Model name: model_name=EAM_Dynamo_CaiYe_1996_AlCu__MO_942551040047_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049763545393944
cohesive_energy=3.3185781967567785
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[5.898509408669039e-20, 1.198269506745234e-19, 1.86350766477174e-19, 2.5415167727478596e-19, 3.1908469189753797e-19, 3.7609814741842796e-19, 4.19627684387574e-19, 4.48383550614606e-19, 4.65284911926672e-19, 4.7357136947772e-19, 4.77418195575954e-19, 4.815069503459219e-19, 4.88160789906924e-19, 4.958512377501239e-19, 5.03745162025842e-19, 5.109181068162599e-19, 5.1638954002137e-19, 5.205696188594759e-19, 5.2421617287846e-19, 5.2700235804498595e-19, 5.290980050822579e-19, 5.305319531696879e-19, 5.31376300255806e-19, 5.31653476813488e-19, 5.313522676062959e-19, 5.30373337682922e-19, 5.286109433855219e-19, 5.259144801105e-19, 5.221061062514819e-19, 5.169775388460479e-19, 5.10334914521484e-19, 5.017536564697799e-19, 4.90910125010868e-19, 4.773284736844499e-19, 4.604271123723839e-19, 4.3947064199966395e-19, 4.1352980011856996e-19, 3.81779465762592e-19, 3.42053496122562e-19, 2.9265358396644e-19, 2.3094254655466196e-19, 1.5342539577782038e-19, 5.52001120065288e-20, -7.04139006700026e-20, -2.3268891908572194e-19, -4.45903381185174e-19, -7.30449951383574e-19, -1.1186861889811859e-18, -1.66200190951356e-18, -2.4479656790885997e-18, -3.63320788762278e-18, -5.52324759745356e-18, -8.774993250287278e-18, -1.502516440835298e-17]
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: 0.012489815314093577
Energy: 0.01419879581941497
Energy: 0.15450995111959734
Energy: 0.4201934591072136
Energy: 0.3894919494311456
Energy: 0.13430961905734493
Energy: 0.013055497901852202
Energy: 0.01280222626099064
Energy: 0.3066452430872639
Energy: 0.11049332973344123
Energy: 0.15549529353891592
Energy: 0.2730831010842447
Energy: 0.01326822057157631
Energy: 0.04429412699860195
Energy: 0.012739342979987574
Energy: 0.30819644233718096
Energy: 0.22923483547537116
Energy: 0.15501196575662654
Energy: 0.15579168045188546
Energy: 0.0434132420596752
Energy: 0.044579335022295725
Energy: 0.01397171247473199
Energy: 0.15488644455096623
Energy: 0.15498902492772887
Energy: 0.41990240737472145
Energy: 0.3916972658214357
Energy: 0.043878295966331235
Energy: 0.01310745674396488
Energy: 0.04391788292689777
Energy: 0.38002852909232737
Energy: 0.11035365795845209
Energy: 0.1544737584825684
Energy: 0.2739916265699603
Energy: 0.013060247481352257
Energy: 0.04417563358255711
Energy: 0.012749894491164565
Energy: 0.307330444422627
Energy: 0.15544690406081121
Energy: 0.15473804503731814
Energy: 0.34373194552128195
Energy: 0.04343399739520409
Energy: 0.044239008730598876

minimum gb energy = 0.012489815314093577 eV
minimum distance =  2.83579426932438 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 0.505380043781878
Energy: 0.4571120459687529
Energy: 0.5156274545413444
Energy: 0.47472575608373524
Energy: 0.55358826859908
Energy: 0.5422284838767771
Energy: 0.4584248073565656
Energy: 0.45200125972669264
Energy: 0.469071450547419
Energy: 0.4536102509636213
Energy: 0.4861446404827769
Energy: 0.4758572089134927
Energy: 0.4571705617835766
Energy: 0.4827790729618828
Energy: 0.44993408164838783
Energy: 0.47560488736046275
Energy: 0.47184764658685113
Energy: 0.488554622347464
Energy: 0.487547552460474
Energy: 0.48947259531124826
Energy: 0.46528838124634786
Energy: 0.4600015557947666
Energy: 0.501166620125162
Energy: 0.45998220936068857
Energy: 0.49683206109412154
Energy: 0.4832909222448171
Energy: 0.4560416268049328
Energy: 0.47780507414945583
Energy: 0.4794590595397662
Energy: 0.45856263949501747
Energy: 0.4755962892091762
Energy: 0.46299233920122035
Energy: 0.4798065069570417
Energy: 0.4746799550255407
Energy: 0.4703861849540869
Energy: 0.46946322405482044
Energy: 0.47797466024284097
Energy: 0.45363930958073817
Energy: 0.45311589277128433
Energy: 0.47331915039330547
Energy: 0.4880796692204121
Energy: 0.4531922667794661
Energy: 0.4585510139256011
Energy: 0.4872089895616441
Energy: 0.4992279206100727
Energy: 0.4777927533369952
Energy: 0.4709383504135572
Energy: 0.5016292386524409
Energy: 0.47038808960160333
Energy: 0.4677835718335452
Energy: 0.4847566611849725
Energy: 0.48212657928285635
Energy: 0.5007975238736613
Energy: 0.4551671979388012
Energy: 0.4605384991887942
Energy: 0.49616821771697817
Energy: 0.4594239451832055
Energy: 0.471138790821192
Energy: 0.4598781938866949
Energy: 0.4672934434281504
Energy: 0.4884298882035488
Energy: 0.4861595017089063
Energy: 0.4651294815289145
Energy: 0.4570724837495565
Energy: 0.47419715777087973
Energy: 0.47237535504962835
Energy: 0.4823842370999175
Energy: 0.47083085324467355
Energy: 0.4834730785704269
Energy: 0.47083851128444615
Energy: 0.46451552437882365
Energy: 0.5000479238163845
Energy: 0.4507364820117563
Energy: 0.4941577905354093
Energy: 0.5219912443130257
Energy: 0.4556124613099651
Energy: 0.48171864833094763
Energy: 0.4921695330724308
Energy: 0.47513139407420596
Energy: 0.4645289990554822
Energy: 0.4848361217324245
Energy: 0.48424514550976006
Energy: 0.46476520626096046
Energy: 0.4623651082222637
Energy: 0.4585080842350647
Energy: 0.49103587333954624
Energy: 0.46005468748438133
Energy: 0.4723701729134697
Energy: 0.47846969383653515
Energy: 0.4636257234545202
Energy: 0.4776968783094999
Energy: 0.49445070388124873
Energy: 0.4862889799095388
Energy: 0.5332024787433566
Energy: 0.49975263868675435
Energy: 0.49469104832821487
Energy: 0.5291199852840358
Energy: 0.4923282715340261
Energy: 0.45091785603788653
Energy: 0.47511213903297994
Energy: 0.4743197176200314
Energy: 0.4718535289862329
Energy: 0.47177823897788923
Energy: 0.466022868875208
Energy: 0.4670484470791178
Energy: 0.45658119567179667
Energy: 0.4751587269664539
Energy: 0.49194658208351494
Energy: 0.468930883509374
Energy: 0.490805030144041
Energy: 0.46928172736021256
Energy: 0.47448340590625493
Energy: 0.4767159939343356
Energy: 0.4691263942631862
Energy: 0.46359829990972673
Energy: 0.47552893198296586
Energy: 0.4836067649025058
Energy: 0.47063299705695
Energy: 0.4921197882574909
Energy: 0.48509784848468745
Energy: 0.45970293562211295
Energy: 0.477360316539948
Energy: 0.4640835916112055
Energy: 0.46728889403939866
Energy: 0.525372082477405
Energy: 0.4777736201752838
Energy: 0.4636949314445558
Energy: 0.4865496689044465
