Model name: model_name=EAM_Dynamo_Mishin_2004_NiAl__MO_101214310689_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5200000256299973
cohesive_energy=4.427798539389678
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: -0.0225496501540919 eV

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

Energy: 0.018067818043742318
Energy: 1.2956890503556244
Energy: 0.018067818043742318
Energy: 1.2956890503552936
Energy: 0.018067818043742318
Energy: 1.2956890503552936
Energy: 1.2956890503552936
Energy: 1.1751969420701704
Energy: 1.2956890503552936
Energy: 1.1751969420692148
Energy: 1.2956890503552936
Energy: 1.1751969420701704
Energy: 0.018067818043742318
Energy: 1.2956890503552936
Energy: 0.018067818043742318
Energy: 1.2956890503549627
Energy: 0.018067818043742318
Energy: 1.2956890503549627
Energy: 1.2956890503552936
Energy: 1.1751969420692148
Energy: 1.2956890503556244
Energy: 1.1751969420692148
Energy: 1.2956890503552936
Energy: 1.1751969420701704
Energy: 0.018067818043742318
Energy: 1.2956890503552936
Energy: 0.018067818043742318
Energy: 1.2956890503549627
Energy: 0.018067818043742318
Energy: 1.2956890503556244
Energy: 1.2956890503549627
Energy: 1.1751969420701704
Energy: 1.2956890503556244
Energy: 1.1751969420695088
Energy: 1.2956890503549627
Energy: 1.1751969420701704

minimum gb energy = 0.018067818043742318 eV
minimum distance =  2.25772896365701 Angstroms
sigma value = 1


