Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Cu__MO_390178379548_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.620386697351933
cohesive_energy=3.54027843853772
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.516529077676262e-19, 2.1862661476910397e-19, 2.7044100711266395e-19, 3.1294995756595197e-19, 3.48872359876866e-19, 3.79760723203752e-19, 4.06613203589592e-19, 4.30118736987006e-19, 4.50782009035704e-19, 4.68982735597944e-19, 4.85020523704284e-19, 4.991356998498239e-19, 5.11523729583912e-19, 5.223464327465819e-19, 5.31741596528358e-19, 5.39824577646888e-19, 5.46699517583382e-19, 5.52451331699442e-19, 5.57160128826768e-19, 5.608915982073539e-19, 5.637066225532919e-19, 5.656596758701379e-19, 5.66798823456912e-19, 5.67170528436e-19, 5.66773188630768e-19, 5.65486640793666e-19, 5.631570759678299e-19, 5.596002438403499e-19, 5.54595044035734e-19, 5.4788032176264e-19, 5.391404482241699e-19, 5.27994105381432e-19, 5.139814685404679e-19, 4.9653857152610995e-19, 4.749732740324699e-19, 4.48426809383724e-19, 4.15833730118262e-19, 3.75848207863524e-19, 3.26767128857568e-19, 2.6639711328844797e-19, 1.9190391069061798e-19, 9.955557103050179e-20, -1.562469890479578e-20, -1.6037307453349796e-19, -3.4398892549643398e-19, -5.795793864663299e-19, -8.8605174390102e-19, -1.291511380314132e-18, -1.8391065146359197e-18, -2.59781725966662e-18, -3.6835482774630596e-18, -5.3035731591658195e-18, -7.85933328218994e-18, -1.221807083675328e-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: 0.013614153977626022
Energy: 0.5282225026308566
Energy: 0.013923409649619776
Energy: 0.013782843968811482
Energy: 0.5294481709938365
Energy: 0.013890902781262406
Energy: 0.5282225027650291
Energy: 0.10396708931441928
Energy: 0.3161916444790634
Energy: 0.8243696779232587
Energy: 0.3161886301471543
Energy: 0.31602324972326384
Energy: 0.013923409649619776
Energy: 0.3161916444790634
Energy: 0.10498973240344614
Energy: 0.013926880475743933
Energy: 0.317494664111183
Energy: 0.10468154887384848
Energy: 0.013782843969402093
Energy: 0.8243696779263159
Energy: 0.013926880475743933
Energy: 0.0138767515098946
Energy: 0.8197034645948084
Energy: 0.013863377985974484
Energy: 0.5294153325182348
Energy: 0.3161886301471543
Energy: 0.3174946641114957
Energy: 0.819703464598769
Energy: 0.5835578933653394
Energy: 0.31766715904645304
Energy: 0.01389090278154034
Energy: 0.31602324972538304
Energy: 0.10468154887263252
Energy: 0.013863377985974484
Energy: 0.3176671590458277
Energy: 0.014058057111751478

minimum gb energy = 0.013614153977626022 eV
minimum distance =  2.55570659458562 Angstroms
sigma value = 1


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

Energy: 1.1203799490495248
Energy: 1.3043615583690364
Energy: 1.0410493623866233
Energy: 1.1220889832926682
Energy: 1.3058613956139935
Energy: 1.0380919157095712
Energy: 1.1090131239144712
Energy: 0.7895257668228164
Energy: 0.7882852053111258
Energy: 0.9940012833194188
Energy: 0.7892308458185879
Energy: 0.772826826579563
Energy: 1.1225107164200288
Energy: 0.807303924781894
Energy: 0.7918038284812448
Energy: 1.1230716554194704
Energy: 0.807032675440054
Energy: 0.7625112581183566
Energy: 1.2155824935018629
Energy: 1.1512225149050916
Energy: 0.9971894947839857
Energy: 1.2175977818410564
Energy: 0.9729607574545265
Energy: 0.9935049563120033
Energy: 1.0305443997219055
Energy: 0.8246361028809305
Energy: 0.8545778645014157
Energy: 1.0602324060025579
Energy: 0.8911067194844178
Energy: 0.8530438039643986
Energy: 1.0026153996750153
Energy: 0.8140310630273537
Energy: 0.839710125240743
Energy: 1.0045064115313944
Energy: 0.8685742413081913
Energy: 0.816375028089619
Energy: 1.0141174562170459
Energy: 0.9649781782183959
Energy: 0.8886342696486422
Energy: 1.0154430476269116
Energy: 0.9772007007200463
Energy: 0.8465648897282246
Energy: 0.966085633903993
Energy: 0.8849113944723463
Energy: 0.8900238799382614
Energy: 0.9662974730005417
Energy: 0.978767278542521
Energy: 0.9168114487427175
Energy: 0.8595964741599088
Energy: 0.8136809787480671
Energy: 0.8142215140865015
Energy: 0.8596989780416899
Energy: 0.9837249377156037
Energy: 0.8148577154083073
Energy: 0.8942692734510114
Energy: 0.861550325456932
Energy: 0.8374822223515875
Energy: 0.8957884711856553
Energy: 0.8612052155479264
Energy: 0.8755171923918716
Energy: 1.1658540642413626
Energy: 0.9448097162822953
Energy: 0.9446201572288895
Energy: 1.1099238512680396
Energy: 1.1246255401709273
Energy: 1.0454041672548142
Energy: 0.8074698154951027
Energy: 0.777502770634156
Energy: 0.7775047806371518
Energy: 0.7880592428184341
Energy: 0.9078386753244129
Energy: 0.7635010167213473
Energy: 0.7889212606846788
Energy: 0.7908213304389936
Energy: 0.8064037679515994
Energy: 0.7889366478570167
Energy: 1.0760299628938557
Energy: 0.7734530014428901
Energy: 1.32437165718546
Energy: 0.9927850532828985
Energy: 0.9924899139080677
Energy: 1.326428604547084
Energy: 1.2151202257541602
Energy: 1.1278495608746906
Energy: 0.821863861273312
Energy: 0.807201251747463
Energy: 0.792568642354952
Energy: 0.8220408474191683
Energy: 0.875409364203694
Energy: 0.8189235057601546
Energy: 0.8376091855946608
Energy: 0.778136713292738
Energy: 0.7793809323678837
Energy: 0.8380856486867555
Energy: 0.8714766409014478
Energy: 0.7855708406423184
Energy: 1.0353627458525831
Energy: 0.9162731993381228
Energy: 0.9160979615523238
Energy: 1.0352569424970424
Energy: 1.0505724877850906
Energy: 0.926248280667293
Energy: 0.9350186285989265
Energy: 0.868221824022709
Energy: 0.884404515337724
Energy: 0.933749816132427
Energy: 0.9386083018397978
Energy: 0.860410832393671
Energy: 0.9622476111775579
Energy: 0.8388030776634464
Energy: 0.8388797335415865
Energy: 0.9640843960992858
Energy: 0.9534667388613122
Energy: 0.8382862714462055
Energy: 1.0319697152062843
Energy: 0.8245823879752694
Energy: 0.8688479683962397
Energy: 1.0625508398810999
Energy: 0.9657245553844023
Energy: 0.9192146963817358
Energy: 1.123063643760412
Energy: 1.0268331718389185
Energy: 0.9466431412510111
Energy: 1.125050761869647
Energy: 0.9929408306243632
Energy: 0.9518570849560642
Energy: 1.0672113903923899
Energy: 0.8268456828303926
Energy: 0.8190837026872679
Energy: 1.0691868539706757
Energy: 0.8296629190242508
Energy: 0.7788460036327975
Energy: 1.0945850102990566
Energy: 0.8185785376248363
Energy: 0.8185219926888955
Energy: 1.0596250428519605
Energy: 0.8223199256042785
Energy: 0.8184164939499644

minimum gb energy = 0.7625112581183566 eV
minimum distance =  2.31820843545906 Angstroms
sigma value = 33


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

Energy: 1.3012382002698433
Energy: 1.1187640362565612
Energy: 0.9996691556065019
Energy: 1.216244305475334
Energy: 1.0943898367852924
Energy: 1.0600170777868183
Energy: 1.2141889344928278
Energy: 0.8016846202576057
Energy: 0.8128939925647474
Energy: 1.1368617936178245
Energy: 0.8020904466300447
Energy: 0.8479146698700516
Energy: 1.0818344600692602
Energy: 0.8741927426126608
Energy: 0.8286941793362005
Energy: 1.0828300901722345
Energy: 0.8212139071149289
Energy: 0.9010790008605436
Energy: 1.0983766214315551
Energy: 0.962664631465962
Energy: 0.958199537847167
Energy: 1.0969737894284843
Energy: 0.9589650453103806
Energy: 0.966122497018932
Energy: 1.1836232107564868
Energy: 0.9211425954677225
Energy: 0.9118555363909587
Energy: 1.1590641169497429
Energy: 0.9284049427230783
Energy: 0.9162832249336518
Energy: 1.1227243629304775
Energy: 0.9417536440581387
Energy: 0.9388803638794484
Energy: 1.10181894360954
Energy: 0.9491029585784525
Energy: 0.8896108136972267
Energy: 1.0756388232939242
Energy: 1.072199518992602
Energy: 0.9256391131042746
Energy: 1.0650534097944355
Energy: 1.0770835273071775
Energy: 0.9081751297655459
Energy: 1.082334451065026
Energy: 0.8901748248299564
Energy: 0.8904476508069245
Energy: 1.0314471804723884
Energy: 0.9292447831860535
Energy: 0.8965678128408916
Energy: 0.929065350360653
Energy: 0.9054792230577694
Energy: 0.9180921810858058
Energy: 0.927959419621505
Energy: 0.9711493666772639
Energy: 0.9334460320176706
Energy: 0.9655735424210651
Energy: 0.9181865386225483
Energy: 0.9685106200104214
Energy: 0.9645971732704264
Energy: 0.949476450167348
Energy: 0.9615670721069899
Energy: 1.2049031740587166
Energy: 0.9970556140587217
Energy: 0.9971870732332093
Energy: 1.0061331788757975
Energy: 1.21940967992889
Energy: 0.9972694437935807
Energy: 0.9129634459277028
Energy: 0.8396709423711429
Energy: 0.9047744451497277
Energy: 0.8826945035054423
Energy: 1.07531917235025
Energy: 0.9351351076764669
Energy: 0.8829437474482625
Energy: 0.9115215453622458
Energy: 0.8808088256912598
Energy: 0.8827974547886618
Energy: 0.8613444239095287
Energy: 0.889160468533331
Energy: 1.2144977133753871
Energy: 0.9653748438654562
Energy: 0.9659600730599857
Energy: 1.2170701125270034
Energy: 1.098900445535638
Energy: 0.9653261066349964
Energy: 0.9414514692387908
Energy: 0.9932570149752684
Energy: 0.9298227614745921
Energy: 0.9359716408242756
Energy: 1.118093516179831
Energy: 0.9148764109640574
Energy: 0.9527442838066134
Energy: 0.9048145302919861
Energy: 0.8888423630804699
Energy: 0.9326154812325227
Energy: 1.0989046019813853
Energy: 0.8793747909862054
Energy: 1.095385000957322
Energy: 0.9208146209277767
Energy: 1.0140117605039607
Energy: 1.0855069119219205
Energy: 1.0547163613956094
Energy: 1.011190002838184
Energy: 0.929016752698246
Energy: 0.9339379268259462
Energy: 0.9325688285738922
Energy: 0.9290074753491879
Energy: 0.9738872112289598
Energy: 0.8918954741295942
Energy: 0.97703294095237
Energy: 0.8292471082537213
Energy: 0.9382994993266516
Energy: 0.9791659979799389
Energy: 0.9201646620721288
Energy: 0.8332071244304317
Energy: 1.1088121326904574
Energy: 0.8489836813565117
Energy: 0.9371992018310609
Energy: 1.103788358003992
Energy: 0.8953800690923466
Energy: 0.837312946361938
Energy: 1.2169713906364477
Energy: 0.9834045102165253
Energy: 1.0605945789558782
Energy: 1.3058746839792104
Energy: 1.0070527088628263
Energy: 0.9971204450669734
Energy: 1.1438881406407377
Energy: 0.8297939116402524
Energy: 0.8303142272062176
Energy: 1.216893614186315
Energy: 0.8300009560446221
Energy: 0.7688204967372038
Energy: 1.0163993939034766
Energy: 0.8139934065124622
Energy: 0.8751492728971512
Energy: 1.0172609064268512
Energy: 0.8753774570269656
Energy: 0.7789203732499346
Energy: 1.0954673419412417
Energy: 1.3243424398221393
Energy: 1.3401895176806315
Energy: 1.0971448213573476
Energy: 1.3326081541630395
Energy: 0.9653880029443673
Energy: 1.0180395431014524
Energy: 0.9214175838780302
Energy: 0.890395305488316
Energy: 1.0683386980496994
Energy: 0.928030741484049
Energy: 0.8703363465848589
Energy: 1.1154190103493118
Energy: 0.9324847833766486
Energy: 0.9361028339030906
Energy: 1.103435077148621
Energy: 0.9371373319380735
Energy: 0.8899203221489314
Energy: 1.1405759672149207
Energy: 1.0488286420696356
Energy: 0.9999454210666027
Energy: 1.1203096047649883
Energy: 1.0635671387331733
Energy: 1.0040233819170072
Energy: 1.044674927171721
Energy: 0.906825237292033
Energy: 0.92077769910343
Energy: 1.0231164165491962
Energy: 0.9920399127808838
Energy: 1.0042412826869584
Energy: 0.9598072044781552
Energy: 0.8988120111533484
Energy: 0.8887231702284643
Energy: 0.9604598061718513
Energy: 0.9614379526870528
Energy: 0.9139113163359259
Energy: 0.9638450315539338
Energy: 0.8998251974524986
Energy: 0.9347543457484663
Energy: 0.9645327644710258
Energy: 0.9177358092493916
Energy: 0.9593890607640708
Energy: 1.023654724755732
Energy: 0.9975851707949197
Energy: 0.997482709092621
Energy: 1.0299321238260728
Energy: 1.2144625487998966
Energy: 0.9973680057375991
Energy: 0.9216407757449241
Energy: 0.7909074395208182
Energy: 0.7464282503691001
Energy: 0.920503955062944
Energy: 1.150206449814224
Energy: 0.8828770473253533
Energy: 0.8833569019127715
Energy: 0.9117211562750979
Energy: 0.8900155808537605
Energy: 0.8837166544074202
Energy: 1.0070497205870563
Energy: 0.8916841598803634
Energy: 1.2148676009988522
Energy: 0.9655675084015998
Energy: 0.9656795631810474
Energy: 1.2165430502574672
Energy: 1.0987330333819256
Energy: 0.9649436339956776
Energy: 0.9454965590800497
Energy: 0.9585937470818658
Energy: 0.9325318679701835
Energy: 0.9337800092688331
Energy: 0.9251515995146923
Energy: 0.9128803784176389
Energy: 0.944532676745006
Energy: 0.8930785946722098
Energy: 0.8791733697090648
Energy: 0.9339932903172317
Energy: 1.0981518472655538
Energy: 0.9224864729477575
Energy: 1.1096967556548167
Energy: 1.0134482887173601
Energy: 1.0128380620820592
Energy: 1.0663772668131943
Energy: 1.1228168612505964
Energy: 1.012990746978954
Energy: 0.9786603009237654
Energy: 0.9469320240438188
Energy: 0.9502631496488175
Energy: 0.9810935227191675
Energy: 0.9413129875587377
Energy: 0.9574807768361357
Energy: 0.9299795140668246
Energy: 0.929395179959633
Energy: 0.8415013875385813
Energy: 0.928894516387452
Energy: 0.8971687032345571
Energy: 0.8925353539781589
Energy: 1.134182113384981
Energy: 0.9135146187044947
Energy: 0.852846006476802
Energy: 0.9828132854813634
Energy: 0.8619306988102895
Energy: 0.9484804883353166
Energy: 1.1263329189571882
Energy: 0.9777667601459583
Energy: 0.9855001497468692
Energy: 1.052501999844904
Energy: 0.9450376331508373
Energy: 0.8282722543280413

minimum gb energy = 0.7464282503691001 eV
minimum distance =  2.3323925005537 Angstroms
sigma value = 51


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

Energy: 1.1411393484473367
Energy: 7.5099615515358815
Energy: 1.2164427839766465
Energy: 1.143963925893787
Energy: 1.3429565500096503
Energy: 0.9824859389730889
Energy: 1.0827499645508734
Energy: 0.8375203750849511
Energy: 0.8215578149142521
Energy: 0.9311608496644094
Energy: 0.8373882839529116
Energy: 0.7807920418738955
Energy: 1.0647397870533424
Energy: 0.8358026950423282
Energy: 0.836014138236353
Energy: 1.0653375046037215
Energy: 0.8360212251729076
Energy: 0.7489251616798598
Energy: 1.0420285792737112
Energy: 1.1042569027025013
Energy: 1.1042703549807578
Energy: 1.042550251316525
Energy: 1.0008097038424504
Energy: 0.9410660729687671
Energy: 0.9756189330207005
Energy: 0.86825736250143
Energy: 0.799877259106064
Energy: 0.9066754896911534
Energy: 0.9477423264195118
Energy: 0.799913044737562
Energy: 0.9633974053486877
Energy: 0.8465369942954654
Energy: 0.8921131339745183
Energy: 0.9632067890138002
Energy: 0.9223937002415229
Energy: 0.8273135684481745
Energy: 0.9507519455485861
Energy: 0.8146760795128783
Energy: 0.7702339755125159
Energy: 0.950487104440838
Energy: 1.0126204726788255
Energy: 0.850481093565469
Energy: 0.9706027379512061
Energy: 0.8483407887178491
Energy: 0.9844814544199512
Energy: 0.9645850280253317
Energy: 0.7249306552623421
Energy: 0.9841571670336985
Energy: 0.835942587314374
Energy: 0.8475386601789979
Energy: 0.8019711637202682
Energy: 0.8358330506730755
Energy: 1.1377662990224535
Energy: 0.7594232363273393
Energy: 0.8378007876459396
Energy: 0.7358202476439869
Energy: 0.7806173763465828
Energy: 0.8223190209400756
Energy: 0.7984063196683137
Energy: 0.8220617375624778
Energy: 0.8215038668575714
Energy: 1.1013211078587608
Energy: 1.101179813486538
Energy: 0.8224895193525488
Energy: 1.100531892585526
Energy: 1.1011644443437516
Energy: 0.8590104001171525
Energy: 0.7369019420512164
Energy: 0.7805395325742396
Energy: 0.8589618904679338
Energy: 1.0351825790677156
Energy: 0.7807421161268855
Energy: 0.8561139112125523
Energy: 0.8204148048702746
Energy: 0.7749759393418806
Energy: 0.8566504306103077
Energy: 1.0661237379059672
Energy: 0.854171106753408
Energy: 0.9358564048121668
Energy: 0.9424120642579836
Energy: 0.9421749527853152
Energy: 0.9358781910910611
Energy: 0.9670791054550187
Energy: 0.9417747249458114
Energy: 0.9959665938321014
Energy: 0.8379083228840318
Energy: 0.8451581189505443
Energy: 0.9969148430210337
Energy: 0.9518637997325441
Energy: 0.8463375264830275
Energy: 0.9406122019877826
Energy: 0.8977101404399345
Energy: 0.8557970728477129
Energy: 0.9406192813673324
Energy: 0.8875461084070266
Energy: 0.8948088041356451
Energy: 1.0790650635598713
Energy: 0.854414170118823
Energy: 0.8544333775524211
Energy: 1.0212612055393715
Energy: 0.8565467213321373
Energy: 0.8543376078730479
Energy: 1.1791529509904752
Energy: 0.8520884430421491
Energy: 0.7798417836062638
Energy: 1.180057979056065
Energy: 0.8592401314775517
Energy: 0.7376979205018976

minimum gb energy = 0.7249306552623421 eV
minimum distance =  2.39051833705516 Angstroms
sigma value = 19


