Model name: model_name=MEAM_LAMMPS_KimKimLee_2009_AlMg__MO_058537087384_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.044650822877884
cohesive_energy=3.360264252923233
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01038304322232042
Energy: 0.010868167318947766
Energy: 0.38299198854046546
Energy: 0.010868167319448804
Energy: 0.010868167318947766
Energy: 0.5098362966744854
Energy: 0.010868167318947766
Energy: 0.5098362966744854
Energy: 0.38299198854046546
Energy: 0.010868167318947766
Energy: 0.01038304322232042
Energy: 0.010868167318947766
Energy: 0.010868167318947766
Energy: 0.5098362966744854
Energy: 0.010868167318947766
Energy: 0.5098362966740121

minimum gb energy = 0.01038304322232042 eV
minimum distance =  2.70790589648165 Angstroms
sigma value = 1


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

Energy: 0.5704700065404031
Energy: 0.5618968517067413
Energy: 0.6278145897887943
Energy: 0.5618968517067413
Energy: 0.5593939001051078
Energy: 0.5699725573980363
Energy: 0.5406652085478325
Energy: 0.5699725573980363
Energy: 0.5398796866792493
Energy: 0.5539260150133153
Energy: 0.5535979479483865
Energy: 0.5539260150127078
Energy: 0.5431455915234863
Energy: 0.5729813553064264
Energy: 0.5444387436506063
Energy: 0.5729813553064264
Energy: 0.5448621766959237
Energy: 0.5683419496013871
Energy: 0.5567062635462471
Energy: 0.5683419496013871
Energy: 0.5390224718634664
Energy: 0.6249774403005071
Energy: 0.5355950442682598
Energy: 0.6249774402998993
Energy: 0.5609336837991299
Energy: 0.5521724817045464
Energy: 0.5395008225124837
Energy: 0.5521724817033311
Energy: 0.5241936147466197
Energy: 0.5659009143638475
Energy: 0.5367742008070311
Energy: 0.5659009143638475
Energy: 0.5442185172368035
Energy: 0.5505701563607414
Energy: 0.5627680681646614
Energy: 0.550570156361349
Energy: 0.5396606594658665
Energy: 0.553210232262143
Energy: 0.5248007851275348
Energy: 0.553210232262143
Energy: 0.5360374815540567
Energy: 0.5680647680932746
Energy: 0.5441848354034665
Energy: 0.5680647680926669
Energy: 0.5735397814193998
Energy: 0.5658404952611628
Energy: 0.5445101109843804
Energy: 0.5658404952611628
Energy: 0.5395154096723416
Energy: 0.5541765423242786
Energy: 0.5611741970812592
Energy: 0.5541765423236709
Energy: 0.5521302793870217
Energy: 0.5620063018505178
Energy: 0.5431336480811491
Energy: 0.5620063018505178
Energy: 0.5521623737864673
Energy: 0.5619255950293729
Energy: 0.5484610747716067
Energy: 0.5619255950293729
Energy: 0.5559541483749245
Energy: 0.5619129693032487
Energy: 0.5521728871664628
Energy: 0.5619129693032487
Energy: 0.5538549037289153
Energy: 0.5538416810324466
Energy: 0.5342215779264387
Energy: 0.5538416810324466
Energy: 0.5406096587512832
Energy: 0.5624081317590701
Energy: 0.5729245504191097
Energy: 0.5624081317596779
Energy: 0.5351582292828015
Energy: 0.564175657752126
Energy: 0.545757218669878
Energy: 0.564175657752126
Energy: 0.5516094547267558
Energy: 0.6253878967310161
Energy: 0.5451471091073673
Energy: 0.6253878967316238
Energy: 0.540086177600637
Energy: 0.5538159682371046
Energy: 0.5240513706581866
Energy: 0.5538159682371046
Energy: 0.5443524920100881
Energy: 0.6364189639108317
Energy: 0.5519774313716035
Energy: 0.6364189639102241
Energy: 0.552326575815373
Energy: 0.5683371290140543
Energy: 0.5340293483592715
Energy: 0.568337129014662
Energy: 0.5481679842681598
Energy: 0.5535430282158029
Energy: 0.5390393154514174
Energy: 0.5535430282158029
Energy: 0.5394598718224096
Energy: 0.6279464997088966
Energy: 0.5616939699778648
Energy: 0.6279464997095042
Energy: 0.5467949914888308
Energy: 0.5657774079582161
Energy: 0.5451933539650536
Energy: 0.5657774079588238
Energy: 0.5543639599423101
Energy: 0.62207770285364
Energy: 0.5442825599081503
Energy: 0.6220777028530324
Energy: 0.5361001512585779
Energy: 0.5521719781324913
Energy: 0.559683749787282
Energy: 0.5521719781324913
Energy: 0.5588419485567412
Energy: 0.5677843721206866
Energy: 0.538038481977498
Energy: 0.5677843721212943
Energy: 0.5708023150000558
Energy: 0.5624300579804314
Energy: 0.5762429015461719
Energy: 0.5624300579810391
Energy: 0.5611077017971723
Energy: 0.5591463663261298
Energy: 0.5394499712180811
Energy: 0.5591463663261298
Energy: 0.5460826515983669
Energy: 0.5563125438482406
Energy: 0.5521201214297108
Energy: 0.556312543847633
Energy: 0.5447121696123957
Energy: 0.5731599324420247
Energy: 0.5460547875874253
Energy: 0.5731599324426323

minimum gb energy = 0.5240513706581866 eV
minimum distance =  2.56915911615588 Angstroms
sigma value = 1


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

Energy: 0.5947491023271746
Energy: 0.60403861602154
Energy: 0.6122266169337004
Energy: 0.6040386160201543
Energy: 0.5747335735039556
Energy: 0.5948661599795714
Energy: 0.5582455113099102
Energy: 0.5948661599795714
Energy: 0.569542790311291
Energy: 0.6069201872037047
Energy: 0.5691751063284576
Energy: 0.6069201872037047
Energy: 0.5599639807492227
Energy: 0.6036560715499345
Energy: 0.5610064840387491
Energy: 0.6036560715506275
Energy: 0.560253863757842
Energy: 0.5898762447584316
Energy: 0.5955860725019002
Energy: 0.5898762447584316
Energy: 0.6034814509613307
Energy: 0.5900923615424396
Energy: 0.5717805485030522
Energy: 0.5900923615424396
Energy: 0.5747488792677172
Energy: 0.6365541557235901
Energy: 0.5648228038520116
Energy: 0.6365541557235901
Energy: 0.5457444044546365
Energy: 0.6049079235392936
Energy: 0.5626951237797042
Energy: 0.6049079235392936
Energy: 0.5598085930491019
Energy: 0.6711416269784138
Energy: 0.5475145015494695
Energy: 0.6711416269777212
Energy: 0.5652611297970428
Energy: 0.6050540171568232
Energy: 0.5789142009391727
Energy: 0.6050540171575159
Energy: 0.5748817628527573
Energy: 0.5856096451022272
Energy: 0.5604882816324601
Energy: 0.5856096451029201
Energy: 0.5524832023213789
Energy: 0.596301381889927
Energy: 0.5899019191496444
Energy: 0.5963013818885413
Energy: 0.5804565379502759
Energy: 0.5875462051617053
Energy: 0.5669906575830572
Energy: 0.5875462051617053
Energy: 0.5798363414361477
Energy: 0.58753953687585
Energy: 0.5769732065908693
Energy: 0.5875395368737714
Energy: 0.5525178202804061
Energy: 0.5963045859565754
Energy: 0.5712836303183865
Energy: 0.5963045859558826
Energy: 0.5748323652625789
Energy: 0.5858834938993562
Energy: 0.5582131385826662
Energy: 0.5858834938993562
Energy: 0.56512871523918
Energy: 0.605050898679766
Energy: 0.5597020670795845
Energy: 0.6050508986790731
Energy: 0.5598178484827017
Energy: 0.6711745369609087
Energy: 0.5475337488643245
Energy: 0.6711745369602159
Energy: 0.5457306559009999
Energy: 0.6065116398349463
Energy: 0.5609842466927913
Energy: 0.6065116398363319
Energy: 0.5747197418011293
Energy: 0.6364160400277916
Energy: 0.5609180696377785
Energy: 0.6364160400277916
Energy: 0.6035300017592654
Energy: 0.5898302864919134
Energy: 0.5621172276842279
Energy: 0.5898302864919134
Energy: 0.5600218563445063
Energy: 0.589865981004348
Energy: 0.5550971735275531
Energy: 0.5898659810064264
Energy: 0.56012914102173
Energy: 0.603586335558867
Energy: 0.5583050452839634
Energy: 0.6035863355595597
Energy: 0.5696438440475723
Energy: 0.6068751873856411
Energy: 0.5691127154440362
Energy: 0.6068751873842554
Energy: 0.5748001455275238
Energy: 0.5950184729299491
Energy: 0.558112151791872
Energy: 0.5950184729278707
Energy: 0.5947491023278675
Energy: 0.60403861602154
Energy: 0.6237048961331122
Energy: 0.6040386160201543
Energy: 0.5747335735046484
Energy: 0.5948661599802642
Energy: 0.558245511310603
Energy: 0.5948661599795714
Energy: 0.569542790311291
Energy: 0.6069201872037047
Energy: 0.578358218701288
Energy: 0.6069201872037047
Energy: 0.5599639807499155
Energy: 0.6036560715492418
Energy: 0.558388543219541
Energy: 0.6036560715506275

minimum gb energy = 0.5457306559009999 eV
minimum distance =  2.52355323259 Angstroms
sigma value = 25