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

Energy: 1.4205888062530658
Energy: 1.3549840541542946
Energy: 1.4205888062530658
Energy: 1.354984054151906
Energy: 1.4205888062530658
Energy: 1.3549840541550906
Energy: 1.515423490858089
Energy: 1.262403912082881
Energy: 1.2761671713919236
Energy: 1.262403912082881
Energy: 1.2762766171037803
Energy: 1.262403912082881
Energy: 1.3327215965752797
Energy: 1.417230252724962
Energy: 1.3327215965768722
Energy: 1.4172302527233698
Energy: 1.3327215965736874
Energy: 1.4172302527281468
Energy: 1.544004249953855
Energy: 1.3227308806064073
Energy: 1.5440042499554476
Energy: 1.3227308806064073
Energy: 1.5440042499562436
Energy: 1.3227308806064073
Energy: 1.355138740388409
Energy: 1.4753432477100603
Energy: 1.3551387403836317
Energy: 1.475343247712449
Energy: 1.3551387403836317
Energy: 1.4753432477092643
Energy: 1.4571621573992333
Energy: 1.2771765114398048
Energy: 1.4571621574008258
Energy: 1.2771765114453781
Energy: 1.4571621573992333
Energy: 1.277176511443786
Energy: 1.3405390164673547
Energy: 1.3860467855025895
Energy: 1.3405390164697435
Energy: 1.3860467854986087
Energy: 1.340539016473724
Energy: 1.3860467854986087
Energy: 1.310072583701163
Energy: 1.4879325343074556
Energy: 1.310072583701163
Energy: 1.4879325343146212
Energy: 1.3100725837067364
Energy: 1.4879325343074556
Energy: 1.4696171617354403
Energy: 1.3945769031468962
Energy: 1.469617161733848
Energy: 1.3945769031453037
Energy: 1.4696171617362366
Energy: 1.3945769031468962
Energy: 1.2499045068679322
Energy: 1.4657781823935103
Energy: 1.2499045068679322
Energy: 1.4657781823951028
Energy: 1.2499045068695247
Energy: 1.4657781824030647
Energy: 1.6355290254546437
Energy: 1.2766431661729407
Energy: 1.6355290254562365
Energy: 1.2766431661737367
Energy: 1.63552902545544
Energy: 1.2766431661737367
Energy: 1.241267344211681
Energy: 1.5302172961995946
Energy: 1.241267344211681
Energy: 1.5302172961932252
Energy: 1.2412673442132733
Energy: 1.5302172961390843
Energy: 1.5660659521893867
Energy: 1.216907298598267
Energy: 1.5660659521893867
Energy: 1.2169072985990632
Energy: 1.5660659521893867
Energy: 1.2169072985974707
Energy: 1.3064726761688517
Energy: 1.3409932847727835
Energy: 1.3064726761680554
Energy: 1.340993284769599
Energy: 1.306472676169648
Energy: 1.3409932847719872
Energy: 1.5629338537068689
Energy: 1.2586952659316757
Energy: 1.5629338537100539
Energy: 1.2586952659292872
Energy: 1.5629338537172195
Energy: 1.2586952659292872
Energy: 1.5746305825613052
Energy: 1.4176470143696729
Energy: 1.574630582560509
Energy: 1.4176470143720616
Energy: 1.5746305825589164
Energy: 1.4176470143704691
Energy: 1.3649715636481534
Energy: 1.3768379384230018
Energy: 1.3649715636489497
Energy: 1.3768379384230018
Energy: 1.364971563646561
Energy: 1.3768379384206133
Energy: 1.3648462539916608
Energy: 1.3382444971514034
Energy: 1.3648462539876798
Energy: 1.3382444971529956
Energy: 1.3648462539908646
Energy: 1.3382444971521996
Energy: 1.366252801222391
Energy: 1.3217792045824384
Energy: 1.366252801222391
Energy: 1.3217792045832344
Energy: 1.3662528012207984
Energy: 1.321779204584827
Energy: 1.4394323704643481
Energy: 1.2769329822804658
Energy: 1.4394323704651442
Energy: 1.276932982276485
Energy: 1.4394323704611633
Energy: 1.2769329822748925
Energy: 1.284631087133447
Energy: 1.7292593209665723
Energy: 1.284631087132651
Energy: 1.729259320961795
Energy: 1.284631087133447
Energy: 1.729259320965776
Energy: 1.420558667374213
Energy: 1.3893309731778472
Energy: 1.4205586673726205
Energy: 1.389330973177051
Energy: 1.4205586673750092
Energy: 1.3893309731778472
Energy: 1.2878943263326863
Energy: 1.5162980442842284
Energy: 1.2201988675801292
Energy: 1.5162980442810439
Energy: 1.220198867581649
Energy: 1.516298044285025

minimum gb energy = 1.2169072985974707 eV
minimum distance =  2.19551390686936 Angstroms
sigma value = 33


