.5695240045246573
Energy: 0.5958370724977684
Energy: 0.6085501235412907
Energy: 0.6093172840270262
Energy: 0.5779026400038022
Energy: 0.6093172840270262
Energy: 0.5600221476933378
Energy: 0.5959658851524938
Energy: 0.5694123043090015
Energy: 0.5959658851545353
Energy: 0.5416440085541608
Energy: 0.6095838788619609
Energy: 0.5622254566107839
Energy: 0.6095838788674575
Energy: 0.544017540201089
Energy: 0.5797898878873479
Energy: 0.5397878999612499
Energy: 0.5797898878880389

minimum gb energy = 0.5091892703563102 eV
minimum distance =  2.55924171219067 Angstroms
sigma value = 25


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

Energy: 0.5847038084614176
Energy: 0.6361584387031638
Energy: 0.5716336364115592
Energy: 0.6361584387031638
Energy: 0.5963197375485857
Energy: 0.6160059908776967
Energy: 0.5717080568673297
Energy: 0.6160059908776967
Energy: 0.5709190817995559
Energy: 0.6538053860878814
Energy: 0.5729642536810675
Energy: 0.6538053860878814
Energy: 0.5724934694454703
Energy: 0.6219103237455168
Energy: 0.5612814578504011
Energy: 0.6219103237455168
Energy: 0.5621498720588758
Energy: 0.6368851033647243
Energy: 0.5765628363299177
Energy: 0.6368851033647243
Energy: 0.5994179091101234
Energy: 0.6534195694547681
Energy: 0.5638428658846889
Energy: 0.6534195694547681
Energy: 0.5729571585385563
Energy: 0.5743441069829882
Energy: 0.5767686122274229
Energy: 0.5743441069829882
Energy: 0.6152472033858527
Energy: 0.6373827040085985
Energy: 0.5414217806968138
Energy: 0.6373827040094018
Energy: 0.5751002199034702
Energy: 0.6122314571056273
Energy: 0.5728402522713355
Energy: 0.6122314571056273
Energy: 0.5718116868072285
Energy: 0.6529761735587271
Energy: 0.5548008068574067
Energy: 0.6529761735579237
Energy: 0.5732709030357496
Energy: 0.6365767392700571
Energy: 0.5718677228747715
Energy: 0.6365767392700571
Energy: 0.5620170495755936
Energy: 0.63630310237838
Energy: 0.5721446861622178
Energy: 0.6363031023791832
Energy: 0.5730655215150644
Energy: 0.6184687464496939
Energy: 0.556207578763828
Energy: 0.6184687464496939
Energy: 0.5754690668318915
Energy: 0.5714833461190721
Energy: 0.5960287711302081
Energy: 0.5714833461190721
Energy: 0.533212343793072
Energy: 0.6363261051337394
Energy: 0.5399645249020112
Energy: 0.6363261051337394
Energy: 0.5717334350465008
Energy: 0.5759079788535908
Energy: 0.5609217790753351
Energy: 0.5759079788527875
Energy: 0.5321365999879231
Energy: 0.6535350127696836
Energy: 0.5317326494326466
Energy: 0.6535350127696836
Energy: 0.5614562539680031
Energy: 0.6188805291834246
Energy: 0.5896496590939068
Energy: 0.6188805291834246
Energy: 0.5531216812852975
Energy: 0.618961855306478
Energy: 0.5621659295811107
Energy: 0.618961855306478
Energy: 0.5647971156168081
Energy: 0.6530794376266683
Energy: 0.5747910555764837
Energy: 0.6530794376274717
Energy: 0.5800926642899983
Energy: 0.6090231027062318
Energy: 0.5773131957899252
Energy: 0.6090231027062318
Energy: 0.585077776975058
Energy: 0.636565835042473
Energy: 0.5957301607506119
Energy: 0.636565835042473
Energy: 0.5972022784056431
Energy: 0.6164588860650188
Energy: 0.5718891975527821
Energy: 0.6164588860642154
Energy: 0.5561297410723366
Energy: 0.6543699333530285
Energy: 0.5716641423920109
Energy: 0.6543699333530285
Energy: 0.5718560822166716
Energy: 0.5815441961690756
Energy: 0.5605028515662813
Energy: 0.581544196169879

minimum gb energy = 0.5317326494326466 eV
minimum distance =  2.56009096383642 Angstroms
sigma value = 9


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

Energy: 0.6159655671796499
Energy: 0.6156023469561273
Energy: 0.6018309230952558
Energy: 0.6156023469551691
Energy: 0.6018286407319366
Energy: 0.6502138307845251
Energy: 0.6066155207612348
Energy: 0.6502138307845251
Energy: 0.5609715352753624
Energy: 0.6140589280509493
Energy: 0.5861875036789143
Energy: 0.6140589280509493
Energy: 0.6130047716028674
Energy: 0.6617863032641497
Energy: 0.5719494217398045
Energy: 0.661786303265108
Energy: 0.6396615738385982
Energy: 0.650044693213657
Energy: 0.6030749441139855
Energy: 0.6500446932146152
Energy: 0.5547112697955805
Energy: 0.6136585601582023
Energy: 0.5731264696891997
Energy: 0.6136585601629717
Energy: 0.6095483822445772
Energy: 0.572232059214394
Energy: 0.5725520674078782
Energy: 0.5722320592115192
Energy: 0.6020773305282812
Energy: 0.6136109614369226
Energy: 0.5679589884907048
Energy: 0.6136109614369226
Energy: 0.6105907940134361
Energy: 0.650310711686617
Energy: 0.6291905764148026
Energy: 0.650310711686617
Energy: 0.6140114841454447
Energy: 0.6154080380499202
Energy: 0.5724073107293561
Energy: 0.6154080380480038
Energy: 0.5823290941155473
Energy: 0.6491114797832617
Energy: 0.5859938712585417
Energy: 0.64911147978422
Energy: 0.6127168049980922
Energy: 0.6332267697027519
Energy: 0.5719213717735709
Energy: 0.6332267697027519
Energy: 0.5545923803971892
Energy: 0.615192174331676
Energy: 0.582295703797438
Energy: 0.6151921743307176
Energy: 0.6008488137770801
Energy: 0.6128361681115339
Energy: 0.6072765064517209
Energy: 0.6128361681105756
Energy: 0.5545938090889979
Energy: 0.6150562309200474
Energy: 0.6018670550391788
Energy: 0.6150562309210056
Energy: 0.6127706796034224
Energy: 0.633214413995867
Energy: 0.5721747019607671
Energy: 0.6332144139949087
Energy: 0.5823481947484044
Energy: 0.6490702429043581
Energy: 0.6102683094788308
Energy: 0.6490702429034
Energy: 0.6138038635412513
Energy: 0.6153921165016605
Energy: 0.5724862044604946
Energy: 0.6153921165026188
Energy: 0.610623128656716
Energy: 0.6501951471180086
Energy: 0.6091351847757049
Energy: 0.650195147116092
Energy: 0.6020526358542387
Energy: 0.6136562372889434
Energy: 0.5678661180034579
Energy: 0.6136562372899016
Energy: 0.6095127099846664
Energy: 0.5723432596224944
Energy: 0.5724629501157633
Energy: 0.5723432596224944

minimum gb energy = 0.5545923803971892 eV
minimum distance =  2.65717096665828 Angstroms
sigma value = 25


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

Energy: 0.5933223650680273
Energy: 0.7027809546199607
Energy: 0.6362581021673399
Energy: 0.7027809546199607
Energy: 0.5833729289070468
Energy: 0.6590505974436021
Energy: 0.5778921794778777
Energy: 0.6590505974436021
Energy: 0.5779581541797887
Energy: 0.6314074812804061
Energy: 0.5774767077139799
Energy: 0.6314074812804061
Energy: 0.5923903027183367
Energy: 0.5848123973214033
Energy: 0.6432098922434732
Energy: 0.5848123973214033
Energy: 0.6416132016242047
Energy: 0.5840141999909844
Energy: 0.6050347779754875
Energy: 0.5840141999909844
Energy: 0.5795251784202475
Energy: 0.7027835997363976
Energy: 0.5789577907312105
Energy: 0.7027835997363976
Energy: 0.5968659117741201
Energy: 0.6582636815760194
Energy: 0.5775584919923222
Energy: 0.6582636815760194
Energy: 0.6353713885026775
Energy: 0.5783346724270662
Energy: 0.5949440460109746
Energy: 0.5783346724270662
Energy: 0.577506059983723
Energy: 0.6564854293013936
Energy: 0.5848000794966692
Energy: 0.6564854293013936
Energy: 0.6597957121430693
Energy: 0.6694472893221318
Energy: 0.5796847391200666
Energy: 0.6694472893221318
Energy: 0.6134550038572235
Energy: 0.6983772089620243
Energy: 0.6977814414943849
Energy: 0.6983772089620243
Energy: 0.5778205643129092
Energy: 0.6001429629474686
Energy: 0.6597590588848127
Energy: 0.6001429629486537
Energy: 0.6365466843144792
Energy: 0.6190760891404072
Energy: 0.5773370381557908
Energy: 0.6190760891415924
Energy: 0.5775307835035708
Energy: 0.6640552474334614
Energy: 0.592486659429278
Energy: 0.6640552474334614
Energy: 0.5775995289291533
Energy: 0.5793748632102808
Energy: 0.6354235444326083
Energy: 0.5793748632079107
Energy: 0.5843302269561605
Energy: 0.6337847389079678
Energy: 0.5795670323459967
Energy: 0.6337847389067829
Energy: 0.578401974473298
Energy: 0.6270518322267258
Energy: 0.6588961504231944
Energy: 0.6270518322279108

minimum gb energy = 0.5773370381557908 eV
minimum distance =  2.63809202927796 Angstroms
sigma value = 17