Energy: 0.4518257517848833
Energy: 0.4794453766178774
Energy: 0.4725680514802449
Energy: 0.4578980454334197
Energy: 0.45847335361416847
Energy: 0.5153746277881144
Energy: 0.4900643700230892
Energy: 0.49220909571974286
Energy: 0.4897464108985675
Energy: 0.4866697663895379
Energy: 0.48263746712032213
Energy: 0.47475000428539643
Energy: 0.46509717929929284
Energy: 0.5240993971818221
Energy: 0.45916025592873017
Energy: 0.49171906603559684
Energy: 0.49692204452813815
Energy: 0.47262669376155036
Energy: 0.4830331683957351
Energy: 0.4864340446981583
Energy: 0.4581854670153553
Energy: 0.4851385182605903
Energy: 0.49144697385597724
Energy: 0.4915943038537119
Energy: 0.48719368565882554
Energy: 0.46186142900207827
Energy: 0.4647263853705977
Energy: 0.5098206314009935
Energy: 0.45384212566318227
Energy: 0.47967002852066853
Energy: 0.4870107951611959
Energy: 0.4551912388482007
Energy: 0.48392870460451887
Energy: 0.4570149487249087
Energy: 0.49135208057153795
Energy: 0.5097706880679268
Energy: 0.49068075531217603
Energy: 0.4715279937543676
Energy: 0.47404535226504696
Energy: 0.48745912927854157
Energy: 0.4505162721183466
Energy: 0.4735632075843688
Energy: 0.4631837010826313
Energy: 0.4521464125301667
Energy: 0.4757953152506733
Energy: 0.463303772421864
Energy: 0.4622205341599336
Energy: 0.49944726335825074
Energy: 0.4871261610888126
Energy: 0.5170985008044013
Energy: 0.48454828839296504
Energy: 0.4509788911067108
Energy: 0.5025217306505084
Energy: 0.4715792949053356
Energy: 0.4541476459613114
Energy: 0.5194531852140113
Energy: 0.4647598024462823
Energy: 0.45974387185732724
Energy: 0.4582133130469773
Energy: 0.488574766167216
Energy: 0.48204054073944264
Energy: 0.4684775235599936
Energy: 0.4604938306493657
Energy: 0.48424504705067173
Energy: 0.4627729243442765
Energy: 0.45479029666383947
Energy: 0.47459149724050276
Energy: 0.46544694416949733
Energy: 0.46784887707594575
Energy: 0.47675871453214
Energy: 0.4573868287719081
Energy: 0.45331642105396347
Energy: 0.4645330760450295
Energy: 0.47153357933442425
Energy: 0.4690912514094118
Energy: 0.45110119719458547
Energy: 0.4884194404420583
Energy: 0.4939328294082616
Energy: 0.47871120910730436
Energy: 0.4694969015603018
Energy: 0.5026434845713907
Energy: 0.48917438261327706
Energy: 0.49290668596974796
Energy: 0.4869720796800112
Energy: 0.47952240335536195
Energy: 0.48739818854403166
Energy: 0.4834260021084956
Energy: 0.5096844148332424
Energy: 0.4879404518212236
Energy: 0.4587522533647248
Energy: 0.47214665819373924
Energy: 0.4679568215681322
Energy: 0.46654906931300877
Energy: 0.4645080568741774
Energy: 0.4873161964492627
Energy: 0.4774345345434051
Energy: 0.4584890033774339
Energy: 0.472988335036673
Energy: 0.47331462869350793
Energy: 0.5079251383216973
Energy: 0.5067663637141722
Energy: 0.5019059082096824
Energy: 0.5060345180033586
Energy: 0.4614205865245869
Energy: 0.5041012047336286
Energy: 0.44957719967561793
Energy: 0.47276974508135616
Energy: 0.5194374608634642
Energy: 0.45684435714822863
Energy: 0.4613701173299606
Energy: 0.4824272386976805
Energy: 0.46518814890318244
Energy: 0.4722712945049419
Energy: 0.5007389406623138
Energy: 0.46691399539568734
Energy: 0.46856359113356344
Energy: 0.4630683758989953
Energy: 0.45935619253824
Energy: 0.48478385383862616
Energy: 0.4713353685415433
Energy: 0.4487808418349412
Energy: 0.5211398830239106
Energy: 0.47424714676388
Energy: 0.486617809733051
Energy: 0.5074784021631921
Energy: 0.4651525587818078
Energy: 0.500017944143225
Energy: 0.4972712059829133
Energy: 0.49219987852451996
Energy: 0.48254735130233456
Energy: 0.4631542723568593
Energy: 0.45812832459677644
Energy: 0.45134906763006144
Energy: 0.4574926652301358
Energy: 0.4750519965162687
Energy: 0.4707187460317533
Energy: 0.46771660470479887
Energy: 0.46974546838411263
Energy: 0.4565580395573773
Energy: 0.46512948912492247
Energy: 0.5059079368780236
Energy: 0.46117845160016757
Energy: 0.48216297015877396
Energy: 0.4964651793131291
Energy: 0.4654423593806562
Energy: 0.47517937668638693
Energy: 0.4517454619434191
Energy: 0.47854791204544506
Energy: 0.47578066660964763
Energy: 0.48505992498054296
Energy: 0.4700474392782827
Energy: 0.48252843155045105
Energy: 0.4512185173455752
Energy: 0.4611118234728433
Energy: 0.4589673331997904
Energy: 0.45062987364639145
Energy: 0.46666310406862
Energy: 0.5085241331961622
Energy: 0.47072244973587696
Energy: 0.4517527647530323
Energy: 0.4953016611493226
Energy: 0.45312860621272405
Energy: 0.45483749492591924
Energy: 0.46425443387817106
Energy: 0.4580326903888863
Energy: 0.47386250685441755
Energy: 0.5104694195644807
Energy: 0.4965552349073598
Energy: 0.4933307845291824
Energy: 0.490441680616321
Energy: 0.48881379270893444
Energy: 0.4821099900112766
Energy: 0.46702990019991913
Energy: 0.4623083598856696
Energy: 0.5017967349080494
Energy: 0.4526599559919414
Energy: 0.4788503541649023
Energy: 0.4694701156268437
Energy: 0.46428376379566183
Energy: 0.49692508897057136
Energy: 0.4861587164926473
Energy: 0.4718770691963864
Energy: 0.4915108962815923
Energy: 0.486368774357051
Energy: 0.4871213988025006
Energy: 0.46976914216123855
Energy: 0.4593283250146403
Energy: 0.4650371538652588
Energy: 0.49238992975556334
Energy: 0.45069096390864577
Energy: 0.46972458935730294
Energy: 0.49295909286206285
Energy: 0.4552019873199462
Energy: 0.45156841320453023
Energy: 0.4569980074823174
Energy: 0.4938123792103013
Energy: 0.49337241985206304
Energy: 0.46545034822765075
Energy: 0.4707122940488543
Energy: 0.47309790833671644
Energy: 0.4689621066706202

minimum gb energy = 0.4487808418349412 eV
minimum distance =  2.57352040522292 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 0.4598767856874506
Energy: 0.46437199075860003
Energy: 0.5021574093362627
Energy: 0.47136583210719385
Energy: 0.575686186478879
Energy: 0.47198477793307164
Energy: 0.463027436107496
Energy: 0.45370335492078295
Energy: 0.45337852607199053
Energy: 0.4765946697741202
Energy: 0.542570697485904
Energy: 0.44992588855442534
Energy: 0.47212537445787695
Energy: 0.45643906489026326
Energy: 0.4518691499206811
Energy: 0.47500660332176653
Energy: 0.47561695724068004
Energy: 0.45294389559749754
Energy: 0.4730350309383349
Energy: 0.4687082134435108
Energy: 0.4728776980259775
Energy: 0.48330523652500057
Energy: 0.47603747867948953
Energy: 0.45381309826868654