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

Energy: 1.4031621682151088
Energy: 1.4713212878037536
Energy: 1.403162168214656
Energy: 1.471321287803301
Energy: 1.4031621682142033
Energy: 1.4713212878046595
Energy: 1.4633790329439234
Energy: 1.330633515462456
Energy: 1.4633790329384888
Energy: 1.330633515462909
Energy: 1.4633790329389416
Energy: 1.330633515462456
Energy: 1.2308114554255005
Energy: 1.328530445413237
Energy: 1.2308114554268594
Energy: 1.3285304454222944
Energy: 1.2308114554286709
Energy: 1.3285304454268227
Energy: 1.4350834510418657
Energy: 1.5123244346487466
Energy: 1.4350834510436772
Energy: 1.5123244346487466
Energy: 1.4350834510414128
Energy: 1.5123244346487466
Energy: 1.3306368291934352
Energy: 1.4196919542805904
Energy: 1.330636829194794
Energy: 1.419691954275609
Energy: 1.3306368291893593
Energy: 1.41969195426791
Energy: 1.3273549534477647
Energy: 1.230817346863282
Energy: 1.327354953446406
Energy: 1.230817346863282
Energy: 1.327354953449576
Energy: 1.2308173468650936
Energy: 1.4714259998651205
Energy: 1.4031096527054405
Energy: 1.4714259998601391
Energy: 1.4031096527031761
Energy: 1.471425999863762
Energy: 1.4031096527104219
Energy: 1.215264801704258
Energy: 1.4035452200210863
Energy: 1.2152648016983707
Energy: 1.4035452200161047
Energy: 1.215264801700635
Energy: 1.403545220021992
Energy: 1.314276168682631
Energy: 1.23472669604881
Energy: 1.314276168682178
Energy: 1.23472669604881
Energy: 1.3142761686808193
Energy: 1.2347266960492629
Energy: 1.1874632950234871
Energy: 1.4554576172601392
Energy: 1.1874632950243926
Energy: 1.4554576172764424
Energy: 1.1874632950216755
Energy: 1.4554576172796125
Energy: 1.4560900754668358
Energy: 1.191413780327503
Energy: 1.4560900754505324
Energy: 1.191413780327503
Energy: 1.4560900754618544
Energy: 1.1914137803279559
Energy: 1.2310407615512295
Energy: 1.313011422232003
Energy: 1.2310407615507766
Energy: 1.313011422232456
Energy: 1.2310407615507766
Energy: 1.313011422232456
Energy: 1.4040659852495112
Energy: 1.2151702564968139
Energy: 1.4040659852499642
Energy: 1.2151702564977194
Energy: 1.4040659852495112
Energy: 1.2151702564972666
Energy: 1.4032547116824634
Energy: 1.4759990299935724
Energy: 1.403254711680199
Energy: 1.475999029994931
Energy: 1.403254711680199
Energy: 1.4759990299899493
Energy: 1.3532931717793129
Energy: 1.3276407194881512
Energy: 1.3532931717788599
Energy: 1.327640719484528
Energy: 1.3532931717797658
Energy: 1.3276407194831696
Energy: 1.2308794515649029
Energy: 1.328836910136898
Energy: 1.2308794515630914
Energy: 1.3288369101427853
Energy: 1.2308794515621855
Energy: 1.3288369101427853
Energy: 1.5172102875454732
Energy: 1.4376533358631252
Energy: 1.5172102875459261
Energy: 1.4376533358626724
Energy: 1.5172102875463789
Energy: 1.4376533358644839
Energy: 1.3288591471967626
Energy: 1.2306264479640785
Energy: 1.3288591471904223
Energy: 1.23062644796272
Energy: 1.3288591471890638
Energy: 1.2306264479645315
Energy: 1.3304827931295156
Energy: 1.3535856451524009
Energy: 1.3304827931290626
Energy: 1.3535856451560238
Energy: 1.330482793127704
Energy: 1.3535856451542123
Energy: 1.4734311685961161
Energy: 1.4068944975153688
Energy: 1.4734311686006447
Energy: 1.4068944975153688
Energy: 1.473431168600192
Energy: 1.406894497514916
Energy: 1.214361515446585
Energy: 1.404435410235791