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

Energy: 0.940516335651313
Energy: 1.140151920000136
Energy: 0.8590465134949056
Energy: 0.9434288257424593
Energy: 1.2200737411926825
Energy: 0.8616570826969555
Energy: 0.9068825089248989
Energy: 0.7798801935531438
Energy: 0.7798335451007402
Energy: 1.0179582200369965
Energy: 0.7801268663537638
Energy: 0.7795182556146789
Energy: 1.0458049715207671
Energy: 0.7803869681374367
Energy: 0.7803885792518477
Energy: 1.0453791737620717
Energy: 0.780375624231224
Energy: 0.7805783734666112
Energy: 0.8509207480750579
Energy: 0.8138151578203845
Energy: 0.8720682048975569
Energy: 0.8500579023087234
Energy: 0.8497869857021694
Energy: 0.8720074375816979
Energy: 0.9094778385898197
Energy: 0.7802896936772336
Energy: 0.7780795240787979
Energy: 0.9098442477684098
Energy: 0.7781707896531221
Energy: 0.7777292536159879
Energy: 0.8538280969610692
Energy: 0.7792586574700083
Energy: 0.7848285493369154
Energy: 0.8539454697874176
Energy: 0.779280821844028
Energy: 0.828366750299268
Energy: 0.8963194182000873
Energy: 0.7889685017591898
Energy: 0.7765357066557231
Energy: 0.8969376572401088
Energy: 0.848682522101094
Energy: 0.7769712352131621
Energy: 0.8497170404363071
Energy: 0.8604757378502083
Energy: 0.8603252898716942
Energy: 0.8495675130678056
Energy: 0.9418396877005165
Energy: 0.8604516435178492
Energy: 0.7805173930968689
Energy: 0.6749867848385724
Energy: 0.6744821137095498
Energy: 0.7804842381162471
Energy: 1.0125009462896184
Energy: 0.7217459970329779
Energy: 0.7797384513624629
Energy: 0.7011313342614844
Energy: 0.779834263491027
Energy: 0.7803680351220688
Energy: 0.9762666396337094
Energy: 0.7806173700254582
Energy: 1.1400823038407562
Energy: 0.849993979417688
Energy: 0.8238828709839949
Energy: 1.1407342312601225
Energy: 0.8518448095720651
Energy: 1.1843225688558288
Energy: 0.9014944041754275
Energy: 0.8147470707594893
Energy: 0.8141951928252052
Energy: 0.7796721519830991
Energy: 0.9168823140115012
Energy: 0.7461595848998359
Energy: 0.758125709253085
Energy: 0.7847505991248689
Energy: 0.7901013245921432
Energy: 0.7580641566533979
Energy: 0.9068282796127772
Energy: 0.82767894235931
Energy: 0.9067634836464245
Energy: 0.8277315629247921
Energy: 0.8282439636809803
Energy: 0.7869237114525662
Energy: 0.8540847012422328
Energy: 0.8281003801520654
Energy: 1.0121637010320346
Energy: 0.7460863399209324
Energy: 0.7461749536614862
Energy: 1.0150577024723506
Energy: 0.7463547299139873
Energy: 0.6745534058878621
Energy: 0.9415293434034769
Energy: 0.814047029014479
Energy: 0.8350922437039804
Energy: 0.9417859504240496
Energy: 0.8140710332593586
Energy: 0.8602432413256038
Energy: 0.9075524386847069
Energy: 0.7798287470112902
Energy: 0.7799342651579256
Energy: 0.974962188791868
Energy: 0.7801248723018945
Energy: 0.7796362000104972
Energy: 0.8702806241813065
Energy: 0.7803689689845567
Energy: 0.7803343511682747
Energy: 0.8700300936970685
Energy: 0.7803489724452061
Energy: 0.7468036431302655
Energy: 0.8498830112937763
Energy: 0.7805695332342161
Energy: 0.7461752149993301
Energy: 0.8499029785446122
Energy: 0.7465134097513892
Energy: 0.7458972341427322
Energy: 0.9068626375062246
Energy: 0.7579863500375661
Energy: 0.7776839353454483
Energy: 0.9068755583652185
Energy: 0.7580012254620818
Energy: 0.7765501007164313
Energy: 0.853135860201467
Energy: 0.7848845181022543
Energy: 0.8277111465292399
Energy: 0.8538954338134203
Energy: 0.8778359720880664
Energy: 0.827886099913411
Energy: 0.8961611322678351
Energy: 0.778358888696546
Energy: 0.7777051317047374
Energy: 0.8962062773843045
Energy: 0.9758864303821039
Energy: 0.7777556059875016
Energy: 0.849738994272378
Energy: 0.859712579958744
Energy: 0.8596887256046221
Energy: 0.8496938113574148
Energy: 0.9421112343155964
Energy: 0.8595577538357724
Energy: 0.7832346008357663
Energy: 0.7472689759260313
Energy: 0.7469912490023686
Energy: 0.7835393365542915
Energy: 1.0123570624158216
Energy: 0.7795644094249108
Energy: 0.7804215574962
Energy: 0.7008559365802123
Energy: 0.7805054288473254
Energy: 0.7803938300628643
Energy: 0.7025469939647156
Energy: 0.7805324946248617
Energy: 1.14215437324231
Energy: 0.8499500126562851
Energy: 0.8240581071273688
Energy: 1.1419249584996571
Energy: 0.8511225900029465
Energy: 1.18571099559676
Energy: 0.8964358354414489
Energy: 0.8370003560774345
Energy: 0.7772887105153587
Energy: 0.8963677521670866
Energy: 0.8720843935386698
Energy: 0.7778339726887614
Energy: 0.7788853020973012
Energy: 0.8282267747795956
Energy: 0.8282878325794807
Energy: 0.779751954829089
Energy: 0.8541602444382969
Energy: 0.7765359731836544
Energy: 0.9098690937510847
Energy: 0.777681411213571
Energy: 0.7772911762842405
Energy: 0.8484757875701633
Energy: 0.8890637159541536
Energy: 0.7758050449861473
Energy: 0.9415757647767211
Energy: 0.8720832544371157
Energy: 0.8352154256818476
Energy: 0.9418408731840905
Energy: 0.8496399858771964
Energy: 0.8604061606632056

minimum gb energy = 0.6744821137095498 eV
minimum distance =  2.33582787097701 Angstroms
sigma value = 27


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

Energy: 0.8011736401396385
Energy: 1.3458283913779698
Energy: 1.1513117649497957
Energy: 0.8036159984108484
Energy: 1.3458688071048903
Energy: 1.152034047701663
Energy: 0.8514518277491775
Energy: 0.7179159843652219
Energy: 0.7179967175187129
Energy: 0.7695169117195699
Energy: 0.7177781980083455
Energy: 0.7179039105880762
Energy: 0.7959206251660003
Energy: 0.7161489847575929
Energy: 0.7162943394115779
Energy: 0.7960071858129362
Energy: 0.7176585170554848
Energy: 0.7163690268047853
Energy: 1.1234460023072363
Energy: 0.6868674536703738
Energy: 0.6877944314939063
Energy: 1.1260911181405728
Energy: 0.8920391774107232
Energy: 0.7322971097078612
Energy: 0.8799364080901063
Energy: 0.7591264489227282
Energy: 0.7793403641836272
Energy: 0.8797688486350889
Energy: 0.8084346266936542
Energy: 0.6830800064652596
Energy: 0.7322431728260013
Energy: 0.7761409471591404
Energy: 0.776203963370587
Energy: 0.7321706976322112
Energy: 0.802943354170726
Energy: 0.7570190251768325
Energy: 0.7517516756662889
Energy: 0.6616969187181516
Energy: 0.6347042669476098
Energy: 0.7515102700159534
Energy: 0.7409717691537425
Energy: 0.752526835622054
Energy: 0.7183455254161492
Energy: 0.9657328161965515
Energy: 0.9664158905667727
Energy: 0.7183185761398723
Energy: 1.0808893152831627
Energy: 0.9321251690091846
Energy: 0.854040496197518
Energy: 0.7290774317628583
Energy: 0.7657249103229783
Energy: 0.8543934789851338
Energy: 1.0880421174051855
Energy: 0.6678110791928908
Energy: 0.7858189877072227
Energy: 0.6991793561281806
Energy: 0.6540079061620182
Energy: 0.7494876057086454
Energy: 0.7949832696032577
Energy: 0.7310734076989974
Energy: 0.7960738214384107
Energy: 0.7389542071325995
Energy: 0.7400049903604062
Energy: 0.7960889339967421
Energy: 0.7480577895718825
Energy: 0.7398489362686188
Energy: 0.7954604942799877
Energy: 0.7179838609474353
Energy: 0.7657398388150315
Energy: 0.7427474398470688
Energy: 0.7913043739815548
Energy: 0.7660653053875686

minimum gb energy = 0.6347042669476098 eV
minimum distance =  2.38428820796671 Angstroms
sigma value = 9


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

Energy: 1.2760448464644423
Energy: 1.4617933921107433
Energy: 1.1077035106233273
Energy: 1.2775387241206524
Energy: 1.5621481296997677
Energy: 1.0922190870339938
Energy: 0.7115863343398293
Energy: 0.6169236999538332
Energy: 0.6173105900553284
Energy: 0.5690116244638829
Energy: 0.617094655830616
Energy: 0.6689749903476542
Energy: 0.6195502178829286
Energy: 0.5987707280812401
Energy: 0.5987416731875841
Energy: 0.6431540562317675
Energy: 0.5990273345809193
Energy: 0.5739024602971934
Energy: 0.8326171183802922
Energy: 0.6194307406822102
Energy: 0.6483192454705133
Energy: 0.8117310863832842
Energy: 0.7365671145477094
Energy: 0.6444896776661845
Energy: 0.8111011568651282
Energy: 0.774972074126273
Energy: 0.5867635668999952
Energy: 0.8111539019024644
Energy: 0.8236355144720827
Energy: 0.6482284085087413
Energy: 0.618675368281221
Energy: 0.8590904189649521
Energy: 0.9344651120677347
Energy: 0.6186104498489672
Energy: 0.9503865068790003
Energy: 0.7353000426546707
Energy: 0.6126597641505791
Energy: 0.55797914466587
Energy: 0.6301291653757524
Energy: 0.6132292610656274
Energy: 0.8063763830673273
Energy: 0.61221937841903
Energy: 0.6005491416507586
Energy: 0.7515763040041069
Energy: 0.6737584081623554
Energy: 0.6007193763588795
Energy: 0.7971594509197674
Energy: 0.6008256735854451
Energy: 0.8226253184039319
Energy: 0.7237615610371091
Energy: 0.6088762698147258
Energy: 0.8237148186997123
Energy: 0.6914759720365065
Energy: 0.6343522924805473
Energy: 0.9705817935559617
Energy: 0.6430827025030867
Energy: 0.6312948543715436
Energy: 0.9719325972958948
Energy: 0.7084960154068501
Energy: 0.5786353449439487
Energy: 0.9148627455144667
Energy: 0.6006563229905892
Energy: 0.6008630240928282
Energy: 0.6446556049287603
Energy: 0.6008333127501518
Energy: 0.6011371509414719
Energy: 0.8222750340748999
Energy: 0.6202246378514025
Energy: 0.6181722299815494
Energy: 0.8236805001604637
Energy: 0.6197480242786024
Energy: 0.6186579865949517
Energy: 1.1136555082523771
Energy: 1.1714400302975096
Energy: 0.9682456278903789
Energy: 1.115464631370818
Energy: 1.1713533239309166
Energy: 0.9765891354818564
Energy: 0.8611696591563186
Energy: 0.6521139882349956
Energy: 0.6112148885472668
Energy: 0.7665274889168943
Energy: 0.7578117817428739
Energy: 0.6575603429512112
Energy: 0.6866274852308022
Energy: 0.6346202912828339
Energy: 0.6381932400171215
Energy: 0.6868948696384927
Energy: 0.6474359006229443
Energy: 0.7507499700088999
Energy: 0.6054496711407199
Energy: 0.5966501215276167
Energy: 0.5813313136084088
Energy: 0.6052276053648451
Energy: 0.6195070648387769
Energy: 0.6045895663152073
Energy: 0.6174537882116795
Energy: 0.7219763532116592
Energy: 0.6180095781460403
Energy: 0.6171584662363355
Energy: 0.9514593350415625
Energy: 0.6179373545166957
Energy: 0.7433527361305444
Energy: 0.9774417954492816
Energy: 0.7570962938236466
Energy: 0.7597849467897427
Energy: 1.1190795001924372
Energy: 0.7301297319488033
Energy: 0.6146444795709161
Energy: 0.5904166970208604
Energy: 0.6323437893719878
Energy: 0.6148364796687587
Energy: 0.6258203602215651
Energy: 0.6120372896119819
Energy: 0.619101894634144
Energy: 0.6168801060305392
Energy: 0.6021538273561514
Energy: 0.6196056104238666
Energy: 0.6198846299270347
Energy: 0.6003503100889878
Energy: 0.6198819025720003
Energy: 0.5986082321361428
Energy: 0.6153469415852505
Energy: 0.6051263853409674
Energy: 0.6140953518467519
Energy: 0.6349179395909641
Energy: 1.2771897129399667
Energy: 0.6162884659047023
Energy: 0.6448826593534224
Energy: 1.2786669439855098
Energy: 0.7597892812651207
Energy: 0.7932867708485856
Energy: 0.9233387862385759
Energy: 0.6185936763551084
Energy: 0.617852718038967
Energy: 0.9838507468352696
Energy: 0.6180004307947539
Energy: 0.6778654392532487
Energy: 0.6203806037067318
Energy: 0.5991686972139506
Energy: 0.5989307164673418
Energy: 0.6202373626205007
Energy: 0.5989325541820437
Energy: 0.5986825806734076
Energy: 0.7981963742010548
Energy: 0.6864193902700542
Energy: 0.732073405513384
Energy: 0.8003216225449912
Energy: 0.6862092813429318
Energy: 0.750973211399954
Energy: 0.7558321060908267
Energy: 0.5948939637901479
Energy: 0.5666445354649791
Energy: 0.7564542749424814
Energy: 0.7501696914510626
Energy: 0.6962818685000073
Energy: 1.1719725308425855
Energy: 0.8623896021337527
Energy: 0.8589769919514172
Energy: 1.1717040796616918
Energy: 0.9534850166766641
Energy: 1.0921027518079365
Energy: 0.6196399727138937
Energy: 0.5942565893702808
Energy: 0.632450958850958
Energy: 0.6199093232721505
Energy: 0.7613485022643177
Energy: 0.6192540509157586
Energy: 0.6022261801394763
Energy: 0.6832727548474032
Energy: 0.6245072042297102
Energy: 0.6006123680650233
Energy: 0.7425748092198792
Energy: 0.6006230037933491
Energy: 0.9451428712793324
Energy: 0.7523158620393736
Energy: 0.7305795945371211
Energy: 0.9466318442643269
Energy: 0.7969572286251363
Energy: 0.8030360933485668
Energy: 0.590982367126415
Energy: 0.620689141628147
Energy: 0.6904624579727312
Energy: 0.5910782422184345
Energy: 0.8347640480582238
Energy: 0.6380436073536195
Energy: 0.9551596289566704
Energy: 0.6802574158011787
Energy: 0.680207235286775
Energy: 0.9571380718754272
Energy: 0.6891948924081435
Energy: 0.8640671957072056
Energy: 0.7728716678789657
Energy: 0.6234104203168758
Energy: 0.6232541185903909
Energy: 0.7654180522399818
Energy: 0.6237216389456758
Energy: 0.6119103375467709
Energy: 1.1238288514295045
Energy: 0.6194820831250325
Energy: 0.6215286353916724
Energy: 1.125645905242471
Energy: 0.6181228284700095
Energy: 0.7300961172784931
Energy: 0.7576319640102698
Energy: 0.6188855232476541
Energy: 0.618654091808286
Energy: 0.7772150184768575
Energy: 0.7357246034762999
Energy: 0.7544985499495817
Energy: 0.7297702595271892
Energy: 0.6031006198872901
Energy: 0.5935329742831911
Energy: 0.7303151275548736
Energy: 0.6438797788237928
Energy: 0.6389459277679534
Energy: 0.5997639279533081
Energy: 0.5960429313809861
Energy: 0.6358397247640656
Energy: 0.5988220370304858
Energy: 0.6432054388216827
Energy: 0.5986066603352395
Energy: 0.6182990906105666
Energy: 0.635797780033283
Energy: 0.5869515997338014
Energy: 0.6199750975536354
Energy: 0.6078366661742333
Energy: 0.6180985201503867
Energy: 1.42777104437926
Energy: 0.9767607095916054
Energy: 0.9768581899254253
Energy: 0.6202450676834986
Energy: 1.1154731203233075
Energy: 1.2040080098656318
Energy: 0.6168643744503389
Energy: 0.5945467317282593
Energy: 0.5866682325307585
Energy: 0.6181455065579314
Energy: 0.6035272976250882
Energy: 0.6264566776036764
Energy: 0.6131807960035326
Energy: 0.6017092536514109
Energy: 0.5854115339247669
Energy: 0.6135026260002275
Energy: 0.6216681156424628
Energy: 0.6110577867106741
Energy: 0.6199451934330835
Energy: 0.5959363783423243
Energy: 0.597152218513023
Energy: 0.6199600879900902
Energy: 0.6137651176137977
Energy: 0.595536451809262
Energy: 0.9235182442822945
Energy: 0.6173767205243906
Energy: 0.6170168507330284
Energy: 0.9234488815701671
Energy: 0.6172864794290702
Energy: 0.6630545638600661

minimum gb energy = 0.55797914466587 eV
minimum distance =  2.35829660980056 Angstroms
sigma value = 57


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

Energy: 0.32104942932930075
Energy: 0.8007965623582026
Energy: 0.23567459958076678
Energy: 0.22948588410989304
Energy: 0.5132812578598464
Energy: 0.3223498086919438
Energy: 0.4772387572777423
Energy: 0.5050984100788617
Energy: 0.5695527989700434
Energy: 0.48446913291177957
Energy: 0.5044142652640888
Energy: 0.43913639461697906
Energy: 0.4952074307463266
Energy: 0.4510935624472588
Energy: 0.5071849190223127
Energy: 0.49511166033772547
Energy: 0.4540204728485065
Energy: 0.4823288464243873
Energy: 1.2310936205834093
Energy: 0.4700118191851883
Energy: 0.46668046018984694
Energy: 1.23116758078884
Energy: 0.5358962086028478
Energy: 0.4705659865830268
Energy: 0.47657105318495696
Energy: 0.22815891269066002
Energy: 0.2963832402438195
Energy: 0.49666036953051684
Energy: 0.2278955267558165
Energy: 0.470450068613418
Energy: 0.44711034935471744
Energy: 0.22778928994766284
Energy: 0.22786483811269856
Energy: 0.47550100891499214
Energy: 0.2276212142472333
Energy: 0.2573751199024913
Energy: 0.4428699198165294
Energy: 0.4455530820370131
Energy: 0.47339898476333275
Energy: 0.4437345964635632
Energy: 0.46440396637589465
Energy: 0.46944782613849706
Energy: 0.9944080747365512
Energy: 1.0439582634720774
Energy: 1.063249055342689
Energy: 0.9929360002222214
Energy: 1.2053918187229578
Energy: 1.0007988171954203
Energy: 0.4836251743036312
Energy: 0.4906390080106239
Energy: 0.46557173336616436
Energy: 0.5127898728573331
Energy: 0.48483168984428254
Energy: 0.4659762142016432
Energy: 0.22746142439629674
Energy: 0.5082242980166028
Energy: 0.25886756428970636
Energy: 0.22768062775223719
Energy: 0.5241156898515641
Energy: 0.22799281616883346
Energy: 0.22751211510683536
Energy: 0.4797759073555512
Energy: 0.48783798976375015
Energy: 0.22770722380957606
Energy: 0.4817349035298742
Energy: 0.25765660755225467
Energy: 0.4857171784422732
Energy: 0.44621159642482233
Energy: 0.49264921376804854
Energy: 0.5115937041110951
Energy: 0.4459376428882792
Energy: 0.4766874271907814
Energy: 1.1943036078851916
Energy: 1.0604815305052777
Energy: 1.0587771604783072
Energy: 1.189956822093141
Energy: 0.9948086022538998
Energy: 1.058199082504997
Energy: 0.48204790756290633
Energy: 0.468204954896698
Energy: 0.47257485933584786
Energy: 0.4830567926321318
Energy: 0.46320911814107013
Energy: 0.4695453992641992
Energy: 0.485621718826989
Energy: 0.22750212406791595
Energy: 0.22749013445692468
Energy: 0.5139966450235433
Energy: 0.22754545609942925
Energy: 0.22805759293658184
Energy: 0.4392506098158037
Energy: 0.46778889249199707
Energy: 0.46598447443269275
Energy: 0.46256165557202117
Energy: 0.22793249265895962
Energy: 0.472501087133348
Energy: 0.4565415711391829
Energy: 0.45415109632429895
Energy: 0.4696277031660047
Energy: 0.45406531966442343
Energy: 0.5116371910693361
Energy: 0.4524955304090373
Energy: 0.49585744459816744
Energy: 0.49612866831908436
Energy: 0.4492592687758257
Energy: 0.49876783379924555
Energy: 1.2235228293504161
Energy: 0.44285472566507134
Energy: 0.32180565543138556
Energy: 0.5656557294021008
Energy: 0.5667897077178159
Energy: 0.22770911703876368
Energy: 0.5322744646062617
Energy: 0.44307496799423035

minimum gb energy = 0.22746142439629674 eV
minimum distance =  2.41462362509625 Angstroms
sigma value = 11