Energy: 0.45393202960155643
Energy: 0.44920418841042203
Energy: 0.45482660478603676
Energy: 0.4722035852163423
Energy: 0.502308214004154
Energy: 0.4700769859090428
Energy: 0.4531927462333308
Energy: 0.459205986534033
Energy: 0.44617439440202433
Energy: 0.44141622862150204
Energy: 0.46107008579217335
Energy: 0.5069840013673713
Energy: 0.4774713563416021
Energy: 0.45723258526409627
Energy: 0.46251027893297847
Energy: 0.44515535371811993
Energy: 0.46126831729017936
Energy: 0.46490952816554076
Energy: 0.4543358280470605
Energy: 0.4665756130494089
Energy: 0.4961506582474145
Energy: 0.45749229517282325
Energy: 0.4662758736642418
Energy: 0.49337625509568384
Energy: 0.4695792502874162
Energy: 0.4599465347644907
Energy: 0.4673270904325866
Energy: 0.45399702142935
Energy: 0.45945769991642765
Energy: 0.4689859917713394
Energy: 0.4867498983133486
Energy: 0.4564928945183332
Energy: 0.4538294142369123
Energy: 0.46614499744141885
Energy: 0.4696500954139507
Energy: 0.48220260009329546
Energy: 0.4855640450091387
Energy: 0.4519790337826985
Energy: 0.4602927521716707
Energy: 0.4533436362421042
Energy: 0.46691363368082983
Energy: 0.49289981760730905
Energy: 0.4613607348406536
Energy: 0.4626056320392579
Energy: 0.4481792175222374
Energy: 0.45541572113410705
Energy: 0.45231689293025795
Energy: 0.46599153663607323
Energy: 0.501713768770092
Energy: 0.47171794301944553
Energy: 0.4744593295151804
Energy: 0.44693711064640557
Energy: 0.4544956211075708
Energy: 0.4629196487459454
Energy: 0.47055035546878266
Energy: 0.4528260516785319
Energy: 0.4556436924666605
Energy: 0.46240733803361095
Energy: 0.4439482175609835
Energy: 0.45659040987671945
Energy: 0.4539380538711402
Energy: 0.47590979647933457
Energy: 0.4852472839501287
Energy: 0.4504578226899199
Energy: 0.5045567588116698
Energy: 0.4894646996707344
Energy: 0.48712011611535355
Energy: 0.48595970669668576
Energy: 0.4688320158941525
Energy: 0.4976233952347499
Energy: 0.4551134303554467
Energy: 0.46970915113441425
Energy: 0.4867713634096269
Energy: 0.47043291261898074
Energy: 0.5072823599642271
Energy: 0.4696713288442839
Energy: 0.4538370346559511
Energy: 0.4611876070360158
Energy: 0.44886885793734776
Energy: 0.4418427040223616
Energy: 0.46600572418018116
Energy: 0.5040324750737334
Energy: 0.4741909364060109
Energy: 0.45361693134548425
Energy: 0.460059517768044
Energy: 0.44249694614461493
Energy: 0.4419155281368467
Energy: 0.46204214385701203
Energy: 0.4837128937900081
Energy: 0.4510701413997871
Energy: 0.49789825409794725
Energy: 0.45543780729349664
Energy: 0.4421538714329201
Energy: 0.5340225481672684
Energy: 0.46176391749804063
Energy: 0.4526858710287281
Energy: 0.4746267910337492
Energy: 0.45704276713898406
Energy: 0.45969376049245503
Energy: 0.46324354909538085
Energy: 0.4699238186781506
Energy: 0.45714114359607644
Energy: 0.4629801897597526
Energy: 0.46664417888947995
Energy: 0.45965606302208756
Energy: 0.4602489194581558
Energy: 0.4806356926048212
Energy: 0.4722065590882752
Energy: 0.46494219446281754
Energy: 0.45117028690505595
Energy: 0.4531917746374598
Energy: 0.4837872272913644
Energy: 0.44129905932774494
Energy: 0.460309121530116
Energy: 0.4555722100346869
Energy: 0.4560880852304167
Energy: 0.45225033196493875
Energy: 0.4651879740587607
Energy: 0.5157878466152352
Energy: 0.47212946248658444
Energy: 0.4425911723942254
Energy: 0.4447955013772009
Energy: 0.45547126736433013
Energy: 0.4536331371600493
Energy: 0.46996715208932455
Energy: 0.48779352626392786
Energy: 0.4620725751320723
Energy: 0.4669069858291214
Energy: 0.45073906034914274
Energy: 0.4563180514421492
Energy: 0.45179392047977296
Energy: 0.46899455917653493
Energy: 0.4842007431179844
Energy: 0.4409901386989239
Energy: 0.5059356230180612
Energy: 0.48287864665517516
Energy: 0.45454389444055965
Energy: 0.4545461637681196
Energy: 0.47697456995819937
Energy: 0.4568849057396639
Energy: 0.4555038113906859
Energy: 0.4910495002669615
Energy: 0.48710072998418175
Energy: 0.46965561288959445
Energy: 0.509420375425025
Energy: 0.4776220158630786
Energy: 0.4583447013731666
Energy: 0.4598410111138629
Energy: 0.45159084876301897
Energy: 0.4973634576418384
Energy: 0.46031225953148064
Energy: 0.5019626503268803
Energy: 0.4697010574123084
Energy: 0.45325176643700654
Energy: 0.4588490183567982
Energy: 0.44284434174409726
Energy: 0.4411086992455698
Energy: 0.4614123457880281
Energy: 0.4834081309833543
Energy: 0.45298149620020356
Energy: 0.45393628415607584
Energy: 0.4536301658929432
Energy: 0.4413249138245618
Energy: 0.45495047641576414
Energy: 0.47212291538701623
Energy: 0.46029448697697734
Energy: 0.47239623660903374
Energy: 0.4558834900711399
Energy: 0.46354710988521347
Energy: 0.450678540896721
Energy: 0.4777974460345991
Energy: 0.46931916580225
Energy: 0.45405105912917354
Energy: 0.4669826069948649
Energy: 0.4548425279833718
Energy: 0.5090368362244478
Energy: 0.468410708492896
Energy: 0.47375149109545667
Energy: 0.46109934785422685
Energy: 0.45455920555915946
Energy: 0.47150375370483383
Energy: 0.4845952320586926
Energy: 0.440788176265703
Energy: 0.5312804568570454
Energy: 0.453889922291023
Energy: 0.45499220386913003
Energy: 0.45346361390872203
Energy: 0.46973526542351973
Energy: 0.5168797321432865
Energy: 0.46128248459536003
Energy: 0.46048634410432115
Energy: 0.44578112581941676
Energy: 0.456073573452213
Energy: 0.45226456032758855
Energy: 0.48447072961167476
Energy: 0.5152042051747044
Energy: 0.4733403734400722
Energy: 0.4672431739689791
Energy: 0.448287504564743
Energy: 0.4587091363168088
Energy: 0.4513405971670987
Energy: 0.456174933475459
Energy: 0.48351560086208134
Energy: 0.44086980076488375
Energy: 0.48266407995054916
Energy: 0.48134508884922056
Energy: 0.4564103341888066
Energy: 0.5179712392714346
Energy: 0.4729856481246843
Energy: 0.4542046193696841
Energy: 0.45449418153654314
Energy: 0.4760480685357419
Energy: 0.4514934048541958
Energy: 0.47724041439907205
Energy: 0.4575383415947496
Energy: 0.48090938806525657
Energy: 0.45774075372517636
Energy: 0.45836700288590304
Energy: 0.45023533583588987
Energy: 0.45072110467660725
Energy: 0.4902832417640881
Energy: 0.4999468301579845
Energy: 0.46892364503695755
Energy: 0.4561277193016633
Energy: 0.4623518547895404
Energy: 0.44275251483672473
Energy: 0.44493965139643854
Energy: 0.4675827592203106
Energy: 0.4614858866350706
Energy: 0.4816614738256346