Energy: 1.2143615154479437
Energy: 1.4044354102366965
Energy: 1.214361515447038
Energy: 1.4044354102326209
Energy: 1.3290368568226254
Energy: 1.2347261642073826
Energy: 1.3290368568303241
Energy: 1.2347261642073826
Energy: 1.329036856823531
Energy: 1.2347261642082883
Energy: 1.1875208483704136
Energy: 1.4558709506510585
Energy: 1.1875208483704136
Energy: 1.4558709506501528
Energy: 1.1875208483708666
Energy: 1.4558709506424539
Energy: 1.455574859811389
Energy: 1.3290621403748415
Energy: 1.4555748598132003
Energy: 1.3290621403716716
Energy: 1.4555748598150118
Energy: 1.3290621403707656
Energy: 1.2307492643170268
Energy: 1.3279943282706312
Energy: 1.2307492643188382
Energy: 1.3279943282629325
Energy: 1.2307492643215552
Energy: 1.3279943282633855
Energy: 1.4035387217649329
Energy: 1.4449895595515483
Energy: 1.403538721762216
Energy: 1.444989559548831
Energy: 1.40353872176131
Energy: 1.4449895595538125
Energy: 1.4035617977139965
Energy: 1.4444613752337887
Energy: 1.4035617977198425
Energy: 1.444461375233336
Energy: 1.4035617977202954
Energy: 1.4444613752383175
Energy: 1.2308378588793438
Energy: 1.3277576835741207
Energy: 1.2308378588825142
Energy: 1.3277576835723093
Energy: 1.2308378588811555
Energy: 1.327757683569592
Energy: 1.4555418681804715
Energy: 1.328869918115524
Energy: 1.4555418681886232
Energy: 1.3288699181168824
Energy: 1.4555418681859058
Energy: 1.3288699181141652
Energy: 1.1875079015516785
Energy: 1.4559031798889364
Energy: 1.1875079015521313
Energy: 1.4559031798844075
Energy: 1.1875079015516785
Energy: 1.455903179887125
Energy: 1.3286061323688332
Energy: 1.2347128585256897
Energy: 1.328606132383778
Energy: 1.234712858524784
Energy: 1.328606132372909
Energy: 1.234712858523878
Energy: 1.214184701342905
Energy: 1.404470635152954
Energy: 1.214184701342905
Energy: 1.4044706351633698
Energy: 1.2141847013447167
Energy: 1.4044706351588412
Energy: 1.473394631040747
Energy: 1.4068528488491239
Energy: 1.4733946310384827
Energy: 1.4068528488495768
Energy: 1.4733946310362183
Energy: 1.4068528488495768
Energy: 1.3304995218179163
Energy: 1.3538005462889176
Energy: 1.3304995218183693
Energy: 1.3538005462943523
Energy: 1.330499521815199
Energy: 1.3538005462808074
Energy: 1.3285456001683138
Energy: 1.2306616520082478
Energy: 1.3285456001692197
Energy: 1.2306616520059834
Energy: 1.3285456001583507
Energy: 1.2306616520068892
Energy: 1.5172436640674045
Energy: 1.4376289915935283
Energy: 1.5172436640664988
Energy: 1.4376289915985099
Energy: 1.5172436640660458
Energy: 1.4376289915994156
Energy: 1.230828745072825
Energy: 1.3287723239967013
Energy: 1.230828745076448
Energy: 1.3287723240053055
Energy: 1.230828745075995
Energy: 1.3287723240044
Energy: 1.3532710134009949
Energy: 1.3276600849163858
Energy: 1.3532710133960133
Energy: 1.3276600849104985
Energy: 1.3532710133991834
Energy: 1.3276600849059699
Energy: 1.4032547511438855
Energy: 1.4761416789817634
Energy: 1.403254751148867
Energy: 1.4761416789813109
Energy: 1.4032547511502256
Energy: 1.4761416789758763
Energy: 1.4040248597062832
Energy: 1.2151096950026734
Energy: 1.4040248596985845
Energy: 1.2151096950053906
Energy: 1.4040248597049245
Energy: 1.2151096950035791
Energy: 1.231040344750651
Energy: 1.313125358466088
Energy: 1.2310403447501983
Energy: 1.313125358465635
Energy: 1.2310403447497453
Energy: 1.3131253584665405