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

Energy: 0.6085117499503416
Energy: 0.6264338644484917
Energy: 0.6887813826641788
Energy: 0.6264338644484917
Energy: 0.5801353428638529
Energy: 0.6274945757424244
Energy: 0.5877287452780457
Energy: 0.6274945757424244
Energy: 0.5785646720544304
Energy: 0.6524420421460817
Energy: 0.588318237026583
Energy: 0.6524420421460817
Energy: 0.5878661816687708
Energy: 0.6440810557644396
Energy: 0.5789753267273341
Energy: 0.6440810557652451
Energy: 0.5809779234237562
Energy: 0.6284418337187144
Energy: 0.581832716714254
Energy: 0.6284418337187144
Energy: 0.6345684662983737
Energy: 0.653416631184895
Energy: 0.593045078428417
Energy: 0.653416631184895
Energy: 0.5787088955613179
Energy: 0.6764414063822028
Energy: 0.5936721965580348
Energy: 0.6764414063822028
Energy: 0.6816087992452855
Energy: 0.6281437323690382
Energy: 0.5710007756550196
Energy: 0.6281437323690382
Energy: 0.5936061898177144
Energy: 0.6093478265975837
Energy: 0.5787132921677733
Energy: 0.6093478265975837
Energy: 0.598020580454138
Energy: 0.6533691391970196
Energy: 0.5761447792859169
Energy: 0.6533691391970196
Energy: 0.5791682723319223
Energy: 0.6256936438480398
Energy: 0.5856476827719438
Energy: 0.6256936438480398
Energy: 0.5709943767641181
Energy: 0.6265285287317244
Energy: 0.5856349064252022
Energy: 0.6265285287317244
Energy: 0.5883472077589084
Energy: 0.6452435855285574
Energy: 0.5758465533785693
Energy: 0.6452435855285574
Energy: 0.5938258524441673
Energy: 0.6405335668639777
Energy: 0.5803423387942648
Energy: 0.6405335668639777
Energy: 0.5844475251121739
Energy: 0.6287137130012498
Energy: 0.5699509689131126
Energy: 0.6287137130012498
Energy: 0.5785243232553042
Energy: 0.5893008364477416
Energy: 0.580867739980464
Energy: 0.5893008364477416
Energy: 0.5696313347565691
Energy: 0.6524897646584511
Energy: 0.5670955766124495
Energy: 0.6524897646584511
Energy: 0.5789401569259388
Energy: 0.6152797095866092
Energy: 0.5805557799757336
Energy: 0.6152797095866092
Energy: 0.577566571658597
Energy: 0.6450950040376427
Energy: 0.5811393026594069
Energy: 0.6450950040368374
Energy: 0.5929150577125674
Energy: 0.6537507717954988
Energy: 0.586293249152188
Energy: 0.6537507717954988
Energy: 0.5912060540561053
Energy: 0.627280479435159
Energy: 0.5857191426466222
Energy: 0.627280479435159
Energy: 0.6093872749042649
Energy: 0.6276184755453335
Energy: 0.6365023556948198
Energy: 0.6276184755453335
Energy: 0.5787681953003544
Energy: 0.6151145016394255
Energy: 0.586272151521644
Energy: 0.61511450163862
Energy: 0.5818074355004039
Energy: 0.6518567058102718
Energy: 0.5973616341527852
Energy: 0.6518567058102718
Energy: 0.5859086921052622
Energy: 0.6246043592459104
Energy: 0.578837721570315
Energy: 0.6246043592459104

minimum gb energy = 0.5670955766124495 eV
minimum distance =  2.52540751073801 Angstroms
sigma value = 9


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

Energy: 0.6160781773438636
Energy: 0.6828264418930036
Energy: 0.7739782887005787
Energy: 0.6828264418939645
Energy: 0.6072796465717725
Energy: 0.64722628891412
Energy: 0.5971538221554784
Energy: 0.6472262889131593
Energy: 0.5906978101161622
Energy: 0.6856666672941435
Energy: 0.5971946032789124
Energy: 0.6856666672931828
Energy: 0.596858392068541
Energy: 0.7000573034607004
Energy: 0.5961512449577648
Energy: 0.7000573034607004
Energy: 0.6637197706249807
Energy: 0.6444897595375096
Energy: 0.5975238442835118
Energy: 0.6444897595384704
Energy: 0.5843931210333223
Energy: 0.6861614295604018
Energy: 0.5979078465896464
Energy: 0.6861614295604018
Energy: 0.596478761863757
Energy: 0.5949964834512538
Energy: 0.595561949145948
Energy: 0.5949964834512538
Energy: 0.6590723586767971
Energy: 0.685862457876086
Energy: 0.5935601650614035
Energy: 0.685862457876086
Energy: 0.5963850035622853
Energy: 0.6470325195545787
Energy: 0.5974224994974174
Energy: 0.6470325195545787
Energy: 0.5965192684192905
Energy: 0.6819611286130123
Energy: 0.598124415618953
Energy: 0.6819611286139732
Energy: 0.5891001005615152
Energy: 0.672260619274959
Energy: 0.5940788651878264
Energy: 0.672260619274959
Energy: 0.5968200870193334
Energy: 0.655192060530052
Energy: 0.5961227457986142
Energy: 0.6551920605290911
Energy: 0.584372331046296
Energy: 0.685913174748998
Energy: 0.5990908032014933
Energy: 0.685913174748998
Energy: 0.6237347439444381
Energy: 0.6010199374172851
Energy: 0.5971773088452335
Energy: 0.6010199374172851
Energy: 0.5843806203343498
Energy: 0.6857414295174237
Energy: 0.6579348961829489
Energy: 0.6857414295183845
Energy: 0.5968027258523793
Energy: 0.6551503764197155
Energy: 0.5961297401551583
Energy: 0.6551503764197155
Energy: 0.5891044074241979
Energy: 0.6722234607389357
Energy: 0.5972977691538538
Energy: 0.6722234607389357
Energy: 0.596527388979393
Energy: 0.6819290205697969
Energy: 0.5981393917429465
Energy: 0.6819290205697969
Energy: 0.5962912394660458
Energy: 0.6470623553784973
Energy: 0.5974909238822441
Energy: 0.6470623553784973
Energy: 0.659055118800977
Energy: 0.6860215502392243
Energy: 0.5936388051531443
Energy: 0.6860215502392243
Energy: 0.5964362893524554
Energy: 0.5949742654407196
Energy: 0.5955621708212235
Energy: 0.5949742654416803

minimum gb energy = 0.584372331046296 eV
minimum distance =  2.65181185486917 Angstroms
sigma value = 25


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

Energy: 0.603945287591148
Energy: 0.7081751606740281
Energy: 0.7956144606694774
Energy: 0.7081751606740281
Energy: 0.5929880413789479
Energy: 0.6015423115170228
Energy: 0.5880369584537367
Energy: 0.6015423115146463
Energy: 0.5881032657357022
Energy: 0.6577640201345512
Energy: 0.5951297818839895
Energy: 0.6577640201393039
Energy: 0.6033993726513854
Energy: 0.6585494037747655
Energy: 0.6778120143607501
Energy: 0.6585494037759536
Energy: 0.6769669112367712
Energy: 0.5928461018586793
Energy: 0.6126830222248264
Energy: 0.5928461018586793
Energy: 0.5903652327337797
Energy: 0.7330814710856293
Energy: 0.5889925843502704
Energy: 0.7330814710856293
Energy: 0.6128994539463714
Energy: 0.657130993067389
Energy: 0.5877026792736318
Energy: 0.657130993067389
Energy: 0.6704265477559945
Energy: 0.7087518335909714
Energy: 0.6031798107770101
Energy: 0.7087518335909714
Energy: 0.5952062897679965
Energy: 0.6597802260855473
Energy: 0.5931443568107649
Energy: 0.6597802260855473
Energy: 0.6880795014323438
Energy: 0.6733840033107543
Energy: 0.5902591397937732
Energy: 0.6733840033107543
Energy: 0.6251316603371221
Energy: 0.708146093601253
Energy: 0.7584667682433502
Energy: 0.708146093601253
Energy: 0.5882648870484073
Energy: 0.6073905357388133
Energy: 0.6900277075595554
Energy: 0.6073905357388133
Energy: 0.6799298658892003
Energy: 0.6729736482523356
Energy: 0.5876385224829529
Energy: 0.6729736482523356
Energy: 0.5878595625956895
Energy: 0.663063134143897
Energy: 0.6034046585165114
Energy: 0.663063134143897
Energy: 0.6018510493250371
Energy: 0.7077611559414634
Energy: 0.6707149929982481
Energy: 0.7077611559414634
Energy: 0.5952660458789993
Energy: 0.6730534178102641
Energy: 0.5903757238558175
Energy: 0.6730534178102641
Energy: 0.5951119925372059
Energy: 0.6258517602840709
Energy: 0.6882530359062381
Energy: 0.6258517602840709

minimum gb energy = 0.5876385224829529 eV
minimum distance =  2.61398468919602 Angstroms
sigma value = 17