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

Energy: 1.0527581866294098
Energy: 1.4012915767120273
Energy: 1.0339978292203555
Energy: 1.055027616520618
Energy: 1.4037502546839096
Energy: 1.1377617466702805
Energy: 0.44794794478848304
Energy: 0.4484257716976943
Energy: 0.44978000942848095
Energy: 0.464465020764521
Energy: 0.4504491782624143
Energy: 0.48788734556801516
Energy: 0.4561938736498241
Energy: 0.4691222143902573
Energy: 0.47001360857610197
Energy: 0.4559164396108436
Energy: 0.4539227439823356
Energy: 0.47129289078509595
Energy: 0.4547906195865655
Energy: 0.48866108885898796
Energy: 0.546475108432748
Energy: 0.4554535306225039
Energy: 0.45232378904381115
Energy: 0.4684208101745065
Energy: 0.44824795611295526
Energy: 0.6155066492808154
Energy: 0.6978659706358611
Energy: 0.4483069902883044
Energy: 0.9256348766970831
Energy: 0.5881914976111917
Energy: 0.6649121313551005
Energy: 1.0442816694415222
Energy: 1.0261596294811297
Energy: 0.6431568927693849
Energy: 1.0295947440598194
Energy: 0.5531522497164876
Energy: 0.496656436506437
Energy: 0.5157253159233703
Energy: 0.5552620202265531
Energy: 0.4508602329135569
Energy: 0.6314450456366827
Energy: 0.45055870740344894
Energy: 0.511790897498391
Energy: 0.5357069031910011
Energy: 0.5352335656102445
Energy: 0.506572320504121
Energy: 0.534559293908115
Energy: 0.649198909027676
Energy: 0.6993673863984341
Energy: 0.5263060389548057
Energy: 0.5391670028929584
Energy: 0.4697160686490714
Energy: 0.5260794679891744
Energy: 0.545612514604767
Energy: 0.9086729570171918
Energy: 0.5526002137119548
Energy: 0.56053553131778
Energy: 0.9100282890460076
Energy: 0.6842175679987077
Energy: 0.6778881529364335
Energy: 0.8309400104833078
Energy: 0.6879131315898059
Energy: 0.6880132540627735
Energy: 0.9126212220314159
Energy: 0.6592950454470442
Energy: 0.6725433021683102
Energy: 0.7465108423291209
Energy: 0.4361589124000558
Energy: 0.46883835185852574
Energy: 0.7463234071283746
Energy: 0.43510853316847814
Energy: 0.7156206427819084
Energy: 0.659691604083026
Energy: 0.7249706482775159
Energy: 0.6833801116841342
Energy: 0.6612327611121841
Energy: 0.7346803062262853
Energy: 0.6628777525252312
Energy: 0.6281611751194441
Energy: 0.5968813444404025
Energy: 0.6112735534884871
Energy: 0.6285499357515336
Energy: 0.8334971942970261
Energy: 0.6778973832545588
Energy: 0.9374159682656262
Energy: 0.8321843969334978
Energy: 0.8235768069829494
Energy: 0.9390587128496002
Energy: 0.8383436767661847
Energy: 0.9375720882099192
Energy: 0.9201688882801593
Energy: 0.6214774119297303
Energy: 0.6366426614839753
Energy: 0.8920879598724867
Energy: 0.8612189552373711
Energy: 0.7322055320269689
Energy: 0.7749951029424554
Energy: 0.9481934680181702
Energy: 0.8766205213839673
Energy: 0.7762201695013435
Energy: 0.96858912624704
Energy: 0.9262111595745094
Energy: 0.5289973246163676
Energy: 0.6619338296977177
Energy: 0.6515142757637177
Energy: 0.808228767005998
Energy: 0.6625750611600851
Energy: 0.6819777318324638
Energy: 0.5277878022484905
Energy: 0.6306237955505304
Energy: 0.6371014332918893
Energy: 0.621142342619437
Energy: 0.6407974252423841
Energy: 0.6451752205524711
Energy: 0.6392612906542324
Energy: 0.7323430902279607
Energy: 0.8449443881863671
Energy: 0.6405314359581131
Energy: 0.7323579845070681
Energy: 0.8275495419707121
Energy: 0.8929494009357912
Energy: 0.5835226554349295
Energy: 0.6206287545399738
Energy: 0.6786541518617133
Energy: 0.8829942480711526
Energy: 0.7652187735178778
Energy: 0.7434857738195106
Energy: 0.9419757332983315
Energy: 0.9308213588470268
Energy: 0.7437040682995597
Energy: 0.9437633580135852
Energy: 1.079675389118348
Energy: 0.5274078380074185
Energy: 0.5803142161829579
Energy: 0.5451911052825954
Energy: 0.5272237595261413
Energy: 0.6930172174157023
Energy: 0.5396627310765786
Energy: 0.5465469605948815
Energy: 0.6166450262958552
Energy: 0.650633706495749
Energy: 0.545162160423651
Energy: 0.6072309237080593
Energy: 0.5440094150088987
Energy: 0.5323093123639607
Energy: 0.44988864311866233
Energy: 0.46917202368352084
Energy: 0.5329638732048927
Energy: 0.45351362744794865
Energy: 0.5411658471849649
Energy: 1.1303707331815835
Energy: 0.5868058632222083
Energy: 0.5899977177187935
Energy: 1.035163842326996
Energy: 0.663997042215294
Energy: 0.7028454556923821

minimum gb energy = 0.43510853316847814 eV
minimum distance =  2.33986229159962 Angstroms
sigma value = 41


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

Energy: 1.0168153925079344
Energy: 1.3588157655971396
Energy: 1.1275420466106976
Energy: 1.0186286527457162
Energy: 1.3586329560340737
Energy: 0.930218492489466
Energy: 0.5048376707439067
Energy: 0.5050866950044923
Energy: 0.5067078628209021
Energy: 0.5446638230882987
Energy: 0.5052555976315243
Energy: 0.5727680553098821
Energy: 0.5084035311705543
Energy: 0.5355802671465624
Energy: 0.535546640512416
Energy: 0.5064893911479019
Energy: 0.5066823446153326
Energy: 0.507442337437637
Energy: 0.5087151548624391
Energy: 0.5106471014804944
Energy: 0.5908193274130081
Energy: 0.5048428926074773
Energy: 0.5073157810067727
Energy: 0.5353967434958979
Energy: 0.5046412900402454
Energy: 0.8253305512735962
Energy: 0.6795782563865896
Energy: 0.5047200763502382
Energy: 0.7368975939234472
Energy: 0.5996147837014605
Energy: 0.7081205370352206
Energy: 1.0176938682322918
Energy: 1.0244285412567984
Energy: 0.7086888840503746
Energy: 1.017325465031976
Energy: 1.0246101199755815
Energy: 0.5758621005761493
Energy: 0.5519386665290473
Energy: 0.5917950076718799
Energy: 0.5062987568088714
Energy: 0.5244379486497776
Energy: 0.5594809527614041
Energy: 0.5936869979694548
Energy: 0.6518521138268277
Energy: 0.6512037662712744
Energy: 0.5952000115668654
Energy: 0.6518858170008549
Energy: 0.6324593687233285
Energy: 0.7888682021630744
Energy: 0.5894830421750594
Energy: 0.6072796138624409
Energy: 0.5836317889954257
Energy: 0.5893315580232241
Energy: 0.6075179480304282
Energy: 0.8012626463631111
Energy: 0.5094057044288399
Energy: 0.509087153522268
Energy: 0.8019173290767946
Energy: 0.5087916581369236
Energy: 0.5328209716996855
Energy: 0.7435552511198334
Energy: 0.5320071969639035
Energy: 0.5328322467662837
Energy: 0.74402960776163
Energy: 0.5431117734185051
Energy: 0.5065926871445472
Energy: 0.9229198924536082
Energy: 0.48072348809338833
Energy: 0.5725843189645483
Energy: 0.9230142526629522
Energy: 0.47986231277430064
Energy: 0.6239529368601279
Energy: 0.6421438376095616
Energy: 0.9131851137966394
Energy: 0.8642889164074976
Energy: 0.6424631071376657
Energy: 0.9421932341515963
Energy: 0.8011931038778937
Energy: 0.5892957797062425
Energy: 0.6327712579767474
Energy: 0.6078040441126208
Energy: 0.5892977293651503
Energy: 0.5246722661714776
Energy: 0.6026458674363021
Energy: 0.6508691957565514
Energy: 0.7309655237559394
Energy: 0.8035217803236494
Energy: 0.6508207455598903
Energy: 0.7974510681525727
Energy: 0.6501762738060392
Energy: 0.77445439201004
Energy: 0.5062448140903673
Energy: 0.5475346014148301
Energy: 0.7183274896528683
Energy: 0.5063537070876499
Energy: 0.5913081948294016
Energy: 1.0189350642164599
Energy: 0.8277149250198264
Energy: 1.124027899485018
Energy: 1.0201951849458537
Energy: 0.825951887793272
Energy: 0.8646154016340702
Energy: 0.5689691359393007
Energy: 0.504712178379893
Energy: 0.5053944896210304
Energy: 0.7599316249055955
Energy: 0.5047605361361664
Energy: 0.4775846326124276
Energy: 0.5070515586934982
Energy: 0.5075832362777901
Energy: 0.5071517366542263
Energy: 0.5073503502486285
Energy: 0.5068405281814753
Energy: 0.5068847952741499
Energy: 0.5075290687507337
Energy: 0.535431045836762
Energy: 0.5088131110015705
Energy: 0.5063687892694739
Energy: 0.5070712333989305
Energy: 0.5361302025701851
Energy: 0.5051484102210033
Energy: 0.5907704830668135
Energy: 0.6044807517963684
Energy: 0.5051291567635001
Energy: 0.544352086483291
Energy: 0.5710293651456662
Energy: 0.8363244091256623
Energy: 1.0189930641942633
Energy: 1.0294345369682416
Energy: 1.3569740843962657
Energy: 1.0223342736518028
Energy: 0.9602576930094585
Energy: 0.8115440826683262
Energy: 0.6625254638445375
Energy: 0.6627073105404997
Energy: 0.5055995838276064
Energy: 0.7185912770025209
Energy: 0.5690069263319527
Energy: 0.5932699334615236
Energy: 0.637105047601358
Energy: 0.7024100876599192
Energy: 0.5927655027973131
Energy: 0.6373029028751537
Energy: 0.6184609086507259
Energy: 0.8129276726589878
Energy: 0.5891231095130508
Energy: 0.6029842910260644
Energy: 0.5064515794042832
Energy: 0.5891376686253441
Energy: 0.6077062830227765
Energy: 0.7443519869865388
Energy: 0.5086465883019494
Energy: 0.532498817245591
Energy: 0.7449426253921335
Energy: 0.588664759457415
Energy: 0.5326165204721998
Energy: 0.8005889310091722
Energy: 0.6184027210866689
Energy: 0.5320612510421749
Energy: 0.8010342982740244
Energy: 0.7053449881329716
Energy: 0.5070296998680408
Energy: 1.060863546643827
Energy: 0.5726029738058028
Energy: 0.6073788587844685
Energy: 0.7756013783836164
Energy: 0.47914148207597185
Energy: 0.6605955682239935
Energy: 0.918062879364866
Energy: 0.9096795771702016
Energy: 0.9089690537150095
Energy: 0.9179607675382562
Energy: 0.9104644197792968
Energy: 0.8668443536462733
Energy: 0.5886280997525134
Energy: 0.6505457584430036
Energy: 0.6658508674577911
Energy: 0.5886630922499133
Energy: 0.5769610743265129
Energy: 0.5896997077674699
Energy: 0.6499401519698896
Energy: 0.7535751587952528
Energy: 0.7140193992253601
Energy: 0.6502164306710196
Energy: 0.7411144267080091
Energy: 0.6504951641147896
Energy: 0.506448307595918
Energy: 0.5073220654801673
Energy: 0.5076205305338161
Energy: 0.5065310200332809
Energy: 0.5069815556314966
Energy: 0.592439225064263
Energy: 1.0128373943880105
Energy: 0.5043569154144292
Energy: 0.47724021954554696
Energy: 1.0138332537349175
Energy: 0.7064711753655887
Energy: 0.47759874359120463

minimum gb energy = 0.47724021954554696 eV
minimum distance =  2.4017400523012 Angstroms
sigma value = 33


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

Energy: 0.685355543468228
Energy: 1.2390356497024382
Energy: 0.9842478230710732
Energy: 0.6872289807940085
Energy: 1.239468794475327
Energy: 0.9839792911970897
Energy: 0.5697165943790151
Energy: 0.5704334813097548
Energy: 0.5551814684760409
Energy: 0.5926321564651946
Energy: 0.5732860422963605
Energy: 0.5549572168022459
Energy: 0.6143341914850501
Energy: 0.60672475040958
Energy: 0.6082826440608297
Energy: 0.6148008044146657
Energy: 0.571596876986486
Energy: 0.6092299856571004
Energy: 0.6104322629620574
Energy: 0.5615202334236544
Energy: 0.6074922933186131
Energy: 0.6113130342409205
Energy: 0.5724691091189417
Energy: 0.6076630203059104
Energy: 0.6586143007454422
Energy: 0.8406514171981688
Energy: 0.6172954327037999
Energy: 0.6587936879419487
Energy: 0.8209595594203591
Energy: 0.5693758403779332
Energy: 0.6610232384758907
Energy: 0.8224569739527239
Energy: 0.8352370082685824
Energy: 0.6611290505306837
Energy: 0.9843532496691385
Energy: 0.8438410620819481
Energy: 0.802370537304939
Energy: 0.6317476526831878
Energy: 0.6732721063226966
Energy: 0.5763707983118824
Energy: 0.581717285355387
Energy: 0.6794681960803645
Energy: 0.6838683424810764
Energy: 0.770975382223666
Energy: 0.556345924465014
Energy: 0.6856988110540405
Energy: 0.771459459358161
Energy: 0.6360035337990457
Energy: 0.6118802338052609
Energy: 0.6185950015330578
Energy: 0.533555550815789
Energy: 0.6224917386270424
Energy: 0.6201970699996838
Energy: 0.5327808384098742
Energy: 0.9848595098949938
Energy: 0.7640468725621055
Energy: 0.7650252813173185
Energy: 0.9054784576667567
Energy: 0.7639948314440678
Energy: 0.7647199553677972
Energy: 0.6673440542983675
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Energy: 0.619747699562024
Energy: 0.5725620011641236
Energy: 0.6118424557664953
Energy: 0.6158912591472023
Energy: 0.7947408070393313
Energy: 0.5349618962034377
Energy: 0.7112426884787587
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Energy: 0.5405498565904138
Energy: 0.6899575010049541
Energy: 0.7938334986864067
Energy: 0.9803382965403035
Energy: 0.978387265652427
Energy: 0.7941449764009612
Energy: 0.9826422915792505
Energy: 0.9783052889623943
Energy: 0.577899854312891
Energy: 0.5605927147967086
Energy: 0.559808942545914
Energy: 0.5786047443511176
Energy: 0.5711433850064628
Energy: 0.5590957307199802
Energy: 0.5326992639199662
Energy: 0.6205031995188803
Energy: 0.6075033056546698
Energy: 0.6179854543390003
Energy: 0.6402929566849549
Energy: 0.555172370664374
Energy: 0.5735336660661196
Energy: 0.5718131443360686
Energy: 0.5712388710289582
Energy: 0.5849201406333798
Energy: 0.6587125596574477
Energy: 0.6060897839047371
Energy: 0.9822296022665574
Energy: 0.6725252324416838
Energy: 0.7634287100233191
Energy: 0.9834971713746392
Energy: 0.6728500167985755
Energy: 0.7624985624707395
Energy: 0.9016436212926899
Energy: 0.6206171456242368
Energy: 0.6516986525938251
Energy: 0.9024170571853595
Energy: 0.6207364678377204
Energy: 0.6789258953821169
Energy: 0.5827174629170357
Energy: 0.6090331574702956
Energy: 0.6119153686967346
Energy: 0.5730332924537328
Energy: 0.6823131349612035
Energy: 0.6793806863918848
Energy: 0.5791964579514295
Energy: 0.608783074228483
Energy: 0.6124271312641235
Energy: 0.5798651324548889
Energy: 0.6476683634387405
Energy: 0.6161906248029371
Energy: 0.5352915320704182
Energy: 0.6124771636433506
Energy: 0.5334595424456927
Energy: 0.5358816849699475
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Energy: 0.7695014669847913
Energy: 0.8398780930857419
Energy: 0.8409328418789257
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Energy: 0.8576965988552259
Energy: 0.7687698264454565
Energy: 0.8912995078177199
Energy: 0.5713388014597373
Energy: 0.5712645852802292
Energy: 0.5719254038079756
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Energy: 0.5330825817912582
Energy: 0.6852024045168982
Energy: 1.0616704437913302
Energy: 0.9844564155078851
Energy: 1.283406333231299
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Energy: 0.9803984431954367
Energy: 0.672619713733883
Energy: 0.5698500932951226
Energy: 0.556162527282691
Energy: 0.5819593508948496
Energy: 0.5709706777974561
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Energy: 0.6119335935559636
Energy: 0.572201663950889
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Energy: 0.5578852333190086
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Energy: 0.5806702670629634
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Energy: 0.5753016630772577
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Energy: 0.6718151799531352
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Energy: 0.5393556323074932
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Energy: 0.618139097290498
Energy: 0.6312603182097459
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Energy: 0.8571937070127205
Energy: 0.842508435623662
Energy: 0.7710938161776103
Energy: 0.8619523132627
Energy: 0.770566711789511
Energy: 0.8909402762092447
Energy: 0.5716667636917645
Energy: 0.6067696400458849
Energy: 0.5330906451861842
Energy: 0.5719086195626969
Energy: 0.6167523186764193
Energy: 1.285153613488138
Energy: 1.0486942290414427
Energy: 0.9790651935866644
Energy: 1.287772035024472
Energy: 0.7949395008623739
Energy: 0.9790322356962697

minimum gb energy = 0.5326951999398738 eV
minimum distance =  2.41315915726787 Angstroms
sigma value = 67


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

Energy: 0.8300453058780606
Energy: 0.9896514367928515
Energy: 0.6258685554617132
Energy: 0.831882082003416
Energy: 1.000405838345642
Energy: 0.6255882754496158
Energy: 0.6458373189427631
Energy: 0.6389068471415817
Energy: 0.6033531497321581
Energy: 0.6461708978844092
Energy: 0.6391340335670191
Energy: 0.6021824530383354
Energy: 0.7185002564885115
Energy: 0.5875960973157748
Energy: 0.6196588695836117
Energy: 0.717514691981513
Energy: 0.5865218515758077
Energy: 0.6179277503438991
Energy: 0.7127474599475426
Energy: 0.6170458400528618
Energy: 0.617593623301513
Energy: 0.6534148929756977
Energy: 0.6149486861195447
Energy: 0.6170234422859774
Energy: 0.651562424967155
Energy: 0.616089445048822
Energy: 0.616898503205567
Energy: 0.6515128939334003
Energy: 0.6099564814958705
Energy: 0.6170062155566172
Energy: 0.652449845451503
Energy: 0.6253291595401059
Energy: 0.6516675727648916
Energy: 0.6524393446441147
Energy: 0.7182466209350239
Energy: 0.6521529905743836
Energy: 0.7210961851850525
Energy: 0.6523062037732841
Energy: 0.6167213194135149
Energy: 0.7209724924651946
Energy: 0.6522773090813293
Energy: 0.6157438264962595

minimum gb energy = 0.5865218515758077 eV
minimum distance =  2.43200192025172 Angstroms
sigma value = 3