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

Energy: 0.6449679336119755
Energy: 0.6445878417091493
Energy: 0.7184849724427417
Energy: 0.6445878417091493
Energy: 0.6694318824814083
Energy: 0.631832669662823
Energy: 0.5933104752269517
Energy: 0.6318326696621518
Energy: 0.6565569085679581
Energy: 0.6419390665830483
Energy: 0.592959873780309
Energy: 0.6419390665830483
Energy: 0.5943238766189963
Energy: 0.6630589945727923
Energy: 0.632213943330462
Energy: 0.6630589945727923
Energy: 0.67145773268014
Energy: 0.6400119980049668
Energy: 0.6055027959055459
Energy: 0.6400119980049668
Energy: 0.599497231183449
Energy: 0.6155948287286217
Energy: 0.6591862271064154
Energy: 0.6155948287286217
Energy: 0.5957645410925978
Energy: 0.6536516950910265
Energy: 0.5934243762211441
Energy: 0.6536516950910265
Energy: 0.6552665301213509
Energy: 0.6610345482708471
Energy: 0.6039144947191217
Energy: 0.6610345482701759
Energy: 0.6014613361504227
Energy: 0.6952348887823773
Energy: 0.6683512987124433
Energy: 0.695234888781706
Energy: 0.7061960588436405
Energy: 0.6318869832090505
Energy: 0.597413242079286
Energy: 0.6318869832097218
Energy: 0.5954582368352529
Energy: 0.6600999125315654
Energy: 0.6583557002240948
Energy: 0.6600999125322368
Energy: 0.602239299251239
Energy: 0.6516085225290708
Energy: 0.602708106067236
Energy: 0.6516085225290708
Energy: 0.6672522556001488
Energy: 0.6435506113572679
Energy: 0.6429780804124082
Energy: 0.6435506113572679
Energy: 0.5972729570909826
Energy: 0.7089746560036471
Energy: 0.6629960883158207
Energy: 0.7089746560036471
Energy: 0.6381341112869392
Energy: 0.654418386011272
Energy: 0.6015089796835148
Energy: 0.654418386011272
Energy: 0.6616322089225464
Energy: 0.6609166311306357
Energy: 0.6555018087381221
Energy: 0.6609166311313069
Energy: 0.5940457295181406
Energy: 0.6500478502810383
Energy: 0.7136362147919247
Energy: 0.6500478502817095
Energy: 0.6541265618036951
Energy: 0.6418849077341316
Energy: 0.5995209998082417
Energy: 0.6418849077341316
Energy: 0.6057187504277987
Energy: 0.6558088310880339
Energy: 0.6335812218527013
Energy: 0.6558088310873628
Energy: 0.5933188399925585
Energy: 0.6627498325145297
Energy: 0.5944205356994563
Energy: 0.6627498325145297
Energy: 0.6242728995383671
Energy: 0.6420781193204157
Energy: 0.6561866511650182
Energy: 0.6420781193197445
Energy: 0.5940828441540621
Energy: 0.6936664593433786
Energy: 0.7062183701530867
Energy: 0.6936664593427074
Energy: 0.6646464029951326
Energy: 0.6611145118587871
Energy: 0.5928762612214711
Energy: 0.6611145118601294
Energy: 0.5985837656770718
Energy: 0.6563204401407597
Energy: 0.6637624063123956
Energy: 0.656320440142102
Energy: 0.5981920633151492
Energy: 0.6573100442684084
Energy: 0.6638809742118252
Energy: 0.6573100442690796
Energy: 0.6650567991676104
Energy: 0.6611953706380799
Energy: 0.5935828366769405
Energy: 0.6611953706374086
Energy: 0.6142745114928126
Energy: 0.678893429967218
Energy: 0.7204464070821733
Energy: 0.6788934299739295
Energy: 0.6578531577137207
Energy: 0.6149774146012673
Energy: 0.6568941253532602
Energy: 0.614977414599925
Energy: 0.7073029376769452
Energy: 0.7040223054695649
Energy: 0.595468863222281
Energy: 0.704022305470236
Energy: 0.6014988024532588
Energy: 0.6719093733619871
Energy: 0.6560381636905688
Energy: 0.6719093733619871

minimum gb energy = 0.5928762612214711 eV
minimum distance =  2.53452186056247 Angstroms
sigma value = 53


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

Energy: 0.5645990034230229
Energy: 0.5640330005179608
Energy: 0.6509718847801409
Energy: 0.5640330005195059
Energy: 0.6643407799386917
Energy: 0.607356725473631
Energy: 0.5707559713822735
Energy: 0.607356725473631
Energy: 0.5654624198432742
Energy: 0.5638228159299051
Energy: 0.6509095958111433
Energy: 0.5638228159299051
Energy: 0.5653097846697857
Energy: 0.5645556302910298
Energy: 0.5709642998243963
Energy: 0.5645556302910298
Energy: 0.664230138503839
Energy: 0.6073353049416048
Energy: 0.5709118392517173
Energy: 0.6073353049431499
Energy: 0.5645990034214778
Energy: 0.5640330005195059
Energy: 0.6509718847801409
Energy: 0.5640330005195059
Energy: 0.6643407799402369
Energy: 0.607356725475176
Energy: 0.5707559713822735
Energy: 0.607356725475176
Energy: 0.5654624198432742
Energy: 0.5638228159299051
Energy: 0.6509095958095983
Energy: 0.5638228159299051
Energy: 0.5653097846713309
Energy: 0.5645556302910298
Energy: 0.5709642998243963
Energy: 0.5645556302910298
Energy: 0.664230138502294
Energy: 0.6073353049416048
Energy: 0.5709118392517173
Energy: 0.6073353049431499
Energy: 0.5645990034214778
Energy: 0.5640330005179608
Energy: 0.6509718847801409
Energy: 0.5640330005195059
Energy: 0.6643407799386917
Energy: 0.607356725473631
Energy: 0.5707559713822735
Energy: 0.607356725473631
Energy: 0.5654624198432742
Energy: 0.5638228159299051
Energy: 0.6509095958111433
Energy: 0.5638228159299051

minimum gb energy = 0.5638228159299051 eV
minimum distance =  2.60920986162898 Angstroms
sigma value = 9


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

Energy: 0.6188028740265327
Energy: 0.7456483268915641
Energy: 0.7810985418531784
Energy: 0.7456483268909923
Energy: 0.694412656884575
Energy: 0.6439147102183406
Energy: 0.6159505921231411
Energy: 0.6439147102177687
Energy: 0.6119344528124142
Energy: 0.6131970235490687
Energy: 0.6153848678274714
Energy: 0.6131970235485228
Energy: 0.6750855078185362
Energy: 0.7176044064647764
Energy: 0.6191644290207823
Energy: 0.7176044064653483
Energy: 0.6871705257222199
Energy: 0.644186745288917
Energy: 0.6172799806008884
Energy: 0.6441867452883452
Energy: 0.6128209101027202
Energy: 0.6129063719600222
Energy: 0.6808397498286242
Energy: 0.6129063719600222
Energy: 0.7726676700618065
Energy: 0.6421454149173242
Energy: 0.6181378857533942
Energy: 0.6421454149178962
Energy: 0.6152710776622919
Energy: 0.6554776239237995
Energy: 0.6827077152576333
Energy: 0.6554776239226557
Energy: 0.6129415965489993
Energy: 0.7435869432355326
Energy: 0.6151270225396617
Energy: 0.7435869432349608
Energy: 0.6128368067815091
Energy: 0.6421453419922907
Energy: 0.615537595815605
Energy: 0.6421453419917189
Energy: 0.6152623855966065
Energy: 0.6582946304767108
Energy: 0.7660507518008058
Energy: 0.6582946304767108
Energy: 0.6911782493782088
Energy: 0.6966076517327217
Energy: 0.6145447427957368
Energy: 0.6966076517332935
Energy: 0.6131383338325821
Energy: 0.6559562198208639
Energy: 0.7251837612895436
Energy: 0.6559562198248671
Energy: 0.6764321005930535
Energy: 0.6816049823435036
Energy: 0.6202674087484845
Energy: 0.6816049823435036
Energy: 0.616356602636709
Energy: 0.6853140373362964
Energy: 0.6796151372982473
Energy: 0.685314037338012
Energy: 0.6142273055842267
Energy: 0.7237316692352302
Energy: 0.6777189284864467
Energy: 0.723731669236374
Energy: 0.6485605432692975
Energy: 0.6861153691290143
Energy: 0.6160151753169695
Energy: 0.6861153691284424
Energy: 0.616135215140624
Energy: 0.642194283735824
Energy: 0.7097535948507773
Energy: 0.6421942837363959
Energy: 0.6865279907292404
Energy: 0.6570047781528859
Energy: 0.6133947615146002
Energy: 0.6570047781528859
Energy: 0.6148782319340753
Energy: 0.6487802504823058
Energy: 0.655667104600231
Energy: 0.6487802504823058
Energy: 0.6796923251810058
Energy: 0.7178615769616482
Energy: 0.67628708092861
Energy: 0.7178615769610762
Energy: 0.6559880829829136
Energy: 0.680677166551367
Energy: 0.6131206274279802
Energy: 0.6806771665502233
Energy: 0.6150882774293174
Energy: 0.6906250642545719
Energy: 0.6134178719598065
Energy: 0.6906250642545719
Energy: 0.7748989128565745
Energy: 0.6555938060066642
Energy: 0.6146016371614821
Energy: 0.655593806007236
Energy: 0.6181904136454595
Energy: 0.7043763727968508
Energy: 0.742699384574636
Energy: 0.7043763727968508
Energy: 0.6485124910939083
Energy: 0.6129486951264628
Energy: 0.6122103798998924
Energy: 0.6129486951276065
Energy: 0.6523677591890876
Energy: 0.6863982827381184
Energy: 0.6750224728577173
Energy: 0.6863982827381184
Energy: 0.6216070800957619
Energy: 0.7415854615918988
Energy: 0.6749497697255318
Energy: 0.741585461591327
Energy: 0.6493047010893513
Energy: 0.6129499315783397
Energy: 0.6120814005183729
Energy: 0.6129499315703334
Energy: 0.6192466048318959
Energy: 0.7059347509290482
Energy: 0.7450439620708649
Energy: 0.7059347509290482
Energy: 0.7341513520215703
Energy: 0.6565969270957505
Energy: 0.6142283927454073
Energy: 0.6565969270963223
Energy: 0.6156406937144974
Energy: 0.6423879326212328
Energy: 0.6127626929149902
Energy: 0.6423879326218046
Energy: 0.615972985522665
Energy: 0.6816833764370156
Energy: 0.6126000904822869
Energy: 0.6816833764375875
Energy: 0.6810424169645168
Energy: 0.7211262729545013
Energy: 0.6753358723160614
Energy: 0.7211262729545013
Energy: 0.6159943455607751
Energy: 0.7060818691172553
Energy: 0.7723724385497395
Energy: 0.7060818691178271