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

Energy: 0.6592492942580732
Energy: 0.6600372645311068
Energy: 0.8239268399780723
Energy: 0.6600372645317796
Energy: 0.6848567414988928
Energy: 0.6292076379347914
Energy: 0.600764851765349
Energy: 0.6292076379354644
Energy: 0.6906556155381817
Energy: 0.6579462373361048
Energy: 0.6043879154140218
Energy: 0.6579462373367778
Energy: 0.5999571707923684
Energy: 0.604384988850574
Energy: 0.6499734499711917
Energy: 0.6043849888492282
Energy: 0.7023266252736594
Energy: 0.6746710116489649
Energy: 0.6078516186738032
Energy: 0.6746710116496377
Energy: 0.6045273874889303
Energy: 0.6132523821525051
Energy: 0.68568101311083
Energy: 0.6132523821525051
Energy: 0.601449460737187
Energy: 0.6545543657071405
Energy: 0.6046175227478161
Energy: 0.6545543657071405
Energy: 0.6844096425020934
Energy: 0.604691216504602
Energy: 0.6056846459677596
Energy: 0.604691216505275
Energy: 0.6046436383375121
Energy: 0.6765674754682793
Energy: 0.6945204513312274
Energy: 0.6765674754689524
Energy: 0.7465734339829796
Energy: 0.6346681814456833
Energy: 0.6025794363001046
Energy: 0.6346681814456833
Energy: 0.600620778220404
Energy: 0.6055777834338064
Energy: 0.6921190417605009
Energy: 0.6055777834338064
Energy: 0.6052341177562164
Energy: 0.6523336999946558
Energy: 0.6062465677155107
Energy: 0.6523336999946558
Energy: 0.6856758959360869
Energy: 0.6058505176904142
Energy: 0.604712380835475
Energy: 0.6058505176897413
Energy: 0.602434770422854
Energy: 0.6099539342919033
Energy: 0.6848556967476855
Energy: 0.6099539343093997
Energy: 0.6523765872118158
Energy: 0.6545828758561966
Energy: 0.6048345243387909
Energy: 0.6545828758568695
Energy: 0.6849639569078728
Energy: 0.6047961568890863
Energy: 0.6998042990296109
Energy: 0.6047961568890863
Energy: 0.6044295479184868
Energy: 0.6426958325904323
Energy: 0.697721052150688
Energy: 0.6426958325890865
Energy: 0.6837941704794108
Energy: 0.657838186151492
Energy: 0.6043396636833452
Energy: 0.657838186151492
Energy: 0.6009840998364692
Energy: 0.6584207641231088
Energy: 0.6455462767218072
Energy: 0.6584207641231088
Energy: 0.6005825798839857
Energy: 0.6055183543556235
Energy: 0.6001190045872279
Energy: 0.6055183543556235
Energy: 0.6492224303663962
Energy: 0.6583329036897743
Energy: 0.6908174878711734
Energy: 0.6583329036897743
Energy: 0.601730164262494
Energy: 0.6885636103818196
Energy: 0.7460233772528779
Energy: 0.6885636103818196
Energy: 0.6990862255307102
Energy: 0.6598484321342546
Energy: 0.5988620260817733
Energy: 0.6598484321335815
Energy: 0.6038080680595247
Energy: 0.6562458396017115
Energy: 0.6834680562242067
Energy: 0.6562458396010384
Energy: 0.603972124144966
Energy: 0.6580559465239031
Energy: 0.6844468545904566
Energy: 0.6580559465239031
Energy: 0.6964195355334849
Energy: 0.6047927895994082
Energy: 0.5995038258001357
Energy: 0.6047927895994082
Energy: 0.6072901672398068
Energy: 0.6891395416008438
Energy: 0.7588683135884314
Energy: 0.6891395416015166
Energy: 0.6862657507602828
Energy: 0.6130828710601804
Energy: 0.6914392457472947
Energy: 0.6130828710608227
Energy: 0.7266737854850664
Energy: 0.6062251784955803
Energy: 0.6013431166368206
Energy: 0.6062251784949075
Energy: 0.6046488244857202
Energy: 0.6776481900889928
Energy: 0.6854062472627761
Energy: 0.6776481900889928

minimum gb energy = 0.5988620260817733 eV
minimum distance =  2.49535161142136 Angstroms
sigma value = 53


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

Energy: 0.5521523628780612
Energy: 0.5523335224667955
Energy: 0.8565278339238402
Energy: 0.5523335224667955
Energy: 0.6732055920598452
Energy: 0.600798664002538
Energy: 0.646482510658604
Energy: 0.600798664002538
Energy: 0.5527806775548318
Energy: 0.5526699457128595
Energy: 0.5739008938693676
Energy: 0.5526699457113102
Energy: 0.5528137172343975
Energy: 0.5526944997094193
Energy: 0.5739370265567588
Energy: 0.5526944997078701
Energy: 0.6732695466099922
Energy: 0.600791577876638
Energy: 0.6579034441427781
Energy: 0.600791577876638
Energy: 0.5521523628780612
Energy: 0.5523335224667955
Energy: 0.8094832080204204
Energy: 0.5523335224667955
Energy: 0.6732055920598452
Energy: 0.600798664002538
Energy: 0.6669496089625059
Energy: 0.600798664002538
Energy: 0.5527806775548318
Energy: 0.5526699457113102
Energy: 0.6403563250515218
Energy: 0.5526699457113102
Energy: 0.5528137172343975
Energy: 0.5526944997094193
Energy: 0.6477165845714569
Energy: 0.5526944997078701
Energy: 0.6732695466115414
Energy: 0.600791577876638
Energy: 0.6470831870466345
Energy: 0.600791577876638
Energy: 0.5521523628780612
Energy: 0.5523335224667955
Energy: 0.7696249668405134
Energy: 0.5523335224667955
Energy: 0.6732055920598452
Energy: 0.600798664002538
Energy: 0.6669496089625059
Energy: 0.6007986640040872
Energy: 0.5527806775548318
Energy: 0.5526699457128595
Energy: 0.6672140620111734
Energy: 0.5526699457128595

minimum gb energy = 0.5521523628780612 eV
minimum distance =  2.60635031034418 Angstroms
sigma value = 9


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

Energy: 0.6202789190677443
Energy: 0.6288586652613197
Energy: 0.8345779603908651
Energy: 0.6288586652613197
Energy: 0.7517842534785739
Energy: 0.6502756786619982
Energy: 0.6340688836617618
Energy: 0.6502756786619982
Energy: 0.6278262948048046
Energy: 0.614600047101169
Energy: 0.6377779878737848
Energy: 0.6146000471005957
Energy: 0.702936815793544
Energy: 0.7303635518891846
Energy: 0.6352797141151953
Energy: 0.7303635518886111
Energy: 0.6925553911873077
Energy: 0.641490217341755
Energy: 0.6375939894840482
Energy: 0.641490217341755
Energy: 0.6142891598194822
Energy: 0.6140709279162357
Energy: 0.7257590627978567
Energy: 0.6140709279168093
Energy: 0.8228094270853124
Energy: 0.6383936703014664
Energy: 0.6347553332280123
Energy: 0.6383936703008931
Energy: 0.629489899225014
Energy: 0.683216389589874
Energy: 0.6881090241757352
Energy: 0.6832163895893005
Energy: 0.6295423814943797
Energy: 0.7322113969007314
Energy: 0.621802622633871
Energy: 0.7322113969007314
Energy: 0.6275320122268444
Energy: 0.6428071158887616
Energy: 0.6285105927151622
Energy: 0.6428071158887616
Energy: 0.6334149611728924
Energy: 0.723488132716805
Energy: 0.7905748302163957
Energy: 0.7234881327173783
Energy: 0.6929937387374345
Energy: 0.7598532514350087
Energy: 0.6351088024703052
Energy: 0.7598532514350087
Energy: 0.6306430881958544
Energy: 0.6794608946060459
Energy: 0.7296425965875085
Energy: 0.6794608946066192
Energy: 0.7246472585145933
Energy: 0.723873702670584
Energy: 0.6247007957063424
Energy: 0.723873702670584
Energy: 0.6350884332613594
Energy: 0.6885629865448988
Energy: 0.6522077122320215
Energy: 0.6885629865448988
Energy: 0.6355657948913388
Energy: 0.7322216218263925
Energy: 0.7134886713226369
Energy: 0.7322216218258192
Energy: 0.6505846395866423
Energy: 0.6885393161681336
Energy: 0.6314632930251539
Energy: 0.6885393161681336
Energy: 0.6344494773160945
Energy: 0.638561708092221
Energy: 0.7196687526219929
Energy: 0.638561708092221
Energy: 0.6995848677977965
Energy: 0.6797310064811869
Energy: 0.6160443501055243
Energy: 0.6797310064811869
Energy: 0.6360099530897689
Energy: 0.6496729084802819
Energy: 0.6959774374981091
Energy: 0.6496729084802819
Energy: 0.6861828044345617
Energy: 0.7257735635172397
Energy: 0.689073778616666
Energy: 0.7257735635172397
Energy: 0.6529791875770677
Energy: 0.6824381842444458
Energy: 0.6299044198792556
Energy: 0.6824381842444458
Energy: 0.6219787390378742
Energy: 0.679044798224159
Energy: 0.6317580272271576
Energy: 0.679044798224159
Energy: 0.7816469442888219
Energy: 0.6839082785598872
Energy: 0.6300335613228347
Energy: 0.6839082785598872
Energy: 0.6347955411449802
Energy: 0.7601813044332132
Energy: 0.7810457325549436
Energy: 0.7601813044332132
Energy: 0.6802579857049744
Energy: 0.6145946196209362
Energy: 0.6294583106256022
Energy: 0.6145946196215096
Energy: 0.6461392862311321
Energy: 0.6532770523143053
Energy: 0.7083079092470502
Energy: 0.6532770523143053
Energy: 0.62960179772961
Energy: 0.7221312589516791
Energy: 0.7225881480570592
Energy: 0.7221312589516791
Energy: 0.6771816596293219
Energy: 0.6143143401177148
Energy: 0.6285461002308679
Energy: 0.6143143401182882
Energy: 0.6341666744921178
Energy: 0.7903755536949721
Energy: 0.7815268241262266
Energy: 0.7903755536949721
Energy: 0.7780281087530887
Energy: 0.7275343534112424
Energy: 0.6290936270664392
Energy: 0.7275343534106691
Energy: 0.6250106171171304
Energy: 0.6430590285099373
Energy: 0.6297064305852853
Energy: 0.6430590285099373
Energy: 0.6272300869307111
Energy: 0.6818008698769205
Energy: 0.62812726781499
Energy: 0.6818008698769205
Energy: 0.685540139000736
Energy: 0.7232283204768014
Energy: 0.7139545431397432
Energy: 0.7232283204768014
Energy: 0.6448726639988512
Energy: 0.6922092763736387
Energy: 0.822200431979628
Energy: 0.6922092763730654

minimum gb energy = 0.6140709279162357 eV
minimum distance =  2.55555632317821 Angstroms
sigma value = 73