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

Energy: 1.0853735488065928
Energy: 1.180135147426414
Energy: 0.8355179453967321
Energy: 1.0866814208062625
Energy: 1.1794977177240717
Energy: 0.8358939468075741
Energy: 0.9737711644156942
Energy: 0.79400041925803
Energy: 0.7905245240896378
Energy: 0.7447629985168751
Energy: 0.8219698584573074
Energy: 0.6831670771251624
Energy: 0.7412053344045615
Energy: 0.7327861867942418
Energy: 0.7331214570857627
Energy: 0.790157219414695
Energy: 0.9454054635895132
Energy: 0.7627436876639795
Energy: 0.6845555123116941
Energy: 0.683503441270255
Energy: 0.6827118828517923
Energy: 0.6845777377762735
Energy: 0.8762234848563738
Energy: 0.6832700900070892
Energy: 0.6910225361315327
Energy: 0.7323907630952097
Energy: 0.6848234387848681
Energy: 0.6916674128553633
Energy: 0.7718626190018829
Energy: 0.6963433224001351
Energy: 0.7871204064952991
Energy: 0.7749596823235932
Energy: 0.7709271421439828
Energy: 0.7874232769023077
Energy: 0.897823492546499
Energy: 0.7615650204395195
Energy: 0.8224257586628467
Energy: 0.7832507776555305
Energy: 0.7830368646943667
Energy: 0.70447946033346
Energy: 0.7852685604761895
Energy: 0.7003448752641649
Energy: 1.0268806405134874
Energy: 0.9379145669485479
Energy: 0.767849764904905
Energy: 1.0273953061655676
Energy: 0.948012971878083
Energy: 0.8064625211574958
Energy: 0.8322698253313697
Energy: 0.7835572534463605
Energy: 0.7769672059616355
Energy: 0.7184170711828577
Energy: 0.8434158666944916
Energy: 0.7510129074262294
Energy: 0.8600914226524611
Energy: 0.6840235380202304
Energy: 0.6845096780979575
Energy: 0.8608548502635477
Energy: 1.0650166311743512
Energy: 0.8243363329573666
Energy: 0.7836730702976774
Energy: 0.781439771374545
Energy: 0.7396343380650688
Energy: 0.7850523017827411
Energy: 0.7039991581571204
Energy: 0.7890354570838078
Energy: 0.7609399713290722
Energy: 0.7562209272268785
Energy: 0.7413509374413816
Energy: 0.7610393646124627
Energy: 0.695704839057061
Energy: 0.7493359510411667
Energy: 0.8550820922152774
Energy: 0.6843229090033193
Energy: 0.6845771006569011
Energy: 0.8540078603259329
Energy: 0.6840194169405646
Energy: 0.6857558884226033
Energy: 0.8311741798669845
Energy: 0.6824030641184551
Energy: 0.6824019618265004
Energy: 0.8312712410529729
Energy: 0.6815467301113431
Energy: 0.6824513186384729
Energy: 0.9129840568746505
Energy: 0.7373161695979197
Energy: 0.7210440933529295
Energy: 0.9126183642221798
Energy: 0.7994809068323028
Energy: 0.7333469584171843
Energy: 0.8939231842288554
Energy: 0.6829309399960738
Energy: 0.6831244291734143
Energy: 0.8958308674473546
Energy: 0.766975347347301
Energy: 0.7484757427021553
Energy: 0.9697818646117228
Energy: 0.7545044062394837
Energy: 0.7537441754807181
Energy: 0.9710720549962878
Energy: 1.2092123191261788
Energy: 0.8567869191856514
Energy: 0.7958843248266761
Energy: 0.7800367999448247
Energy: 0.7401859913107156
Energy: 0.7963331205151317
Energy: 0.7861864917033475
Energy: 0.7461499243394135
Energy: 1.0372903947304457
Energy: 0.8235913314189028
Energy: 0.753801693940554
Energy: 1.0360599473085947
Energy: 0.7754651887924888
Energy: 0.7816015001452313
Energy: 0.9615417011700788
Energy: 0.7347891507600313
Energy: 0.7286240383821299
Energy: 0.7422203861015092
Energy: 0.7325415790735309
Energy: 0.6836052851536133
Energy: 0.7785221977957422
Energy: 0.7175090924474901
Energy: 0.7275817949681308
Energy: 0.7796970108607468
Energy: 0.7227583197218804
Energy: 0.7489089421609642
Energy: 0.8212469251035771
Energy: 0.727206405489177
Energy: 0.7434787508401737
Energy: 0.8222268375050783
Energy: 0.726088186087331
Energy: 0.751133057368981
Energy: 0.7297643139392347
Energy: 0.7056608800953647
Energy: 0.7414558739018092
Energy: 0.7304168374196102
Energy: 0.726384910214943
Energy: 0.6893809667133496
Energy: 0.7793971113754211
Energy: 0.7580665980433047
Energy: 0.7101255524377256
Energy: 0.8107950935117337
Energy: 1.0389048122233164
Energy: 0.7730276935682264
Energy: 0.829261303891287
Energy: 0.7395841219516734
Energy: 0.7546949351994888
Energy: 0.8305680317940954
Energy: 0.6935386559476943
Energy: 0.6819023147553905
Energy: 1.145570628472911
Energy: 0.9126440482735996
Energy: 0.8878942295288074
Energy: 0.8723050606982445
Energy: 0.8225392751279732
Energy: 0.8215017619130836
Energy: 0.8252792266122431
Energy: 0.9125103005378095
Energy: 0.8879907625581235
Energy: 0.8108504350251632
Energy: 0.9173386035026501
Energy: 0.8210113009210103
Energy: 0.8279458786457573
Energy: 0.7690867799059996
Energy: 0.7886000900119227
Energy: 0.8283344992856538
Energy: 0.7740620245909451
Energy: 0.6887263383130837
Energy: 0.7715264571608211
Energy: 0.817906296900449
Energy: 0.7329867151056977
Energy: 0.7722732203960956
Energy: 0.9459255505209474
Energy: 0.7608367361309456
Energy: 0.683127279503271
Energy: 0.73759587361566
Energy: 0.680542534296762
Energy: 0.6837050644417122
Energy: 0.7712247525744843
Energy: 0.6861811516713177
Energy: 0.7055174878595271
Energy: 0.7455969925399435
Energy: 0.6972658236456674
Energy: 0.7340699693935377
Energy: 0.9379348562303224
Energy: 0.6967246609830153
Energy: 0.6991701176588995
Energy: 0.8130797993083154
Energy: 0.820130570214146
Energy: 0.689876443615794
Energy: 0.8370498923873276
Energy: 0.7379579356992336
Energy: 1.0231377675106972
Energy: 0.8116007814848956
Energy: 0.830885530242905
Energy: 1.0308843615382468
Energy: 0.8115942674464118
Energy: 0.7539853324701751
Energy: 0.739768316106486
Energy: 0.8061134321635762
Energy: 0.7994799303572085
Energy: 0.8933204094605718
Energy: 0.8563511593325963
Energy: 0.7589431440579735
Energy: 0.6928273826171946
Energy: 0.8664100216088592
Energy: 0.7375740866529378
Energy: 0.6944394084443813
Energy: 0.8988165522043335
Energy: 0.7821744528125248
Energy: 0.8995084337416154
Energy: 0.6841292951193716
Energy: 0.6845499394679891
Energy: 0.8986868011410297
Energy: 1.09758323097145
Energy: 0.8230248978300234
Energy: 0.8343752971685656
Energy: 0.7511529021487988
Energy: 0.7466902974073985
Energy: 0.835030488037312
Energy: 0.6978680628351457
Energy: 0.7407385159005391
Energy: 0.8636956806555672
Energy: 0.7338747733309839
Energy: 0.696865989354745
Energy: 0.8611706497602428
Energy: 0.702115030879776
Energy: 0.7017273094203744
Energy: 0.7794266337484472
Energy: 0.6819609606565576
Energy: 0.6881501340912545
Energy: 0.7264682152808537
Energy: 0.6840435336802494
Energy: 0.6868785307020691
Energy: 0.9088952714242853
Energy: 0.6830505451793681
Energy: 0.6834889838796394
Energy: 0.9100122020846089
Energy: 0.694745855033558
Energy: 0.684256345536854
Energy: 0.9031552269101399
Energy: 0.8258022549955933
Energy: 0.6829561105551094
Energy: 0.8064313898957953
Energy: 0.7739710724354626
Energy: 0.6906318856256417
Energy: 0.8655120541486165
Energy: 0.748488826126453
Energy: 0.7486192695068693
Energy: 0.8665964806334266
Energy: 0.7718489354630773
Energy: 0.7613158825051434
Energy: 0.942474886207257
Energy: 0.804073843228015
Energy: 0.7534474832901853
Energy: 0.9585737788756026
Energy: 0.9312230878548703
Energy: 0.8565133717171518
Energy: 0.8024707286186493
Energy: 0.7284152693123765
Energy: 0.7280608129779877
Energy: 0.792630056922955
Energy: 0.965113727025999
Energy: 0.7528518692694046
Energy: 0.9677059144299277
Energy: 0.7315763692587987
Energy: 0.7898803604626808
Energy: 0.9691769611663743
Energy: 0.7448882871892482
Energy: 0.7325830644563109
Energy: 0.7263589160489212
Energy: 0.728436934345731
Energy: 0.7284215004708187
Energy: 0.7174535733027189
Energy: 0.7314336483897227
Energy: 0.6840396488060686
Energy: 0.8238000461962395
Energy: 0.7159984349091127
Energy: 0.7338618208967618
Energy: 0.8236617435231407
Energy: 0.7146024969106123
Energy: 0.7532790585127925
Energy: 0.7282821777543825
Energy: 0.7417841348208123
Energy: 0.7526675963275494
Energy: 0.7170005160489403
Energy: 0.7258321910346199
Energy: 0.7251383720745156
Energy: 0.7455088856373913
Energy: 0.6833031995801402
Energy: 0.7397079467816163
Energy: 0.7467866193028464
Energy: 0.8655422924835826
Energy: 0.7525132207657683
Energy: 0.9702945288735603
Energy: 0.7588364155435561
Energy: 0.7085079667821094
Energy: 0.7831880272138666
Energy: 0.9292576600745663
Energy: 0.793312861681127
Energy: 0.9555776658490952
Energy: 0.8074841496547938
Energy: 0.7360484040363593
Energy: 0.720704192435403
Energy: 0.7211175850967829
Energy: 0.740191736022092

minimum gb energy = 0.680542534296762 eV
minimum distance =  2.36732753295861 Angstroms
sigma value = 81


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

Energy: 1.2981733443164347
Energy: 0.8509286776545787
Energy: 0.7551763182667277
Energy: 1.299389380275672
Energy: 0.7572358994236278
Energy: 0.9192711274562431
Energy: 0.8765408397471381
Energy: 0.8605631739823211
Energy: 0.7973162289821444
Energy: 0.876356256173561
Energy: 0.8610361724369939
Energy: 0.7434966656582392
Energy: 0.7949405777470036
Energy: 0.727958842573306
Energy: 0.7090717723873211
Energy: 0.7954074102181558
Energy: 0.8784197336048517
Energy: 0.7350449640334078
Energy: 0.7143646013860318
Energy: 0.7321100326629003
Energy: 0.714707451038629
Energy: 0.7144012041468926
Energy: 0.7665983664341273
Energy: 0.7142956294116659
Energy: 0.7168885915505473
Energy: 0.7553594547580034
Energy: 0.7407959798453871
Energy: 0.717086857275785
Energy: 0.7328845204828591
Energy: 0.7210954065559758
Energy: 0.7954590862036488
Energy: 0.7532696986960963
Energy: 0.7542489167203449
Energy: 0.7951785027182364
Energy: 0.7904953041253291
Energy: 0.7502819183337344
Energy: 0.9512417317513099
Energy: 0.7366237286433528
Energy: 0.7368805408010347
Energy: 0.8923159249794504
Energy: 0.7366177456739301
Energy: 0.7233656170221051
Energy: 1.049306259796033
Energy: 0.9018004792542104
Energy: 0.9316167590154891
Energy: 1.0459493750420648
Energy: 0.9044741719885777
Energy: 0.7457393726160626
Energy: 0.9778627335775704
Energy: 0.7539726754192133
Energy: 0.7289921197519539
Energy: 0.9783127962941829
Energy: 0.7607501879900403
Energy: 0.7855576301891726
Energy: 0.7870351571927573
Energy: 0.7594713298193149
Energy: 0.7138348548671418
Energy: 0.8104951271838309
Energy: 1.1273489955917109
Energy: 0.7134356897423217
Energy: 0.8363447382444642
Energy: 0.713683525692231
Energy: 0.7122504514218196
Energy: 0.8376690289894475
Energy: 0.6824814648488148
Energy: 0.7755068541769509
Energy: 0.7660467842894422
Energy: 0.762037556943837
Energy: 0.7114541519176013
Energy: 0.7725519883572074
Energy: 0.7481542042020162
Energy: 0.7316935089805331
Energy: 0.8788294534205107
Energy: 0.7495723297028801
Energy: 0.7498882661444877
Energy: 0.8790873117355482
Energy: 0.7496512320392142
Energy: 0.6826057851006755
Energy: 0.8450478662788077
Energy: 0.751845948911438
Energy: 0.7426437284873401
Energy: 0.8462461897091312
Energy: 0.7410482900727355
Energy: 0.7435762930906218
Energy: 1.0290163184178085
Energy: 0.7373926986955206
Energy: 0.7376823797368351
Energy: 1.0297448270911307
Energy: 0.7324867490989471
Energy: 0.7439487122129367
Energy: 0.6992425807778933
Energy: 0.7222922586064744
Energy: 0.7259836410912871
Energy: 0.6993012295959686
Energy: 0.8758879739726003
Energy: 0.723609323240556
Energy: 0.8971489931270307
Energy: 0.6825235962186231
Energy: 0.6830183621323535
Energy: 0.9089341763277271
Energy: 1.0461713960927548
Energy: 0.7068527201697288
Energy: 0.6655516821691027
Energy: 0.6660045119678166
Energy: 0.6669369261352309
Energy: 0.6660289696968112
Energy: 0.6642480706532442
Energy: 0.6669540740640161
Energy: 0.6686089277513113
Energy: 0.6625097121683544
Energy: 0.6624516245223471
Energy: 0.6683786306203419
Energy: 0.8596971159809383
Energy: 0.66258412900726
Energy: 0.7939940429703827
Energy: 0.6629836614424086
Energy: 0.6630145020927499
Energy: 0.7281551815851799
Energy: 0.7489617080126367
Energy: 0.6630587603802522
Energy: 0.6656906664960175
Energy: 0.6636939308407334
Energy: 0.6676672751530597
Energy: 0.6661604858797137
Energy: 0.6631901581267148
Energy: 0.6663954769768734
Energy: 0.7564553798258783
Energy: 0.7103207123240709
Energy: 0.6823475625511122
Energy: 0.8391527246063436
Energy: 0.8771597457270778
Energy: 0.7798117381748306
Energy: 0.713025312543965
Energy: 0.7131029734663711
Energy: 0.7201521948872798
Energy: 0.7139836044635035
Energy: 0.7511378564146254
Energy: 0.7201137305042447
Energy: 0.7397968350938974
Energy: 0.7848937277900246
Energy: 0.722965192827616
Energy: 0.7404256717178319
Energy: 1.0164905342083939
Energy: 0.7353968932665021
Energy: 0.9752812708519372
Energy: 0.7453742985883156
Energy: 0.749089583912459
Energy: 0.974857759289972
Energy: 0.7420782583221421
Energy: 0.7504338126312057
Energy: 1.0633499530139086
Energy: 0.745255195766217
Energy: 0.7463447604915336
Energy: 1.043691559187265
Energy: 0.8972747560296364
Energy: 0.726620382699641
Energy: 1.07035277716139
Energy: 0.7042253085942581
Energy: 0.7116417977731598
Energy: 0.8198008898325446
Energy: 0.7084762003200559
Energy: 0.729486455405475
Energy: 0.8107482232985491
Energy: 0.6747422087535662
Energy: 0.7318585922951041
Energy: 0.8107276612531472
Energy: 0.6829440166027441
Energy: 0.7752465132424193
Energy: 0.819897709252555
Energy: 0.7596210242174721
Energy: 0.7106373277793193
Energy: 0.8439404340058403
Energy: 1.2069405594630749
Energy: 0.7595428132949659
Energy: 0.8532347562781625
Energy: 0.7368778974679767
Energy: 0.728122081000131
Energy: 0.8490730524658081
Energy: 0.7533708473778541
Energy: 0.7600605438903446
Energy: 0.8821531361730908
Energy: 0.8475674114278647
Energy: 0.811555617859449
Energy: 0.7356935559733768
Energy: 0.8084225282513726
Energy: 0.6826317698432981
Energy: 0.8188362736155633
Energy: 0.7333689184037849
Energy: 0.7332183252335975
Energy: 0.7676136985636183
Energy: 0.7335856795790677
Energy: 0.6961979919871865
Energy: 0.7366896215449797
Energy: 0.7313783855465011
Energy: 0.7297113383716533
Energy: 0.7544285665468925
Energy: 0.7316963553359832
Energy: 0.7458618230706637
Energy: 0.7444200424560763
Energy: 0.7503719163612041
Energy: 0.7518533185037114
Energy: 0.722475582160164
Energy: 0.8784778277188224
Energy: 0.7502203099343956
Energy: 0.7206742291708116
Energy: 0.7416065066284595
Energy: 0.741466939218965
Energy: 0.7204854528218014
Energy: 0.7677313591177044
Energy: 0.7421403403124939
Energy: 0.8613700261396993
Energy: 0.7992830809074244
Energy: 0.6890187795379331
Energy: 0.8544739768633784
Energy: 1.045099366749925
Energy: 0.8947486003163891
Energy: 0.8763196266909514
Energy: 0.8044511324419139
Energy: 0.746093086128513
Energy: 0.8763262408137041
Energy: 0.9892146137818266
Energy: 0.7442680820369629
Energy: 1.2982760608032824
Energy: 0.8896855594283242
Energy: 0.9396572749783063
Energy: 1.2994065073289758
Energy: 0.7358175787203176
Energy: 0.9169838454662621

minimum gb energy = 0.6624516245223471 eV
minimum distance =  2.32866992630246 Angstroms
sigma value = 43


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

Energy: 1.196728972766605
Energy: 0.8905983538526696
Energy: 0.7913678251768924
Energy: 1.1968360729121594
Energy: 0.8908823460986166
Energy: 0.7273758343725993
Energy: 0.8353937092505207
Energy: 0.709312889485771
Energy: 0.7673570180793605
Energy: 0.8054624477236211
Energy: 0.709309291230596
Energy: 0.7168387291273024
Energy: 0.9147067376601054
Energy: 0.7069736281432575
Energy: 0.6958770718769768
Energy: 0.9148955731676169
Energy: 0.6950069323255822
Energy: 0.7085945501779205
Energy: 0.6980207494531369
Energy: 0.7044236680463595
Energy: 0.6960997763447092
Energy: 0.6956427982333184
Energy: 0.8469322470303225
Energy: 0.6957570218780738
Energy: 0.7018893660737304
Energy: 0.735518501490954
Energy: 0.7664201756478353
Energy: 0.7025413926586327
Energy: 0.7096507531713347
Energy: 0.7065476963488484
Energy: 0.7111871356211756
Energy: 0.7112967624385352
Energy: 0.7129324316738548
Energy: 0.7099253002290252
Energy: 0.7117900509486457
Energy: 0.7323499813367756
Energy: 0.7095395031871331
Energy: 0.6953812032004738
Energy: 0.6954490622066548
Energy: 0.7095636999737583
Energy: 0.695409002747259
Energy: 0.6954338388501491
Energy: 0.8311131388422607
Energy: 0.7123960036178761
Energy: 0.730676246108675
Energy: 1.01382416251467
Energy: 0.7128156158821165
Energy: 0.7090662162762881
Energy: 0.7100501413202156
Energy: 0.7108128830882271
Energy: 0.7088664336081221
Energy: 0.7096937484665683
Energy: 0.8043805611948595
Energy: 0.7083340636928149
Energy: 0.8567192386124256
Energy: 0.7650369909318491
Energy: 0.7492772688512904
Energy: 0.8568212871723151
Energy: 0.8388001568518795
Energy: 0.7493049530715163
Energy: 0.8142535798385909
Energy: 0.7267039280329456
Energy: 0.7698719811310689
Energy: 0.8142907158866703
Energy: 0.7788338605047477
Energy: 0.7345184496164828
Energy: 0.8367923288006007
Energy: 0.7623854756859074
Energy: 0.7082651558073607
Energy: 0.6933456196310438
Energy: 0.9440402818481739
Energy: 0.7092756568929712
Energy: 0.8898800721476292
Energy: 0.7522566275687083
Energy: 0.7096578498486893
Energy: 0.8811171354683442
Energy: 0.7521606174119587
Energy: 0.7096606753122722
Energy: 0.6959300571318092
Energy: 0.7616848367152325
Energy: 0.7700143581130925
Energy: 0.696223498365821
Energy: 0.7634444440914723
Energy: 0.7802593221746092
Energy: 0.6958935330775482
Energy: 0.7378218611834314
Energy: 0.7586708836575331
Energy: 0.6960057059381776
Energy: 0.7210345040295594
Energy: 0.7720215368401633
Energy: 0.6808319789579622
Energy: 0.6992326376880745
Energy: 0.6845214313032847
Energy: 0.6796069132999433
Energy: 0.7590739603519694
Energy: 0.6794967663120794
Energy: 0.7038149235295349
Energy: 0.6940208106512518
Energy: 0.6941605652123848
Energy: 0.7038299646211845
Energy: 0.7650543180287755
Energy: 0.6940497623686143
Energy: 0.820367526568683
Energy: 0.7657486907750152
Energy: 0.6939913424767185
Energy: 0.824507864095856
Energy: 0.8303195898156327
Energy: 0.7606465107781752
Energy: 0.7728063988165015
Energy: 0.8533710735293264
Energy: 0.8212010872743695
Energy: 0.8131911514929208
Energy: 0.8527352603348345
Energy: 0.7086214717773728
Energy: 0.8717245188963636
Energy: 0.829153000183266
Energy: 0.8183241223856934
Energy: 0.7594132868576131
Energy: 0.9567487091476004
Energy: 0.7666984978326834
Energy: 0.8427767899574463
Energy: 0.7698199680147579
Energy: 0.7363268342307372
Energy: 0.8430526835218521
Energy: 0.7193156885866382
Energy: 0.7659872983679754
Energy: 0.8681823908222946
Energy: 0.7132064267681781
Energy: 0.7128214230198651
Energy: 0.8675101953061297
Energy: 1.0779102597323953
Energy: 0.7272615035726957
Energy: 0.8229659801230552
Energy: 0.7652019902969195
Energy: 0.7665617347328388
Energy: 0.7720479394810057
Energy: 0.7937589715052358
Energy: 0.7763275360761243
Energy: 0.7900244563356581
Energy: 0.6938356126953402
Energy: 0.6940589159708097
Energy: 0.7899747192008022
Energy: 0.7038552553369611
Energy: 0.6939953395550479
Energy: 0.8370261525957297
Energy: 0.6801195849871705
Energy: 0.682427971527969
Energy: 0.8388208359128265
Energy: 0.6798818398528209
Energy: 0.6943228025900335
Energy: 0.7774207115813939
Energy: 0.6875263260396045
Energy: 0.6872401249542169
Energy: 0.7772876948317323
Energy: 0.6876013862408636
Energy: 0.7104153340657505
Energy: 0.7772640255060069
Energy: 0.7864331609787933
Energy: 0.6906859841038251
Energy: 0.7766358686455381
Energy: 0.7764321167967978
Energy: 0.7931852325898785
Energy: 0.7638664220305557
Energy: 0.7690818476894847
Energy: 0.7107466923428627
Energy: 0.7615955744412303
Energy: 0.789180334030224
Energy: 0.7079246392221614
Energy: 0.8140708709312731
Energy: 0.709465561687251
Energy: 0.7090772377199611
Energy: 0.8145611212581744
Energy: 1.0106641131964291
Energy: 0.7091396826674924
Energy: 0.9460162419630587
Energy: 0.7063372235356514
Energy: 0.7168466775087843
Energy: 0.9474852279018651
Energy: 0.7002400596088366
Energy: 0.7096843511960137
Energy: 1.1911198941023697
Energy: 0.989177945859018
Energy: 0.8139020355670147
Energy: 1.1914285055906895
Energy: 0.9952794970042167
Energy: 0.8134975556831154

minimum gb energy = 0.6794967663120794 eV
minimum distance =  2.30891026062401 Angstroms
sigma value = 57