minimum gb energy = 0.6119344528124142 eV
minimum distance =  2.55778690827569 Angstroms
sigma value = 73


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

Energy: 0.6554957409684107
Energy: 0.6539760798474711
Energy: 0.767148594314449
Energy: 0.6539760798465638
Energy: 0.6569090578877235
Energy: 0.6629775735115363
Energy: 0.6141801194200651
Energy: 0.662977573510629
Energy: 0.6183224994845832
Energy: 0.6485153572753427
Energy: 0.6140243812361857
Energy: 0.6485153572771573
Energy: 0.6117532955077548
Energy: 0.6195519207471385
Energy: 0.6196895183023867
Energy: 0.6195519207471385
Energy: 0.6448227031466285
Energy: 0.662490679867236
Energy: 0.6140998049591131
Energy: 0.6624906798681435
Energy: 0.6221868405270982
Energy: 0.6143024119171697
Energy: 0.7164875252132427
Energy: 0.6143024119171697
Energy: 0.7658995768381635
Energy: 0.6984241705475488
Energy: 0.6188147194462695
Energy: 0.6984241705475488
Energy: 0.6132228929985643
Energy: 0.6117991402614045
Energy: 0.7273892161317811
Energy: 0.6117991402614045
Energy: 0.745037604692468
Energy: 0.6124995812269165
Energy: 0.6138800184233938
Energy: 0.6124995812251021
Energy: 0.6174551975899556
Energy: 0.65805152582512
Energy: 0.6162003245220153
Energy: 0.65805152582512
Energy: 0.6120774277184476
Energy: 0.6126724313157181
Energy: 0.7165393203465749
Energy: 0.6126724313157181
Energy: 0.6838729133787967
Energy: 0.6193027112918127
Energy: 0.6117818195513205
Energy: 0.6193027112918127
Energy: 0.6219837190139579
Energy: 0.6529155957883633
Energy: 0.7198773171731889
Energy: 0.652915595790178
Energy: 0.7347087932868077
Energy: 0.6904165961173097
Energy: 0.6240641081054192
Energy: 0.6904165961182169
Energy: 0.6120191745030045
Energy: 0.7051388522547639
Energy: 0.7142268218992347
Energy: 0.7051388522556712
Energy: 0.71564350877041
Energy: 0.6119614931482888
Energy: 0.6138875919482552
Energy: 0.6119614931473816
Energy: 0.6530714034034409
Energy: 0.652359452206532
Energy: 0.6184665931726829
Energy: 0.652359452206532
Energy: 0.6533462237246574
Energy: 0.6536852299941034
Energy: 0.6188683040688385
Energy: 0.6536852299941034
Energy: 0.6105526866863419
Energy: 0.6124125301490453
Energy: 0.613305392842044
Energy: 0.6124125301490453
Energy: 0.6139951886602781
Energy: 0.6662351841740989
Energy: 0.7454911265585732
Energy: 0.6662351841740989
Energy: 0.736101473045321
Energy: 0.6143012073493375
Energy: 0.623659907053694
Energy: 0.6143012073502448
Energy: 0.6195974173941461
Energy: 0.6611811361282376
Energy: 0.687322670704783
Energy: 0.6611811361273302

minimum gb energy = 0.6105526866863419 eV
minimum distance =  2.57218453951564 Angstroms
sigma value = 7


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

Energy: 0.6284877561124392
Energy: 0.6276927599244913
Energy: 0.7838663336797463
Energy: 0.6276927599238497
Energy: 0.682630026169698
Energy: 0.6371841518468789
Energy: 0.6162370853306582
Energy: 0.6371841518411049
Energy: 0.6151194562950343
Energy: 0.6281047698161546
Energy: 0.6278535073053213
Energy: 0.6281047698200041
Energy: 0.6338705097536018
Energy: 0.6645115219107668
Energy: 0.6165538119142431
Energy: 0.6645115219082005
Energy: 0.6151078256695264
Energy: 0.6536389851908374
Energy: 0.6259103276672016
Energy: 0.6536389851908374
Energy: 0.61463113874672
Energy: 0.6294654885308775
Energy: 0.7355939371100598
Energy: 0.6294654885283403
Energy: 0.6875447766425958
Energy: 0.683680282168047
Energy: 0.6257050611829216
Energy: 0.6836802821699717
Energy: 0.6144772776873766
Energy: 0.628895582122236
Energy: 0.7592830977371393
Energy: 0.6288955821248023
Energy: 0.6935688216391762
Energy: 0.6578651465703417
Energy: 0.6198971986980744
Energy: 0.6578651465639259
Energy: 0.6125130752113241
Energy: 0.66787423630637
Energy: 0.6801479535740496
Energy: 0.667874236303162
Energy: 0.6322507694185859
Energy: 0.629700816042242
Energy: 0.6315088548892853
Energy: 0.6297008160441668
Energy: 0.6334666977719644
Energy: 0.6538732352456474
Energy: 0.633444720731672
Energy: 0.6538732352475723
Energy: 0.6307799575224434
Energy: 0.6293933896458781
Energy: 0.6338537925215137
Energy: 0.6293933896458781
Energy: 0.6285023086895284
Energy: 0.6249345277731143
Energy: 0.6338994534607565
Energy: 0.6249345277776054
Energy: 0.6114784553016357
Energy: 0.7191656573410126
Energy: 0.6892703870313351
Energy: 0.719165657341654
Energy: 0.7836103328429196
Energy: 0.6245315182863411
Energy: 0.6205332529404465
Energy: 0.6245315182844164
Energy: 0.6112692466110925
Energy: 0.6534006102728297
Energy: 0.6552646599029186
Energy: 0.6534006102709051
Energy: 0.6227945412754954
Energy: 0.7156589135341588
Energy: 0.6330056836787321
Energy: 0.7156589135360835
Energy: 0.61137885313407
Energy: 0.6294959399835425
Energy: 0.6331712551805632
Energy: 0.629495939982901
Energy: 0.6123995414966181
Energy: 0.6549134576181495
Energy: 0.6328575011976981
Energy: 0.6549134576219989
Energy: 0.632340823523985
Energy: 0.6326998015159532
Energy: 0.6198721812193514
Energy: 0.6326998015191609
Energy: 0.6142484766736523
Energy: 0.6278428131927926
Energy: 0.6801395895016518
Energy: 0.627842813192151
Energy: 0.7432434442151896
Energy: 0.6578411234804747
Energy: 0.6257900851634733
Energy: 0.6578411234798331
Energy: 0.629122930947468
Energy: 0.6285344326807486
Energy: 0.7344811716149294
Energy: 0.628534432680107
Energy: 0.6325980000970001
Energy: 0.6551687137841085
Energy: 0.625010271282301
Energy: 0.6551687137809007
Energy: 0.6320559445635088
Energy: 0.6285367126122685
Energy: 0.6314385322845012
Energy: 0.6285367126129101
Energy: 0.615301862669856
Energy: 0.6655166758029613
Energy: 0.6228976700408753
Energy: 0.665516675809377
Energy: 0.6354566170096816
Energy: 0.6532819256583637
Energy: 0.6162032347508677
Energy: 0.6532819256590052
Energy: 0.6154301428860552
Energy: 0.6286546276154559
Energy: 0.6821549215238473
Energy: 0.6286546276128895
Energy: 0.6331090987451866
Energy: 0.6334154861085299
Energy: 0.6159389637573958
Energy: 0.6334154861059637
Energy: 0.6154151564891565
Energy: 0.6284329872924422
Energy: 0.7164771417925371
Energy: 0.6284329872924422

minimum gb energy = 0.6112692466110925 eV
minimum distance =  2.55187298518359 Angstroms
sigma value = 29