Energy: 0.454493515982077
Energy: 0.4576427054782564
Energy: 0.4411364307118746
Energy: 0.4587946139084457
Energy: 0.4709632431797679
Energy: 0.45686205701338106
Energy: 0.47213792866676185
Energy: 0.45472073313232636
Energy: 0.45796872297673563
Energy: 0.4525362504357164
Energy: 0.49680330087727237
Energy: 0.4751764507831458
Energy: 0.452574208171552
Energy: 0.4739494822122006
Energy: 0.45285278399529677
Energy: 0.45556265556079406
Energy: 0.48141572311748826
Energy: 0.4721622565838959
Energy: 0.4618682471409411
Energy: 0.4523857295164709
Energy: 0.4654424580620119
Energy: 0.48463642766862425
Energy: 0.46454293198214563
Energy: 0.531665230481586
Energy: 0.4559141013367301
Energy: 0.45620395744795456
Energy: 0.462883570906953
Energy: 0.45234680015247114
Energy: 0.4634190535068003
Energy: 0.4538004382395042
Energy: 0.4619663772646783
Energy: 0.44753319159667876
Energy: 0.4577677980384572

minimum gb energy = 0.440788176265703 eV
minimum distance =  2.57905107303058 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 0.4922590134052413
Energy: 0.46486560183197223
Energy: 0.4959511253778444
Energy: 0.44635754910248665
Energy: 0.49224894465462493
Energy: 0.4773801306514176
Energy: 0.447667379324363
Energy: 0.47061966072071465
Energy: 0.4730510785243578
Energy: 0.4797004459560905
Energy: 0.4553554298552995
Energy: 0.464582691636677
Energy: 0.4593566947941769
Energy: 0.47944258364431513
Energy: 0.48639642356611423
Energy: 0.4578855031475535
Energy: 0.4648022435903018
Energy: 0.46100558675685693
Energy: 0.4725173773932073
Energy: 0.4711304241391043
Energy: 0.4673278027467201
Energy: 0.45684254631680477
Energy: 0.4618078245675938
Energy: 0.46842091159904103
Energy: 0.5027784139380782
Energy: 0.4646375953140058
Energy: 0.4661776390870701
Energy: 0.4587161520146193
Energy: 0.477097809367583
Energy: 0.4812603611435024
Energy: 0.4692031218912309
Energy: 0.5013757096445006
Energy: 0.47077327326642965
Energy: 0.459351057061339
Energy: 0.4743876530834409
Energy: 0.46204062554505027
Energy: 0.4745492369250412
Energy: 0.4651099182358203
Energy: 0.44815104960694757
Energy: 0.47789463930852216
Energy: 0.45546668471732654
Energy: 0.48720267969945824
Energy: 0.5009020610038799
Energy: 0.4575793950178266
Energy: 0.46704122516426577
Energy: 0.4535272210690268
Energy: 0.4544945067247348
Energy: 0.47787203801108524
Energy: 0.47375337031960224
Energy: 0.4724308646246049
Energy: 0.47759429750791316
Energy: 0.47004585723663794
Energy: 0.49335753450459147
Energy: 0.49469673378953133
Energy: 0.4634184591462805
Energy: 0.4815183865793977
Energy: 0.47077265709790717
Energy: 0.4688967074674281
Energy: 0.4652792258377799
Energy: 0.47288531607001355
Energy: 0.46239056451064636
Energy: 0.4648558112733007
Energy: 0.46881334920961243
Energy: 0.4571018502992245
Energy: 0.47430318522969406
Energy: 0.45478717804567137
Energy: 0.500464546997714
Energy: 0.46967140299699695
Energy: 0.47041165083472514
Energy: 0.4624425736787271
Energy: 0.47311092220426143
Energy: 0.46805145503926365
Energy: 0.47994755522741767
Energy: 0.5025481235564512
Energy: 0.48687344186136056
Energy: 0.5363970135989673
Energy: 0.47970447165373364
Energy: 0.4678484753373886
Energy: 0.4886044009790592
Energy: 0.4619035506407971
Energy: 0.4527679441561604
Energy: 0.45370564282064324
Energy: 0.4571815979417531
Energy: 0.4642567974989594
Energy: 0.49823493872415525
Energy: 0.4748519006060708
Energy: 0.48208099225393636
Energy: 0.4541659605608273
Energy: 0.4472161998422531
Energy: 0.4747486449729244
Energy: 0.488075125180325
Energy: 0.46828513989863707
Energy: 0.4973710160412417
Energy: 0.47156500972446486
Energy: 0.47837154345855276
Energy: 0.5039420816737559
Energy: 0.48522820136825406
Energy: 0.49906810447190986
Energy: 0.475097739297246
Energy: 0.4641628462673602
Energy: 0.4966318308550201
Energy: 0.4731286604644007
Energy: 0.46986378454315525
Energy: 0.45746585822546826
Energy: 0.46194560760076836
Energy: 0.45448383994642894
Energy: 0.47543922719020837
Energy: 0.45366224532157207
Energy: 0.46857699665700187
Energy: 0.4766766388917062
Energy: 0.4627758754678265
Energy: 0.4614376593145088
Energy: 0.46740583781190004
Energy: 0.47519286830829177
Energy: 0.46901241151324513
Energy: 0.482379060301774
Energy: 0.4644156784885337
Energy: 0.47122095148841625
Energy: 0.46168872803997246
Energy: 0.4517215413811808
Energy: 0.47205850932404747
Energy: 0.4681572669914537
Energy: 0.45553537181855386
Energy: 0.47200019632149603
Energy: 0.45427806580873503
Energy: 0.4572018977057154
Energy: 0.4949889712669013
Energy: 0.48315733380446274
Energy: 0.46904002259136546
Energy: 0.4544254269447936
Energy: 0.474725257230729
Energy: 0.46401953347200253
Energy: 0.4699842365888512
Energy: 0.49166710845797407
Energy: 0.5140571524566226
Energy: 0.4725203101951937
Energy: 0.48994260109113397
Energy: 0.5168517364515018
Energy: 0.48043203858110634
Energy: 0.4957560513276126
Energy: 0.495539443268281
Energy: 0.4849930237984538
Energy: 0.45952236978207023
Energy: 0.4768364113100411
Energy: 0.46807058499166204
Energy: 0.45670646874060483
Energy: 0.47633395946217183
Energy: 0.46695071803072075
Energy: 0.44990331944080764
Energy: 0.4613919148640009
Energy: 0.4605573312886989
Energy: 0.46592284285212376
Energy: 0.45925363997519725
Energy: 0.4681695377811674
Energy: 0.47967198635461633
Energy: 0.47696974486276994
Energy: 0.490595810122658
Energy: 0.5155587268847388
Energy: 0.4683428026099213
Energy: 0.4663839715908303
Energy: 0.46854707627645625
Energy: 0.46291699301417555
Energy: 0.44121008806964496
Energy: 0.4651046364197184
Energy: 0.4630869583143837
Energy: 0.46707132406069735
Energy: 0.45870868608319915
Energy: 0.4719573872608919
Energy: 0.47852198345153335
Energy: 0.4746649225750438
Energy: 0.47097415815913785
Energy: 0.47513630668660356
Energy: 0.4717854153829995
Energy: 0.4552880754755775
Energy: 0.4693640343658588
Energy: 0.4641992590299274
Energy: 0.47356072959754597
Energy: 0.47510679838395903
Energy: 0.49480079123268766
Energy: 0.5130484522504349
Energy: 0.5007093923829808
Energy: 0.4899685243806127
Energy: 0.4745569646368592
Energy: 0.458033462408183
Energy: 0.46791955568889204
Energy: 0.447505246002803
Energy: 0.4453643716966576
Energy: 0.4634054241988211
Energy: 0.4871482064446744
Energy: 0.46255605213476525
Energy: 0.4414141993115458
Energy: 0.45845682974563784