minimum gb energy = 1.1874632950216755 eV
minimum distance =  2.32878454132324 Angstroms
sigma value = 51


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

Energy: 1.4133669193030247
Energy: 1.4253915845435046
Energy: 1.4133669193030247
Energy: 1.425391584541406
Energy: 1.4133669193030247
Energy: 1.4253915845435046
Energy: 1.5149812807042196
Energy: 1.3292891155479267
Energy: 1.5149814264220587
Energy: 1.3292891155479267
Energy: 1.5149813716973892
Energy: 1.3292891155479267
Energy: 1.324464767311848
Energy: 1.6303233733392655
Energy: 1.3244647673107988
Energy: 1.6303233733361175
Energy: 1.3244647673139467
Energy: 1.6303233733361175
Energy: 1.4027842057208977
Energy: 1.2352840616784981
Energy: 1.4027842057198485
Energy: 1.235284061677449
Energy: 1.4027842057208977
Energy: 1.2352840616795475
Energy: 1.4197702611416754
Energy: 1.3547190563403315
Energy: 1.4197702611427248
Energy: 1.3547190563371838
Energy: 1.4197702611427248
Energy: 1.3547190563403315
Energy: 1.4190674239060137
Energy: 1.3546184148180525
Energy: 1.419067423903915
Energy: 1.3546184148212004
Energy: 1.4190674239060137
Energy: 1.3546184148212004
Energy: 1.3799851873501865
Energy: 1.3541970082087524
Energy: 1.379985187352285
Energy: 1.3541970082108512
Energy: 1.3799851873480877
Energy: 1.354197008213999
Energy: 1.30187284739899
Energy: 1.3561512575507837
Energy: 1.3018728473979406
Energy: 1.3561512575528822
Energy: 1.3018728473968915
Energy: 1.3561512575549808
Energy: 1.5914177058702967
Energy: 1.2349471340212212
Energy: 1.5914177058681982
Energy: 1.2349471340212212
Energy: 1.5914177058734449
Energy: 1.2349471340212212
Energy: 1.2806321185401357
Energy: 1.6037140361608082
Energy: 1.2806321185422342
Energy: 1.6037140361650055
Energy: 1.2806321185390865
Energy: 1.6037140361608082
Energy: 1.4666434350454391
Energy: 1.246729093764938
Energy: 1.4663879122690817
Energy: 1.246729093764938
Energy: 1.4666719196942755
Energy: 1.246729093764938
Energy: 1.4106560887680806
Energy: 1.4273576901556297
Energy: 1.41065608876913
Energy: 1.4273576901556297
Energy: 1.4106560887680806
Energy: 1.427357690156679
Energy: 1.5985426868094355
Energy: 1.3303213672627459
Energy: 1.5985426868314707
Energy: 1.3303213672627459
Energy: 1.5985426868472101
Energy: 1.3303213672616967
Energy: 1.3242858423753927
Energy: 1.3398348876704722
Energy: 1.3242858423732942
Energy: 1.339834887667324
Energy: 1.3242858423743435
Energy: 1.3398348876694228
Energy: 1.4536915892680655
Energy: 1.429399728626736
Energy: 1.4536915892701638
Energy: 1.4293997286277855
Energy: 1.4536915892701638
Energy: 1.4293997286277855
Energy: 1.4194333618992703
Energy: 1.3545281564935379
Energy: 1.4194333618992703
Energy: 1.3545281564935379
Energy: 1.419433361898221
Energy: 1.3545281564956366
Energy: 1.4192376272280718
Energy: 1.4642642798648202
Energy: 1.419237627224924
Energy: 1.464264279866919
Energy: 1.419237627224924
Energy: 1.4642642798658698
Energy: 1.3806591655809992
Energy: 1.3609208800964658
Energy: 1.3806591655809992
Energy: 1.3609208800964658
Energy: 1.38065916557995
Energy: 1.3609208800964658

minimum gb energy = 1.2349471340212212 eV
minimum distance =  2.19662795385458 Angstroms
sigma value = 19