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

Energy: 0.600169741785031
Energy: 0.5911389089551364
Energy: 0.6457411885530387
Energy: 0.5911389089551364
Energy: 0.5795134690752386
Energy: 0.6023016475824436
Energy: 0.6018187521833751
Energy: 0.6023016475828659
Energy: 0.5834815200316009
Energy: 0.6291429630563348
Energy: 0.6469624439181332
Energy: 0.629142963056136
Energy: 0.6025824886434383
Energy: 0.5802915594848523
Energy: 0.6018074719422961
Energy: 0.5802915594844302
Energy: 0.6003802311206033
Energy: 0.6159110416615032
Energy: 0.6474551650878863
Energy: 0.6159110416619502
Energy: 0.5943996968283888
Energy: 0.6290766630547093
Energy: 0.5942687088145984
Energy: 0.6290766630549328
Energy: 0.5831045333380191
Energy: 0.615911169683548
Energy: 0.600363353275931
Energy: 0.6159111696833245
Energy: 0.60187032991237
Energy: 0.5803973682423749
Energy: 0.6026095060919527
Energy: 0.5803973682419529
Energy: 0.6469367940406913
Energy: 0.62921584546046
Energy: 0.5811051077248832
Energy: 0.6292158454609071

minimum gb energy = 0.5795134690752386 eV
minimum distance =  2.60630216086018 Angstroms
sigma value = 5


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

Energy: 0.5844336738826496
Energy: 0.5943247394984
Energy: 0.6620241065114907
Energy: 0.5943247394984
Energy: 0.584929505669821
Energy: 0.6052872750193352
Energy: 0.5659009659975396
Energy: 0.6052872750205474
Energy: 0.5698407389113387
Energy: 0.589547954906583
Energy: 0.6736254707068101
Energy: 0.589547954907189
Energy: 0.5651804582305798
Energy: 0.6166988464834657
Energy: 0.5752502870667042
Energy: 0.6166988464828597
Energy: 0.5758936043326832
Energy: 0.6205888219212338
Energy: 0.6667822631341528
Energy: 0.6205888219212338
Energy: 0.5922999636561138
Energy: 0.5963214960913142
Energy: 0.5650345211362858
Energy: 0.5963214960919202
Energy: 0.569645584458649
Energy: 0.6195739736056329
Energy: 0.5711919572279303
Energy: 0.6195739736050268
Energy: 0.5675561608689401
Energy: 0.5967248337187688
Energy: 0.5725126841667552
Energy: 0.5967248337181629
Energy: 0.5760434562064272
Energy: 0.6196415842074524
Energy: 0.5775682248517708
Energy: 0.6196415842080584
Energy: 0.5738165486986491
Energy: 0.619790296995482
Energy: 0.5720345729053066
Energy: 0.619790296995482
Energy: 0.5812735338489305
Energy: 0.5966888930297796
Energy: 0.5715717529730384
Energy: 0.5966888930303856
Energy: 0.5722814779783895
Energy: 0.6267898918485135
Energy: 0.5943804879933389
Energy: 0.6267898918491195
Energy: 0.5912524659095417
Energy: 0.5948962766855609
Energy: 0.5928646597689867
Energy: 0.594896276686167
Energy: 0.5756064363609377
Energy: 0.595167730428811
Energy: 0.5871632729987212
Energy: 0.595167730428811
Energy: 0.5881046125518115
Energy: 0.6174907590283865
Energy: 0.5713454407000418
Energy: 0.6174907590271745
Energy: 0.5727402054944143
Energy: 0.5894636655614178
Energy: 0.5835938830622763
Energy: 0.5894636655608116
Energy: 0.6670498702707471
Energy: 0.6283568676803806
Energy: 0.5719034312219783
Energy: 0.6283568676803806
Energy: 0.5768914786737149
Energy: 0.5950711669184755
Energy: 0.6325591711624005
Energy: 0.5950711669184755
Energy: 0.5721677382089851
Energy: 0.6205923056671636
Energy: 0.5657231144179042
Energy: 0.6205923056677696
Energy: 0.5701847864056734
Energy: 0.6204312207369239
Energy: 0.5868333355968626
Energy: 0.6204312207369239
Energy: 0.5731324392151635
Energy: 0.5957965589102739
Energy: 0.5722122980320545
Energy: 0.5957965589096678
Energy: 0.580336706572576
Energy: 0.6197767074564481
Energy: 0.5781076189716181
Energy: 0.6197767074564481
Energy: 0.5653314323808971
Energy: 0.5961618300119234
Energy: 0.5644869745895096
Energy: 0.5961618300131355
Energy: 0.5941437594189292
Energy: 0.5961927115666233
Energy: 0.5690823209912403
Energy: 0.5961927115660172
Energy: 0.6012477668514822
Energy: 0.5891441019644539
Energy: 0.5703280484909997
Energy: 0.5891441019632417
Energy: 0.5887507217118945
Energy: 0.5952248089931982
Energy: 0.5760732311759816
Energy: 0.595224808990774
Energy: 0.5679968525381601
Energy: 0.6121052163875532
Energy: 0.582035487046459
Energy: 0.6121052163875532
Energy: 0.5966965366676295
Energy: 0.60941312593896
Energy: 0.572804944837575
Energy: 0.60941312593896
Energy: 0.570342967124823
Energy: 0.6054197292426858
Energy: 0.6702724910435354
Energy: 0.6054197292414737
Energy: 0.6337549777925041
Energy: 0.5947288589318614
Energy: 0.5769853403307369
Energy: 0.5947288589312555
Energy: 0.5718212964843458
Energy: 0.5798678067739991
Energy: 0.6332787641663579
Energy: 0.579867806773393
Energy: 0.6678073581283064
Energy: 0.6089507596733407
Energy: 0.5699301277984657
Energy: 0.6089507596745528
Energy: 0.5740569539630045
Energy: 0.6090263330031993
Energy: 0.5655076067727492
Energy: 0.6090263330038054

minimum gb energy = 0.5644869745895096 eV
minimum distance =  2.56597228420667 Angstroms
sigma value = 1


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

Energy: 0.5691973825623132
Energy: 0.5686393091492318
Energy: 0.6430043111519482
Energy: 0.5686393091500697
Energy: 0.5808479712689201
Energy: 0.5778999387700233
Energy: 0.550589681563756
Energy: 0.5778999387691854
Energy: 0.5373110631606355
Energy: 0.5690250057304022
Energy: 0.7327770440277321
Energy: 0.569025005732078
Energy: 0.5520078573807446
Energy: 0.6034647652893427
Energy: 0.5464926635459394
Energy: 0.6034647652868287
Energy: 0.5367158811457463
Energy: 0.6217775752535597
Energy: 0.5515274565518297
Energy: 0.6217775752510458
Energy: 0.5355785515946744
Energy: 0.5709723381621192
Energy: 0.5467658902054753
Energy: 0.5709723381612812
Energy: 0.536777197182034
Energy: 0.6214799275389926
Energy: 0.5671549994337396
Energy: 0.6214799275373167
Energy: 0.5371746280286308
Energy: 0.5708121415643267
Energy: 0.5662052621264069
Energy: 0.5708121415643267
Energy: 0.5682748989819649
Energy: 0.5668248676922815
Energy: 0.5551085787533769
Energy: 0.5668248676922815
Energy: 0.5682369489550971
Energy: 0.5666564640318498
Energy: 0.5561507267078782
Energy: 0.5666564640301739
Energy: 0.5369725008114932
Energy: 0.5707749052339255
Energy: 0.5553192946525998
Energy: 0.5707749052347636
Energy: 0.5370331146178609
Energy: 0.6213224518833191
Energy: 0.5514145747546413
Energy: 0.6213224518833191
Energy: 0.5353071431894566
Energy: 0.5709174603366585
Energy: 0.5465661880806834
Energy: 0.5709174603349824
Energy: 0.5368416749662424
Energy: 0.6217359797960837
Energy: 0.5691009935950201
Energy: 0.6217359797977599
Energy: 0.5521716074111751
Energy: 0.6034373657385667
Energy: 0.5464134013701786
Energy: 0.6034373657368907
Energy: 0.5373052010274871
Energy: 0.5691652940471144
Energy: 0.6676440789164295
Energy: 0.5691652940487905
Energy: 0.5808714927628589
Energy: 0.5779499992190174
Energy: 0.5505977248514583
Energy: 0.5779499992198553
Energy: 0.5691973825623132
Energy: 0.5686393091492318
Energy: 0.657452774234335
Energy: 0.5686393091500697
Energy: 0.5808479712664062
Energy: 0.5778999387700233
Energy: 0.550589681563756
Energy: 0.5778999387691854
Energy: 0.5373110631606355
Energy: 0.5690250057295643
Energy: 0.7327770440277321
Energy: 0.5690250057312402
Energy: 0.5520078573790688
Energy: 0.6034647652893427
Energy: 0.5464926635467772
Energy: 0.6034647652868287
Energy: 0.5367158811457463
Energy: 0.6217775752527218
Energy: 0.5515274565568575
Energy: 0.6217775752510458
Energy: 0.5355785515946744
Energy: 0.5709723381621192
Energy: 0.5467658902054753
Energy: 0.5709723381612812
Energy: 0.536777197182034
Energy: 0.6214799275389926
Energy: 0.5671549994354155
Energy: 0.6214799275373167

minimum gb energy = 0.5353071431894566 eV
minimum distance =  2.58212384427457 Angstroms
sigma value = 17