Energy: 0.46076893862456436
Energy: 0.46920298371156577
Energy: 0.4589302176542472
Energy: 0.46717921226773296
Energy: 0.4778363657653803
Energy: 0.45628037582021674
Energy: 0.47429702661162393
Energy: 0.5290299581501303
Energy: 0.4823592343753198
Energy: 0.46540926938793403
Energy: 0.4715674013292387
Energy: 0.4625310503398555
Energy: 0.46097139340361243
Energy: 0.4672205373812597
Energy: 0.4701447582091029
Energy: 0.4720406629075932
Energy: 0.4578705785822093
Energy: 0.4747308891022732
Energy: 0.4964075994418899
Energy: 0.4420385601302148
Energy: 0.464421499534076
Energy: 0.48230246131730564
Energy: 0.4610720434678568
Energy: 0.4573966126306548
Energy: 0.45811161138473905
Energy: 0.47760495991993607
Energy: 0.4680835137119537
Energy: 0.48094797837852443
Energy: 0.49570814279351944
Energy: 0.5036560792055601
Energy: 0.49909146880540606
Energy: 0.50821714011955
Energy: 0.4723892316359133
Energy: 0.47468877355776684
Energy: 0.4858060426432431
Energy: 0.4530019567770223
Energy: 0.45095460987251074
Energy: 0.4615160607773857
Energy: 0.47662572597034375
Energy: 0.48250707211070243
Energy: 0.46274592828996997
Energy: 0.4561426745356627
Energy: 0.46091948070602534
Energy: 0.46831232314305915
Energy: 0.4704700318310661
Energy: 0.46177360360327546
Energy: 0.46081989452138084
Energy: 0.47602995765646783
Energy: 0.4845248523916992
Energy: 0.5050643966724614
Energy: 0.4828401350447708
Energy: 0.5187802576583984
Energy: 0.47408956165385413
Energy: 0.4693359248617914
Energy: 0.46630561911060386
Energy: 0.46330219213979246
Energy: 0.48081932375724523
Energy: 0.4716543397471202
Energy: 0.46437209445324557
Energy: 0.45907883110152414

minimum gb energy = 0.44121008806964496 eV
minimum distance =  2.58494355409239 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.43319322857745773
Energy: 0.425790844558046
Energy: 0.5761799385908559
Energy: 0.5244812963022077
Energy: 0.46934105400319825
Energy: 0.4902548894653986
Energy: 0.4269774398194348
Energy: 0.4253278919685783
Energy: 0.47006648070662455
Energy: 0.4897396290830169
Energy: 0.4757225966625003
Energy: 0.45258545101935316
Energy: 0.4610860257664112
Energy: 0.4648737918188686
Energy: 0.4629620153126447
Energy: 0.44423671066019843
Energy: 0.4497229890402367
Energy: 0.47217735363399066
Energy: 0.45266765168135564
Energy: 0.4601172556586721
Energy: 0.4591714048146829
Energy: 0.45761409042159096
Energy: 0.4444377223309559
Energy: 0.49194971041501306
Energy: 0.4514112086770281
Energy: 0.47682267356073005
Energy: 0.4547740433155742
Energy: 0.4855131555310232
Energy: 0.46109991366518305
Energy: 0.4518395144521298
Energy: 0.49639382920498837
Energy: 0.4516008275009825
Energy: 0.4740383191665782
Energy: 0.4550282340521579
Energy: 0.46256676273333847
Energy: 0.4272473434623869
Energy: 0.45201176137191607
Energy: 0.45421730699472546
Energy: 0.44438306050763693
Energy: 0.47014603822267875
Energy: 0.4607967818233933
Energy: 0.46569178951231766
Energy: 0.45719885430473794
Energy: 0.45919299271703445
Energy: 0.4486924059747884
Energy: 0.4610339839408186
Energy: 0.42717464063320554
Energy: 0.42755270971407733
Energy: 0.4610734077311233
Energy: 0.42630520531451416
Energy: 0.4707884966372031
Energy: 0.4884482955334612
Energy: 0.44481602697634437
Energy: 0.4951569566714074
Energy: 0.45431270070626156
Energy: 0.49524266103914477
Energy: 0.4261481449776221
Energy: 0.47064665642761905
Energy: 0.4964325006635359
Energy: 0.44508092345978995
Energy: 0.4510685516717125
Energy: 0.45134075401661655
Energy: 0.4597059265974089
Energy: 0.4575851215888199
Energy: 0.4600692728453527
Energy: 0.45176218129105267
Energy: 0.4709999107468755
Energy: 0.4535052007649246
Energy: 0.45981978163516246
Energy: 0.4590622201280489
Energy: 0.45824577241352676
Energy: 0.442549333189971
Energy: 0.45030850175469883
Energy: 0.4430941608107667
Energy: 0.45296337602709086
Energy: 0.46612110495817005
Energy: 0.4874688776170204
Energy: 0.4672213523044331
Energy: 0.4527722556948721
Energy: 0.4889581492394012
Energy: 0.44328906523804856
Energy: 0.4749109027336063
Energy: 0.4553174028137954
Energy: 0.46208621399013244
Energy: 0.42587704762334955
Energy: 0.4523164505869175
Energy: 0.4965311562505184
Energy: 0.4522604389513279
Energy: 0.4899022148070802
Energy: 0.4531505930369015
Energy: 0.461052720923678
Energy: 0.4584877901391403
Energy: 0.4453378646229438
Energy: 0.4498267398164124
Energy: 0.4715154482131116
Energy: 0.42668145793169987
Energy: 0.426097449932506
Energy: 0.4605086206488741
Energy: 0.4244073732426872
Energy: 0.4583325809708729
Energy: 0.4528907523121875
Energy: 0.4759295455040368
Energy: 0.42551580107760123
Energy: 0.4259722911368465
Energy: 0.46030024911615963
Energy: 0.4333840276199341
Energy: 0.48957990717740946
Energy: 0.4704921969355083
Energy: 0.4506768714549796
Energy: 0.4696276926275875
Energy: 0.4906165516453942
Energy: 0.425482328729653
Energy: 0.462231403892281
Energy: 0.46989565673579253
Energy: 0.4900254011556298
Energy: 0.47573454695907663
Energy: 0.45260103864527623
Energy: 0.4616501298683085
Energy: 0.4643659244939461
Energy: 0.46058935762119185
Energy: 0.44528001184452004
Energy: 0.4505029230270168
Energy: 0.4723388228268833
Energy: 0.4533540645240558
Energy: 0.460061719365205
Energy: 0.45909001578061076
Energy: 0.457640792618234
Energy: 0.44520713130617584
Energy: 0.49020016171713615
Energy: 0.45093147808725437
Energy: 0.4757544668521148
Energy: 0.4549081314436577
Energy: 0.5151330420117188
Energy: 0.46062666709213673
Energy: 0.4528013341432301
Energy: 0.4968307946212992
Energy: 0.4512725189407942
Energy: 0.4746584995869109
Energy: 0.4977804203109407
Energy: 0.4623073272614523
Energy: 0.4245887368185944
Energy: 0.4521160732841254
Energy: 0.449455392964879
Energy: 0.4441441454263244
Energy: 0.47155155810132315
Energy: 0.4251113341964796
Energy: 0.4661865545253989
Energy: 0.45720246274181303
Energy: 0.458872901950923
Energy: 0.44955591619092566
Energy: 0.4616144892750484
Energy: 0.42641653454162487
Energy: 0.4276460843973442
Energy: 0.46074478914746975
Energy: 0.4281761507078476
Energy: 0.4707725351552094
Energy: 0.4886104721894625
Energy: 0.4443392305651217
Energy: 0.49474118962939
Energy: 0.4288443749359603
Energy: 0.4636885365419963
Energy: 0.4262938935579662
Energy: 0.47063658278916065
Energy: 0.5022067786055412
Energy: 0.4440800924820942