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

Energy: 1.3274963774232276
Energy: 1.3170018187554657
Energy: 1.2027863232776668
Energy: 1.3170018187560881
Energy: 1.3274963774256887
Energy: 1.3170018187567107
Energy: 1.4580941696743661
Energy: 1.414488988017499
Energy: 1.4580941696700092
Energy: 1.4144889880212335
Energy: 1.4580941696756111
Energy: 1.414488988019366
Energy: 1.2265128099352676
Energy: 1.2685760585911887
Energy: 1.22651280993589
Energy: 1.268576058593678
Energy: 1.2265128099377574
Energy: 1.2685760585930559
Energy: 1.414854362679857
Energy: 1.2268264310169237
Energy: 1.4148543626811019
Energy: 1.226779848188629
Energy: 1.4148543626817245
Energy: 1.2268264310132175
Energy: 1.2930916262700167
Energy: 1.2630502949813047
Energy: 1.2930916262718841
Energy: 1.200198104974414
Energy: 1.2930916262706393
Energy: 1.2630502949800597
Energy: 1.1649429481515743
Energy: 1.2625975078188463
Energy: 1.1649429481503297
Energy: 1.2001286100422408
Energy: 1.1649429481497071
Energy: 1.2625975078163567
Energy: 1.2672280767776452
Energy: 1.226860386820959
Energy: 1.2672280767795125
Energy: 1.226860386820959
Energy: 1.2672280767795125
Energy: 1.226860386822826
Energy: 1.226422170103827
Energy: 1.545578739871957
Energy: 1.2264234388128261
Energy: 1.5455787398750689
Energy: 1.2264221701044493
Energy: 1.5455787398756913
Energy: 1.313866113132305
Energy: 1.3356076197502187
Energy: 1.3138661131360396
Energy: 1.3356076197309241
Energy: 1.3138661131354172
Energy: 1.3356076197776048
Energy: 1.2027863232776668
Energy: 1.3170018187567107
Energy: 1.2027863232782892
Energy: 1.3170018187567107
Energy: 1.2027863232776668
Energy: 1.3170018187579553
Energy: 1.4580941696718765
Energy: 1.4144889880199885
Energy: 1.4580941696687646
Energy: 1.4144889880231004
Energy: 1.4580941696756111
Energy: 1.4144889880218556
Energy: 1.2265128099352676
Energy: 1.2685760585930559
Energy: 1.22651280993589
Energy: 1.2685760585955455
Energy: 1.2265128099377574
Energy: 1.2685760585924333
Energy: 1.4148543626804795
Energy: 1.2267588276222947
Energy: 1.414854362682969
Energy: 1.2268054328418379
Energy: 1.4148543626817245
Energy: 1.2267588276204275
Energy: 1.2930916262700167
Energy: 1.2001981049731691
Energy: 1.2930916262718841
Energy: 1.2631881603642034
Energy: 1.2930916262706393
Energy: 1.2001981049731691
Energy: 1.1649429481521967
Energy: 1.2001286100434856
Energy: 1.1649429481497071
Energy: 1.2626785447159872
Energy: 1.1649429481490847
Energy: 1.2001286100416184
Energy: 1.267228076780135
Energy: 1.226860386822826
Energy: 1.2672280767807573
Energy: 1.226860386822826
Energy: 1.26722807678138
Energy: 1.2268603868234487
Energy: 1.2264400671606377
Energy: 1.545578739871957
Energy: 1.226424474551852
Energy: 1.5455787398756913
Energy: 1.2264400671625049
Energy: 1.5455787398756913
Energy: 1.241800788733782
Energy: 1.3356076197545756
Energy: 1.3138661131403964
Energy: 1.3356076197819617
Energy: 1.2418007887350269
Energy: 1.3356076197483515
Energy: 1.327496377424444
Energy: 1.3170018187554657
Energy: 1.2027863232776668
Energy: 1.317001818757333
Energy: 1.3274963774256887
Energy: 1.3170018187579553
Energy: 1.4580941696731213
Energy: 1.4144889880187435
Energy: 1.458094169668142
Energy: 1.4144889880224782
Energy: 1.4580941696768557
Energy: 1.4144889880206108
Energy: 1.2265128099377574
Energy: 1.268576058593678
Energy: 1.2265128099371347
Energy: 1.268576058593678
Energy: 1.2265128099383795
Energy: 1.2685760585930559
Energy: 1.4148543626786123
Energy: 1.2268264310163013
Energy: 1.4148543626811019
Energy: 1.226779848189874
Energy: 1.4148543626817245
Energy: 1.2268264310132175
Energy: 1.2930916262700167
Energy: 1.2630502949806823
Energy: 1.2930916262718841
Energy: 1.2001981049737918
Energy: 1.2930916262712617
Energy: 1.2630502949800597
Energy: 1.1649429481515743
Energy: 1.2625975078188463
Energy: 1.1649429481497071
Energy: 1.2001286100422408
Energy: 1.1649429481490847
Energy: 1.2625975078163567
Energy: 1.26722807677889
Energy: 1.2268603868203365
Energy: 1.2672280767807573
Energy: 1.2268603868203365
Energy: 1.26722807678138
Energy: 1.226860386820959
Energy: 1.226422170105694
Energy: 1.5455787398738239
Energy: 1.2264234388109587
Energy: 1.5455787398775584
Energy: 1.226422170105694
Energy: 1.5455787398756913
Energy: 1.3138661131316827
Energy: 1.3356076197645341
Energy: 1.313866113136662
Energy: 1.3356076197284625
Energy: 1.3138661131360396
Energy: 1.3356076197651565
Energy: 1.2027863232776668
Energy: 1.3170018187567107
Energy: 1.2027863232776668
Energy: 1.3170018187567107
Energy: 1.2027863232776668
Energy: 1.317001818757333
Energy: 1.4580941696718765
Energy: 1.4144889880199885
Energy: 1.4580941696700092
Energy: 1.414488988023723
Energy: 1.4580941696768557
Energy: 1.4144889880212335
Energy: 1.2265128099365126
Energy: 1.268576058594923
Energy: 1.2265128099365126
Energy: 1.2685760585943007
Energy: 1.2265128099383795
Energy: 1.2685760585924333