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

Energy: 0.5649142896941173
Energy: 0.5643204852080339
Energy: 0.6649279156323987
Energy: 0.564320485207516
Energy: 0.6531454511648764
Energy: 0.5568159729412776
Energy: 0.5495139452324435
Energy: 0.5568159729428314
Energy: 0.5443588463843126
Energy: 0.5573545975011988
Energy: 0.6716255221646176
Energy: 0.5573545975022345
Energy: 0.5649227992263524
Energy: 0.5437129094247756
Energy: 0.5433422196320414
Energy: 0.5437129094268472
Energy: 0.5402012558906863
Energy: 0.5987151926299763
Energy: 0.5604834125455526
Energy: 0.5987151926299763
Energy: 0.5377043312365088
Energy: 0.6454803800076963
Energy: 0.5513244910535408
Energy: 0.6454803800082142
Energy: 0.5474466207098251
Energy: 0.5890487988439751
Energy: 0.5715609621585451
Energy: 0.5890487988439751
Energy: 0.5379355573068243
Energy: 0.5843661487443796
Energy: 0.542534808897355
Energy: 0.5843661487428259
Energy: 0.5666738441479144
Energy: 0.6543620522676773
Energy: 0.5587422672059326
Energy: 0.6543620522676773
Energy: 0.5648566888376597
Energy: 0.5831928539449315
Energy: 0.5459381244285667
Energy: 0.5831928539459673
Energy: 0.5441712011066157
Energy: 0.5716348743291297
Energy: 0.5435843182959427
Energy: 0.5716348743280939
Energy: 0.5464895171339877
Energy: 0.5852061801675497
Energy: 0.5470991073229857
Energy: 0.5852061801670316
Energy: 0.5365334467334127
Energy: 0.5774595097755163
Energy: 0.5472988749744253
Energy: 0.5774595097765521
Energy: 0.5446699569357899
Energy: 0.5978632084745217
Energy: 0.5763430476051089
Energy: 0.5978632084729679
Energy: 0.5483021856542414
Energy: 0.5451131047426617
Energy: 0.56926644863337
Energy: 0.5451131047421437
Energy: 0.544209919688002
Energy: 0.5582263713000392
Energy: 0.5611578078564564
Energy: 0.5582263712995212
Energy: 0.5546926913834657
Energy: 0.5450661772841157
Energy: 0.5474686818720603
Energy: 0.5450661772835977
Energy: 0.5410188561139858
Energy: 0.5644845055239609
Energy: 0.5484258858103335
Energy: 0.5644845055239609
Energy: 0.6396484841885686
Energy: 0.5878974969968317
Energy: 0.544170843797554
Energy: 0.5878974969983854
Energy: 0.5490285234231933
Energy: 0.5575316731768393
Energy: 0.5729054884817304
Energy: 0.5575316731758034
Energy: 0.5520487015693625
Energy: 0.5523731151556615
Energy: 0.5485234306755445
Energy: 0.5523731151556615
Energy: 0.5420467109703393
Energy: 0.5653677483104405
Energy: 0.6144796934566656
Energy: 0.5653677483088867
Energy: 0.5580688329950083
Energy: 0.5519150444520113
Energy: 0.5497941676019988
Energy: 0.5519150444514934
Energy: 0.5441737741155298
Energy: 0.5900429548771399
Energy: 0.6455733997759915
Energy: 0.590042954876104
Energy: 0.5548247734393311
Energy: 0.5650901793514501
Energy: 0.5418326528271747
Energy: 0.5650901793514501
Energy: 0.5477992665234799
Energy: 0.5991122091126513
Energy: 0.5541705638152663
Energy: 0.5991122091116156
Energy: 0.6290512192055774
Energy: 0.5782203927097089
Energy: 0.5449443332094335
Energy: 0.5782203927071193
Energy: 0.5720158242173643
Energy: 0.6444445421652689
Energy: 0.543886210754148
Energy: 0.644444542164751
Energy: 0.5741123015648246
Energy: 0.5977434925730399
Energy: 0.5408224086815724
Energy: 0.5977434925735579
Energy: 0.5480098016400761
Energy: 0.5771741190458812
Energy: 0.5716950890448521
Energy: 0.5771741190453633
Energy: 0.5430458498066184
Energy: 0.5977371418951799
Energy: 0.5485814683522606
Energy: 0.597737141894662
Energy: 0.5465986332652669
Energy: 0.5710823182017652
Energy: 0.5425812378413507
Energy: 0.5710823182022832
Energy: 0.5447869536597345
Energy: 0.5827744607648773
Energy: 0.6434164749172168
Energy: 0.5827744607648773
Energy: 0.5712071958409956
Energy: 0.6532441538106502
Energy: 0.5507882133919888
Energy: 0.6532441538122039
Energy: 0.541300504623397
Energy: 0.5652775134292117
Energy: 0.5616063427982975
Energy: 0.5652775134286938
Energy: 0.5802757043113118
Energy: 0.5897781140076074
Energy: 0.546632296297103
Energy: 0.5897781140065715
Energy: 0.5499827930614002
Energy: 0.5499214747967661
Energy: 0.5389640970293315
Energy: 0.5499214748071245
Energy: 0.5599924544638695
Energy: 0.5993948788734819
Energy: 0.5487411828105048
Energy: 0.5993948788760716

minimum gb energy = 0.5365334467334127 eV
minimum distance =  2.56933695467818 Angstroms
sigma value = 89


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

Energy: 0.4980155432846988
Energy: 0.4978971735259151
Energy: 0.8047454878764017
Energy: 0.4978971735259151
Energy: 0.5033214565813185
Energy: 0.5151300693621397
Energy: 0.5043251792463354
Energy: 0.5151300693621397
Energy: 0.5033360542882244
Energy: 0.5890012109486008
Energy: 0.804552530163697
Energy: 0.589001210949956
Energy: 0.4970133681608765
Energy: 0.5150996771034034
Energy: 0.504431887089885
Energy: 0.5150996771034034
Energy: 0.5045100951620082
Energy: 0.5475737510365937
Energy: 0.5032692605940802
Energy: 0.5475737510379487
Energy: 0.5029561654388048
Energy: 0.4985297920061881
Energy: 0.5007393263638296
Energy: 0.4985297920061881
Energy: 0.5035957629534197
Energy: 0.5888731004758333
Energy: 0.4978439749291853
Energy: 0.5888731004758333
Energy: 0.4998413464773043
Energy: 0.5885918179491646
Energy: 0.5045651373329694
Energy: 0.5885918179396785
Energy: 0.5043012958618446
Energy: 0.5476861885182194
Energy: 0.4947129934205485
Energy: 0.5476861885182194
Energy: 0.51672592514255
Energy: 0.621321713616804
Energy: 0.5045886674773408
Energy: 0.621321713616804
Energy: 0.49761234818565836
Energy: 0.5156108659367834
Energy: 0.5048301428294082
Energy: 0.5156108659367834
Energy: 0.4975885690032241
Energy: 0.5897073016461386
Energy: 0.5043436120152764
Energy: 0.5897073016461386
Energy: 0.5040431928848832
Energy: 0.4995034908060069
Energy: 0.4947164780464116
Energy: 0.4995034908060069
Energy: 0.4986045718115399
Energy: 0.5463089981731539
Energy: 0.4985110591133856
Energy: 0.5463089981731539
Energy: 0.49508537998908503
Energy: 0.499695927098124
Energy: 0.5041562405336569
Energy: 0.499695927098124

minimum gb energy = 0.4947129934205485 eV
minimum distance =  2.59413563659551 Angstroms
sigma value = 13