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

Energy: 0.6637675774688051
Energy: 0.6260206828179595
Energy: 0.8384206924964938
Energy: 0.6260206828179595
Energy: 0.6355111054388871
Energy: 0.6564706225855871
Energy: 0.6291936478752735
Energy: 0.6564706225855871
Energy: 0.6342337666355538
Energy: 0.6294161097515505
Energy: 0.6198119266139199
Energy: 0.6294161097515505
Energy: 0.6397466378347718
Energy: 0.6281896059667279
Energy: 0.6444441438746095
Energy: 0.6281896059667279
Energy: 0.6551921598154674
Energy: 0.6589326666389325
Energy: 0.6200256924765707
Energy: 0.6589326666389325
Energy: 0.6374199367136727
Energy: 0.6211788259588322
Energy: 0.785090819239921
Energy: 0.6211788259588322
Energy: 0.7318146621645801
Energy: 0.7054561090914325
Energy: 0.6393510339119276
Energy: 0.7054561090914325
Energy: 0.6327414186793348
Energy: 0.6147098458601392
Energy: 0.6948004063187233
Energy: 0.6147098458601392
Energy: 0.8407452886070756
Energy: 0.6164577136446396
Energy: 0.6169441530154353
Energy: 0.6164577136446396
Energy: 0.6278284117806686
Energy: 0.6599609751214198
Energy: 0.616838577005702
Energy: 0.6599609751223295
Energy: 0.629023888566631
Energy: 0.6166490313409836
Energy: 0.7687035193212104
Energy: 0.6166490313409836
Energy: 0.6606942680716223
Energy: 0.6274101891353349
Energy: 0.6399075430987026
Energy: 0.6274101891353349
Energy: 0.631782049255269
Energy: 0.6496127878402532
Energy: 0.7293211834224259
Energy: 0.6496127878411629
Energy: 0.78199093827653
Energy: 0.6862921978216282
Energy: 0.6400990422170999
Energy: 0.6862921978207185
Energy: 0.6339674131472033
Energy: 0.6652531190548127
Energy: 0.7352704168049734
Energy: 0.6652531190548127
Energy: 0.7718172490967002
Energy: 0.6159601338156243
Energy: 0.6339698224751377
Energy: 0.6159601338156243
Energy: 0.6674960275651466
Energy: 0.6802113488338687
Energy: 0.6342910708604962
Energy: 0.6802113488338687
Energy: 0.6664474687474287
Energy: 0.6793361040153377
Energy: 0.6408197324313042
Energy: 0.6793361040171574
Energy: 0.7131923865697042
Energy: 0.6145798907238762
Energy: 0.6325668691834974
Energy: 0.6145798907238762
Energy: 0.6361987402247227
Energy: 0.6886040709531284
Energy: 0.8009487045205669
Energy: 0.6886040709531284
Energy: 0.7706289792259515
Energy: 0.62096670367076
Energy: 0.6382594643706209
Energy: 0.6209667036716696
Energy: 0.6443304962372532
Energy: 0.6557061772615022
Energy: 0.7121080721379878
Energy: 0.655706177262412

minimum gb energy = 0.6145798907238762 eV
minimum distance =  2.55365745159734 Angstroms
sigma value = 7


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

Energy: 0.6312783857631421
Energy: 0.6311018248490232
Energy: 0.8221281969548057
Energy: 0.6311018248496666
Energy: 0.7491049249487609
Energy: 0.6546152844695398
Energy: 0.6187588985351794
Energy: 0.65461528446761
Energy: 0.6246416993294408
Energy: 0.6315806753471314
Energy: 0.6420489168452107
Energy: 0.6315806753484178
Energy: 0.6567986500865488
Energy: 0.6602973433166702
Energy: 0.6282549139386512
Energy: 0.6602973433153836
Energy: 0.6247766611639646
Energy: 0.6494736456933964
Energy: 0.6315684448311706
Energy: 0.6494736456927531
Energy: 0.6251800864775434
Energy: 0.6322354141464943
Energy: 0.7875705782222437
Energy: 0.6322354141464943
Energy: 0.732013928394686
Energy: 0.692379679155229
Energy: 0.6505418012825782
Energy: 0.6923796791565155
Energy: 0.6250542569885467
Energy: 0.6314925836489086
Energy: 0.8277395978236557
Energy: 0.6314925836495519
Energy: 0.7060698639615026
Energy: 0.6558026417698938
Energy: 0.6269488794482688
Energy: 0.6558026417692506
Energy: 0.6246059767403191
Energy: 0.6658619905352139
Energy: 0.7028468822524616
Energy: 0.665861990537787
Energy: 0.6561460809263994
Energy: 0.7082742528110848
Energy: 0.650927391851646
Energy: 0.7082742528104417
Energy: 0.6311752331286189
Energy: 0.6494616640524635
Energy: 0.6561961261726448
Energy: 0.6494616640499196
Energy: 0.6336866114270322
Energy: 0.6324111573149286
Energy: 0.6545542610257169
Energy: 0.6324111573149286
Energy: 0.6317452687849869
Energy: 0.6283206407041704
Energy: 0.6443462634844366
Energy: 0.6283206407028837
Energy: 0.6163317411461636
Energy: 0.6599532216348974
Energy: 0.7546414393855917
Energy: 0.659953221636184
Energy: 0.8262501846696673
Energy: 0.6279973400985576
Energy: 0.6317333110914483
Energy: 0.6279973400985576
Energy: 0.6256318655904805
Energy: 0.6482264122790754
Energy: 0.6985309070836813
Energy: 0.6482264122771456
Energy: 0.6258571844854671
Energy: 0.6255802881810073
Energy: 0.6440289294350237
Energy: 0.6255802881790776
Energy: 0.6257857735835433
Energy: 0.7079847815543061
Energy: 0.6511413994247837
Energy: 0.7079847815549494
Energy: 0.617323982503511
Energy: 0.6528521502082585
Energy: 0.6305564531575422
Energy: 0.6528521502082585
Energy: 0.6403635777518271
Energy: 0.7088375827453479
Energy: 0.6269820923186763
Energy: 0.7088375827472778
Energy: 0.6245690083184511
Energy: 0.6319541366650098
Energy: 0.64394860626671
Energy: 0.6319541366650098
Energy: 0.7869948102834536
Energy: 0.6563658426281179
Energy: 0.6438303840369376
Energy: 0.6563658426287612
Energy: 0.631485737365198
Energy: 0.6311922040223712
Energy: 0.8159965995372715
Energy: 0.6311922040230145
Energy: 0.6317179447183419
Energy: 0.6524747221277959
Energy: 0.6504266111209022
Energy: 0.6524747221265094
Energy: 0.6377469122214671
Energy: 0.660766738098289
Energy: 0.649381357504793
Energy: 0.6607667380989324
Energy: 0.6248027606513882
Energy: 0.6626766530321149
Energy: 0.690691410036126
Energy: 0.6626766530327582
Energy: 0.6724503158937716
Energy: 0.6485777509002196
Energy: 0.628293408027613
Energy: 0.6485777509002196
Energy: 0.6287111900148389
Energy: 0.6311992972527403
Energy: 0.7426470409642589
Energy: 0.631199297252097
Energy: 0.6823437369122718
Energy: 0.6448435013232109
Energy: 0.6177145891533871
Energy: 0.6448435013219243
Energy: 0.6287151021443359
Energy: 0.6313229985928451
Energy: 0.7577769949995125
Energy: 0.6313229985928451

minimum gb energy = 0.6163317411461636 eV
minimum distance =  2.53991492790328 Angstroms
sigma value = 29


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

Energy: 0.5941606453820313
Energy: 0.5811448002429814
Energy: 0.8610205743031627
Energy: 0.5811448002427573
Energy: 0.6589463803124896
Energy: 0.5719408894141889
Energy: 0.5732677901273078
Energy: 0.5719408894144129
Energy: 0.6045232074610802
Energy: 0.609204590797001
Energy: 0.6583986248696087
Energy: 0.6092045907967769
Energy: 0.5938130674358284
Energy: 0.5943373227073806
Energy: 0.6694632787695707
Energy: 0.5943373227073806
Energy: 0.5943019189910387
Energy: 0.592401275132805
Energy: 0.6141450169295658
Energy: 0.592401275132805
Energy: 0.5811703149364601
Energy: 0.6092181351291642
Energy: 0.5811844243618436
Energy: 0.6092181351289402
Energy: 0.581146237843019
Energy: 0.5925404707560945
Energy: 0.5943028946407809
Energy: 0.5925404707565426
Energy: 0.6695236446892314
Energy: 0.594534063628635
Energy: 0.5937846099867096
Energy: 0.5945340636284359
Energy: 0.6582625122426858
Energy: 0.6091930448576622
Energy: 0.6585965492588055
Energy: 0.6091930448578864

minimum gb energy = 0.5719408894141889 eV
minimum distance =  2.59977551220326 Angstroms
sigma value = 5


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

Energy: 0.5941065645698663
Energy: 0.5917500545247851
Energy: 0.7119106504946024
Energy: 0.5917500545247851
Energy: 0.6018812470778724
Energy: 0.5867081470596704
Energy: 0.5913649172573183
Energy: 0.5867081470590628
Energy: 0.5821390116827654
Energy: 0.5877744788755026
Energy: 0.6960302130941809
Energy: 0.5877744788755026
Energy: 0.5950877430289072
Energy: 0.6144062922202858
Energy: 0.5848467258616844
Energy: 0.6144062922196781
Energy: 0.5861179916579361
Energy: 0.6173721836636338
Energy: 0.6402930001655526
Energy: 0.6173721836636338
Energy: 0.6178205250826755
Energy: 0.592289822928154
Energy: 0.5811125436324633
Energy: 0.592289822928154
Energy: 0.5829890564816858
Energy: 0.6158019727416513
Energy: 0.5937700056723473
Energy: 0.6158019727416513
Energy: 0.5805414351830054
Energy: 0.5927791345900139
Energy: 0.5832961033926093
Energy: 0.5927791345894061
Energy: 0.5865541265275741
Energy: 0.6160795118832821
Energy: 0.5862758916710706
Energy: 0.6160795118838899
Energy: 0.5830662459205361
Energy: 0.6161612800594983
Energy: 0.6030336907642999
Energy: 0.6161612800588907
Energy: 0.5988742207468576
Energy: 0.6149842840521116
Energy: 0.5881688175477031
Energy: 0.6149842840521116
Energy: 0.5880145628721671
Energy: 0.6182209556702013
Energy: 0.5930360427353505
Energy: 0.6182209556702013
Energy: 0.6187067309299062
Energy: 0.5919131955462521
Energy: 0.5938994967302585
Energy: 0.5919131955468597
Energy: 0.592066006468976
Energy: 0.5929348308724638
Energy: 0.6038282137940156
Energy: 0.5929348308724638
Energy: 0.7059758524376298
Energy: 0.5814055611333452
Energy: 0.5880142005354723
Energy: 0.5814055611333452
Energy: 0.583353621655616
Energy: 0.588124443352399
Energy: 0.702624740541676
Energy: 0.588124443352399
Energy: 0.6749300683244437
Energy: 0.5885169686894419
Energy: 0.5913385995705476
Energy: 0.5885169686894419
Energy: 0.5861832579385591
Energy: 0.5918729002618021
Energy: 0.7550970329688392
Energy: 0.5918729002624097
Energy: 0.592472391648535
Energy: 0.6173813144526346
Energy: 0.5835094153958893
Energy: 0.6173813144532423
Energy: 0.5831744593960556
Energy: 0.6452944053905122
Energy: 0.5845852489759183
Energy: 0.6452944053899045
Energy: 0.5931897703024817
Energy: 0.6129539288923425
Energy: 0.5869994358570512
Energy: 0.6129539288923425
Energy: 0.5941935563801332
Energy: 0.6159411512800697
Energy: 0.5815235569069718
Energy: 0.6159411512800697
Energy: 0.5911406752620585
Energy: 0.5930152064806358
Energy: 0.5968359794910887
Energy: 0.593015206481851
Energy: 0.5918313521596479
Energy: 0.6175844383768458
Energy: 0.5910527427628438
Energy: 0.6175844383768458
Energy: 0.5970889423129873
Energy: 0.5924921758095514
Energy: 0.5891840659456964
Energy: 0.5924921758101591
Energy: 0.5917543159208114
Energy: 0.5929162095428047
Energy: 0.5861842041463741
Energy: 0.5929162095428047
Energy: 0.5911776217639423
Energy: 0.5786310529839372
Energy: 0.6138596668384942
Energy: 0.5786310529839372
Energy: 0.7096247608521675
Energy: 0.6155663553566219
Energy: 0.5833450217472173
Energy: 0.6155663553578371
Energy: 0.5922555522512196
Energy: 0.5862499943417447
Energy: 0.6240839425292146
Energy: 0.5862499943435678
Energy: 0.762320114994404
Energy: 0.5918833388136229
Energy: 0.5861118846743155
Energy: 0.5918833388124075
Energy: 0.5828218044939454
Energy: 0.5845956360307486
Energy: 0.7408830863728592
Energy: 0.5845956360301409
Energy: 0.6736494091602853
Energy: 0.619662075236166
Energy: 0.582067760035981
Energy: 0.6196620752373814
Energy: 0.5849802952171903
Energy: 0.6144136565466619
Energy: 0.591939813540504
Energy: 0.6144136565460543