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

Energy: 1.0123818122338755
Energy: 0.7385912558220032
Energy: 0.744343236167681
Energy: 1.014330036236058
Energy: 0.7381497682571387
Energy: 0.744225290416546
Energy: 0.8469844024291612
Energy: 0.7322729654191394
Energy: 0.7342606348680522
Energy: 0.8251635709488512
Energy: 0.7321303459992984
Energy: 0.7243369898450203
Energy: 0.8660420911407113
Energy: 0.6694910238802392
Energy: 0.6666019335025086
Energy: 0.8659814442787225
Energy: 0.7676311824272183
Energy: 0.6932893896323894
Energy: 0.6973280364516806
Energy: 0.669912986841996
Energy: 0.6671571105236906
Energy: 0.6970497276350166
Energy: 0.8331414633106615
Energy: 0.6963665107996503
Energy: 0.6985559406169066
Energy: 0.7467853021660656
Energy: 0.6846417987083894
Energy: 0.6990014707962388
Energy: 0.7362116750524739
Energy: 0.7165740809335632
Energy: 0.6925619263307257
Energy: 0.7370691853681073
Energy: 0.7220825830654476
Energy: 0.7206776772059444
Energy: 0.7360066633663856
Energy: 0.7094428764439614
Energy: 0.7350757141858288
Energy: 0.6974139816606278
Energy: 0.6973306807384126
Energy: 0.7350932936404737
Energy: 0.702258679479274
Energy: 0.6971659015614216
Energy: 0.7228013168936537
Energy: 0.7174510280868199
Energy: 0.712068125466004
Energy: 0.7227316383002306
Energy: 0.7231753988406664
Energy: 0.7126482105430028
Energy: 0.7340856622795926
Energy: 0.7241037475982915
Energy: 0.7225911589896556
Energy: 0.7334524133493645
Energy: 0.8257802751845367
Energy: 0.7234513156939647
Energy: 1.0545680707971665
Energy: 0.7901173727370323
Energy: 0.7212411298443183
Energy: 0.7338938563759692
Energy: 1.0958055180366164
Energy: 0.6961528473123566
Energy: 0.824489491184977
Energy: 0.7765257714548648
Energy: 0.7821353740470613
Energy: 0.8246835162863453
Energy: 0.7337566432915562
Energy: 0.7245991578038956
Energy: 0.6940772398674708
Energy: 0.8253626292326403
Energy: 0.7249912130779267
Energy: 0.6951591854317827
Energy: 0.825064710151586
Energy: 0.7399334727728468
Energy: 0.69467982877356
Energy: 0.7330454139593302
Energy: 0.7389072025325794
Energy: 0.6464366020354381
Energy: 0.7332118776847533
Energy: 0.7389928586146985
Energy: 0.8251705809757943
Energy: 0.7312459487592398
Energy: 0.7358584534491821
Energy: 0.8252200088678278
Energy: 0.7317251766690644
Energy: 0.7239069369034518
Energy: 0.7237290440297155
Energy: 0.7352034327604711
Energy: 0.7262566519664269
Energy: 0.7246700109662677
Energy: 0.9272283435383377
Energy: 0.7146900766729717
Energy: 0.6999357193030429
Energy: 0.6864800871939712
Energy: 0.6872230278808553
Energy: 0.701195358094764
Energy: 0.7829370802843202
Energy: 0.7122544063078167
Energy: 0.70067143136128
Energy: 0.7362785394388729
Energy: 0.7047052648286845
Energy: 0.6993786618032858
Energy: 0.7221886035552987
Energy: 0.6948107355837739
Energy: 0.7209559585030009
Energy: 0.7129825698854092
Energy: 0.7378775643243106
Energy: 0.7224224220738629
Energy: 0.702028860397667
Energy: 0.7085834120962176
Energy: 0.7352624423480096
Energy: 0.6967328908862813
Energy: 0.7213810352743206
Energy: 0.7349921879261787
Energy: 0.6969457007000794
Energy: 0.7222103186566188
Energy: 0.7357470842229703
Energy: 0.8085654663245561
Energy: 0.7126123746919407
Energy: 0.73350505198985
Energy: 0.8643448270159375
Energy: 0.7218329047238915
Energy: 0.7333823169896817
Energy: 0.7215413179845892
Energy: 0.7228505803108866
Energy: 0.7332409916796403
Energy: 0.7313717761899415
Energy: 0.7363590460685007
Energy: 0.7367250784537286
Energy: 0.7357192050857813
Energy: 0.7255062071081027
Energy: 0.7368209436556074
Energy: 1.0973923912945744
Energy: 0.7245762654415857
Energy: 0.8252683909377597
Energy: 0.7311429143066679
Energy: 0.7233062399106741
Energy: 0.825180122491799
Energy: 0.826079650898805
Energy: 0.7827781916155597
Energy: 0.6721259217772738
Energy: 0.7464341167200659
Energy: 0.7388833027438273
Energy: 0.6464056692235407
Energy: 0.8243778101996079
Energy: 0.7389480028286213

minimum gb energy = 0.6464056692235407 eV
minimum distance =  2.40322382656571 Angstroms
sigma value = 17


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

Energy: 1.0877656223502867
Energy: 1.013330021193622
Energy: 0.8182979532723714
Energy: 1.089444863278447
Energy: 1.0140168777645922
Energy: 0.6852405531314912
Energy: 0.8124586845965064
Energy: 0.7414427376650179
Energy: 0.7312539170331036
Energy: 0.8129185718187455
Energy: 0.7300296321231455
Energy: 0.7311898680906741
Energy: 0.8953946769507904
Energy: 0.6796284721147277
Energy: 0.6791351398766582
Energy: 0.8966987816016044
Energy: 0.681065119710857
Energy: 0.6527958114616917
Energy: 0.7210414568516121
Energy: 0.68045903399065
Energy: 0.6663912469065728
Energy: 0.7210736382056221
Energy: 0.6163425146377444
Energy: 0.7564710624121064
Energy: 0.64201646397269
Energy: 0.6787981067231268
Energy: 0.6793282184808894
Energy: 0.6426558080410691
Energy: 0.7919430924470355
Energy: 0.6848833290026863
Energy: 0.9425882456898683
Energy: 0.6341110534858807
Energy: 0.6342916648603792
Energy: 0.9519719141038618
Energy: 0.6337554290658577
Energy: 0.6681621121964544
Energy: 0.6941716536418642
Energy: 0.6324753036913419
Energy: 0.6326764561081015
Energy: 0.6942170450802524
Energy: 0.6363069205454299
Energy: 0.6569082514776067
Energy: 0.9028048275898778
Energy: 0.6560271430899262
Energy: 0.7172190313678889
Energy: 0.904230399815093
Energy: 0.6559661791910404
Energy: 0.6925472307078601
Energy: 0.634893231013012
Energy: 0.7009072865770312
Energy: 0.659151817268217
Energy: 0.6361809432006942
Energy: 0.6897854043369338
Energy: 0.6329250664597204
Energy: 0.6336473028256268
Energy: 0.7086009961285616
Energy: 0.6825034146762536
Energy: 0.6334964434132617
Energy: 0.7088834444268077
Energy: 0.6483471460643512
Energy: 0.8736815721248766
Energy: 0.7126055801136645
Energy: 0.6768708916377636
Energy: 0.8747035297174584
Energy: 0.6964470034219112
Energy: 0.6710370005245967
Energy: 0.8546198696082183
Energy: 0.7209946903476686
Energy: 0.7209059156753765
Energy: 0.7326203511067476
Energy: 0.721239933201044
Energy: 0.7210187558705887
Energy: 0.7689124491548972
Energy: 0.7947603006848694
Energy: 0.7217789693056995
Energy: 0.722963010152745
Energy: 0.9099468480654983
Energy: 0.7307930562323567
Energy: 0.7625178864193638
Energy: 0.7212421950806495
Energy: 0.7314765766202398
Energy: 0.7625535729435902
Energy: 0.8136471696844517
Energy: 0.7678727820175066
Energy: 0.9746948428970748
Energy: 0.7358843314718531
Energy: 0.7358933766434275
Energy: 0.9778902855128432
Energy: 0.7350937476488065
Energy: 0.7216697010364704
Energy: 0.812028628034059
Energy: 0.7315150127723986
Energy: 0.7671031925872352
Energy: 0.8139618911868359
Energy: 0.7301801183815845
Energy: 0.7309997239346465
Energy: 0.7124237810230012
Energy: 0.7967915228890703
Energy: 0.7893811764218218
Energy: 0.7125155025469787
Energy: 0.796236380253832
Energy: 0.7899400904237559

minimum gb energy = 0.6163425146377444 eV
minimum distance =  2.38038462154973 Angstroms
sigma value = 17


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

Energy: 1.1230193977725347
Energy: 0.9545085114344781
Energy: 0.6731530723269804
Energy: 1.1247405313823438
Energy: 1.0035129534544738
Energy: 0.6633378140196933
Energy: 0.7770756211383371
Energy: 0.7032624237340119
Energy: 0.702363818089928
Energy: 0.7778256440680262
Energy: 0.7105817766260355
Energy: 0.6737518102001857
Energy: 0.8570537090271805
Energy: 0.6362494414717101
Energy: 0.6506602632649772
Energy: 0.8492734738304911
Energy: 0.61122930261426
Energy: 0.6492794026356967
Energy: 0.7124371261623165
Energy: 0.6493485582590558
Energy: 0.6484895253857081
Energy: 0.7133158835112356
Energy: 0.5857147739161171
Energy: 0.6453163987860498
Energy: 0.6242217652406691
Energy: 0.6426785216419103
Energy: 0.6663618988656549
Energy: 0.6248442898969697
Energy: 0.8255534253966367
Energy: 0.6676470309241352
Energy: 0.9873799259357825
Energy: 0.6159049554818958
Energy: 0.6244358851149439
Energy: 0.8422660636988069
Energy: 0.6155347122355811
Energy: 0.624146581841222
Energy: 0.6250582407644932
Energy: 0.616005264148128
Energy: 0.615963660879108
Energy: 0.6253646804079924
Energy: 0.6181367059574407
Energy: 0.6246731096871732
Energy: 0.8265067182073899
Energy: 0.6318885568874965
Energy: 0.6525260005108524
Energy: 0.8265049262741587
Energy: 0.6516251640098042
Energy: 0.652529177650743
Energy: 0.5770543470649525
Energy: 0.6333855698198654
Energy: 0.5764370732227656
Energy: 0.5782299781647426
Energy: 0.5827611644099209
Energy: 0.5769469577997359
Energy: 0.5760380458788403
Energy: 0.6350267307282713
Energy: 0.6515025531597407
Energy: 0.5761739689801627
Energy: 0.6354423041741919
Energy: 0.6565191887337205
Energy: 0.7139916004797646
Energy: 0.5762584730565409
Energy: 0.6923031424048955
Energy: 0.7429471098712438
Energy: 0.57612948308103
Energy: 0.6933623927476716
Energy: 0.578425065395851
Energy: 0.5768550923952668
Energy: 0.5770883456812808
Energy: 0.5799799775194925
Energy: 0.5808398237116887
Energy: 0.5764587387878798
Energy: 0.5759554273172158
Energy: 0.646654077676135
Energy: 0.6458548569932532
Energy: 0.6737670864114386
Energy: 0.8277026973044932
Energy: 0.6373858477781037
Energy: 0.6159392269335026
Energy: 0.6466633538357254
Energy: 0.6592868287151221
Energy: 0.6160875234435935
Energy: 0.5759678605451198
Energy: 0.616157397577072
Energy: 0.6155874360627803
Energy: 0.7099551820266647
Energy: 0.7100622396424691
Energy: 0.6156666461742116
Energy: 0.8356193152311497
Energy: 0.6533253781053088
Energy: 0.8646669852849213
Energy: 0.7799927909107904
Energy: 0.6673691624049546
Energy: 0.8262508482777471
Energy: 0.6684083156409136
Energy: 0.630371338605065
Energy: 0.5762937693730387
Energy: 0.7103777664029394
Energy: 0.7103722397133618
Energy: 0.5772902399073611
Energy: 0.7107434468158487
Energy: 0.6157435487772377
Energy: 0.6298858829707061
Energy: 0.7644404211953814
Energy: 0.7326847778005517
Energy: 0.6300694914642403
Energy: 0.8588284563129943
Energy: 0.6539268904089316
Energy: 0.8753341629274757
Energy: 0.7090155170032768
Energy: 0.6782043173140155
Energy: 0.8772520526293027
Energy: 0.6187963398360148
Energy: 0.7589283833404363
Energy: 0.7960476055463894
Energy: 0.7107067499592004
Energy: 0.702641140930269
Energy: 0.8578193889613438
Energy: 0.8353858288533297
Energy: 0.7903547327265504
Energy: 0.9079514237678538
Energy: 0.701625249311165
Energy: 0.7015311613963994
Energy: 0.909192266528096
Energy: 0.7816734283483583
Energy: 0.7206256482990631
Energy: 0.5848529869330809
Energy: 0.7723995017003293
Energy: 0.7721478270992383
Energy: 0.6613540493568963
Energy: 0.8631177102758768
Energy: 0.6367170267947577
Energy: 0.7424040143512124
Energy: 0.7396476441114699
Energy: 0.732952980902819
Energy: 0.7432924250336118
Energy: 0.7127466891862891
Energy: 0.7719682081128578
Energy: 0.8561862585255026
Energy: 0.6445580541519066
Energy: 0.7323288063436214
Energy: 0.857272905382861
Energy: 0.5845129171135681
Energy: 0.7320571359523255
Energy: 0.7089860085855325
Energy: 0.6594495385728755
Energy: 0.6505054037681739
Energy: 0.7091334725038244
Energy: 0.6587338263575212
Energy: 0.6483012925768892
Energy: 0.7368008231035327
Energy: 0.6475061473143364
Energy: 0.6498101541984784
Energy: 0.738138998737748
Energy: 0.646077309286625
Energy: 0.6485757290799863
Energy: 0.9892658918094365
Energy: 0.7281857909425268
Energy: 0.731706780697343
Energy: 0.6584704093900187
Energy: 0.7279917698819152
Energy: 0.6590889504317521
Energy: 0.6155299258806732
Energy: 0.6157719759118001
Energy: 0.6158717188965667
Energy: 0.6166561825602714
Energy: 0.6175311612021697
Energy: 0.6160013613442731
Energy: 0.8301292386209113
Energy: 0.6732277697154945
Energy: 0.6723463826973356
Energy: 0.8298652718220714
Energy: 0.5848114253331976
Energy: 0.671065320344259
Energy: 0.5761672456162398
Energy: 0.6529440494700938
Energy: 0.6640322962746577
Energy: 0.5763118686203451
Energy: 0.694820294163917
Energy: 0.6333517688199987
Energy: 0.5806901282386007
Energy: 0.649271957236933
Energy: 0.6793300971048563
Energy: 0.5816541255770019
Energy: 0.6419360190526345
Energy: 0.5766660056772014
Energy: 0.8702366989967207
Energy: 0.6638959178529815
Energy: 0.66898341426527
Energy: 0.8711743796061218
Energy: 0.5763637547002709
Energy: 0.6232787980067357
Energy: 0.6992238191967728
Energy: 0.581469422752603
Energy: 0.5768308873986149
Energy: 0.699625978384795
Energy: 0.5774220684162354
Energy: 0.577003815682449
Energy: 0.943741226277771
Energy: 0.6329161983545684
Energy: 0.6056076888096453
Energy: 0.9456246881122543
Energy: 0.5764731696721219
Energy: 0.636436201089654
Energy: 0.6216483910256021
Energy: 0.6287725347580573
Energy: 0.6339551821458088
Energy: 0.615545226974516
Energy: 0.6306411361581018
Energy: 0.7028139644818475
Energy: 0.616056641186274
Energy: 0.6552787686356584
Energy: 0.6162504425411497
Energy: 0.6160942996598183
Energy: 0.6346271799142761
Energy: 0.6155579140943003
Energy: 0.8241620002693159
Energy: 0.6695970085697309
Energy: 0.671603931002891
Energy: 0.8251832513195441
Energy: 0.6298341266272935
Energy: 0.6729326922475236
Energy: 0.8634170958442265
Energy: 0.7094293894790362
Energy: 0.7094715944484135
Energy: 0.6214217214616939
Energy: 0.7104426443638493
Energy: 0.709352591620856
Energy: 1.057172826522753
Energy: 0.8065096661794785
Energy: 0.6164538239732399
Energy: 0.8658078018925598
Energy: 0.8521266291923395
Energy: 0.6056505016333771
Energy: 0.875811664884209
Energy: 0.709103989917826
Energy: 0.6988482060254965
Energy: 0.8755914496949725
Energy: 0.7644189552887597
Energy: 0.7226403539632208
Energy: 0.8059432201954373
Energy: 0.6419175715450052
Energy: 0.6685049557680404
Energy: 0.8005334287824118
Energy: 0.6450055868639423
Energy: 0.6794549716504794
Energy: 0.853405835367729
Energy: 0.6683875263256074
Energy: 0.7386276666535929
Energy: 0.862102426311121
Energy: 0.6281585469064989
Energy: 0.7346279896218607
Energy: 0.7428374065213769
Energy: 0.7928683503256458
Energy: 0.7324615551962921
Energy: 0.7262511044281516
Energy: 0.7655971063419037
Energy: 0.7726078757435272

minimum gb energy = 0.5759554273172158 eV
minimum distance =  2.3658607926572 Angstroms
sigma value = 57


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

Energy: 1.009659957450067
Energy: 0.9460084932702566
Energy: 0.6515065140187062
Energy: 1.0110429685355715
Energy: 0.946936735007616
Energy: 0.6988497714233404
Energy: 0.850268472703578
Energy: 0.6752187017669289
Energy: 0.7263810125726213
Energy: 0.8513197830710857
Energy: 0.6864008234147182
Energy: 0.6195033503857107
Energy: 0.7995906723883699
Energy: 0.6028049277865131
Energy: 0.5924093000508038
Energy: 0.8010095211153038
Energy: 0.7284197522372233
Energy: 0.6450895946246954
Energy: 0.71913919918452
Energy: 0.5893996854954552
Energy: 0.6452348032691313
Energy: 0.7206920360721712
Energy: 0.6817532309755049
Energy: 0.6281786279695912
Energy: 0.5928698414246102
Energy: 0.6041562394889695
Energy: 0.639420642875657
Energy: 0.5933947309450732
Energy: 0.7757042296488671
Energy: 0.6203106558797379
Energy: 0.9176885801798785
Energy: 0.5985579817780742
Energy: 0.591356396663214
Energy: 0.9197650345503889
Energy: 0.5981851464510036
Energy: 0.6127484117053188
Energy: 0.6738800948305567
Energy: 0.6034664206382924
Energy: 0.6028660166986083
Energy: 0.6746360200813661
Energy: 0.602031133199993
Energy: 0.5987156726302435
Energy: 0.7543555917691167
Energy: 0.5803059236428869
Energy: 0.6011325807816791
Energy: 0.6911772878261571
Energy: 0.5958219375207313
Energy: 0.6028109813776005
Energy: 0.5538030052980258
Energy: 0.5781953090606449
Energy: 0.5514518864350395
Energy: 0.554751180263351
Energy: 0.5594347902344045
Energy: 0.5514483654915717
Energy: 0.5512314104626526
Energy: 0.6259176711677611
Energy: 0.6545752810887577
Energy: 0.5512837991837767
Energy: 0.6101660901261043
Energy: 0.6444708715443314
Energy: 0.8498927546147743
Energy: 0.5308265579250989
Energy: 0.6315568292658639
Energy: 0.5990010178539255
Energy: 0.530365620122083
Energy: 0.6329623706565111
Energy: 0.5547026210971168
Energy: 0.537452644518137
Energy: 0.5306941701356601
Energy: 0.5549898830167981
Energy: 0.5348714624934525
Energy: 0.5909047121854589
Energy: 0.5304652931444909
Energy: 0.6177081374854672
Energy: 0.6284548257753856
Energy: 0.5302094577006365
Energy: 0.6025618087186111
Energy: 0.6792287864834988
Energy: 0.53121452481928
Energy: 0.6095616399781846
Energy: 0.5302423307155031
Energy: 0.5324219264533218
Energy: 0.564465452744493
Energy: 0.5307082779915161
Energy: 0.5304206846030779
Energy: 0.5781699746446344
Energy: 0.5903020926887991
Energy: 0.5304801479227356
Energy: 0.5729668844774631
Energy: 0.6366916301512007
Energy: 0.6733707102514543
Energy: 0.5643065877804996
Energy: 0.6570982497431538
Energy: 0.6741269986735753
Energy: 0.5604950863162584
Energy: 0.6522977603553317
Energy: 0.5631405649916426
Energy: 0.560946177259343
Energy: 0.5516949558046083
Energy: 0.5632513781779729
Energy: 0.557649810959351
Energy: 0.5517386521193294
Energy: 0.5987055428198943
Energy: 0.6027020464389201
Energy: 0.6004138600900323
Energy: 0.5627133818653063
Energy: 0.7683849648871827
Energy: 0.5983956821884426
Energy: 0.5983281935440808
Energy: 0.574205988843684
Energy: 0.5979030017204652
Energy: 0.5995496248620401
Energy: 0.5624724499829737
Energy: 0.5979745634322229
Energy: 0.7690664186409232
Energy: 0.6285367866206152
Energy: 0.649730856166067
Energy: 0.7703308598834234
Energy: 0.6037620485728432
Energy: 0.7188556436396424
Energy: 0.8065878201856832
Energy: 0.7430091758915331
Energy: 0.6615076836418051
Energy: 0.7316518509690594
Energy: 0.7160239433901577
Energy: 0.612296058890945
Energy: 0.5937666163179504
Energy: 0.6839260917220654
Energy: 0.5985641216390386
Energy: 0.58662580072881
Energy: 0.6931618943509691
Energy: 0.6148356547023442
Energy: 0.6968506656384176
Energy: 0.7342769534328883
Energy: 0.6975572512442012
Energy: 0.6934681161298185
Energy: 0.8078380912520259
Energy: 0.7003674565203354
Energy: 0.7824970728173641
Energy: 0.598331112034051
Energy: 0.6746825997386464
Energy: 0.7839368069029666
Energy: 0.608777578958492
Energy: 0.6514986238377869
Energy: 0.8086966371903656
Energy: 0.6420103146634756
Energy: 0.6228013784874024
Energy: 0.8078506327287157
Energy: 0.6339475670136259
Energy: 0.7030476846359167
Energy: 0.849627846780298
Energy: 0.6898812472402
Energy: 0.7025248710199596
Energy: 0.8508921854565836
Energy: 0.7351614399912902
Energy: 0.6988903857821714
Energy: 1.0118914006238717
Energy: 0.7354305516476046
Energy: 0.6470236080922739
Energy: 0.6062529852804361
Energy: 0.8076960653625808
Energy: 0.6460704950764995

minimum gb energy = 0.5302094577006365 eV
minimum distance =  2.36767271342694 Angstroms
sigma value = 43