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

Energy: 0.49790796488528594
Energy: 0.47974632953060076
Energy: 0.5942350753843758
Energy: 0.47974632952889684
Energy: 0.5769668986049901
Energy: 0.5707679337805771
Energy: 0.4762030567409461
Energy: 0.5707679337805771
Energy: 0.4804855893004972
Energy: 0.47990677355803635
Energy: 0.6863635766998196
Energy: 0.4799067735432684
Energy: 0.48452122761889477
Energy: 0.5708238166881748
Energy: 0.4736582189429109
Energy: 0.5708238166898788
Energy: 0.48594735260384136
Energy: 0.5163597299517995
Energy: 0.4866065909360783
Energy: 0.5163597299517995
Energy: 0.4800694571516824
Energy: 0.49245552619175814
Energy: 0.48627103264004684
Energy: 0.49245552619346217
Energy: 0.4857686254891613
Energy: 0.5174223579387841
Energy: 0.49926704963444385
Energy: 0.5174223579404881
Energy: 0.4748593730699355
Energy: 0.5706965348515695
Energy: 0.48634916081895424
Energy: 0.5706965348492974
Energy: 0.4860347835218909
Energy: 0.5173697919732239
Energy: 0.5620361180610721
Energy: 0.5173697919709519
Energy: 0.5658763329648719
Energy: 0.6028342418328227
Energy: 0.47368937903488006
Energy: 0.6028342418288467
Energy: 0.4860055607746675
Energy: 0.5275515897778557
Energy: 0.47846640023062825
Energy: 0.5275515897835356
Energy: 0.496660245970675
Energy: 0.5270368668431306
Energy: 0.473061722269095
Energy: 0.5270368668425626
Energy: 0.5034632118494128
Energy: 0.488601683043845
Energy: 0.4754135667447778
Energy: 0.48860168304043705
Energy: 0.6497839798416633
Energy: 0.527173699830524
Energy: 0.4730058153010394
Energy: 0.5271736998293879
Energy: 0.4861300553325927
Energy: 0.48014653735924684
Energy: 0.4751012371416339
Energy: 0.4801465373529989
Energy: 0.48807136202822254
Energy: 0.5273018396647372
Energy: 0.47530512424565674
Energy: 0.5273018396687131
Energy: 0.482964995258356
Energy: 0.5132798069996007
Energy: 0.475528932016973
Energy: 0.5132798069973287
Energy: 0.4831792263558601
Energy: 0.5159174311433775
Energy: 0.49172438104026445
Energy: 0.5159174311388337
Energy: 0.48299371815958836
Energy: 0.48907417766532035
Energy: 0.49161356377852217
Energy: 0.48907417766475236
Energy: 0.4831799113105368
Energy: 0.48881806785310333
Energy: 0.491854098048119
Energy: 0.48881806785310333
Energy: 0.483001964716164
Energy: 0.515916156151906
Energy: 0.49161775838147603
Energy: 0.515916156147362
Energy: 0.4831736761945143
Energy: 0.5133980739136076
Energy: 0.47560951781349475
Energy: 0.5133980739084957
Energy: 0.4874789855276999
Energy: 0.5273865743635843
Energy: 0.4751738998735011
Energy: 0.5273865743641523
Energy: 0.48611297280661686
Energy: 0.48000909278969167
Energy: 0.4749022795158043
Energy: 0.48000909278685167
Energy: 0.6498604837065057
Energy: 0.5271812710812726
Energy: 0.4732130622346197
Energy: 0.5271812710795686
Energy: 0.5033655875793713
Energy: 0.48874880978948665
Energy: 0.4746919617666513
Energy: 0.48874880978948665
Energy: 0.4966801173281061
Energy: 0.5270816275295305
Energy: 0.47319977840945204
Energy: 0.5270816275329384
Energy: 0.48599066004110947
Energy: 0.5275822289974096
Energy: 0.48592817565519125
Energy: 0.5275822289996815
Energy: 0.5656319197800661
Energy: 0.6030294836440253
Energy: 0.4736873655907431
Energy: 0.6030294836491373
Energy: 0.4859635947504706
Energy: 0.5175045792299794
Energy: 0.5723167756894012
Energy: 0.5175045792333873
Energy: 0.47500426141448343
Energy: 0.5710067380412839
Energy: 0.48612674414635315
Energy: 0.5710067380407159
Energy: 0.4857026175082633
Energy: 0.517405643693568
Energy: 0.6510781155062504
Energy: 0.5174056436941359
Energy: 0.4802592248583307
Energy: 0.49248406022870844
Energy: 0.48651223022866785
Energy: 0.49248406023095465
Energy: 0.48584629350575875
Energy: 0.516253141842567
Energy: 0.4945280006957394
Energy: 0.516253141844839
Energy: 0.4852540275077174
Energy: 0.5707094330530655
Energy: 0.47360013644352067
Energy: 0.5707094330530655

minimum gb energy = 0.4730058153010394 eV
minimum distance =  2.54414445995974 Angstroms
sigma value = 37


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

Energy: 0.4566588101633606
Energy: 0.4562923301752334
Energy: 0.7235912152119977
Energy: 0.4562923301752334
Energy: 0.46059945569259153
Energy: 0.45615670733704144
Energy: 0.4343368472167667
Energy: 0.45615670733704144
Energy: 0.44217778639282845
Energy: 0.5168500079586953
Energy: 0.7242509424736046
Energy: 0.5168500079586953
Energy: 0.4312187127296961
Energy: 0.5843296980215492
Energy: 0.4343020522058361
Energy: 0.584329698020572
Energy: 0.433544148354239
Energy: 0.4560394952685495
Energy: 0.43074943374030017
Energy: 0.4560394952685495
Energy: 0.42725531365362845
Energy: 0.4560918943935617
Energy: 0.43183679529764324
Energy: 0.4560918943945389
Energy: 0.4480429502570249
Energy: 0.47838099911165116
Energy: 0.5713246011969132
Energy: 0.4783809991126284
Energy: 0.4315870343779243
Energy: 0.45672552927774634
Energy: 0.45820080641825645
Energy: 0.45672552927774634
Energy: 0.43353457279906643
Energy: 0.45652657130174207
Energy: 0.5725050356357486
Energy: 0.45652657130174207
Energy: 0.5975655060430798
Energy: 0.4709001861059663
Energy: 0.4319175480558535
Energy: 0.4709001861059663
Energy: 0.4480502446417189
Energy: 0.4781409221565885
Energy: 0.43495283897797304
Energy: 0.4781409221565885
Energy: 0.5941614445236179
Energy: 0.45620543761486543
Energy: 0.4343712178155097
Energy: 0.45620543761486543
Energy: 0.4335495388341758
Energy: 0.4561586847859277
Energy: 0.427358394186843
Energy: 0.4561586847859277
Energy: 0.5719085268984498
Energy: 0.53025721178456
Energy: 0.43450500432681805
Energy: 0.53025721178456
Energy: 0.4558629816429643
Energy: 0.47852385452161195
Energy: 0.4337913556106989
Energy: 0.47852385452161195
Energy: 0.4561180110548553
Energy: 0.5089740182954376
Energy: 0.43429654987229593
Energy: 0.5089740182954376
Energy: 0.43368766626290634
Energy: 0.5099818799124077
Energy: 0.4324992884037506
Energy: 0.5099818799124077
Energy: 0.43044179259633253
Energy: 0.529995603140288
Energy: 0.43431882618829953
Energy: 0.5299956031393108
Energy: 0.43468116777979143
Energy: 0.45703061376949716
Energy: 0.4322363161125857
Energy: 0.45703061376949716
Energy: 0.43053880023133717
Energy: 0.45679040428616285
Energy: 0.430096497519151
Energy: 0.4567904042871401

minimum gb energy = 0.42725531365362845 eV
minimum distance =  2.61260810215495 Angstroms
sigma value = 25


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

Energy: 0.42185786979179696
Energy: 0.39799646489289114
Energy: 0.6595689276459542
Energy: 0.397996464892128
Energy: 0.5081722142552532
Energy: 0.4082772758707955
Energy: 0.40003518428402823
Energy: 0.4082772758715586
Energy: 0.3964969775981097
Energy: 0.39640382660284507
Energy: 0.5251235381388182
Energy: 0.39640382660208195
Energy: 0.39801853893130856
Energy: 0.5051934565965351
Energy: 0.40028567467180404
Energy: 0.5051934565972981
Energy: 0.3993696857170174
Energy: 0.5056142965942234
Energy: 0.5342975696796408
Energy: 0.5056142965942234
Energy: 0.3833819953817156
Energy: 0.5053650485904312
Energy: 0.4002740728230014
Energy: 0.5053650485896681
Energy: 0.39976703808905556
Energy: 0.3965316121928766
Energy: 0.39844123227545303
Energy: 0.3965316121936397
Energy: 0.38152315570420775
Energy: 0.42164999017461535
Energy: 0.3972569815497885
Energy: 0.42164999017537835
Energy: 0.39954794778184116
Energy: 0.40820542910377333
Energy: 0.5170955190150327
Energy: 0.40820542910377333
Energy: 0.38376371124786796
Energy: 0.49685687112030846
Energy: 0.42260479797380135
Energy: 0.49685687111954535
Energy: 0.39979454125597885
Energy: 0.3964656771726936
Energy: 0.6074157570647133
Energy: 0.3964656771726936
Energy: 0.5139284801038997
Energy: 0.5561414383220203
Energy: 0.3972831892505679
Energy: 0.5561414383220203
Energy: 0.3995250298413835
Energy: 0.4081141089563523
Energy: 0.4959947828985979
Energy: 0.4081141089563523
Energy: 0.5160146539803765
Energy: 0.5354902893712165
Energy: 0.4002954872894054
Energy: 0.5354902893735057
Energy: 0.3998959364138221
Energy: 0.3966182971253015
Energy: 0.3898080246014983
Energy: 0.3966182971253015
Energy: 0.5130740973633373
Energy: 0.5562335018551661
Energy: 0.40171922358957934
Energy: 0.5562335018544029
Energy: 0.39962556411473976
Energy: 0.4215449979839188
Energy: 0.38166465648274484
Energy: 0.42154499798315576
Energy: 0.5059142919412608
Energy: 0.5050672801064557
Energy: 0.4003665494696963
Energy: 0.5050672801072188
Energy: 0.4245798879875252
Energy: 0.3969450565591466
Energy: 0.3891390342721457
Energy: 0.3969450565591466
Energy: 0.6023171637285447
Energy: 0.5557341164723975
Energy: 0.4017815674736783
Energy: 0.5557341164731606
Energy: 0.3995255453514078
Energy: 0.5553301425207301
Energy: 0.3875526128323116
Energy: 0.5553301425207301
Energy: 0.39639060259595515
Energy: 0.40827073308381173
Energy: 0.40036518560700307
Energy: 0.40827073308381173
Energy: 0.3998776181369893
Energy: 0.43915882262624584
Energy: 0.5214777298478084
Energy: 0.43915882262395656
Energy: 0.38481111520232497
Energy: 0.46560652805902636
Energy: 0.40182151278068917
Energy: 0.46560652805902636
Energy: 0.39897759560182433
Energy: 0.5558192689084474
Energy: 0.5142892559894923
Energy: 0.5558192689084474
Energy: 0.38347675672477627
Energy: 0.4216990826282249
Energy: 0.4004037099258429
Energy: 0.4216990826282249