minimum gb energy = 1.1649429481490847 eV
minimum distance =  2.26899261656814 Angstroms
sigma value = 27


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

Energy: 1.1793735740575377
Energy: 1.1263354493895756
Energy: 1.179373574056013
Energy: 1.1263354493911
Energy: 1.1793735740575377
Energy: 1.1263354493911
Energy: 1.4855253951696505
Energy: 1.1992835265579236
Energy: 1.485525395168126
Energy: 1.1992835265609727
Energy: 1.485525395171175
Energy: 1.1992835265579236
Energy: 1.1525839104465072
Energy: 1.3276378958443416
Energy: 1.1525839104480318
Energy: 1.3276378958443416
Energy: 1.1525839104434579
Energy: 1.3276378958443416
Energy: 1.289313689998338
Energy: 1.0911890398942625
Energy: 1.289313689993764
Energy: 1.0911890398942625
Energy: 1.289313689993764
Energy: 1.091189039895787
Energy: 1.2887644586639742
Energy: 1.0911247650485798
Energy: 1.2887644586654985
Energy: 1.0911247650470555
Energy: 1.2887644586654985
Energy: 1.0911247650470555
Energy: 1.2973551976045616
Energy: 1.3711745671826052
Energy: 1.2973551976045616
Energy: 1.3711745671841296
Energy: 1.2973551976030717
Energy: 1.3711745671826052
Energy: 1.0914244783086144
Energy: 1.201269561359399
Energy: 1.09142447830709
Energy: 1.201269561359399
Energy: 1.091424478310139
Energy: 1.201269561359399
Energy: 1.1747904407646879
Energy: 1.1267686732990592
Energy: 1.1747904407646879
Energy: 1.1267686732975346
Energy: 1.1747904407662124
Energy: 1.1267686732990592
Energy: 1.333402958906151
Energy: 1.1535276543566821
Energy: 1.3334029589046263
Energy: 1.1535276543536328
Energy: 1.3334029589015772
Energy: 1.1535276543475343
Energy: 1.276831952385861
Energy: 1.3470189072798184
Energy: 1.276831952385861
Energy: 1.3470189072813428
Energy: 1.276831952385861
Energy: 1.3470189072813428
Energy: 1.2062019380462372
Energy: 1.0915780055330453
Energy: 1.2062019380462372
Energy: 1.0915780055315205
Energy: 1.2062019380462372
Energy: 1.0915780055315205
Energy: 1.36541990648148
Energy: 1.2423586463677583
Energy: 1.3654199064830046
Energy: 1.2423586463662337
Energy: 1.3654199064860537
Energy: 1.2423586463677583

minimum gb energy = 1.0911247650470555 eV
minimum distance =  2.19146284456529 Angstroms
sigma value = 9