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

Energy: 0.9303844808986033
Energy: 0.760627451480346
Energy: 0.5860882497711427
Energy: 0.9320190390375478
Energy: 0.7588588420602386
Energy: 0.5683713148786521
Energy: 0.687926355552593
Energy: 0.6156405795499958
Energy: 0.6119367952513475
Energy: 0.6320057434843187
Energy: 0.6754060598279459
Energy: 0.52372960349073
Energy: 0.6862375210819793
Energy: 0.4977716138372927
Energy: 0.5156074303775676
Energy: 0.6874264391455145
Energy: 0.563711718151968
Energy: 0.5229866364153156
Energy: 0.6194797852060767
Energy: 0.5184849496224876
Energy: 0.5146759196417099
Energy: 0.6155547980991614
Energy: 0.563181572732411
Energy: 0.5567383415455016
Energy: 0.6044707182459195
Energy: 0.5402622662914784
Energy: 0.534849248227282
Energy: 0.6047118280209137
Energy: 0.6572350175837085
Energy: 0.5270804529286699
Energy: 0.8646120954906479
Energy: 0.5331421666243256
Energy: 0.5163295575903734
Energy: 0.7011254138583699
Energy: 0.5323641579829324
Energy: 0.4964974629078524
Energy: 0.6689444835655574
Energy: 0.5314041817570954
Energy: 0.5314728578018811
Energy: 0.5799045992189663
Energy: 0.5359228338060567
Energy: 0.5683740677176167
Energy: 0.6482316864354255
Energy: 0.5313902518499224
Energy: 0.5009422805843289
Energy: 0.5857400146269599
Energy: 0.4970591803601893
Energy: 0.48919436145301204
Energy: 0.4933359996738793
Energy: 0.488515517283799
Energy: 0.4911174042393936
Energy: 0.4945114025324765
Energy: 0.49931504581015645
Energy: 0.4911059600164778
Energy: 0.4911529702087226
Energy: 0.49455035311453266
Energy: 0.5002051577020479
Energy: 0.49134213769599605
Energy: 0.5108994376272096
Energy: 0.48871039948808426
Energy: 0.6280300912107647
Energy: 0.4666902016103043
Energy: 0.49052532060469695
Energy: 0.49831266095775484
Energy: 0.4660168599422822
Energy: 0.512481507329284
Energy: 0.6328446320107945
Energy: 0.46631592087752544
Energy: 0.4660820247907326
Energy: 0.6345880436651651
Energy: 0.4667394473968403
Energy: 0.5383858265576723
Energy: 0.6126342723445045
Energy: 0.49779740199630823
Energy: 0.4657821336074732
Energy: 0.6121313637683254
Energy: 0.49129725537418345
Energy: 0.49203785907116837
Energy: 0.4517674625373686
Energy: 0.5322445093041677
Energy: 0.4519014272679608
Energy: 0.45311331729785814
Energy: 0.5386941209641991
Energy: 0.4519253490081555
Energy: 0.45236441833057384
Energy: 0.5089523728106354
Energy: 0.5389616593790781
Energy: 0.452466263084054
Energy: 0.5080780170843493
Energy: 0.5381669766323146
Energy: 0.5361523747459308
Energy: 0.4452248260822113
Energy: 0.44551353799220705
Energy: 0.4463827239895375
Energy: 0.4448640741182318
Energy: 0.5343646007627694
Energy: 0.5210077649296357
Energy: 0.4448201886440925
Energy: 0.44515576959468767
Energy: 0.45400421568159594
Energy: 0.44501847230979513
Energy: 0.5331760698612976
Energy: 0.44561782028515184
Energy: 0.522431594286456
Energy: 0.5221151734483636
Energy: 0.4455122816030967
Energy: 0.48163559719785787
Energy: 0.5065411799370041
Energy: 0.4450414775251026
Energy: 0.5570623712893629
Energy: 0.4451168562115906
Energy: 0.4457732488457665
Energy: 0.6200062648390458
Energy: 0.44507003037041637
Energy: 0.4461634754226848
Energy: 0.4655772903685699
Energy: 0.5477294187795749
Energy: 0.447212249908909
Energy: 0.47816535757316947
Energy: 0.5268130622733078
Energy: 0.46805161457604716
Energy: 0.45170241229321256
Energy: 0.4521057876471171
Energy: 0.4687151712601428
Energy: 0.4518111276149723
Energy: 0.5388214952227388
Energy: 0.4482446061534445
Energy: 0.45135144443345226
Energy: 0.45227876583501564
Energy: 0.4469810070000191
Energy: 0.45155348575154847
Energy: 0.5155110934495102
Energy: 0.46656226168405723
Energy: 0.5071860250880148
Energy: 0.5106663879661295
Energy: 0.4669947411418723
Energy: 0.5729509034640483
Energy: 0.5211811586358013
Energy: 0.46651755439928344
Energy: 0.5252610055844462
Energy: 0.46606522842879783
Energy: 0.46798425390893406
Energy: 0.45150969699791693
Energy: 0.4660920216857727
Energy: 0.6233708680714514
Energy: 0.5005857752594333
Energy: 0.4954846482101554
Energy: 0.5795707269141748
Energy: 0.500570432966274
Energy: 0.4956259415122272
Energy: 0.6419752933155128
Energy: 0.49130364445444435
Energy: 0.4911444882279569
Energy: 0.520861578153873
Energy: 0.4913364985905778
Energy: 0.5130125657873481
Energy: 0.6568797155304238
Energy: 0.49147855485058906
Energy: 0.4924919960132772
Energy: 0.49799397647474825
Energy: 0.491491695673262
Energy: 0.5193283926413268
Energy: 0.5314507044346082
Energy: 0.5107857774734119
Energy: 0.5172813515563989
Energy: 0.531504567471801
Energy: 0.5870631888205686
Energy: 0.5046820088122282
Energy: 0.533870265891486
Energy: 0.4992126526770107
Energy: 0.5318032892121987
Energy: 0.5350964842315087
Energy: 0.5672811475873599
Energy: 0.5315561000913981
Energy: 0.6506876384429323
Energy: 0.49318313782549744
Energy: 0.5150764721200154
Energy: 0.6522226345183653
Energy: 0.5094238105095025
Energy: 0.5083422987742323
Energy: 0.6757595322863479
Energy: 0.6155761063237938
Energy: 0.5508981984994133
Energy: 0.5917388967268442
Energy: 0.6191919913302233
Energy: 0.6431721345242394
Energy: 0.8979461493602044
Energy: 0.5991836653786295
Energy: 0.5342255084389443
Energy: 0.7464303638338002
Energy: 0.5993037402310686
Energy: 0.5079163774907685
Energy: 0.6202655280072632
Energy: 0.5988591044023425
Energy: 0.5928777827340311
Energy: 0.6271778916721605
Energy: 0.685451192223642
Energy: 0.5934360900366235
Energy: 0.67490830967511
Energy: 0.5572053450878705
Energy: 0.5401811462663395
Energy: 0.6759091590509355
Energy: 0.5890733401132956
Energy: 0.5941347311464337
Energy: 0.6901983902448002
Energy: 0.5164590712942463
Energy: 0.5501334998758426
Energy: 0.6915302928891208
Energy: 0.5736323387977155
Energy: 0.5512545128035257
Energy: 0.7202436358701583
Energy: 0.5987349584798404
Energy: 0.5911513214585511
Energy: 0.7201677789116081
Energy: 0.6877233177228006
Energy: 0.5924524107740087

minimum gb energy = 0.4448201886440925 eV
minimum distance =  2.35400289125815 Angstroms
sigma value = 81


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

Energy: 0.02383787110624418
Energy: 0.03429089917480177
Energy: 0.0244284123214124
Energy: 0.025887961100075477
Energy: 0.05529814524761114
Energy: 0.024410917495709793
Energy: 0.024571272250857878
Energy: 0.024641861145106598
Energy: 0.024677903341623782
Energy: 0.024683986200154568
Energy: 0.026327031373335825
Energy: 0.024442195509487667
Energy: 0.34993893433876594
Energy: 0.02432173662474281
Energy: 0.024398136003200926
Energy: 0.34455457337573603
Energy: 0.024382454321657473
Energy: 0.0558662887029424
Energy: 0.025916158135284615
Energy: 0.024550891198721763
Energy: 0.02443437296278503
Energy: 0.024648317020867786
Energy: 0.024283301285786152
Energy: 0.056466264284041
Energy: 0.05593252393934633
Energy: 0.34452972337921056
Energy: 0.05534066293046549
Energy: 0.05683518690147334
Energy: 0.3478916837756556
Energy: 0.03412702069419079
Energy: 0.024873555380319722
Energy: 0.05537105612695637
Energy: 0.024505636044291516
Energy: 0.026049305063947467
Energy: 0.024706595790902418
Energy: 0.02445345141042437
Energy: 0.024431356647350924
Energy: 0.024557748164342943
Energy: 0.02478721016115772
Energy: 0.024690252916414974
Energy: 0.024557867223364872
Energy: 0.02462965268002781
Energy: 0.34440045444895667
Energy: 0.024493563286462034
Energy: 0.02446182756950799
Energy: 0.05531606329640351
Energy: 0.024186421003055566
Energy: 0.05624653130045293
Energy: 0.025043634751967296
Energy: 0.02433856047780764
Energy: 0.05725942391513801
Energy: 0.026227464580018008
Energy: 0.0243084797042491
Energy: 0.05775887601407817
Energy: 0.024350836305186616
Energy: 0.34451310111538347
Energy: 0.055254442770461314
Energy: 0.02438427190310143
Energy: 0.3478493900679213
Energy: 0.024387879339784126

minimum gb energy = 0.02383787110624418 eV
minimum distance =  2.5578196180726 Angstroms
sigma value = 3


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

Energy: 0.9589704258840255
Energy: 0.6908396813647961
Energy: 0.6297672028215352
Energy: 0.9601937608028945
Energy: 0.6909610352709445
Energy: 0.5340099971784807
Energy: 0.6001870281679541
Energy: 0.5765528700895403
Energy: 0.563642475702276
Energy: 0.6003262822764114
Energy: 0.6522330648702808
Energy: 0.5857634473366338
Energy: 0.6275882534817886
Energy: 0.5452022851329907
Energy: 0.5452781116370763
Energy: 0.628050776114504
Energy: 0.5628980424920959
Energy: 0.578329127285724
Energy: 0.5951338227535884
Energy: 0.5472399451048877
Energy: 0.546926948995993
Energy: 0.5963694301574629
Energy: 0.49508776173416114
Energy: 0.5902460593219081
Energy: 0.4834952086430392
Energy: 0.5767808730129018
Energy: 0.5894892314851162
Energy: 0.4833615838152375
Energy: 0.5764329369566623
Energy: 0.5950254365187428
Energy: 0.915972549032054
Energy: 0.566225347389149
Energy: 0.5359539068007306
Energy: 0.9062556710490831
Energy: 0.5665483490961489
Energy: 0.5377592086784784
Energy: 0.5661879614491968
Energy: 0.5460606871159182
Energy: 0.5597477353972865
Energy: 0.5664597195602781
Energy: 0.4920374627769677
Energy: 0.5405767265781537
Energy: 0.5965940699373381
Energy: 0.5408142563694975
Energy: 0.541040916663557
Energy: 0.5972014712923752
Energy: 0.5176237137818968
Energy: 0.5255063173722041
Energy: 0.5867814662648475
Energy: 0.5439472075464125
Energy: 0.57926049286347
Energy: 0.5871535174695605
Energy: 0.45503362393323027
Energy: 0.5788065189067906
Energy: 0.45858607754657443
Energy: 0.533587877326284
Energy: 0.533553956824751
Energy: 0.4585410010389052
Energy: 0.5344954128208652
Energy: 0.5332448049273997
Energy: 0.8300451551932104
Energy: 0.5520230943561496
Energy: 0.5474127537142657
Energy: 0.5240213923602635
Energy: 0.5646015426849305
Energy: 0.5246584212798491
Energy: 0.46105009047180734
Energy: 0.5640038142471784
Energy: 0.5722629735752383
Energy: 0.46012601065764797
Energy: 0.5024060024762176
Energy: 0.4570421587507372
Energy: 0.4807075250641612
Energy: 0.5129355823523912
Energy: 0.5289078931682364
Energy: 0.48109811421887305
Energy: 0.5132637370017115
Energy: 0.4796340205485281
Energy: 0.6182855507377587
Energy: 0.43872410817186563
Energy: 0.5400488581381415
Energy: 0.5750865668130376
Energy: 0.43854411931885895
Energy: 0.5337251601702019
Energy: 0.5589214799856862
Energy: 0.44348195482439445
Energy: 0.4433981802325898
Energy: 0.5599828973696196
Energy: 0.4430508791737855
Energy: 0.4417294971870963
Energy: 0.5582690512939207
Energy: 0.5198091431414475
Energy: 0.5198572856513083
Energy: 0.5166555287550691
Energy: 0.5595016561532125
Energy: 0.5184782955099337
Energy: 0.43811135541987595
Energy: 0.5189318436202155
Energy: 0.5238633229471368
Energy: 0.43097072995051156
Energy: 0.5194991202250409
Energy: 0.430857015039892
Energy: 0.43833322469473335
Energy: 0.5455720865263336
Energy: 0.5486301113078853
Energy: 0.4383733410954289
Energy: 0.7042044425874014
Energy: 0.5439493203043405
Energy: 0.7063250052313428
Energy: 0.49490676702250785
Energy: 0.544474935399167
Energy: 0.697591244417627
Energy: 0.49523803110370457
Energy: 0.5437468022864339
Energy: 0.5544850856758552
Energy: 0.42959588494181966
Energy: 0.42909673461180536
Energy: 0.5551415526425656
Energy: 0.42958779829740285
Energy: 0.42900609176446036
Energy: 0.5537066715240173
Energy: 0.5200421632714434
Energy: 0.5189092176371705
Energy: 0.554124829181688
Energy: 0.49926817413089325
Energy: 0.5186838697275366
Energy: 0.45297451450299264
Energy: 0.5166712494050267
Energy: 0.48408749721787414
Energy: 0.4537851131398712
Energy: 0.5165101722202563
Energy: 0.45171008404635893
Energy: 0.43862825372394143
Energy: 0.549170449448388
Energy: 0.5522211667088093
Energy: 0.43890714947905846
Energy: 0.6203349170450186
Energy: 0.559254118013989
Energy: 0.7999947113915764
Energy: 0.4797950295338915
Energy: 0.4798998530084702
Energy: 0.8012377857238037
Energy: 0.4797066794012581
Energy: 0.49439061454373734
Energy: 0.4937607495952112
Energy: 0.45810120038266644
Energy: 0.45752491281620966
Energy: 0.4947721434980253
Energy: 0.46117213456638956
Energy: 0.45769735393852634
Energy: 0.5642197369559537
Energy: 0.5332934587451755
Energy: 0.5336928857969983
Energy: 0.5641581285795343
Energy: 0.5137026441059532
Energy: 0.5476144053113363
Energy: 0.5331121679958631
Energy: 0.5337297581119662
Energy: 0.5179843261604444
Energy: 0.5344667988293949
Energy: 0.5006176484653599
Energy: 0.5333565564361725
Energy: 0.46960855483129893
Energy: 0.5922660404447639
Energy: 0.5935581318803475
Energy: 0.46963992257228376
Energy: 0.5880268246914155
Energy: 0.5903590459360205
Energy: 0.8630963710575399
Energy: 0.594291794492033
Energy: 0.5568101699276671
Energy: 0.5512368788440294
Energy: 0.5943040399221807
Energy: 0.5128755510722571
Energy: 0.49210447046362155
Energy: 0.571260402845696
Energy: 0.5534961432617561
Energy: 0.49246565531619446
Energy: 0.569076722753449
Energy: 0.5684684432669235
Energy: 0.5707148400935409
Energy: 0.5463104986533169
Energy: 0.5459904237482032
Energy: 0.5709621162022509
Energy: 0.5202011170908127
Energy: 0.5478462125225682
Energy: 0.6286041717930553
Energy: 0.553800897604335
Energy: 0.5944423457623169
Energy: 0.6289667125378431
Energy: 0.4639660937139833
Energy: 0.5888802989030222
Energy: 0.496339764790927
Energy: 0.5947294166080548
Energy: 0.5734272675572003
Energy: 0.4962453911710642
Energy: 0.576269526290114
Energy: 0.5746832858187015

minimum gb energy = 0.42900609176446036 eV
minimum distance =  2.3560312518949 Angstroms
sigma value = 67


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

Energy: 0.9488700775114334
Energy: 0.6954682238929365
Energy: 0.7241216807730774
Energy: 0.9502959639844567
Energy: 0.9589284781641804
Energy: 0.735797236178653
Energy: 0.7141838667935191
Energy: 0.6860859227237296
Energy: 0.6793185321928537
Energy: 0.7149187772265566
Energy: 0.7029124589118181
Energy: 0.6800759100277072
Energy: 0.7064179045174089
Energy: 0.6764341536977987
Energy: 0.692377451814677
Energy: 0.7070916834142085
Energy: 0.6832883661256464
Energy: 0.7130960163901126
Energy: 0.6537881749508133
Energy: 0.7057399821974153
Energy: 0.7173681644744231
Energy: 0.6546899786381145
Energy: 0.6265568832330219
Energy: 0.7156792700661203
Energy: 0.6204790725699441
Energy: 0.7174178816915616
Energy: 0.6793672424565684
Energy: 0.6205099431830674
Energy: 0.7041334330215131
Energy: 0.7178488867220639
Energy: 0.8958122484992489
Energy: 0.7300976004843986
Energy: 0.6997640426051539
Energy: 0.9147531983121584
Energy: 0.7301235933432072
Energy: 0.7066467718888243
Energy: 0.6267481497357552
Energy: 0.6604260079844515
Energy: 0.6561556800986977
Energy: 0.6272467480782953
Energy: 0.6403899785624986
Energy: 0.6209591581104664
Energy: 0.6685042458177338
Energy: 0.6760773797328702
Energy: 0.6209541509414341
Energy: 0.6690545050630996
Energy: 0.6775414652294915
Energy: 0.6673715953766759
Energy: 0.6992543132019401
Energy: 0.6942959038535933
Energy: 0.6983010751449924
Energy: 0.6852490384821391
Energy: 0.5703313708451857
Energy: 0.7161356529503887
Energy: 0.5490473533638617
Energy: 0.5889665845831793
Energy: 0.5889974929406738
Energy: 0.5494133449807788
Energy: 0.5881099922412308
Energy: 0.5888894939801121
Energy: 0.7914490493984984
Energy: 0.7079490779791612
Energy: 0.6936662553616854
Energy: 0.6934704607353833
Energy: 0.6438246336774711
Energy: 0.6953412054690862
Energy: 0.5552466051095657
Energy: 0.6765947028308452
Energy: 0.6758542015990547
Energy: 0.5560116221585834
Energy: 0.6922524205257911
Energy: 0.5538875963959745
Energy: 0.5668559271220539
Energy: 0.62876348731767
Energy: 0.6286620543728628
Energy: 0.5677907155232125
Energy: 0.6782282811231491
Energy: 0.5638980054614463
Energy: 0.8038818692191909
Energy: 0.6256649392628307
Energy: 0.6706366776873287
Energy: 0.7270405810909535
Energy: 0.5576783516346125
Energy: 0.6699462689263191
Energy: 0.6195562880489898
Energy: 0.5550242246148507
Energy: 0.5534280756283587
Energy: 0.6202271598017302
Energy: 0.5531552526725905
Energy: 0.5532334298728208
Energy: 0.6834499582072981
Energy: 0.6791843045921339
Energy: 0.6776580565596164
Energy: 0.6775051584792813
Energy: 0.549711015093345
Energy: 0.6757580875447219
Energy: 0.5981234982942703
Energy: 0.6795043805479655
Energy: 0.6290950535561622
Energy: 0.5973660632270905
Energy: 0.6626024611992267
Energy: 0.5955564854960373
Energy: 0.5736874286231446
Energy: 0.7273942144769923
Energy: 0.7061619073601678
Energy: 0.5747198742712932
Energy: 0.6994560762278751
Energy: 0.5697743671817399
Energy: 0.8407242764968194
Energy: 0.7407465749033492
Energy: 0.6504608171476464
Energy: 0.9536148699314376
Energy: 0.7380595560203659
Energy: 0.7156376971419387
Energy: 0.5722788897366516
Energy: 0.64372205588077
Energy: 0.6406228316328805
Energy: 0.5730577262941084
Energy: 0.6432954264279344
Energy: 0.6761209296211327
Energy: 0.6435753356760394
Energy: 0.7129141217417815
Energy: 0.7096481601214403
Energy: 0.6413125414779326
Energy: 0.6247207321329286
Energy: 0.7315297663085714
Energy: 0.7061371465984019
Energy: 0.6625587709908125
Energy: 0.6922430144299812
Energy: 0.7060112525446868
Energy: 0.6723036411884019
Energy: 0.7153804972414652
Energy: 0.6588949638542148
Energy: 0.6258219369432902
Energy: 0.6889995182031502
Energy: 0.6594263547612281
Energy: 0.6226337929063256
Energy: 0.6810649568358615

minimum gb energy = 0.5490473533638617 eV
minimum distance =  2.36982424199219 Angstroms
sigma value = 33