Energy: 0.4521049454419497
Energy: 0.4512850762977669
Energy: 0.4658016493766414
Energy: 0.45745578464707665
Energy: 0.45975604668819064
Energy: 0.4504114079457165
Energy: 0.4708296713090954
Energy: 0.4533683001989973
Energy: 0.45992984817402754
Energy: 0.459034037050632
Energy: 0.45815762331899235
Energy: 0.44248919968834016
Energy: 0.4521491867558226
Energy: 0.44293018508795073
Energy: 0.452800560587577
Energy: 0.4534936142984229
Energy: 0.48781023769055126
Energy: 0.477190002740451
Energy: 0.4527994886297481
Energy: 0.44237861984465
Energy: 0.4436262115096192
Energy: 0.4753746122879508
Energy: 0.4541514671219965
Energy: 0.4647116083761958
Energy: 0.42605583820409115
Energy: 0.4519339171387048
Energy: 0.4962197555267758
Energy: 0.4527309385591913
Energy: 0.4895725130445283
Energy: 0.45286418738055145
Energy: 0.46097878633687867
Energy: 0.45853182160279454
Energy: 0.4457296007031503
Energy: 0.450075054170621
Energy: 0.47148971495437175
Energy: 0.4265701185756334
Energy: 0.4260488900978771
Energy: 0.4605198337237551
Energy: 0.42448549368096206
Energy: 0.4583495404062231
Energy: 0.4527355988069923
Energy: 0.4441593680502689
Energy: 0.4253204766977609
Energy: 0.4261271533351422
Energy: 0.4643297507817319

minimum gb energy = 0.4244073732426872 eV
minimum distance =  2.58251828991364 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 0.5413204444698977
Energy: 0.5294206899395073
Energy: 0.47182930811008517
Energy: 0.586395026288293
Energy: 0.4413020534548292
Energy: 0.4688165793097656
Energy: 0.5279717724354294
Energy: 0.4549246054367333
Energy: 0.42139172295577
Energy: 0.5096255087731936
Energy: 0.4569994818640591
Energy: 0.4236993189419197
Energy: 0.4939941639839708
Energy: 0.44924572966720583
Energy: 0.44043154026275194
Energy: 0.44665730778465146
Energy: 0.465024696489577
Energy: 0.44378376618576476
Energy: 0.47292390197462464
Energy: 0.48737281878023714
Energy: 0.49984376480169873
Energy: 0.5458184539571099
Energy: 0.42511569666646365
Energy: 0.48452907032616627
Energy: 0.4557493992969828
Energy: 0.4281055178460842
Energy: 0.45535221615874444
Energy: 0.5026604575323763
Energy: 0.43812554215365096
Energy: 0.41793984353572805
Energy: 0.45320447977009887
Energy: 0.43272897790785575
Energy: 0.4239547755923716
Energy: 0.45526917954756063
Energy: 0.45092892017603253
Energy: 0.4274236641203583
Energy: 0.42215617197456884
Energy: 0.45712864750062393
Energy: 0.432499396691479
Energy: 0.4433045927183702
Energy: 0.4467330617027377
Energy: 0.44651897245245126
Energy: 0.48899844671983167
Energy: 0.43265389907345947
Energy: 0.46801643317285235
Energy: 0.444976276320282
Energy: 0.4273828840885828
Energy: 0.430450763245732
Energy: 0.445990053067745
Energy: 0.440811766665446
Energy: 0.4324250440748563
Energy: 0.4659507098251545
Energy: 0.46769650563450293
Energy: 0.4301899944408357
Energy: 0.43834980110103144
Energy: 0.4487747366806644
Energy: 0.44701487123954253
Energy: 0.4228482308756577
Energy: 0.45379678986593885
Energy: 0.45533943837655605
Energy: 0.42407024453370873
Energy: 0.4488326330514102
Energy: 0.4548744077868533
Energy: 0.48814555959754385
Energy: 0.4717056497740886
Energy: 0.4528482660203721
Energy: 0.5085051736035915
Energy: 0.44274442615547605
Energy: 0.46806843810240295
Energy: 0.4973467992547801
Energy: 0.44469799160016005
Energy: 0.438444231405118
Energy: 0.4574722337364456
Energy: 0.4554106459231818
Energy: 0.4271676541227597
Energy: 0.4301960163457092
Energy: 0.4564807795890886
Energy: 0.4727970101884046
Energy: 0.43271509134674313
Energy: 0.5101037916234795
Energy: 0.44321854352412765
Energy: 0.5255064050575892
Energy: 0.5295860979677869
Energy: 0.4993566804010326
Energy: 0.5282826772869719
Energy: 0.43983630481444896
Energy: 0.4468109148356219
Energy: 0.5087178863765055
Energy: 0.4604355893487739
Energy: 0.445743089390659
Energy: 0.4416150944775594
Energy: 0.5259317336140953
Energy: 0.47356812290104994
Energy: 0.45115328482705475
Energy: 0.43138766831181224
Energy: 0.46462729845948403
Energy: 0.46535650030004383
Energy: 0.4477960162674716
Energy: 0.44055512909316163
Energy: 0.42171967881761296
Energy: 0.5045904544877077
Energy: 0.4428220328947728
Energy: 0.5511928071062097
Energy: 0.5459343040076895
Energy: 0.5120355558818163
Energy: 0.5449053757291047
Energy: 0.46320232066733275
Energy: 0.46686547573633874
Energy: 0.45525694544953127
Energy: 0.4282954361865774
Energy: 0.4651860202007623
Energy: 0.4548646026410574
Energy: 0.4380435387049167
Energy: 0.448189740265326
Energy: 0.4548885467311557
Energy: 0.4331771007398608
Energy: 0.43736149249774514
Energy: 0.4445728450773618
Energy: 0.4492059655479644
Energy: 0.42733954289118314
Energy: 0.4537978485416009
Energy: 0.46853243744846074
Energy: 0.4424639825914649
Energy: 0.4430949269240783
Energy: 0.4472219538226974
Energy: 0.4411562548460104
Energy: 0.4277760505080758
Energy: 0.42152156540805436
Energy: 0.4526899821307262
Energy: 0.46810977316610947
Energy: 0.4283293194104146
Energy: 0.42753054325653317
Energy: 0.4467712847854577
Energy: 0.44646508804752205
Energy: 0.4320241455794084
Energy: 0.46566629618863303
Energy: 0.46864292074728564
Energy: 0.4173806415320346
Energy: 0.43838608403258705
Energy: 0.4474026527388629
Energy: 0.4696041852952646
Energy: 0.44422639454215807
Energy: 0.46284887922716006
Energy: 0.46513236199322827
Energy: 0.4219650334048526
Energy: 0.44897687939247777
Energy: 0.45435049988024506
Energy: 0.4888829715494837
Energy: 0.4305780394522425
Energy: 0.45303783840691514
Energy: 0.4591226535298521
Energy: 0.4283980666546496
Energy: 0.44550217270655673
Energy: 0.4481737588415409
Energy: 0.5455761101862616
Energy: 0.460708108687702
Energy: 0.5193860143624571
Energy: 0.4567087406521705
Energy: 0.4859154136762953
Energy: 0.45610819054516183
Energy: 0.4472974488315069
Energy: 0.4752258721964528
Energy: 0.4325751025570863
Energy: 0.48152619425048476
Energy: 0.4426817078538052
Energy: 0.5266556680632986
Energy: 0.5273312674242095
Energy: 0.5078557715446663
Energy: 0.5258716106793684
Energy: 0.47739891861401795
Energy: 0.443718985677362
Energy: 0.43159805346948804
Energy: 0.4727218739078449
Energy: 0.4622667690053075
Energy: 0.4376329565980254

minimum gb energy = 0.4173806415320346 eV
minimum distance =  2.585932304272 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.5340957276312608
Energy: 0.49527876294737766