minimum gb energy = 0.5786310529839372 eV
minimum distance =  2.52750893789058 Angstroms
sigma value = 1


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

Energy: 0.5659093145693789
Energy: 0.5659646003073647
Energy: 0.720140342524427
Energy: 0.5659646003073647
Energy: 0.5907599024558827
Energy: 0.5536541377506835
Energy: 0.5660239010250733
Energy: 0.5536541377506835
Energy: 0.5537156556252706
Energy: 0.5664182133938089
Energy: 0.6459174687684343
Energy: 0.5664182133921286
Energy: 0.6767042392998691
Energy: 0.5974723890995476
Energy: 0.5580220249349942
Energy: 0.5974723890995476
Energy: 0.55373281265785
Energy: 0.5690003502510249
Energy: 0.6270202926552606
Energy: 0.5690003502518651
Energy: 0.5541618668342679
Energy: 0.5966069604994155
Energy: 0.5581983184123811
Energy: 0.5966069604994155
Energy: 0.5538738956863583
Energy: 0.6083124412639304
Energy: 0.5572330885883308
Energy: 0.6083124412647706
Energy: 0.5540289390124143
Energy: 0.5664601831573182
Energy: 0.5879659960521736
Energy: 0.5664601831556378
Energy: 0.5659241085976167
Energy: 0.5691028069159189
Energy: 0.5637033005687302
Energy: 0.5691028069167591
Energy: 0.5660163848422609
Energy: 0.569197705078429
Energy: 0.5880284828091666
Energy: 0.569197705078429
Energy: 0.5541106151673328
Energy: 0.5665914668794905
Energy: 0.5634914683835284
Energy: 0.5665914668794905
Energy: 0.5540035717833992
Energy: 0.608372864002328
Energy: 0.5628137675839707
Energy: 0.608372864002328
Energy: 0.5542068213334788
Energy: 0.5974830491733744
Energy: 0.558026299983795
Energy: 0.5974830491725341
Energy: 0.5537036583997665
Energy: 0.5689835935060058
Energy: 0.6437420496351492
Energy: 0.5689835935060058
Energy: 0.6765439292550566
Energy: 0.5974342704164071
Energy: 0.5580262266694462
Energy: 0.5974342704172473
Energy: 0.5537066511632028
Energy: 0.5663864744322649
Energy: 0.5811332367803551
Energy: 0.5663864744314245
Energy: 0.5906510458510006
Energy: 0.5536450151688304
Energy: 0.5660250930454268
Energy: 0.5536450151696705
Energy: 0.5659093145693789
Energy: 0.5659646003073647
Energy: 0.8109501873169771
Energy: 0.5659646003065246
Energy: 0.5907599024550424
Energy: 0.5536541377506835
Energy: 0.5660239010250733
Energy: 0.5536541377498433
Energy: 0.5537156556252706
Energy: 0.5664182133929688
Energy: 0.7569514616504163
Energy: 0.5664182133921286
Energy: 0.6767042392998691
Energy: 0.5974723890987074
Energy: 0.5580220249349942
Energy: 0.5974723890995476
Energy: 0.5537328126570099
Energy: 0.5690003502510249
Energy: 0.6270202926552606
Energy: 0.5690003502518651
Energy: 0.5541618668334277
Energy: 0.5966069605002557
Energy: 0.5581983184123811
Energy: 0.5966069605002557
Energy: 0.5538738956863583
Energy: 0.6083124412639304
Energy: 0.5572330886084952
Energy: 0.6083124412647706

minimum gb energy = 0.5536450151688304 eV
minimum distance =  2.54447285413103 Angstroms
sigma value = 17


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

Energy: 0.5629213209149134
Energy: 0.5630422413654218
Energy: 0.8235983916634053
Energy: 0.5630422413659412
Energy: 0.592072580422387
Energy: 0.5608806869671162
Energy: 0.5561691229073955
Energy: 0.5608806869655583
Energy: 0.5543631631031265
Energy: 0.5568496606807446
Energy: 0.5997260281516432
Energy: 0.5568496606812638
Energy: 0.5880504452972704
Energy: 0.5502111799503425
Energy: 0.5532095759578354
Energy: 0.5502111799508618
Energy: 0.5505796947631862
Energy: 0.591549585760519
Energy: 0.6402755566641026
Energy: 0.5915495857594804
Energy: 0.5671401021019562
Energy: 0.6520201717683475
Energy: 0.5597097865616643
Energy: 0.6520201717683475
Energy: 0.5674337473463849
Energy: 0.582596992898329
Energy: 0.5593227581884018
Energy: 0.582596992898329
Energy: 0.5494257258548227
Energy: 0.6538026182778134
Energy: 0.5536677358286282
Energy: 0.6538026182783326
Energy: 0.5643237176374295
Energy: 0.6577081526383726
Energy: 0.5618592250928588
Energy: 0.6577081526383726
Energy: 0.5664822016230097
Energy: 0.5822372955903803
Energy: 0.5547244811161176
Energy: 0.5822372955903803
Energy: 0.5573676907629921
Energy: 0.6479981261770962
Energy: 0.5566432616257041
Energy: 0.6479981261765769
Energy: 0.5528359975654017
Energy: 0.5814419083365959
Energy: 0.5476193234282895
Energy: 0.5814419083371153
Energy: 0.5506279488590063
Energy: 0.6531500282650179
Energy: 0.5558534035364469
Energy: 0.6531500282650179
Energy: 0.5616943162173139
Energy: 0.5903918589578042
Energy: 0.563050051221223
Energy: 0.5903918589578042
Energy: 0.5528030356381659
Energy: 0.6480493039363608
Energy: 0.5684850930115769
Energy: 0.6480493039363608
Energy: 0.5575471058337307
Energy: 0.5573111159837292
Energy: 0.6407486738772051
Energy: 0.5573111159847679
Energy: 0.5757824536291961
Energy: 0.6474138948787812
Energy: 0.5560236330618704
Energy: 0.6474138948787812
Energy: 0.5502550212898288
Energy: 0.5632367535174093
Energy: 0.7612187268601213
Energy: 0.5632367535179288
Energy: 0.6054328296314133
Energy: 0.5836802413216777
Energy: 0.5563468741270313
Energy: 0.5836802413211584
Energy: 0.556819595939432
Energy: 0.5566673187533475
Energy: 0.7107141039721748
Energy: 0.5566673187533475
Energy: 0.5693047595397116
Energy: 0.5562507869767414
Energy: 0.565652933573306
Energy: 0.5562507869767414
Energy: 0.5662537763375332
Energy: 0.5643513409531472
Energy: 0.5699604720320862
Energy: 0.5643513409515893
Energy: 0.5760908434546989
Energy: 0.5561512551003215
Energy: 0.5580873526180823
Energy: 0.55615125510136
Energy: 0.5567594058476336
Energy: 0.5834017377604827
Energy: 0.6440002480619246
Energy: 0.5834017377599634
Energy: 0.6844279235440587
Energy: 0.5633599534040945
Energy: 0.5515200937470736
Energy: 0.5633599534040945
Energy: 0.5574720120891898
Energy: 0.5911483416578738
Energy: 0.5543782206546158
Energy: 0.5911483416578738
Energy: 0.6202602764794326
Energy: 0.579379942040815
Energy: 0.5587316268118458
Energy: 0.5793799420413341
Energy: 0.5713144873250352
Energy: 0.6485782314360723
Energy: 0.5557153206583029
Energy: 0.6485782314365914
Energy: 0.5630352090475258
Energy: 0.5897316586742345
Energy: 0.5638361734361337
Energy: 0.5897316586747537
Energy: 0.557442547369291
Energy: 0.6538167465910302
Energy: 0.5655329794308186
Energy: 0.6538167465910302
Energy: 0.5548738746743139
Energy: 0.5891546644026667
Energy: 0.5573008592139613
Energy: 0.589154664403186
Energy: 0.5597752881399882
Energy: 0.6466116242572635
Energy: 0.5552968191517194
Energy: 0.6466116242572635
Energy: 0.5589295653699611
Energy: 0.5824248531081337
Energy: 0.6274727618057667
Energy: 0.582424853108653
Energy: 0.5769491350031989
Energy: 0.6568666547091873
Energy: 0.5620880917484762
Energy: 0.6568666547091873
Energy: 0.5531358384571082
Energy: 0.56361215884226
Energy: 0.5783551296776756
Energy: 0.5636121588427793
Energy: 0.5603110911895826
Energy: 0.5835003493228225
Energy: 0.568183978364221
Energy: 0.5835003493228225
Energy: 0.5580323571898063
Energy: 0.6517471022448749
Energy: 0.5689365163712228
Energy: 0.6517471022448749
Energy: 0.5770809528395411
Energy: 0.5923902067975736
Energy: 0.5577180094005785
Energy: 0.5923902067975736

minimum gb energy = 0.5476193234282895 eV
minimum distance =  2.54126284570449 Angstroms
sigma value = 89