minimum gb energy = 0.38152315570420775 eV
minimum distance =  2.61950649983234 Angstroms
sigma value = 41


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

Energy: 0.5295462932181682
Energy: 0.370874435379501
Energy: 0.611162206224364
Energy: 0.370874435379501
Energy: 0.5443431773551848
Energy: 0.36236970304855476
Energy: 0.3575411927899389
Energy: 0.362369703046678
Energy: 0.3700290363796529
Energy: 0.35619531920391795
Energy: 0.6115298039578964
Energy: 0.35619531920391795
Energy: 0.4534247647644953
Energy: 0.4440733464383337
Energy: 0.3574922221710406
Energy: 0.4440733464383337
Energy: 0.355407009995886
Energy: 0.45824919529742403
Energy: 0.5090078054037507
Energy: 0.45824919529742403
Energy: 0.36275480797206333
Energy: 0.4430946005189794
Energy: 0.35749343524506727
Energy: 0.44309460047518734
Energy: 0.35703021712562444
Energy: 0.4436375252309102
Energy: 0.3621626260564806
Energy: 0.44363752523278704
Energy: 0.34772896429867717
Energy: 0.37081766278008005
Energy: 0.3557289414804727
Energy: 0.37081766278008005
Energy: 0.35880014041788494
Energy: 0.3714015827721949
Energy: 0.4525133155852063
Energy: 0.3714015827746973
Energy: 0.34704190316837835
Energy: 0.4391980972685736
Energy: 0.37048887714088535
Energy: 0.43919809726356884
Energy: 0.3571105856333864
Energy: 0.3623073688089114
Energy: 0.610666617797308
Energy: 0.36230736880640907
Energy: 0.34810861935460174
Energy: 0.4507241958989004
Energy: 0.5299594246823025
Energy: 0.45072419589827484
Energy: 0.35877143503136183
Energy: 0.3708555575898877
Energy: 0.6105300905850236
Energy: 0.37085555758488287
Energy: 0.46255582162803177
Energy: 0.41014735783339135
Energy: 0.3705680505145081
Energy: 0.410147357834017
Energy: 0.35723083199350164
Energy: 0.3624487670426028
Energy: 0.5378173683426759
Energy: 0.36244876704072604
Energy: 0.4679522911860976
Energy: 0.449762678580084
Energy: 0.3557624729589769
Energy: 0.449762678580084
Energy: 0.3588254229727553
Energy: 0.3705295266188594
Energy: 0.44560430721559036
Energy: 0.37052952661760813
Energy: 0.46019241564773566
Energy: 0.4063786168560139
Energy: 0.35753460908985996
Energy: 0.4063786168572651
Energy: 0.35715376900438
Energy: 0.37070046191633227
Energy: 0.3572587853583033
Energy: 0.3707004619169579
Energy: 0.4616726121736791
Energy: 0.4496647138376843
Energy: 0.3605108331269192
Energy: 0.44966471383705875
Energy: 0.3717903555919217
Energy: 0.37179315689728937
Energy: 0.3556273277441433
Energy: 0.37179315689728937
Energy: 0.610495443975552
Energy: 0.3802976215632302
Energy: 0.35763678047523334
Energy: 0.380297621561979
Energy: 0.5307395670352921
Energy: 0.4505936128679436
Energy: 0.3564816234049743
Energy: 0.45059361285605726
Energy: 0.5298924778539879
Energy: 0.4508392941752892
Energy: 0.3607547851920546
Energy: 0.4508392941752892
Energy: 0.371811459454478
Energy: 0.40694112462520465
Energy: 0.3541648908802484
Energy: 0.4069411246270815
Energy: 0.5365080482613034
Energy: 0.3800706645956742
Energy: 0.35765258993605537
Energy: 0.38007066459755096
Energy: 0.35714501248323133
Energy: 0.4499653233953513
Energy: 0.465134102431232
Energy: 0.44996532339597695
Energy: 0.3582259190167694
Energy: 0.37110595814346325
Energy: 0.3607728599766993
Energy: 0.3711059581428377
Energy: 0.35883869968617427
Energy: 0.4073205688442135
Energy: 0.4604200033801021
Energy: 0.40732056884358786
Energy: 0.35340477625266237
Energy: 0.3930288615651559
Energy: 0.35924320853821334
Energy: 0.3930288615670327
Energy: 0.36008990043827177
Energy: 0.44997891604803086
Energy: 0.4644724008867196
Energy: 0.44997891605300727
Energy: 0.34810754076185374
Energy: 0.3708317917857406
Energy: 0.3738348299141177
Energy: 0.37083179178886855

minimum gb energy = 0.34704190316837835 eV
minimum distance =  2.60483349113565 Angstroms
sigma value = 15


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

Energy: 0.4807265960492848
Energy: 0.33689162119209826
Energy: 0.5746249098390267
Energy: 0.3368916211905083
Energy: 0.5540405367861566
Energy: 0.33577866328474504
Energy: 0.3357137729422051
Energy: 0.33577866328368505
Energy: 0.3476660314102553
Energy: 0.33461432275040187
Energy: 0.5754892188168477
Energy: 0.3346143227493419
Energy: 0.48913350666405664
Energy: 0.3357095128194261
Energy: 0.33562634869182867
Energy: 0.3357095128194261
Energy: 0.3342601415154551
Energy: 0.3677121144643865
Energy: 0.4886867938294904
Energy: 0.3677121144659764
Energy: 0.48560133968547214
Energy: 0.40339357873456133
Energy: 0.33564309959619004
Energy: 0.40339357873244147
Energy: 0.3352915924205642
Energy: 0.4084571655935645
Energy: 0.3319981661183645
Energy: 0.4084571655930345
Energy: 0.4079425575982985
Energy: 0.40794219033107615
Energy: 0.33563275467451814
Energy: 0.40794219033054613
Energy: 0.33642430928446865
Energy: 0.34197528951835315
Energy: 0.4128825656443599
Energy: 0.34197528951782313
Energy: 0.33096272937088494
Energy: 0.3353212518458496
Energy: 0.3344720027873539
Energy: 0.3353212518744681
Energy: 0.3353745514460337
Energy: 0.3356505162513308
Energy: 0.48962535073487057
Energy: 0.3356505162513308
Energy: 0.3315152149629562
Energy: 0.4032317951445354
Energy: 0.34814721824607
Energy: 0.40323179514506535
Energy: 0.33635929648860635
Energy: 0.3424618662754154
Energy: 0.6086703698131384
Energy: 0.34246186627223557
Energy: 0.33083906729456347
Energy: 0.33669786687280046
Energy: 0.48099332984567733
Energy: 0.33669786687227055
Energy: 0.33560339929924515
Energy: 0.33566133291840977
Energy: 0.6134195946069267
Energy: 0.3356613329210596
Energy: 0.4203852750584362
Energy: 0.4031953202690612
Energy: 0.34792651094996435
Energy: 0.4031953202685313
Energy: 0.3364430685631635
Energy: 0.34140859702687587
Energy: 0.5466455690586741
Energy: 0.3414085970274059
Energy: 0.42615909114616635
Energy: 0.36875869535591155
Energy: 0.33447320145156434
Energy: 0.3687586953553815
Energy: 0.33553233944341904
Energy: 0.3355467771870632
Energy: 0.4851567655572135
Energy: 0.33554677718017356
Energy: 0.4217364696383691
Energy: 0.40407397776491966
Energy: 0.33560736760991944
Energy: 0.40407397776332976
Energy: 0.3365621072199814
Energy: 0.3486984663611832
Energy: 0.4089556100317278
Energy: 0.3486984663590633
Energy: 0.42322116193378173
Energy: 0.34201434804156194
Energy: 0.33801038715838655
Energy: 0.3420143480383821
Energy: 0.3354412615959362
Energy: 0.33476716409388313
Energy: 0.3283922456730228
Energy: 0.33476716409865287
Energy: 0.5681217452784062
Energy: 0.4037447060210203
Energy: 0.335628965061831
Energy: 0.40374470602049034
Energy: 0.34887780821425834
Energy: 0.3484772428181611
Energy: 0.3308219749546551
Energy: 0.3484772428335303
Energy: 0.5518259723975408
Energy: 0.3409125701647405
Energy: 0.33766876841757787
Energy: 0.3409125701673904
Energy: 0.48174207545190784
Energy: 0.33465149518455056
Energy: 0.32852634959209714
Energy: 0.33465149524867716
Energy: 0.611552765504121
Energy: 0.4026232613554147
Energy: 0.33570066052527164
Energy: 0.4026232613564746
Energy: 0.34887796180436664
Energy: 0.3786943892906814
Energy: 0.3294261423646843
Energy: 0.37869438930123267
Energy: 0.4849739574630181
Energy: 0.34096890086639164
Energy: 0.33777963475431877
Energy: 0.3409689008674516
Energy: 0.33545608262967025
Energy: 0.3650223786355232
Energy: 0.4233311542547248
Energy: 0.3650223786371131
Energy: 0.48296250863041534
Energy: 0.33544146187171064
Energy: 0.33566101657055447
Energy: 0.33544146187171064
Energy: 0.336585746963146
Energy: 0.3804599782879513
Energy: 0.41829343056753693
Energy: 0.3804599782868913
Energy: 0.33261867485470986
Energy: 0.34881036903669976
Energy: 0.3378642479772904
Energy: 0.34881036903510987
Energy: 0.332388638362565
Energy: 0.3675066125234292
Energy: 0.42444484409947003
Energy: 0.36750661252395916
Energy: 0.3295837782440776
Energy: 0.3345031194484711
Energy: 0.3366357657463054
Energy: 0.3345031194823411
Energy: 0.3363661355676682
Energy: 0.3821250850632267
Energy: 0.5680789110189933
Energy: 0.38212508506905635