Energy: 0.5770695186611373
Energy: 0.48655327502382695
Energy: 0.5402303267196499
Energy: 0.5344130836130424
Energy: 0.4755550705827256
Energy: 0.502617630106701
Energy: 0.5173674145065114
Energy: 0.4914819976523254
Energy: 0.45993058057722414
Energy: 0.5597410957322281
Energy: 0.5352334328132986
Energy: 0.5332274635432379
Energy: 0.5415444584238732
Energy: 0.47765507351999065
Energy: 0.5093503895106778
Energy: 0.50822090051066
Energy: 0.5481025177842282
Energy: 0.5053368530665485
Energy: 0.4744460789616899
Energy: 0.5279202402890759
Energy: 0.4823232323847412
Energy: 0.5368016650171005
Energy: 0.5512704666430905
Energy: 0.5449989484893385
Energy: 0.5343650500798028
Energy: 0.5224228145773916
Energy: 0.4329522030445357
Energy: 0.5384174162362935
Energy: 0.5091751457934774
Energy: 0.48945598405602214
Energy: 0.4726446937973859
Energy: 0.50494382012834
Energy: 0.5246622338479282
Energy: 0.4755597935976061
Energy: 0.4925394433140578
Energy: 0.521310927729104
Energy: 0.4685164651801039
Energy: 0.4849217455412096
Energy: 0.5011120016889783
Energy: 0.5003822039675071
Energy: 0.49065890294658593
Energy: 0.44041363549268725
Energy: 0.5181796753420189
Energy: 0.4988510074832669
Energy: 0.5190022030958333
Energy: 0.5002312514754639
Energy: 0.48724883258161034
Energy: 0.4808385077345798
Energy: 0.4451682182227066
Energy: 0.4412143502918443
Energy: 0.5077994780563748
Energy: 0.5125713984121534
Energy: 0.468641930890219
Energy: 0.45837186442635897
Energy: 0.4437348914599349
Energy: 0.48323104356106955
Energy: 0.4805678411264734
Energy: 0.4379277845719354
Energy: 0.5180607110029558
Energy: 0.5543034027800573
Energy: 0.47773356087601404
Energy: 0.5240477390498935
Energy: 0.46980622964190155
Energy: 0.4603468724319802
Energy: 0.4485823717007285
Energy: 0.4470526587128625
Energy: 0.48091797056349567
Energy: 0.4505205226839057
Energy: 0.47629537904673436
Energy: 0.45004339871947846
Energy: 0.4548033046341822
Energy: 0.43756897883571055
Energy: 0.4658064002177158
Energy: 0.4963812265884219
Energy: 0.49006294707406206
Energy: 0.4526878828102473
Energy: 0.4395152954290192
Energy: 0.5018392346760938
Energy: 0.5141337178448258
Energy: 0.4897652198510392
Energy: 0.5221780275018458
Energy: 0.4439786119551288
Energy: 0.5050376926258976
Energy: 0.43532199155845774
Energy: 0.46561082109369933
Energy: 0.4665215945273103
Energy: 0.4639868244637492
Energy: 0.46728672807772703
Energy: 0.4401581403544933
Energy: 0.503712810347438
Energy: 0.4449505823318304
Energy: 0.4927264339371012
Energy: 0.4599926164500738
Energy: 0.45184595672805744
Energy: 0.496122682033666
Energy: 0.4584376183756514
Energy: 0.4516955373848901
Energy: 0.5287914273494492
Energy: 0.4821339215698926
Energy: 0.46519531849412094
Energy: 0.45833569076712405
Energy: 0.48377520521479467
Energy: 0.46990082100178177
Energy: 0.43122323015616193
Energy: 0.4504887462276444
Energy: 0.48641718273052403
Energy: 0.48000416301032006
Energy: 0.48099293577758767
Energy: 0.5058549505148008
Energy: 0.5175717894337313
Energy: 0.5061536887669071
Energy: 0.5057062408336154
Energy: 0.51243613826528
Energy: 0.5153647192453485
Energy: 0.5202361130861536
Energy: 0.5367073863801716
Energy: 0.5160116940611151
Energy: 0.48205956668490124
Energy: 0.49534569151661134
Energy: 0.5144882701216823
Energy: 0.5173194749950177
Energy: 0.5236892080551312
Energy: 0.4566667674180695
Energy: 0.5252245008301705
Energy: 0.46486173909741196
Energy: 0.4745648668513853
Energy: 0.5170198122832468
Energy: 0.4956699061540768
Energy: 0.4687134768256745
Energy: 0.48376742067065576
Energy: 0.5136932639639752
Energy: 0.5388943236617655
Energy: 0.49070634202829466
Energy: 0.5439540490135664
Energy: 0.5858363394538129
Energy: 0.5409379778547333
Energy: 0.5336105175353915
Energy: 0.5547450162863754
Energy: 0.5583869614484259
Energy: 0.45563602817966375
Energy: 0.48599209465347115
Energy: 0.48975513506888557
Energy: 0.5428215298175962
Energy: 0.526395682341577
Energy: 0.46535790843700287
Energy: 0.5595411429699927
Energy: 0.44292229094538177
Energy: 0.5148739218999008
Energy: 0.47172484804934084
Energy: 0.5413988752455221
Energy: 0.5264782911254969
Energy: 0.5608421427686708
Energy: 0.5325267238275606
Energy: 0.5478092693828261
Energy: 0.5764312010623146
Energy: 0.5517777990935918
Energy: 0.5399700984976088
Energy: 0.5340008368484638
Energy: 0.489775005766327
Energy: 0.5223261410769551
Energy: 0.5185593783746595
Energy: 0.4691818810441071
Energy: 0.492795210700425
Energy: 0.49679047979557145
Energy: 0.4564757614576845
Energy: 0.5070715590794258
Energy: 0.4833462615389809
Energy: 0.4771416565603548
Energy: 0.5090820437929117
Energy: 0.5010219279129919
Energy: 0.5393482273757831
Energy: 0.5031576093202306
Energy: 0.5427194334242689
Energy: 0.5289365487799438
Energy: 0.4934314939672766
Energy: 0.5327536047529401
Energy: 0.5537113990406028
Energy: 0.5205449054758897
Energy: 0.5364675402684893
Energy: 0.5016776677212222
Energy: 0.4538294074089552
Energy: 0.4680804693264822
Energy: 0.5240305329742806
Energy: 0.4900336331872106
Energy: 0.46822698823979747
Energy: 0.48574086645766185
Energy: 0.5233353871254807
Energy: 0.47547781024398433
Energy: 0.4722195085043941
Energy: 0.5215646174179818
Energy: 0.4694140123133544
Energy: 0.48488856731993607
Energy: 0.5013924102827686
Energy: 0.519916764170169
Energy: 0.49217015920918256
Energy: 0.4382783039242085
Energy: 0.490968907977321
Energy: 0.4975489337208296
Energy: 0.4980934835273289
Energy: 0.5077756233463989
Energy: 0.4973652473186927
Energy: 0.5038377114403638
Energy: 0.4449886970469642
Energy: 0.46567608958032625
Energy: 0.4468766753606357
Energy: 0.4927294676176953
Energy: 0.44144982050408943
Energy: 0.4476886088827179
Energy: 0.4327731329879633
Energy: 0.46905928014549375
Energy: 0.4813285564086742
Energy: 0.4630913112424477
Energy: 0.4962626637338875
Energy: 0.5013574985571742
Energy: 0.4744477519714014
Energy: 0.4546854042130863
Energy: 0.4694329734922428
Energy: 0.4402969305072879
Energy: 0.447019476766238
Energy: 0.4468295157074164
Energy: 0.4533755772745548
Energy: 0.449982540953441
Energy: 0.4747692331630898
Energy: 0.4496718387716811
Energy: 0.45484896598441177
Energy: 0.47107432157631174
Energy: 0.46610079615232336
Energy: 0.46402579055330656
Energy: 0.4747531456507669
Energy: 0.43863266026135234
Energy: 0.4393956689292256