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

Energy: 0.49262328476412076
Energy: 0.49267169356371254
Energy: 0.7148435485414097
Energy: 0.49267169356371254
Energy: 0.49295556797421825
Energy: 0.5088641359695256
Energy: 0.5033427586162218
Energy: 0.5088641359695256
Energy: 0.5014158852215178
Energy: 0.572845359901489
Energy: 0.6302433523629263
Energy: 0.572845359901489
Energy: 0.6318771610906403
Energy: 0.5088626013217367
Energy: 0.5033799672732966
Energy: 0.5088626013217367
Energy: 0.5013940104833188
Energy: 0.49425089714544385
Energy: 0.6333180214384782
Energy: 0.49425089714544385
Energy: 0.5015109598096974
Energy: 0.492858429486405
Energy: 0.49497900989977844
Energy: 0.492858429486405
Energy: 0.5015797824988399
Energy: 0.5732776839796954
Energy: 0.4928452387775897
Energy: 0.5732776839796954
Energy: 0.5058145828471797
Energy: 0.6666750951099353
Energy: 0.5032105095867695
Energy: 0.6666750951099353
Energy: 0.5014335460986281
Energy: 0.532275002317994
Energy: 0.630061796831072
Energy: 0.532275002317994
Energy: 0.5088711979745819
Energy: 0.6206219325091883
Energy: 0.5013862658424753
Energy: 0.6206219325091883
Energy: 0.49259044480662206
Energy: 0.5089553824002206
Energy: 0.5013548031408731
Energy: 0.5089553824002206
Energy: 0.4926453746956761
Energy: 0.5712792886023454
Energy: 0.5032740669314691
Energy: 0.5712792886023454
Energy: 0.5015044806707988
Energy: 0.5304251996894057
Energy: 0.5043979314940379
Energy: 0.5304251996894057
Energy: 0.501426429241991
Energy: 0.5300901250462204
Energy: 0.5014491302348416
Energy: 0.5300901250475794
Energy: 0.495493789989561
Energy: 0.5304382079118339
Energy: 0.5013949880833821
Energy: 0.5304382079104751

minimum gb energy = 0.49259044480662206 eV
minimum distance =  2.55287698722695 Angstroms
sigma value = 13


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

Energy: 0.5018048110660613
Energy: 0.49233300046767037
Energy: 0.6491533240813461
Energy: 0.49233300046880935
Energy: 0.5267857598261068
Energy: 0.5031875919061626
Energy: 0.4913352866593417
Energy: 0.5031875919067321
Energy: 0.4927437459003017
Energy: 0.49260204257746515
Energy: 0.569643635986822
Energy: 0.4926020425757566
Energy: 0.49090191420583323
Energy: 0.5033087973366449
Energy: 0.48836138253357736
Energy: 0.5033087973360754
Energy: 0.4964126730142272
Energy: 0.5184733512988686
Energy: 0.5216208545508056
Energy: 0.5184733512977296
Energy: 0.48596846458747217
Energy: 0.5055256129788609
Energy: 0.49173562246558006
Energy: 0.5055256129771523
Energy: 0.4962073748734229
Energy: 0.6212898978448076
Energy: 0.5994188879648332
Energy: 0.6212898978470857
Energy: 0.48541473411946356
Energy: 0.5036582793159387
Energy: 0.49174082406499176
Energy: 0.5036582793136607
Energy: 0.49627683395639544
Energy: 0.5210351188004517
Energy: 0.5449919242766725
Energy: 0.5210351188015906
Energy: 0.5756643458040155
Energy: 0.5274978760882366
Energy: 0.48831657629171904
Energy: 0.5274978760882366
Energy: 0.4964510461078211
Energy: 0.5282403447498942
Energy: 0.49257526418169423
Energy: 0.5282403447498942
Energy: 0.5956920324446572
Energy: 0.5278273765934883
Energy: 0.4927214994853613
Energy: 0.5278273765940578
Energy: 0.5081827542737646
Energy: 0.4965994416768529
Energy: 0.5012801350241936
Energy: 0.49659944167856135
Energy: 0.6084880006579454
Energy: 0.5277259143624616
Energy: 0.49288204376729783
Energy: 0.5277259143624616
Energy: 0.4963479254487233
Energy: 0.49187717333971087
Energy: 0.48946990341959795
Energy: 0.49187717333971087
Energy: 0.4843797925417054
Energy: 0.5276574763440147
Energy: 0.48679121170441414
Energy: 0.5276574763434452
Energy: 0.4923988601728219
Energy: 0.5143982410396225
Energy: 0.48709634470761515
Energy: 0.5143982410413309
Energy: 0.49112077858365605
Energy: 0.5199195922485959
Energy: 0.48999275479152615
Energy: 0.5199195922480264
Energy: 0.4922839921705873
Energy: 0.5221594718548849
Energy: 0.48993771980448436
Energy: 0.5221594718554544
Energy: 0.4922875838881489
Energy: 0.5223675899519759
Energy: 0.49012999243738364
Energy: 0.5223675899525454
Energy: 0.4910205326802899
Energy: 0.5198908686314897
Energy: 0.49006234865822185
Energy: 0.5198908686314897
Energy: 0.4921547515872825
Energy: 0.5144244360422512
Energy: 0.48711397476913904
Energy: 0.5144244360422512
Energy: 0.4843584656669998
Energy: 0.5277218055690702
Energy: 0.48705153124197004
Energy: 0.5277218055679312
Energy: 0.4963484508395599
Energy: 0.4918335399757771
Energy: 0.4878387781463225
Energy: 0.49183353997748563
Energy: 0.6088677013843623
Energy: 0.5278770700810036
Energy: 0.4928972896115419
Energy: 0.5278770700787256
Energy: 0.5086046212582682
Energy: 0.49651333214806986
Energy: 0.4862169896363636
Energy: 0.49651333214693094
Energy: 0.5958662071985877
Energy: 0.5278562169177654
Energy: 0.492678159597347
Energy: 0.5278562169177654
Energy: 0.496270184642672
Energy: 0.528061763639975
Energy: 0.49243349399414904
Energy: 0.5280617636371275
Energy: 0.5754671510850858
Energy: 0.5276300176406813
Energy: 0.48830984348260004
Energy: 0.5276300176406813
Energy: 0.49652497498631687
Energy: 0.5210570630164424
Energy: 0.5847006170465678
Energy: 0.5210570630164424
Energy: 0.48544366082121115
Energy: 0.5034553395176793
Energy: 0.491616893819883
Energy: 0.5034553395188184
Energy: 0.49911586457385376
Energy: 0.6219261099126623
Energy: 0.6358126191993446
Energy: 0.6219261099120929
Energy: 0.4860380684706953
Energy: 0.5056483069389205
Energy: 0.4917710973218379
Energy: 0.5056483069366424
Energy: 0.49634244083392515
Energy: 0.518671834657363
Energy: 0.5238473473005407
Energy: 0.5186718346562239
Energy: 0.49094917240179664
Energy: 0.5032069569001638
Energy: 0.48837074177658674
Energy: 0.5032069569001638

minimum gb energy = 0.4843584656669998 eV
minimum distance =  2.5676896515541 Angstroms
sigma value = 37


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

Energy: 0.5324887631069428
Energy: 0.5427274111154636
Energy: 0.45514549844303553
Energy: 0.5427274111144837
Energy: 0.524805754640742
Energy: 0.586301514627575
Energy: 0.4514469727835756
Energy: 0.586301514627575
Energy: 0.4606392295715032
Energy: 0.6004985416724973
Energy: 0.6023306300627277
Energy: 0.6004985416724973
Energy: 0.48969942824788165
Energy: 0.4624403288304514
Energy: 0.4532841969758973
Energy: 0.4624403288304514
Energy: 0.4527190983341926
Energy: 0.5865212851428054
Energy: 0.4758635758963552
Energy: 0.5865212851428054
Energy: 0.4553427440007431
Energy: 0.5882263423175096
Energy: 0.510201603239942
Energy: 0.5882263423175096
Energy: 0.45979088575461147
Energy: 0.7157600448632402
Energy: 0.5836901160343361
Energy: 0.7157600448632402
Energy: 0.44115791539828614
Energy: 0.4619115639033957
Energy: 0.46351922563762005
Energy: 0.4619115639033957
Energy: 0.45185374989467375
Energy: 0.586775864666207
Energy: 0.5424949619506527
Energy: 0.586775864666207
Energy: 0.6026564820282677
Energy: 0.5870983541604684
Energy: 0.510176405514414
Energy: 0.5870983541614483
Energy: 0.45238057289313993
Energy: 0.6866954268316156
Energy: 0.495530703011348
Energy: 0.6866954268316156
Energy: 0.60744362718293
Energy: 0.4616766178991428
Energy: 0.45338045028628915
Energy: 0.4616766178991428
Energy: 0.5082977906878923
Energy: 0.5867230796750925
Energy: 0.4494710710130855
Energy: 0.5867230796741127
Energy: 0.5983468398612807
Energy: 0.7133922103719027
Energy: 0.4456877477357741
Energy: 0.7133922103728826
Energy: 0.5326507373556246
Energy: 0.4843366285426406
Energy: 0.44590240689808053
Energy: 0.4843366285426406
Energy: 0.5271765187461872
Energy: 0.5873359734563458
Energy: 0.4513493668175127
Energy: 0.5873359734573256
Energy: 0.5083126523282194
Energy: 0.5878272323278328
Energy: 0.4518051507191658
Energy: 0.5878272323288127
Energy: 0.49558793005898283
Energy: 0.687693352811253
Energy: 0.4524368501531692
Energy: 0.6876933528122329
Energy: 0.45248678553669225
Energy: 0.461690251537742
Energy: 0.45054082458737077
Energy: 0.461690251537742
Energy: 0.45027755045126977
Energy: 0.5873807727655461
Energy: 0.5037765725475387
Energy: 0.5873807727655461

minimum gb energy = 0.44115791539828614 eV
minimum distance =  2.54528901605265 Angstroms
sigma value = 25