minimum gb energy = 0.3283922456730228 eV
minimum distance =  2.60898939377435 Angstroms
sigma value = 85


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

Energy: 0.48483164903648107
Energy: 0.3326181903184513
Energy: 0.383201000898381
Energy: 0.3326181900170704
Energy: 0.5847252138407363
Energy: 0.32671699019341605
Energy: 0.3063555862253709
Energy: 0.3267169901966335
Energy: 0.4660904486232483
Energy: 0.3301034593489795
Energy: 0.36575187866320036
Energy: 0.33010345934760055
Energy: 0.5692833214691969
Energy: 0.3509363089995638
Energy: 0.30641007912102103
Energy: 0.350936308972006
Energy: 0.35533823798131775
Energy: 0.31066357850804993
Energy: 0.3067017137479255
Energy: 0.31066357850804993
Energy: 0.5114271808549353
Energy: 0.3563999856160778
Energy: 0.30646859678742183
Energy: 0.3563999856169971
Energy: 0.3368166526886994
Energy: 0.3872990017732984
Energy: 0.34059870434597134
Energy: 0.3872990017742177
Energy: 0.4521749769894857
Energy: 0.35066336490150113
Energy: 0.3112234960421063
Energy: 0.3506633649005818
Energy: 0.31069368246317836
Energy: 0.36916727614806805
Energy: 0.40972804441004085
Energy: 0.36916727614806805
Energy: 0.3880077644473333
Energy: 0.3827812305340979
Energy: 0.33707259230669934
Energy: 0.38278123053501717
Energy: 0.30717273668804523
Energy: 0.32386489521070844
Energy: 0.47178319698163534
Energy: 0.32386489520749095
Energy: 0.3196225367905228
Energy: 0.3275408934640797
Energy: 0.35555896336113507
Energy: 0.3275408934934762
Energy: 0.3060380549969583
Energy: 0.31375748198164927
Energy: 0.5288950980667853
Energy: 0.31375748198072995
Energy: 0.28606806958188047
Energy: 0.35781083800316976
Energy: 0.4663396127561834
Energy: 0.357810838004089
Energy: 0.3073372347659609
Energy: 0.35094206177930803
Energy: 0.6248975614052608
Energy: 0.3509420617802273
Energy: 0.2849867929870084
Energy: 0.3259210828945296
Energy: 0.45098704537093737
Energy: 0.3259210828931507
Energy: 0.3061147288460099
Energy: 0.31456128590573296
Energy: 0.596496257226451
Energy: 0.3145612859071119
Energy: 0.36402962222506896
Energy: 0.3577938089898799
Energy: 0.4663364114872393
Energy: 0.35779380898896057
Energy: 0.3072216954653318
Energy: 0.35069531368772555
Energy: 0.568847616579732
Energy: 0.35069531368588686
Energy: 0.36971084276995364
Energy: 0.3258555156106584
Energy: 0.35563465914048714
Energy: 0.32585551561111803
Energy: 0.30654193399872315
Energy: 0.31890814262601225
Energy: 0.5115633858363599
Energy: 0.3189081426241736
Energy: 0.39835919083541094
Energy: 0.377494876677002
Energy: 0.337022810026248
Energy: 0.37749487667562304
Energy: 0.31246357522056134
Energy: 0.3233294907673573
Energy: 0.45219862715973613
Energy: 0.3233294908224938
Energy: 0.4048071022402266
Energy: 0.3355273454875625
Energy: 0.3111769852621468
Energy: 0.3355273454889415
Energy: 0.33801058234114467
Energy: 0.35069174729405533
Energy: 0.3858700447703543
Energy: 0.35069174729405533
Energy: 0.5306914472593388
Energy: 0.3775001254264112
Energy: 0.3085014703523047
Energy: 0.37750012542687084
Energy: 0.3563743716314193
Energy: 0.32336410035989893
Energy: 0.3197896916684258
Energy: 0.3233641003603587
Energy: 0.5374939437131783
Energy: 0.3355529377328427
Energy: 0.3064455466141699
Energy: 0.3355529383801903
Energy: 0.46695423351206494
Energy: 0.35760090348539947
Energy: 0.32024253870905955
Energy: 0.357600903449568
Energy: 0.6282205779400769
Energy: 0.3773966760966203
Energy: 0.30725575396056165
Energy: 0.3773966760961607
Energy: 0.48566508430885463
Energy: 0.3293348860448952
Energy: 0.28504787035234963
Energy: 0.32933488604627414
Energy: 0.5821676066187024
Energy: 0.33411155554384286
Energy: 0.3064555027287104
Energy: 0.3341115555365094
Energy: 0.4671179645626878
Energy: 0.35741933892400246
Energy: 0.2857592984766642
Energy: 0.3574193389226235
Energy: 0.5689963956556611
Energy: 0.3505186533638413
Energy: 0.3072099104283076
Energy: 0.3505186533638413
Energy: 0.35644660716818544
Energy: 0.3232703062658661
Energy: 0.370013450608275
Energy: 0.32327030626632575
Energy: 0.46211656536472917
Energy: 0.3403046852100212
Energy: 0.3074407277748094
Energy: 0.34030468517235124
Energy: 0.3380452644605976
Energy: 0.37745783641680114
Energy: 0.3986634779714101
Energy: 0.3774578364181801
Energy: 0.45217702395353965
Energy: 0.3231786120386654
Energy: 0.3120534119376852
Energy: 0.3231786120418829
Energy: 0.3113270126391306
Energy: 0.32331856618909555
Energy: 0.4046879092410682
Energy: 0.3233185661886359
Energy: 0.3245462071454561
Energy: 0.3454517477211279
Energy: 0.3393553766886458
Energy: 0.3454517477271033
Energy: 0.3078504266725412
Energy: 0.3774146582508162
Energy: 0.5317279307788984
Energy: 0.37741465825541265
Energy: 0.3197753353894545
Energy: 0.32330754699905806
Energy: 0.35758994260897886
Energy: 0.3233075469999774
Energy: 0.30728674751909096
Energy: 0.3232341087630741
Energy: 0.5361737180326659
Energy: 0.3232341087621548

minimum gb energy = 0.2849867929870084 eV
minimum distance =  2.62310559810635 Angstroms
sigma value = 113


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

Energy: 0.011809174407296539
Energy: 0.013122668672991436
Energy: 0.38988363745511967
Energy: 0.013122668672304364
Energy: 0.3894946631293774
Energy: 0.15224939702379708
Energy: 0.15215998940531267
Energy: 0.15224939702448417
Energy: 0.011809174407296539
Energy: 0.013122668673344788
Energy: 0.38988363745478594
Energy: 0.013122668672304364
Energy: 0.3894946631293774
Energy: 0.15224939702379708
Energy: 0.1521599894066868
Energy: 0.15224939702413084
Energy: 0.011809174407296539
Energy: 0.013122668672991436
Energy: 0.3898836374544326
Energy: 0.013122668672304364
Energy: 0.3894946631293774
Energy: 0.15224939702379708
Energy: 0.1521599894084143
Energy: 0.15224939702448417

minimum gb energy = 0.011809174407296539 eV
minimum distance =  2.84851172281664 Angstroms
sigma value = 1