Energy: 0.5013383399266977
Energy: 0.5025163426742947
Energy: 0.5173825836981615
Energy: 0.5230360743568715
Energy: 0.4754400328730673
Energy: 0.5073636228358076
Energy: 0.4407270046481485
Energy: 0.46594480254088017
Energy: 0.48056446321198093
Energy: 0.4796716758659804
Energy: 0.4734417014547007
Energy: 0.440510688896346
Energy: 0.5028029705241128
Energy: 0.44881322183365224
Energy: 0.4935500419321106
Energy: 0.4717489602420685
Energy: 0.44625051919627734
Energy: 0.4900048083493745
Energy: 0.4786486359551062
Energy: 0.46774007054750394
Energy: 0.49082115923437725
Energy: 0.5162832211997463
Energy: 0.43902660835097995
Energy: 0.46447141474258813
Energy: 0.48353402008677543
Energy: 0.4690414501457455
Energy: 0.4321595111438939
Energy: 0.4507439218550064
Energy: 0.4895389441697248
Energy: 0.4793036352768875
Energy: 0.4711328620743048
Energy: 0.48100302781181037
Energy: 0.500099905862854
Energy: 0.5047003055942689
Energy: 0.48821124975199487
Energy: 0.5115265179074575
Energy: 0.5156973366676002
Energy: 0.5206764306078278
Energy: 0.5059211104814614
Energy: 0.43710682602102024
Energy: 0.482820082198101
Energy: 0.48246089888442656
Energy: 0.5153429948779715
Energy: 0.5161735978655027
Energy: 0.5330384916020829
Energy: 0.45703815383826285
Energy: 0.4863116303935648
Energy: 0.5296005032465225
Energy: 0.5174174449263138
Energy: 0.5085427313749851
Energy: 0.5012845703609377
Energy: 0.47261046994322564
Energy: 0.46658399444517884
Energy: 0.5258118501685428
Energy: 0.5433095740310757
Energy: 0.5847368168779291
Energy: 0.5433410606617677
Energy: 0.48392141070954936
Energy: 0.5402421814821469
Energy: 0.5330990660216384
Energy: 0.4979707871002029
Energy: 0.5582082762410174
Energy: 0.4920189246188808
Energy: 0.48662141074251647
Energy: 0.4761120590953622
Energy: 0.5429277208231668
Energy: 0.5264994998594867
Energy: 0.4664606904692999
Energy: 0.5587620016650059
Energy: 0.5025509891528119
Energy: 0.5137461766849928
Energy: 0.5236306561486427
Energy: 0.5419128965418377
Energy: 0.5262108020540263
Energy: 0.5172311115333852
Energy: 0.5293708694951815
Energy: 0.4695622596294681
Energy: 0.5743680411197117
Energy: 0.5431755281977662
Energy: 0.5039277601780815
Energy: 0.533842422062685
Energy: 0.5166342755408376

minimum gb energy = 0.43122323015616193 eV
minimum distance =  2.53917762021424 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.47163799597773487
Energy: 0.4593560899070331
Energy: 0.4162743046963704
Energy: 0.4159520566838251
Energy: 0.4165977428565253
Energy: 0.4175963882395283
Energy: 0.4600787040889936
Energy: 0.4742259350310833
Energy: 0.49846698061623534
Energy: 0.41622288418150366
Energy: 0.4167130768285775
Energy: 0.41658444138677525
Energy: 0.4163767770022301
Energy: 0.49816831073538775
Energy: 0.45568700210137647
Energy: 0.4985130190562554
Energy: 0.4164413235678826
Energy: 0.4160264108500568
Energy: 0.41607491743349184
Energy: 0.41616894782395547
Energy: 0.4168853373679082
Energy: 0.45623344069283367
Energy: 0.49886379140001536
Energy: 0.4161225493333029
Energy: 0.41581318374994497
Energy: 0.4156655457627629
Energy: 0.41621083406033793
Energy: 0.41740633712576236
Energy: 0.47360295418936854
Energy: 0.4987242834309618
Energy: 0.45266273906166715
Energy: 0.49896563784534403
Energy: 0.41712556154854097
Energy: 0.45563797299184694
Energy: 0.49868301564712597
Energy: 0.45924703961935687
Energy: 0.4979032310638854
Energy: 0.41592693434808253
Energy: 0.41625098858045007
Energy: 0.4157627253881377
Energy: 0.4156221470531225
Energy: 0.46049112128504943
Energy: 0.4561341445598583
Energy: 0.49838588959499197
Energy: 0.451748456626761
Energy: 0.41666031154691113
Energy: 0.4165532522557743
Energy: 0.41632290279550227
Energy: 0.49834232353519325
Energy: 0.45568107394423707
Energy: 0.49817073851451205
Energy: 0.41626574351169626
Energy: 0.41619440762374216
Energy: 0.4162964585893055
Energy: 0.4162355194500179
Energy: 0.49832403137998366
Energy: 0.45743326000786866
Energy: 0.4982843277198573
Energy: 0.41584951606316123
Energy: 0.41597725920941864
Energy: 0.4156122676429824
Energy: 0.41587176093408396
Energy: 0.4609904850141103
Energy: 0.4734706942849469
Energy: 0.4989871766498118
Energy: 0.4537902650444464
Energy: 0.499351076814471
Energy: 0.49814114781173957
Energy: 0.4535235694479489
Energy: 0.498378815417582
Energy: 0.45668486194648494
Energy: 0.4980413569550716
Energy: 0.41632225657552674
Energy: 0.4156300934245058
Energy: 0.4157101641494927
Energy: 0.4159981905257025
Energy: 0.46157325667345095
Energy: 0.45577880788824554
Energy: 0.497706608189301
Energy: 0.41634698145399535
Energy: 0.41655511242172427
Energy: 0.4161626760030822
Energy: 0.4165949923545372
Energy: 0.4981950936991046
Energy: 0.45628508697793363
Energy: 0.498331234490098
Energy: 0.41637428129339676
Energy: 0.4162509990825466
Energy: 0.41661739882091736
Energy: 0.4161213774049029
Energy: 0.498494888346219
Energy: 0.4598660900476085
Energy: 0.4981680266481923
Energy: 0.4157675862268056
Energy: 0.41578190726806563
Energy: 0.41611035067119995
Energy: 0.4157507656630369
Energy: 0.46012531769291753
Energy: 0.47370720974043473
Energy: 0.49874062810274544
Energy: 0.4219864773290911
Energy: 0.41673148490977097
Energy: 0.4166256703484553
Energy: 0.41658471946652753
Energy: 0.49852270467217846
Energy: 0.4559503212058293
Energy: 0.49899919944217636
Energy: 0.41628130417104503
Energy: 0.4157689580996109
Energy: 0.4162075742426094
Energy: 0.41612135934228633
Energy: 0.4172600440066864
Energy: 0.45581975618665077
Energy: 0.4980325999545027
Energy: 0.4159524430795136
Energy: 0.4159255022609274
Energy: 0.4163245361792546
Energy: 0.4164192220691243
Energy: 0.41686223223845026
Energy: 0.4738711550526267
Energy: 0.49846743650970937
Energy: 0.41624630912968263
Energy: 0.41660770253250934
Energy: 0.4168903388202485
Energy: 0.4162898910376238
Energy: 0.4986351844326584
Energy: 0.4626529645106544
Energy: 0.49694718813006605
Energy: 0.4158402013436237
Energy: 0.4159915974113017
Energy: 0.41618635812933086
Energy: 0.41591577261496654
Energy: 0.460028872911716
Energy: 0.4568320169186379
Energy: 0.4985179435113095
Energy: 0.41616067860191047
Energy: 0.41662340415727567
Energy: 0.4163442126245543
Energy: 0.4167251445599102
Energy: 0.49828313724757

minimum gb energy = 0.4156122676429824 eV
minimum distance =  2.68886857121185 Angstroms
sigma value = 23