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

Energy: 0.43118758110859534
Energy: 0.4136759131467743
Energy: 0.4190120081816801
Energy: 0.4136759131460092
Energy: 0.49114050620169714
Energy: 0.6167809003524838
Energy: 0.4125802609833022
Energy: 0.6167809003517187
Energy: 0.4078165093056488
Energy: 0.4079117928940867
Energy: 0.7367844145806128
Energy: 0.4079117928940867
Energy: 0.416439968384583
Energy: 0.6183782094432967
Energy: 0.4115666521645725
Energy: 0.6183782094432967
Energy: 0.4116906860922355
Energy: 0.6166270421614652
Energy: 0.4196634290487229
Energy: 0.6166270421607001
Energy: 0.39864855171022645
Energy: 0.618571800018171
Energy: 0.4126974703073381
Energy: 0.618571800018171
Energy: 0.4122536901165056
Energy: 0.4094743315398948
Energy: 0.41782360102749516
Energy: 0.40947433154065993
Energy: 0.4000212663442254
Energy: 0.5331062062633374
Energy: 0.40881554652330104
Energy: 0.5331062062625722
Energy: 0.4115650410298225
Energy: 0.6168722734490264
Energy: 0.5281034888484696
Energy: 0.6168722734497915
Energy: 0.399363196920421
Energy: 0.4105482322948904
Energy: 0.4320920931196366
Energy: 0.4105482322956554
Energy: 0.41223051063176125
Energy: 0.40926150446235987
Energy: 0.5523493920553117
Energy: 0.4092615044615948
Energy: 0.5113753285620943
Energy: 0.6515547578973272
Energy: 0.40882031988515216
Energy: 0.651554757896562
Energy: 0.4115172948415301
Energy: 0.6173651657115924
Energy: 0.47556660441835347
Energy: 0.6173651657123576
Energy: 0.5208362648692557
Energy: 0.6295122573463526
Energy: 0.4126096377512712
Energy: 0.6295122573463526
Energy: 0.41209420986624806
Energy: 0.4092311860216642
Energy: 0.4024796734895997
Energy: 0.4092311860216642
Energy: 0.5053090155345201
Energy: 0.6376684654565262
Energy: 0.4114051774723252
Energy: 0.6376684654565262
Energy: 0.41165851494013367
Energy: 0.5331810241305418
Energy: 0.400051067393194
Energy: 0.5331810241305418
Energy: 0.48964887376524985
Energy: 0.6163799689296252
Energy: 0.4124045187638668
Energy: 0.6163799689296252
Energy: 0.4349600884251318
Energy: 0.40812183992907514
Energy: 0.39896751836860733
Energy: 0.40812183992831
Energy: 0.5521930133382011
Energy: 0.6351312849620208
Energy: 0.4112953384246498
Energy: 0.6351312849620208
Energy: 0.4117535681580035
Energy: 0.6502287806720859
Energy: 0.40021724064959496
Energy: 0.6502287806720859
Energy: 0.4081027958846101
Energy: 0.6166740958645884
Energy: 0.4109205491737825
Energy: 0.6166740958645884
Energy: 0.4123332404391302
Energy: 0.6283047985601715
Energy: 0.5209727697478902
Energy: 0.6283047985601715
Energy: 0.39951794492406195
Energy: 0.6344064783109579
Energy: 0.41126747455600565
Energy: 0.6344064783109579
Energy: 0.41143599775485457
Energy: 0.6504352249003222
Energy: 0.49624477837687775
Energy: 0.6504352249003222
Energy: 0.3990604876556556
Energy: 0.5328859330907834
Energy: 0.4079280368102655
Energy: 0.5328859330907834

minimum gb energy = 0.39864855171022645 eV
minimum distance =  2.48337151609851 Angstroms
sigma value = 41


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

Energy: 0.5322806463848136
Energy: 0.5508705538108752
Energy: 0.7015597972846522
Energy: 0.5508705538108752
Energy: 0.5044628870372037
Energy: 0.37969405998837014
Energy: 0.37226043723039853
Energy: 0.3796940599889974
Energy: 0.3821866204676985
Energy: 0.37371042498418633
Energy: 0.4707027720509036
Energy: 0.3737104249854409
Energy: 0.44375335252591475
Energy: 0.377369499917201
Energy: 0.37220438968191677
Energy: 0.3773694999178283
Energy: 0.3693452186637212
Energy: 0.557959826705736
Energy: 0.3863888456589607
Energy: 0.5579598267051087
Energy: 0.3831242022832532
Energy: 0.37646438999448245
Energy: 0.37230002743138974
Energy: 0.3764643899951098
Energy: 0.37158389745804665
Energy: 0.38053895339655797
Energy: 0.383677420637059
Energy: 0.38053895339091265
Energy: 0.36553048896550205
Energy: 0.4680669683178355
Energy: 0.36993771730937597
Energy: 0.4680669683172083
Energy: 0.37386953325971223
Energy: 0.5762998712916769
Energy: 0.47438103284396127
Energy: 0.5762998712923041
Energy: 0.36944754272009833
Energy: 0.3720515021549489
Energy: 0.3826882016687362
Energy: 0.37205150215306715
Energy: 0.37162227426537753
Energy: 0.3785665730227449
Energy: 0.5046908352130818
Energy: 0.3785665730214904
Energy: 0.36482413634705213
Energy: 0.5494711229079817
Energy: 0.532830701429919
Energy: 0.5494711229079817
Energy: 0.37391281872757726
Energy: 0.5777191693734017
Energy: 0.5529199063290854
Energy: 0.5777191693734017
Energy: 0.45869571068829207
Energy: 0.49805656275419924
Energy: 0.3826394475691862
Energy: 0.49805656275545374
Energy: 0.3715964281902262
Energy: 0.3792482936801399
Energy: 0.48963994864977184
Energy: 0.37924829367825813
Energy: 0.46676113535845476
Energy: 0.5782525395916582
Energy: 0.3698532132394058
Energy: 0.578252539591031
Energy: 0.3739481773001887
Energy: 0.5773116580507424
Energy: 0.4597218044108384
Energy: 0.5773116580507424
Energy: 0.46370015719452523
Energy: 0.49597851947377036
Energy: 0.3721905358306724
Energy: 0.49597851947502497
Energy: 0.371669010008616
Energy: 0.4680203848218595
Energy: 0.36527234283427784
Energy: 0.46802038482123226
Energy: 0.44960754337264713
Energy: 0.5782331821062854
Energy: 0.3740767360991225
Energy: 0.5782331821069125
Energy: 0.3844190430633303
Energy: 0.5774733810097429
Energy: 0.36663563205326005
Energy: 0.5774733810097429
Energy: 0.5880873955738743
Energy: 0.6068819626854267
Energy: 0.3721919622110053
Energy: 0.6068819626854267
Energy: 0.5340020034102549
Energy: 0.5497628244190821
Energy: 0.3653123612500686
Energy: 0.5497628244184548
Energy: 0.5021949165736476
Energy: 0.5780115680371141
Energy: 0.37401890219294925
Energy: 0.5780115680371141
Energy: 0.38445531361979646
Energy: 0.5761634463424594
Energy: 0.3669201588141782
Energy: 0.5761634463430867
Energy: 0.48841367882599057
Energy: 0.6056350860879491
Energy: 0.37217304344486013
Energy: 0.605635086087322
Energy: 0.37169937197903874
Energy: 0.5756372826924324
Energy: 0.46775976451226975
Energy: 0.5756372826924324
Energy: 0.3739458910324323
Energy: 0.5766642089039109
Energy: 0.373931904340248
Energy: 0.5766642089039109
Energy: 0.3739613240774593
Energy: 0.5996428868623626
Energy: 0.46418941791203994
Energy: 0.5996428868617353
Energy: 0.36967138219872187
Energy: 0.5948332811879858
Energy: 0.37426333265264483
Energy: 0.5948332811886131
Energy: 0.3718530051988879
Energy: 0.5757989885831342
Energy: 0.4516769399285286
Energy: 0.5757989885825069
Energy: 0.3696452106239244
Energy: 0.5765440170041995
Energy: 0.3870656725597902
Energy: 0.5765440170041995

minimum gb energy = 0.36482413634705213 eV
minimum distance =  2.47864034851319 Angstroms
sigma value = 15