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

Energy: 1.0730464713830268
Energy: 0.9355675341199845
Energy: 0.8311744541566447
Energy: 1.0745656555202139
Energy: 0.9753744025088299
Energy: 0.7534359439098379
Energy: 0.8011627837443496
Energy: 0.7462283918880718
Energy: 0.7457568418024841
Energy: 0.8013883067529608
Energy: 0.7994532106612281
Energy: 0.7735920482718751
Energy: 0.8217805369573852
Energy: 0.7917266867671259
Energy: 0.7934111447973611
Energy: 0.822672676396282
Energy: 0.7836116021802895
Energy: 0.780593281909048
Energy: 0.6998018876622043
Energy: 0.8064669181197831
Energy: 0.8022177066075096
Energy: 0.7007065377507274
Energy: 0.8126563338503217
Energy: 0.8026516902478312
Energy: 0.6884970338367735
Energy: 0.7767013604114988
Energy: 0.7740020737723723
Energy: 0.6869737320099608
Energy: 0.8005391139663971
Energy: 0.8150551296190871
Energy: 0.9892103220447214
Energy: 0.8126920837380476
Energy: 0.8276348492654089
Energy: 0.9906933843607346
Energy: 0.8387882961762225
Energy: 0.7585045344916512
Energy: 0.6864272935939812
Energy: 0.7851155451395612
Energy: 0.7950236983558142
Energy: 0.6869501216874344
Energy: 0.7716970026693263
Energy: 0.6869483714261593
Energy: 0.696505339470888
Energy: 0.7946283317645272
Energy: 0.7972289043035985
Energy: 0.6975312166469039
Energy: 0.7943687557964416
Energy: 0.6964761816428564
Energy: 0.759947005274482
Energy: 0.7218347989383447
Energy: 0.7844381747529107
Energy: 0.759820293256597
Energy: 0.6384467965594974
Energy: 0.7721750139238538
Energy: 0.7910056922797429
Energy: 0.6327294001462912
Energy: 0.632862244306183
Energy: 0.783765507639289
Energy: 0.6346885158367764
Energy: 0.6326589941528439
Energy: 0.8582800319034771
Energy: 0.6998175656554046
Energy: 0.7665704197409029
Energy: 0.7529922144653001
Energy: 0.6317244264008955
Energy: 0.7533725722096528
Energy: 0.6351380060879647
Energy: 0.6948088024647854
Energy: 0.6926454102726317
Energy: 0.6361542504929053
Energy: 0.8066109983373991
Energy: 0.6321466457407879
Energy: 0.6389078266887049
Energy: 0.7736988447804088
Energy: 0.6384203445261555
Energy: 0.6388621042815614
Energy: 0.7848174889735321
Energy: 0.6380532266777552
Energy: 0.9075265699470846
Energy: 0.8003738119683627
Energy: 0.7998066876817733
Energy: 0.7595681250522706
Energy: 0.7425163993502664
Energy: 0.7061188386048296
Energy: 0.7244384429530075
Energy: 0.696339927337887
Energy: 0.6963862719457246
Energy: 0.7221127565690328
Energy: 0.696896720249705
Energy: 0.7168786922270054
Energy: 0.7077978160716191
Energy: 0.7975346597505584
Energy: 0.7973710787910654
Energy: 0.7093810728137253
Energy: 0.6573928637537841
Energy: 0.727730844831922
Energy: 0.8201303390659189
Energy: 0.826522273250815
Energy: 0.8266359115024793
Energy: 0.8124094915273874
Energy: 0.8265528508112981
Energy: 0.7879842563367168
Energy: 0.7989289747594691
Energy: 0.749631345197784
Energy: 0.7486387330241512
Energy: 0.7996484015934802
Energy: 0.7489315014901704
Energy: 0.7345952860204277
Energy: 1.0737682953463261
Energy: 0.7990284342432415
Energy: 0.810472575789171
Energy: 1.0747948930158076
Energy: 0.7987293607032013
Energy: 0.7752735522904128
Energy: 0.7117062936298116
Energy: 0.7479495130059787
Energy: 0.773773144631914
Energy: 0.7123052602378507
Energy: 0.8005523487729109
Energy: 0.7740172264030285
Energy: 0.8117858994024424
Energy: 0.8040742855847766
Energy: 0.8043245431642343
Energy: 0.8257342476144923
Energy: 0.8039858720498796
Energy: 0.7627438611283143
Energy: 0.7667111870344321
Energy: 0.7915191393148734
Energy: 0.7918988234888482
Energy: 0.7676873682628791
Energy: 0.8144571422280712
Energy: 0.7927181914254032
Energy: 0.6884188389517328
Energy: 0.7455870856116436
Energy: 0.7454371728304654
Energy: 0.6886983948885367
Energy: 0.8008092542912816
Energy: 0.8109492027760655
Energy: 0.9883116383131603
Energy: 0.8125771378422979
Energy: 0.8280897591557901
Energy: 0.9896432302039575
Energy: 0.8382876642647942
Energy: 0.7038477731362741
Energy: 0.6876928134915695
Energy: 0.791355657624743
Energy: 0.8204534250024431
Energy: 0.688240851965617
Energy: 0.7729409551029061
Energy: 0.7685499417228621
Energy: 0.6954784787443253
Energy: 0.794630027129686
Energy: 0.739159820702003
Energy: 0.696573858648779
Energy: 0.7944102836516789
Energy: 0.6965060119473482
Energy: 0.7798840219214533
Energy: 0.7818934992369843
Energy: 0.7720062959978923
Energy: 0.7808745586649759
Energy: 0.6285780245062877
Energy: 0.770731957184068
Energy: 0.7628223635195994
Energy: 0.6349130193246467
Energy: 0.635094727374316
Energy: 0.7616055104173541
Energy: 0.6370508286424302
Energy: 0.6292863939649707
Energy: 0.8557307008002961
Energy: 0.6319166516680276
Energy: 0.7032605258933974
Energy: 0.8570570137172493
Energy: 0.6325390966698275
Energy: 0.7692420413835611
Energy: 0.6324409402041473
Energy: 0.6933413947316911
Energy: 0.6946004980439746
Energy: 0.6316202468285711
Energy: 0.8055879252756256
Energy: 0.6321072471441638
Energy: 0.6285982759040603
Energy: 0.766517945163094
Energy: 0.6384907287702082
Energy: 0.6290859465074531
Energy: 0.7806747283940663
Energy: 0.6381305288747401
Energy: 0.6173342165549865
Energy: 0.7982335242587717
Energy: 0.7990018442782596
Energy: 0.7589568505258717
Energy: 0.7427023034093284
Energy: 0.7604338608660923
Energy: 0.7215895022921138
Energy: 0.6966559950490472
Energy: 0.6962626086961964
Energy: 0.7216752904085769
Energy: 0.6989092572622653
Energy: 0.7172948220537374
Energy: 0.7079893443600017
Energy: 0.72928532155158
Energy: 0.7317980487170362
Energy: 0.708563240262531
Energy: 0.6574354781958761
Energy: 0.7302227853059018
Energy: 0.8110075342450165
Energy: 0.8265659702078024
Energy: 0.826697634643354
Energy: 0.810926276507765
Energy: 0.8388242272565131
Energy: 0.7877868173535175
Energy: 0.7981715495654862
Energy: 0.7478333891149662
Energy: 0.7467665644544478
Energy: 0.7990468580893886
Energy: 0.6874192536455235
Energy: 0.7462471890560503
Energy: 1.0754182670657735
Energy: 0.7737688413310814
Energy: 0.8113929095783475
Energy: 0.9615781481127954
Energy: 0.8020051382998913
Energy: 0.7873742388701942

minimum gb energy = 0.6173342165549865 eV
minimum distance =  2.35474193997723 Angstroms
sigma value = 41


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

Energy: 1.0026656771967988
Energy: 1.0287474360503563
Energy: 1.0323132176344234
Energy: 1.0039618491758118
Energy: 1.1873682371475134
Energy: 1.0342390728897606
Energy: 0.8885254306731304
Energy: 0.8923200685528544
Energy: 0.8799749602321788
Energy: 0.886298668856422
Energy: 0.8885599385424247
Energy: 0.8770474989017084
Energy: 0.8740970613998943
Energy: 0.9504196542861676
Energy: 0.953422861046561
Energy: 0.8754131561569066
Energy: 0.9495522605580896
Energy: 0.9003736993609422
Energy: 0.875820204980073
Energy: 0.8441000808630941
Energy: 0.8453610339326717
Energy: 0.8589777887084113
Energy: 0.8432872309545293
Energy: 0.818171582139552
Energy: 0.7504427398628316
Energy: 0.8892064890155943
Energy: 0.8699338127251538
Energy: 0.750769895639538
Energy: 0.8828131455816651
Energy: 0.9138183496611899
Energy: 0.928780562038364
Energy: 0.9485764008630226
Energy: 0.9525664274611297
Energy: 0.9298226925347626
Energy: 0.8963692994832188
Energy: 0.9546527786662803
Energy: 0.7514377273627064
Energy: 0.8604580525859175
Energy: 0.8312531673107143
Energy: 0.7515500635654705
Energy: 0.8579434608008233
Energy: 0.7545697155661258
Energy: 0.7312297059720897
Energy: 0.8692200250303888
Energy: 0.7919969684731876
Energy: 0.7322249307594221
Energy: 0.9349720753319011
Energy: 0.7693767196197797
Energy: 0.84915113703266
Energy: 0.796016878130034
Energy: 0.8600706632770401
Energy: 0.8805353110440995
Energy: 0.7317502706124871
Energy: 0.8672399556081349
Energy: 0.8094084040691627
Energy: 0.7378472811497128
Energy: 0.7322760455211113
Energy: 0.8094121845209782
Energy: 0.7346609771404224
Energy: 0.7321992172214494
Energy: 0.7796704289579162
Energy: 0.7513219138098977
Energy: 0.8313421109443889
Energy: 0.7808724164642351
Energy: 0.6986542009614617
Energy: 0.722016599603255
Energy: 0.8218166305981035
Energy: 0.8748146388573547
Energy: 0.8212000142819784
Energy: 0.8226039485456801
Energy: 1.008324127408484
Energy: 0.8565254531953465
Energy: 0.8886199061631032
Energy: 0.8329800089796969
Energy: 0.856604754984956
Energy: 0.8895975594736673
Energy: 0.8360332226174191
Energy: 0.8783662742033873
Energy: 1.0059090195460247
Energy: 0.8941153823592419
Energy: 1.0273818082592112
Energy: 1.0065860821980883
Energy: 0.8900217141714829
Energy: 1.029124500534741

minimum gb energy = 0.6986542009614617 eV
minimum distance =  2.32941334129164 Angstroms
sigma value = 11


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

Energy: 1.243243710889046
Energy: 1.2062824590458008
Energy: 1.2100944796236552
Energy: 1.2452833955307614
Energy: 1.2956716204027086
Energy: 1.0575108488329572
Energy: 0.976463608086104
Energy: 0.8384546927240134
Energy: 0.8320890717147497
Energy: 0.9771237769708044
Energy: 0.8385490846980048
Energy: 0.8917346069341584
Energy: 0.9798402330448363
Energy: 0.9025679316185284
Energy: 1.019645004819014
Energy: 0.9897831757105652
Energy: 0.9225946264660821
Energy: 1.0036889532408775
Energy: 0.9744992052893686
Energy: 0.8887342136968863
Energy: 0.9091646549807568
Energy: 0.9743163689607035
Energy: 0.8304872166192835
Energy: 0.9098582747802154
Energy: 0.8630098085454311
Energy: 0.8413488880498131
Energy: 0.8712236447262727
Energy: 0.8853282638990092
Energy: 0.8435163615971168
Energy: 0.90241088441598
Energy: 0.9761508423571825
Energy: 0.8302326939211299
Energy: 0.9184538192632696
Energy: 0.9638038757076015
Energy: 0.8172107086455929
Energy: 0.920919702455702
Energy: 0.8169679789989492
Energy: 0.9290400548836888
Energy: 0.9106438969623106
Energy: 0.816921784556786
Energy: 0.9399193180058466
Energy: 0.9110719666231266
Energy: 0.8380675732183758
Energy: 0.9235364280171513
Energy: 0.8936379941715966
Energy: 0.8390115242271242
Energy: 0.8776334488508434
Energy: 0.916337570383751
Energy: 0.8195276784898885
Energy: 0.9924482105481862
Energy: 1.0047738468615444
Energy: 0.8819960285130876
Energy: 0.9840875210300639
Energy: 1.0516786705079737
Energy: 0.8588526650920991
Energy: 1.0083432537046715
Energy: 1.0050553066633612
Energy: 0.8510470522517969
Energy: 1.0424342029990705
Energy: 1.0515055298466744
Energy: 0.83812627748554
Energy: 0.8835518677427722
Energy: 0.8945723284916334
Energy: 0.8392023955303795
Energy: 0.883360124680145
Energy: 0.8318790631867138
Energy: 1.0574427625610583
Energy: 1.0661450044882472
Energy: 1.122919829133577
Energy: 1.0346586792226327
Energy: 1.1295844878119263
Energy: 1.123016284993956
Energy: 0.8181929506458092
Energy: 0.9275221221733333
Energy: 0.938316083733353
Energy: 0.8182126048870085
Energy: 0.9889648220792921
Energy: 0.8945242044243341
Energy: 1.0649665838005096
Energy: 0.992617190223419
Energy: 0.9994979327458765
Energy: 1.0128327859162192
Energy: 0.9885992687199772
Energy: 1.007824871059983
Energy: 0.8026798846975796
Energy: 0.9042229285973098
Energy: 0.9065643187412822
Energy: 0.8032902162105595
Energy: 0.9513261076035919
Energy: 0.8785070862310695
Energy: 0.8018902383087687
Energy: 0.9255147950764462
Energy: 0.8970583212239094
Energy: 0.8031531051194736
Energy: 0.9555730705575844
Energy: 0.818751375421437
Energy: 0.7886411005570043
Energy: 0.9177127764906563
Energy: 0.9049083413258759
Energy: 0.7888246338783856
Energy: 0.9103020359963394
Energy: 0.8869428152005978
Energy: 1.0099290802781677
Energy: 0.8894180340717479
Energy: 0.9126339899287842
Energy: 1.010959359438356
Energy: 0.9004526509458245
Energy: 0.9173745082619604
Energy: 0.8381837668259804
Energy: 0.9021962388688425
Energy: 0.8864885016354046
Energy: 0.8377394144499969
Energy: 0.9085578178649291
Energy: 0.8914641000109172
Energy: 0.9732152128892979
Energy: 0.9363012106726152
Energy: 1.0495663652765193
Energy: 0.9738364950066639
Energy: 0.9563055571658635
Energy: 0.9569131719658426
Energy: 0.8975750675840313
Energy: 0.8985323706642322
Energy: 0.904224515013028
Energy: 0.9059948454908465
Energy: 0.8265989826797936
Energy: 0.8772278404163608
Energy: 0.8365665382038956
Energy: 0.897951200923927
Energy: 0.8816163846179328
Energy: 0.836798540540207
Energy: 0.8976995321715052
Energy: 0.8637891940550839
Energy: 1.1814920938867988
Energy: 0.9784123802244212
Energy: 1.126958155626846
Energy: 1.075087859007766
Energy: 0.9850238936731318
Energy: 1.1256101884028697
Energy: 0.9149020170580816
Energy: 0.838101979502109
Energy: 0.8850851849503121
Energy: 0.9161755541443811
Energy: 0.8378751102391048
Energy: 0.8904382290542068
Energy: 0.8894376682328171
Energy: 0.9599076907268443
Energy: 0.927817173083284
Energy: 0.8910417721784886
Energy: 0.97474004452369
Energy: 0.9277614644475062
Energy: 0.9577040241555174
Energy: 0.8319147846712335
Energy: 0.9049205049908831
Energy: 0.908050002783823
Energy: 0.7887938989863411
Energy: 0.8803389491898513
Energy: 0.9319334234169822
Energy: 0.7933601153188299
Energy: 0.8004786637815227
Energy: 0.9278816091831013
Energy: 0.801015510117971
Energy: 0.8946322714904128
Energy: 0.9170784240435862
Energy: 0.8887056323382824
Energy: 0.8609907218243767
Energy: 0.9019349807902431
Energy: 0.817292882563876
Energy: 0.9056785917793585
Energy: 0.9797005443498392
Energy: 0.9901489411715069
Energy: 0.9789548146915409
Energy: 0.979822138002542
Energy: 1.0080642465041314
Energy: 0.9748801744411497
Energy: 1.0043248055995575
Energy: 0.8188011267409977
Energy: 0.8944597585096974
Energy: 0.9916800136230589
Energy: 0.8183414414153846
Energy: 0.9134223266458492
Energy: 1.246204826289236
Energy: 0.9017519933429512
Energy: 1.197492587814974
Energy: 1.19005849131143
Energy: 0.9699688473696211
Energy: 1.1987369026573143

minimum gb energy = 0.7886411005570043 eV
minimum distance =  2.32860998543046 Angstroms
sigma value = 57


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

Energy: 1.1172896653672708
Energy: 1.2748407224746516
Energy: 0.9768563385102305
Energy: 1.1189359192664392
Energy: 1.2714773137498263
Energy: 0.9775695419534965
Energy: 0.9166556927409331
Energy: 0.8560410569635221
Energy: 0.8496112688045921
Energy: 0.9168906942533027
Energy: 0.8821272883456384
Energy: 0.9199606691079073
Energy: 0.8837379181480031
Energy: 0.9230791546923943
Energy: 0.9226366773246075
Energy: 0.8842541146231621
Energy: 0.9915345959728087
Energy: 0.8803895871613122
Energy: 0.9003661343061292
Energy: 0.9247321258299509
Energy: 0.8494016860102954
Energy: 0.9014062703860033
Energy: 0.9221777051222653
Energy: 0.8497912056008046
Energy: 0.8193280918521403
Energy: 0.8791822316359974
Energy: 0.9469594063790503
Energy: 0.819633776311494
Energy: 0.9034080245696628
Energy: 0.9473828571501168
Energy: 0.9928872045763973
Energy: 0.9260739933993941
Energy: 0.954245748343203
Energy: 0.925985657652854
Energy: 0.8744514976535902
Energy: 0.9555076469469735
Energy: 0.8746527450635244
Energy: 0.8576453823654849
Energy: 0.8997783096371315
Energy: 0.875876719718737
Energy: 0.8598256143625089
Energy: 0.9245122574849592
Energy: 0.916918985270489
Energy: 0.891630582538256
Energy: 0.8951379427766484
Energy: 0.9182417454081436
Energy: 0.8207820340532964
Energy: 0.8945338454739291
Energy: 0.7652472048575846
Energy: 0.8842308338594729
Energy: 0.9741801756028936
Energy: 0.90406956606408
Energy: 0.8803786264783217
Energy: 0.9745467704775528
Energy: 0.7649922873272638
Energy: 0.879153794967721
Energy: 0.974185788199828
Energy: 0.9041472766508818
Energy: 0.8874013620031288
Energy: 0.9743814714368394
Energy: 0.9178359081691085
Energy: 0.9231237857571261
Energy: 0.8953226735459794
Energy: 0.9187091280074094
Energy: 0.8583963143937056
Energy: 0.8499446731905773
Energy: 1.0971049576963496
Energy: 0.9914217419348459
Energy: 0.9253098093593188
Energy: 1.0973554362929079
Energy: 0.9883213746624723
Energy: 1.0964843122577395
Energy: 0.8197219879236853
Energy: 0.9012581662729011
Energy: 0.9014887958371982
Energy: 0.8209146630777061
Energy: 0.9208111914010219
Energy: 0.9307649962827705
Energy: 0.9918431581221285
Energy: 0.8747449128215904
Energy: 0.9486256171731404
Energy: 0.9926144557474149
Energy: 0.9033513735601958
Energy: 0.950707383598314
Energy: 0.9032927319800754
Energy: 0.9007838754425946
Energy: 0.9336050184248348
Energy: 0.9033982274643169
Energy: 0.8620472528511919
Energy: 0.9092807669683022
Energy: 0.875442368982659
Energy: 0.8588151210424646
Energy: 0.9263509144538918
Energy: 0.8743953414468169
Energy: 0.8640228925244497
Energy: 0.8741631048873937
Energy: 0.7646064283225932
Energy: 0.8556539041360406
Energy: 0.8321626366201903
Energy: 0.764926843920166
Energy: 0.8212263598814317
Energy: 0.8750476217193706

minimum gb energy = 0.7646064283225932 eV
minimum distance =  2.34465462597056 Angstroms
sigma value = 9