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

Energy: 0.48506685319752785
Energy: 0.5429616672279035
Energy: 0.5864905923497529
Energy: 0.5429616672273722
Energy: 0.541821710478224
Energy: 0.5208683114423343
Energy: 0.3499865168501618
Energy: 0.5208683114418028
Energy: 0.3605440616388827
Energy: 0.5003488221053761
Energy: 0.6029912881844706
Energy: 0.5003488221048448
Energy: 0.4579124969428207
Energy: 0.5333949579623745
Energy: 0.34993648767208113
Energy: 0.533394957961843
Energy: 0.34809366104630274
Energy: 0.549303079012247
Energy: 0.5148077149969696
Energy: 0.5493030790117156
Energy: 0.4072645251023575
Energy: 0.5192770578444347
Energy: 0.3498566091204902
Energy: 0.5192770578454976
Energy: 0.34949597893475964
Energy: 0.5008274034042458
Energy: 0.35641353722381464
Energy: 0.5008274034042458
Energy: 0.3564870721090048
Energy: 0.4996432821122036
Energy: 0.3498708520897196
Energy: 0.4996432821122036
Energy: 0.35101967479745433
Energy: 0.5473563586861948
Energy: 0.40762852056787435
Energy: 0.5473563586867262
Energy: 0.33971720404418
Energy: 0.5230243210655782
Energy: 0.3484323063163626
Energy: 0.5230243210650467
Energy: 0.3496075906585504
Energy: 0.5196338912929005
Energy: 0.4597679352027092
Energy: 0.5196338912934318
Energy: 0.34081637861413133
Energy: 0.35067750322747376
Energy: 0.3607500239104462
Energy: 0.3506775032280051
Energy: 0.35124212240641794
Energy: 0.5470643467695832
Energy: 0.5392235860207664
Energy: 0.5470643467695832
Energy: 0.3406999864866403
Energy: 0.5540078102845665
Energy: 0.48555701784459904
Energy: 0.5540078102850977
Energy: 0.3494962198050395
Energy: 0.5221033165590937
Energy: 0.5413465677482794
Energy: 0.5221033165590937
Energy: 0.4162116547655025
Energy: 0.50053124845637
Energy: 0.36075363606879046
Energy: 0.5005312484569013
Energy: 0.35100839410639134
Energy: 0.5469719868791302
Energy: 0.4603437422887616
Energy: 0.5469719868801929
Energy: 0.42635458936226356
Energy: 0.5600438634531311
Energy: 0.34841005323343804
Energy: 0.5600438634531311
Energy: 0.34948539331544737
Energy: 0.5222999832268287
Energy: 0.4097038337955688
Energy: 0.5222999832262973
Energy: 0.4209233833984303
Energy: 0.5219915749543355
Energy: 0.3498209096740312
Energy: 0.5219915749543355
Energy: 0.3509528657032125
Energy: 0.5336374742642345
Energy: 0.3573076441289585
Energy: 0.5336374742637031
Energy: 0.42344666277434223
Energy: 0.558926881511024
Energy: 0.3527359323450868
Energy: 0.5589268815104926
Energy: 0.3494636590409176
Energy: 0.5218705179926353
Energy: 0.3386784315812711
Energy: 0.5218705179921039
Energy: 0.5204105271948625
Energy: 0.5221269968549008
Energy: 0.3498597169110888
Energy: 0.5221269968549008
Energy: 0.36188604283902
Energy: 0.5332856205335184
Energy: 0.3443021780370424
Energy: 0.5332856205340497
Energy: 0.5393331193844046
Energy: 0.5585549387116208
Energy: 0.35276457877524997
Energy: 0.5585549387110894
Energy: 0.4862390306700897
Energy: 0.5403054445798927
Energy: 0.33881992917860687
Energy: 0.5403054445798927
Energy: 0.6157906182847819
Energy: 0.5225790850957672
Energy: 0.349832373109412
Energy: 0.5225790850952359
Energy: 0.361999846745094
Energy: 0.5589354092010443
Energy: 0.3443811877061208
Energy: 0.5589354092005129
Energy: 0.4461617817438581
Energy: 0.5481070115857088
Energy: 0.3527765351019889
Energy: 0.5481070115857088
Energy: 0.34949788923200553
Energy: 0.547127576666256
Energy: 0.42883575986018346
Energy: 0.5471275766657245
Energy: 0.45044791486316466
Energy: 0.5219236048954701
Energy: 0.3500089901233866
Energy: 0.5219236048954701
Energy: 0.35100073486281647
Energy: 0.5596893814759539
Energy: 0.4286021686242767
Energy: 0.5596893814754225
Energy: 0.3415230316441983
Energy: 0.533191099841629
Energy: 0.35285042517439824
Energy: 0.5331910998426918
Energy: 0.3432865790190225
Energy: 0.5472291005220653
Energy: 0.4291634078079669
Energy: 0.5472291005215338
Energy: 0.349691542006621
Energy: 0.5217990659671036
Energy: 0.3512942240082539
Energy: 0.5217990659665722
Energy: 0.3509196849653822
Energy: 0.559817970603661
Energy: 0.516489031702905
Energy: 0.559817970603661

minimum gb energy = 0.3386784315812711 eV
minimum distance =  2.56073792817938 Angstroms
sigma value = 85


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

Energy: 0.45636244208817306
Energy: 0.504308014321627
Energy: 0.6539158477450353
Energy: 0.504308014321627
Energy: 0.5648615757496827
Energy: 0.47923196991090006
Energy: 0.3193878062639014
Energy: 0.47923196991090006
Energy: 0.4378109637795812
Energy: 0.45559827750359255
Energy: 0.3975162858625302
Energy: 0.45559827750359255
Energy: 0.4952438581937753
Energy: 0.47918290069130987
Energy: 0.3194145313268112
Energy: 0.47918290069130987
Energy: 0.3330595078363176
Energy: 0.4423327506918926
Energy: 0.47428683579340875
Energy: 0.4423327506918926
Energy: 0.42477441585066333
Energy: 0.48065100690491075
Energy: 0.319324320130762
Energy: 0.4806510069053716
Energy: 0.31744643153532265
Energy: 0.4647279433024313
Energy: 0.33735546613392153
Energy: 0.4647279433024313
Energy: 0.3808620229213379
Energy: 0.47878617153226927
Energy: 0.31946206398950666
Energy: 0.47878617153226927
Energy: 0.31901871058964854
Energy: 0.44879162907068876
Energy: 0.3810024727427379
Energy: 0.44879162907068876
Energy: 0.33723759968550954
Energy: 0.4645386968834201
Energy: 0.31784762906790626
Energy: 0.4645386968834201
Energy: 0.3203436575536637
Energy: 0.47990860781114614
Energy: 0.4248024134702296
Energy: 0.47990860781114614
Energy: 0.30583159926512665
Energy: 0.47913909159729917
Energy: 0.3333587332081481
Energy: 0.4791390915968384
Energy: 0.319006501167894
Energy: 0.44841563282652125
Energy: 0.526821746110732
Energy: 0.44841563282652125
Energy: 0.3062562577628
Energy: 0.45554209594062406
Energy: 0.43802380776734123
Energy: 0.45554209594016326
Energy: 0.32038020286799823
Energy: 0.47919474712583754
Energy: 0.5653949662006328
Energy: 0.47919474712583754
Energy: 0.30453804058918754
Energy: 0.5044292833834338
Energy: 0.4566806474789472
Energy: 0.5044292833838948
Energy: 0.3190758617362932
Energy: 0.44831520828909915
Energy: 0.5652601691631401
Energy: 0.44831520828909915
Energy: 0.3709620697676103
Energy: 0.45553535836583503
Energy: 0.43818206742844773
Energy: 0.45553535836537407
Energy: 0.3203624859833655
Energy: 0.4791680003999479
Energy: 0.49613431899975735
Energy: 0.4791680003999479
Energy: 0.3784996026761832
Energy: 0.5137737467138521
Energy: 0.3334603623632123
Energy: 0.5137737467143131
Energy: 0.3189904538219679
Energy: 0.44862662768286843
Energy: 0.45928062723493795
Energy: 0.44862662768286843
Energy: 0.37713494939250525
Energy: 0.47966121631369346
Energy: 0.31784902882414334
Energy: 0.4796612163132326
Energy: 0.32030602213608794
Energy: 0.478626225756997
Energy: 0.3815107687727434
Energy: 0.47862622575745783
Energy: 0.37957041943182174
Energy: 0.511783321484768
Energy: 0.31948492710947457
Energy: 0.511783321484768
Energy: 0.31890460752011635
Energy: 0.39585646911187833
Energy: 0.3377521139009058
Energy: 0.3958564691123392
Energy: 0.4509946157727291
Energy: 0.4790639285749144
Energy: 0.31976818606544005
Energy: 0.4790639285753753
Energy: 0.3345310341480783
Energy: 0.47898909634473336
Energy: 0.3063952362669548
Energy: 0.47898909634473336
Energy: 0.4572641585849319
Energy: 0.5119566030610319
Energy: 0.3194005220356587
Energy: 0.5119566030610319
Energy: 0.43900692127339735
Energy: 0.45558426410197217
Energy: 0.3065002253358106
Energy: 0.45558426410197217
Energy: 0.610959109914536
Energy: 0.4790846408204517
Energy: 0.31954461333252443
Energy: 0.4790846408199908
Energy: 0.45764344569665066
Energy: 0.5012340089137473
Energy: 0.3051912978171347
Energy: 0.5012340089137473
Energy: 0.5512825424292416
Energy: 0.5126977667724646
Energy: 0.3194099235489798
Energy: 0.5126977667724646
Energy: 0.4391192909374876
Energy: 0.45557536722637604
Energy: 0.30573788231019133
Energy: 0.45557536722637604
Energy: 0.5437459448404607
Energy: 0.4790277831424917
Energy: 0.319933418391527
Energy: 0.4790277831424917
Energy: 0.3344998203827215
Energy: 0.5099626744673763
Energy: 0.3787003092040857
Energy: 0.5099626744669153
Energy: 0.3991359602646743
Energy: 0.5103180929856591
Energy: 0.3193239166713716
Energy: 0.5103180929856591
Energy: 0.31906432090095893
Energy: 0.47934750337235893
Energy: 0.37735377287997063
Energy: 0.47934750337235893
Energy: 0.39356590424061555
Energy: 0.4785465808835595
Energy: 0.3198870308693642
Energy: 0.47854658088309865
Energy: 0.3204479333559532
Energy: 0.5100501349301901
Energy: 0.3793796207856776
Energy: 0.510050134930651
Energy: 0.3079852198771703
Energy: 0.49807807354702105
Energy: 0.3206340609738734
Energy: 0.49807807354702105
Energy: 0.3188941087822401
Energy: 0.47916955328858835
Energy: 0.46464158663850363
Energy: 0.4791695532881275
Energy: 0.30465515756764455
Energy: 0.4787212646898113
Energy: 0.33340540619822734
Energy: 0.4787212646898113
Energy: 0.3203835342560617
Energy: 0.5099445384945507
Energy: 0.45709193962387956
Energy: 0.5099445384945507

minimum gb energy = 0.30453804058918754 eV
minimum distance =  2.56116711614477 Angstroms
sigma value = 113


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

Energy: 0.011733830870461315
Energy: 0.013135554827182233
Energy: 0.39295484573535433
Energy: 0.013135554827182233
Energy: 0.3926147503108113
Energy: 0.17518777893427204
Energy: 0.17552733878121038
Energy: 0.17518777893427204
Energy: 0.011733830870461315
Energy: 0.013135554826827944
Energy: 0.3929467836557784
Energy: 0.013135554827182233
Energy: 0.3926147503108113
Energy: 0.17518777893427204
Energy: 0.1755254437174895
Energy: 0.17518777893391776
Energy: 0.011733830870461315
Energy: 0.013135554826827944
Energy: 0.39295782982933536
Energy: 0.013135554827182233
Energy: 0.3926147503108113
Energy: 0.17518777893460663
Energy: 0.17551793210372094
Energy: 0.17518777893391776

minimum gb energy = 0.011733830870461315 eV
minimum distance =  2.83530856683076 Angstroms
sigma value = 1