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

Energy: 1.3346970803960192
Energy: 1.5490972778506327
Energy: 1.1703306673444833
Energy: 1.2449972152403144
Energy: 1.5490626541742452
Energy: 1.1453141423312094
Energy: 0.9826466408776664
Energy: 0.8712476225402542
Energy: 0.8805188944350868
Energy: 0.9919015499177446
Energy: 0.8795996324664352
Energy: 0.8577586996344907
Energy: 0.9724534874771963
Energy: 0.9322815668807121
Energy: 1.0540914970658384
Energy: 0.9744404685189854
Energy: 0.9671546474691629
Energy: 1.0532516477665923
Energy: 0.890906053257976
Energy: 0.8592524698789586
Energy: 0.8321794297557602
Energy: 0.8912970051176418
Energy: 0.871471942804182
Energy: 0.8498918817546259
Energy: 0.9136567957819736
Energy: 0.8743049488807633
Energy: 0.8757447080793298
Energy: 0.9141735574023966
Energy: 0.8768505264749524
Energy: 0.8813135571716262
Energy: 0.9062472233869473
Energy: 0.8632732808423085
Energy: 0.8198745315241084
Energy: 0.8752824545492767
Energy: 0.9032279733861477
Energy: 0.8193437027244184
Energy: 1.2218321279318094
Energy: 0.9486550334157158
Energy: 1.156580084395304
Energy: 1.0090951493564606
Energy: 1.017343248281584
Energy: 1.1594949144650462
Energy: 0.8996870376306167
Energy: 0.8189880365500047
Energy: 0.823356720274971
Energy: 0.9003356427212809
Energy: 0.9440693729297803
Energy: 0.8981175979489228
Energy: 1.0300372581640636
Energy: 0.8884497769948162
Energy: 0.8775335781964606
Energy: 1.0611487154801638
Energy: 0.8863773826906798
Energy: 1.0518195028908486
Energy: 1.0349321047307907
Energy: 0.894605552251412
Energy: 0.8782121079560992
Energy: 0.9877934148392835
Energy: 0.883714535346564
Energy: 0.8803023024041016
Energy: 0.9118124966647102
Energy: 0.902850822863036
Energy: 0.8701077011259813
Energy: 0.9122729914702464
Energy: 0.9029173875715785
Energy: 0.8695405830167938
Energy: 0.8773391632824747
Energy: 0.8946717977444748
Energy: 0.8573940906642422
Energy: 0.87757575083045
Energy: 0.9067835509802404
Energy: 0.8551384975356581
Energy: 1.0202696106356512
Energy: 0.8953111146558672
Energy: 0.9117095242827807
Energy: 0.9490936100438427
Energy: 0.8921680463267687
Energy: 0.9500638608449543
Energy: 1.0569815676164245
Energy: 0.9441723936073243
Energy: 0.9148271803840651
Energy: 1.0578681226856284
Energy: 0.9433843125755332
Energy: 0.9151252527735134
Energy: 0.9062961481166713
Energy: 0.8946703608544613
Energy: 0.8750452796341118
Energy: 0.8772550712541946
Energy: 0.8976991944263776
Energy: 0.8808186003667609
Energy: 0.8737391238479452
Energy: 1.0638880821418608
Energy: 1.2132186949641626
Energy: 0.8735582358486693
Energy: 1.0953666838255416
Energy: 1.215898113331255
Energy: 0.9497731672272688
Energy: 0.9316886210880652
Energy: 0.8317889664421447
Energy: 0.9498995690726044
Energy: 0.9918764659727849
Energy: 0.8319783259963287
Energy: 0.9660174470545431
Energy: 0.9076175840802249
Energy: 0.9204503373131065
Energy: 0.9665975887935666
Energy: 0.9071557985927929
Energy: 0.9165603597836347
Energy: 0.905499895007238
Energy: 0.9388473945173126
Energy: 0.9163922804782143
Energy: 0.9059934648949596
Energy: 0.933582479990511
Energy: 0.9160911244323989
Energy: 0.934380986925672
Energy: 0.9373516169329759
Energy: 0.9313492462762837
Energy: 0.9097386772826788
Energy: 0.9381136111470473
Energy: 0.9163590285576372
Energy: 0.951153099187556
Energy: 0.8789297668103416
Energy: 0.8809709794563686
Energy: 0.9506505612310252
Energy: 0.8739008572730546
Energy: 0.8805291549265123

minimum gb energy = 0.8189880365500047 eV
minimum distance =  2.34211161017546 Angstroms
sigma value = 27


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

Energy: 1.2023592732626773
Energy: 1.2581207126088332
Energy: 1.1021386306460548
Energy: 1.2038753418805819
Energy: 1.2768406099931422
Energy: 1.1033466855101
Energy: 1.0136200227146734
Energy: 0.9707298729515271
Energy: 0.9723398874301428
Energy: 1.0145476110478786
Energy: 0.9065128739167873
Energy: 0.9141848778953682
Energy: 0.9292305382821152
Energy: 0.91099003495468
Energy: 0.9117878602189444
Energy: 0.9297797128035116
Energy: 0.8436824678628978
Energy: 0.9206094710622954
Energy: 0.9371165930034118
Energy: 0.8456011219660189
Energy: 0.8400190958983517
Energy: 0.8744373035982235
Energy: 0.8891270928130803
Energy: 0.8565426841415663
Energy: 0.8471949588427529
Energy: 0.9530203100690041
Energy: 0.9420561559917788
Energy: 0.8477635622950425
Energy: 0.9519211968556176
Energy: 0.9478671361476048
Energy: 0.8555173499967654
Energy: 0.8629871559384296
Energy: 0.8460540079475137
Energy: 0.8558754435580387
Energy: 0.8583944290758337
Energy: 0.8460345670401901
Energy: 1.0013221350205155
Energy: 0.9967291996237977
Energy: 0.9961475699429525
Energy: 1.0020189621973015
Energy: 1.0677503529404782
Energy: 0.9958783773320485
Energy: 0.9148707153667488
Energy: 0.8496045831546563
Energy: 0.910320550150283
Energy: 0.9150255322554007
Energy: 0.9287129808674879
Energy: 0.9161132948793281
Energy: 0.9171348669719991
Energy: 0.9828328317348404
Energy: 0.9863367086725554
Energy: 0.9865454666397578
Energy: 0.9813805992996193
Energy: 0.8769137026763508
Energy: 0.8790961558186927
Energy: 0.880644171652331
Energy: 0.8823718697747979
Energy: 0.8568655341255371
Energy: 0.8834654625854673
Energy: 0.8850317974680321
Energy: 0.992041577208619
Energy: 0.9866098404075818
Energy: 0.9703009858258033
Energy: 0.9883805577427067
Energy: 0.8444246019631323
Energy: 0.9369436687000523
Energy: 0.8982120978637987
Energy: 0.869250877444673
Energy: 0.8689678795052551
Energy: 0.8983135725260516
Energy: 0.8732328161902996
Energy: 0.8690433745212096
Energy: 1.063682777785672
Energy: 1.0004085657582193
Energy: 0.9943049714668742
Energy: 1.0645798434991178
Energy: 1.0044431258104638
Energy: 0.9970341913300058
Energy: 1.0635725471297537
Energy: 0.9279676456496467
Energy: 1.0244556408169196
Energy: 1.064221595238586
Energy: 0.9392914588955961
Energy: 1.023739061396521
Energy: 0.9185941602297992
Energy: 0.8700075244278351
Energy: 0.8916117564935632
Energy: 0.9196386155103773
Energy: 0.8701268438034806
Energy: 0.8874296180284007
Energy: 0.9755046477451238
Energy: 0.9816592949187396
Energy: 0.8390885675397456
Energy: 0.9723387643841062
Energy: 0.9833156693215945
Energy: 0.8564485006458213
Energy: 0.8441041400894241
Energy: 0.9572957460791282
Energy: 0.9567670669213827
Energy: 0.8446105868351256
Energy: 0.9732868431671756
Energy: 0.9536469519040469
Energy: 0.863761569668406
Energy: 0.8693875927747808
Energy: 0.8473300557054105
Energy: 0.8642442425368493
Energy: 0.8672717548217074
Energy: 0.8468016429576571
Energy: 1.0207131412814525
Energy: 0.9960005974798348
Energy: 0.9958578266261908
Energy: 1.0207455997064934
Energy: 1.0667275991827814
Energy: 0.9974881071425593
Energy: 0.9528763004372224
Energy: 1.0144025659231588
Energy: 1.001615748705557
Energy: 0.9532098970456481
Energy: 1.0669030578764407
Energy: 1.0016393778346382
Energy: 0.9444014588651316
Energy: 0.8651174980811911
Energy: 0.8649722233319097
Energy: 0.8519127929393433
Energy: 0.8619029272957061
Energy: 0.8459335381327648
Energy: 0.8423699205136232
Energy: 0.9803061911371627
Energy: 0.8718289484283496
Energy: 0.8429226999131438
Energy: 0.9780099152911791
Energy: 0.8725450730150135
Energy: 0.9412255599215966
Energy: 0.892342037849996
Energy: 0.8915059649482511
Energy: 0.9954512874055351
Energy: 0.8923121300332254
Energy: 0.898018944425185
Energy: 0.9301412074067065
Energy: 0.8895764360191
Energy: 0.8870614319493249
Energy: 0.9298228990817029
Energy: 0.8985805997772514
Energy: 0.8899191467324734
Energy: 1.2021262748596895
Energy: 0.9042942490864585
Energy: 0.9051380855405173
Energy: 1.2022790981800813
Energy: 0.9415614655246118
Energy: 0.8840144458987439

minimum gb energy = 0.8390885675397456 eV
minimum distance =  2.33689101505265 Angstroms
sigma value = 19


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

Energy: 1.2672992923864044
Energy: 1.2901132535082112
Energy: 1.2885078462449338
Energy: 1.1463035858758186
Energy: 1.5797824487307746
Energy: 1.2918807628327895
Energy: 0.9828778587001781
Energy: 0.9301199054538506
Energy: 0.931140909118029
Energy: 0.9829477565451032
Energy: 0.9088676930164568
Energy: 0.8391925330988167
Energy: 0.9188168100105246
Energy: 0.9198802796872277
Energy: 0.898162853220358
Energy: 0.9196260321026626
Energy: 0.9277793846570351
Energy: 0.9073926566519558
Energy: 0.884500504199363
Energy: 0.9073180037582261
Energy: 0.8396187428526743
Energy: 0.8847668615137465
Energy: 0.8716704014640785
Energy: 0.8395558423790098
Energy: 0.8373422501956321
Energy: 0.9214845148472697
Energy: 0.8980401467138023
Energy: 0.8389747090951903
Energy: 0.920443015848135
Energy: 0.8992248670999407
Energy: 0.9242774221774032
Energy: 0.8941914343819773
Energy: 0.8433075259645454
Energy: 0.9247011739854585
Energy: 0.9767957991625841
Energy: 0.8430507057887378
Energy: 0.834073853216749
Energy: 1.2320086905936036
Energy: 1.188437199216256
Energy: 0.9060673415623923
Energy: 1.2326744225646504
Energy: 1.1872004629573296
Energy: 0.9294708492906091
Energy: 0.8436057957900959
Energy: 0.8404013721742659
Energy: 0.9299659097923528
Energy: 0.9415140033403236
Energy: 0.8968896383709845
Energy: 0.8268824286721627
Energy: 0.8511090350603532
Energy: 0.8325941976107921
Energy: 0.8264144969990924
Energy: 0.8590942388398778
Energy: 0.8326809828534367
Energy: 0.8864498798614159
Energy: 0.8753658169622249
Energy: 0.8459305150342392
Energy: 0.8795061468956028
Energy: 0.9087290237996323
Energy: 0.8459983161494616
Energy: 1.0248376632665959
Energy: 0.9811466261149198
Energy: 0.9561702046082737
Energy: 1.026200517969616
Energy: 0.9983549039783686
Energy: 0.9538869448508773
Energy: 0.9027264118147682
Energy: 0.8348997023225038
Energy: 0.8259277324611259
Energy: 0.9119146978632262
Energy: 0.8919046155517073
Energy: 0.8213013064451706
Energy: 1.1458628208246935
Energy: 0.89262901958098
Energy: 0.8744077912039088
Energy: 1.0838374023421182
Energy: 0.8880485394741182
Energy: 0.832554641095573
Energy: 0.9113345019954794
Energy: 0.9134617081742988
Energy: 0.9158431420508389
Energy: 0.9611113072696845
Energy: 0.9059914582167777
Energy: 0.9208874662703187
Energy: 0.8277482249163625
Energy: 0.8342748911899635
Energy: 0.8253331116832903
Energy: 0.8280866437066347
Energy: 0.8110491888316073
Energy: 0.8204272897359227
Energy: 0.8808731933739421
Energy: 0.8245088111707213
Energy: 0.820805209938972
Energy: 0.8811544136585088
Energy: 0.8420320865958891
Energy: 0.8206760195067906
Energy: 1.023181660010085
Energy: 0.8879449355565621
Energy: 1.1054018783834363
Energy: 1.0242826090709642
Energy: 0.8808064533743601
Energy: 1.1068726775322664
Energy: 0.8369687799757846
Energy: 0.9285088422981729
Energy: 0.8298802235271616
Energy: 0.8986932244618285
Energy: 0.9246466093726582
Energy: 0.9369168937453961
Energy: 0.8915496673367727
Energy: 0.9592508706225499
Energy: 0.9205935452115799
Energy: 0.8924937926995796
Energy: 0.9418563314885247
Energy: 0.9032117942521696
Energy: 0.906098450768337
Energy: 0.9398327435684194
Energy: 0.9266954068830974
Energy: 0.9073976414520974
Energy: 0.9598014847652475
Energy: 0.8963167115624251
Energy: 0.8103027862322612
Energy: 0.8370399097453589
Energy: 0.8199274602945466
Energy: 0.8104454978898988
Energy: 0.8287304376443099
Energy: 0.8217941077990819
Energy: 0.8485770880507444
Energy: 0.8315209058903547
Energy: 0.819977112092374
Energy: 0.8490562685121051
Energy: 0.8568757429531709
Energy: 0.8195226312323886
Energy: 0.977556692571155
Energy: 0.8520485527284164
Energy: 0.8410241567451556
Energy: 0.9790768459126798
Energy: 1.1449620197250765
Energy: 0.873986317311283
Energy: 0.9114495673133713
Energy: 0.9265327253906139
Energy: 0.9098651362288958
Energy: 0.9114025668794622
Energy: 0.904499211359653
Energy: 0.8935066717178264
Energy: 0.9239057954750286
Energy: 0.9041452804337263
Energy: 0.8252043606625235
Energy: 0.9091061610477336
Energy: 0.9003120960357096
Energy: 0.8855925691654144
Energy: 0.9303252816447489
Energy: 0.9306985461187911
Energy: 0.9139058087344578
Energy: 0.9308414809666079
Energy: 1.051970301310728
Energy: 0.9139179862193584
Energy: 0.8566926774219586
Energy: 0.839611011502778
Energy: 0.8465307550417895
Energy: 0.8586800834532266
Energy: 0.8458403194571255
Energy: 0.8468533781493942
Energy: 0.8626827546406244
Energy: 0.8432694458395537
Energy: 0.8456951242002823
Energy: 0.857554893229245
Energy: 0.8492585334151962
Energy: 0.8389402949197956
Energy: 1.025159725135456
Energy: 0.9125264091938952
Energy: 0.9155508140193304
Energy: 0.9288674883212458
Energy: 0.911716920053078
Energy: 0.8824806945261333

minimum gb energy = 0.8103027862322612 eV
minimum distance =  2.34795984404524 Angstroms
sigma value = 101


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

Energy: 1.1305393102882035
Energy: 1.4966069258872419
Energy: 1.3211784751898448
Energy: 1.1321757592462065
Energy: 1.4954610244926814
Energy: 1.0250167564987895
Energy: 0.920575330512258
Energy: 0.8355544419043285
Energy: 0.8846893206058583
Energy: 0.9210442818162241
Energy: 0.8632695057980909
Energy: 0.8529217736572172
Energy: 0.9497162585427292
Energy: 0.9530291846079874
Energy: 0.9291692878600465
Energy: 0.9511638858556869
Energy: 0.9538010955483116
Energy: 0.9280976351806101
Energy: 0.8540982198795783
Energy: 0.832373527145555
Energy: 0.8318997941314898
Energy: 0.8548664026501152
Energy: 0.8706701527538844
Energy: 0.831813008597701
Energy: 0.8019933956433861
Energy: 0.9437243022574165
Energy: 0.9256974334210349
Energy: 0.8039900762563246
Energy: 0.9513026069641857
Energy: 0.8234503554048731
Energy: 0.8897509479294408
Energy: 0.8316947663308519
Energy: 0.8311358702393189
Energy: 0.8632156376916593
Energy: 0.9165290942515789
Energy: 0.8356611389969192
Energy: 0.9558503782827633
Energy: 1.188888957832135
Energy: 1.1688354111338224
Energy: 1.0495932262531429
Energy: 0.9500040061254693
Energy: 1.1673208698845239
Energy: 0.8930204031029021
Energy: 0.8342568590993746
Energy: 0.8333481161349412
Energy: 0.8935048006283841
Energy: 0.8726666202795085
Energy: 0.8505118693436736
Energy: 0.7905547854758075
Energy: 0.8267992786930263
Energy: 0.8199982390088886
Energy: 0.7916001231082662
Energy: 0.8454526543681932
Energy: 0.820145558848485
Energy: 0.8399969171225203
Energy: 0.8411870595902319
Energy: 0.8249344948807357
Energy: 0.8404109724561893
Energy: 0.9097346411441508
Energy: 0.8246201838672053
Energy: 0.9300646604635217
Energy: 1.07082104208262
Energy: 1.028544913709516
Energy: 0.9309904632113016
Energy: 1.072133305590438
Energy: 1.0268520887094819
Energy: 0.8934673429187027
Energy: 0.8350425174314713
Energy: 0.851251226675565
Energy: 0.894098416144488
Energy: 0.8196418898940705
Energy: 0.840620369495919
Energy: 0.966951064583649
Energy: 1.1478937985033892
Energy: 1.18298052327474
Energy: 0.9675767142065437
Energy: 0.9459092928640176
Energy: 1.183759061925571
Energy: 0.7965671331106602
Energy: 0.8753626347075739
Energy: 0.8389702584416583
Energy: 0.8246839912281845
Energy: 0.8785198652940699
Energy: 0.8777774394411666
Energy: 0.8456038982626162
Energy: 0.8054722700279344
Energy: 0.8198670132001241
Energy: 0.8466813879867613
Energy: 0.8036938338584042
Energy: 0.820518969469681
Energy: 0.9208866726756736
Energy: 0.8336063172956597
Energy: 0.8327113740701427
Energy: 0.9209010110122308
Energy: 0.8239985140444214
Energy: 0.8316656512044368
Energy: 1.1357495037274707
Energy: 1.0776271524678278
Energy: 1.3095817166744121
Energy: 1.1323038099342149
Energy: 1.0732506758612164
Energy: 1.0392163053306582
Energy: 0.9135082539041073
Energy: 0.8090583398088542
Energy: 0.8362881418270394
Energy: 0.8446431172714283
Energy: 0.8427288440587208
Energy: 0.8571838751015181
Energy: 0.9504748773855639
Energy: 0.9860041561106996
Energy: 0.9452409788948748
Energy: 0.9508746927895909
Energy: 0.9515846565722197
Energy: 0.9434892557115764
Energy: 0.9688432373921962
Energy: 0.9519202830477135
Energy: 0.9540201881540882
Energy: 0.9699899860458316
Energy: 0.9845878298044676
Energy: 0.9526156301528728
Energy: 0.805049609459309
Energy: 0.959890726300664
Energy: 0.9435860400568827
Energy: 0.803092760656276
Energy: 0.96809157167135
Energy: 0.8267480870662017
Energy: 0.8397874571654911
Energy: 0.8866411501544055
Energy: 0.8317364943753423
Energy: 0.8410733554533816
Energy: 0.9246379100620876
Energy: 0.8318098868257677
Energy: 0.8058154588128851
Energy: 1.2083674474558144
Energy: 1.1786765062170166
Energy: 0.8061649165872693
Energy: 1.209651628223332
Energy: 1.179618558958164
Energy: 0.8414523694018985
Energy: 0.8603754424641025
Energy: 0.8381441028544406
Energy: 0.8416830741368391
Energy: 0.83935106651364
Energy: 0.8594042592935518
Energy: 0.7878277407291645
Energy: 0.8269148561217727
Energy: 0.8214746664005613
Energy: 0.7882426438767299
Energy: 0.8460824713541802
Energy: 0.8226528987382565
Energy: 0.7888460516757131
Energy: 0.8506753646135279
Energy: 0.8192457691060313
Energy: 0.7901662732006665
Energy: 0.9225032258141722
Energy: 0.8207567069428899
Energy: 0.9756280103489087
Energy: 1.0523340746145669
Energy: 1.053358007834934
Energy: 0.9764257675575985
Energy: 1.109857606618271
Energy: 1.0508481196971244
Energy: 0.8668190416092346
Energy: 0.8055722382048771
Energy: 0.8107672776521511
Energy: 0.8677363471517591
Energy: 0.8058281893120348
Energy: 0.8442333452148246
Energy: 0.9667763429173745
Energy: 0.8309533132918049
Energy: 0.8743306866863381
Energy: 0.9553733434217094
Energy: 0.9461967244459062
Energy: 0.841025119451525
Energy: 0.9668242971817028
Energy: 0.8888614688761863
Energy: 0.8694443060189668
Energy: 0.9677043225935451
Energy: 0.8769641057530781
Energy: 0.8415713439219324
Energy: 0.8600270135527223
Energy: 0.8190180603775871
Energy: 0.82406235826868
Energy: 0.8457587797201199
Energy: 0.8024971881689164
Energy: 0.8242583038650975
Energy: 0.8448096014216055
Energy: 0.8328341227681597
Energy: 0.8323358535329395
Energy: 0.8469127900337308
Energy: 0.824546594019365
Energy: 0.8321810038120288
Energy: 1.1307622097852694
Energy: 0.8637769570323592
Energy: 0.8009303118926734
Energy: 1.1005748882222157
Energy: 0.8426338316188571
Energy: 0.8014217247600156

minimum gb energy = 0.7878277407291645 eV
minimum distance =  2.34301154708188 Angstroms
sigma value = 33


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

Energy: 0.015402656951205719
Energy: 0.585185637559669
Energy: 0.01587074627251025
Energy: 0.017093138543214665
Energy: 0.5872623868907093
Energy: 0.015872822151673936
Energy: 0.4602324107229282
Energy: 0.11029964730210602
Energy: 0.10998895991434114
Energy: 0.11235108048382753
Energy: 0.11164596579590343
Energy: 0.10981215013900594
Energy: 0.9375244629372247
Energy: 0.5871062933718785
Energy: 0.5854949382780844
Energy: 0.5881650088377803
Energy: 0.5885024969362989
Energy: 0.5854494366578405
Energy: 0.016476622887905124
Energy: 0.11029964730210602
Energy: 0.10998895991475875
Energy: 0.11235108048426971
Energy: 0.11164596579590343
Energy: 0.10981215013900594

minimum gb energy = 0.015402656951205719 eV
minimum distance =  2.52540746421981 Angstroms
sigma value = 1