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

Energy: 1.1432713803695587
Energy: 1.121198863129424
Energy: 1.1432713803695587
Energy: 1.121198863129424
Energy: 1.1432713803704158
Energy: 1.121198863129424
Energy: 1.4949040014932993
Energy: 1.0672696885985467
Energy: 1.4949040015001533
Energy: 1.067269688598975
Energy: 1.4949040014932993
Energy: 1.0672696885985467
Energy: 1.0080215773428558
Energy: 1.4459431273448828
Energy: 1.0080215773411423
Energy: 1.4459431273457397
Energy: 1.0080215773428558
Energy: 1.4459431273435976
Energy: 1.06751335113976
Energy: 1.0111474488616752
Energy: 1.0675133511389034
Energy: 1.011147448864674
Energy: 1.0675133511389034
Energy: 1.01114744885782
Energy: 1.1135646200706892
Energy: 1.071999477843147
Energy: 1.1135646200694043
Energy: 1.071999477843147
Energy: 1.1135646200689762
Energy: 1.0719994778427187
Energy: 1.124299258466149
Energy: 1.1347621425039305
Energy: 1.1242992584622937
Energy: 1.1119421870677528
Energy: 1.1242992584597233
Energy: 1.1119421870677528
Energy: 1.0568465430598288
Energy: 1.1731782273842541
Energy: 1.0568465430594005
Energy: 1.1731782273846822
Energy: 1.0568465430632559
Energy: 1.1731782273838256
Energy: 0.9791955571605767
Energy: 1.1847845749149009
Energy: 0.9791955571614334
Energy: 1.1847845749149009
Energy: 0.9791955571605767
Energy: 1.1847845749157575
Energy: 1.3403008312124922
Energy: 1.0723845237009013
Energy: 1.340300831214634
Energy: 1.0723845237009013
Energy: 1.340300831213349
Energy: 1.0723845237004732
Energy: 1.1553639414022285
Energy: 1.4658756976979332
Energy: 1.155363941400515
Energy: 1.4658756976983616
Energy: 1.1553639413966597
Energy: 1.4658756976992184
Energy: 1.0679986696929669
Energy: 1.0178298505222179
Energy: 1.06799866969211
Energy: 1.0178298505222179
Energy: 1.0679986696912533
Energy: 1.017829850522646
Energy: 1.044939554482801
Energy: 1.250669378551323
Energy: 1.044939554482373
Energy: 1.250669378551323
Energy: 1.0449395544819444
Energy: 1.2506693785564635
Energy: 1.098540025204018
Energy: 1.0824737250995087
Energy: 1.0985400251984492
Energy: 1.0824737250995087
Energy: 1.0985400252031614
Energy: 1.0824737250939396
Energy: 1.1395257324714942
Energy: 1.4797452227608183
Energy: 1.13952573247792
Energy: 1.4797452227621033
Energy: 1.1395257324757784
Energy: 1.4797452227625316
Energy: 1.0363432864810633
Energy: 1.149836558249093
Energy: 1.0363432864814917
Energy: 1.149836558249093
Energy: 1.0363432864802065
Energy: 1.149836558249093
Energy: 1.02972422926414
Energy: 1.0870220687465875
Energy: 1.029724229259428
Energy: 1.0870220687453025
Energy: 1.0297242292572861
Energy: 1.0870220687500145
Energy: 1.3127124192788397
Energy: 1.2883350886032308
Energy: 1.3127124192784114
Energy: 1.2883350886019456
Energy: 1.312712419279268
Energy: 1.2883350886087994
Energy: 1.0540135426241182
Energy: 1.0723358424606177
Energy: 1.05401354262626
Energy: 1.0723358424597609
Energy: 1.054013542628402
Energy: 1.0723358424589042
Energy: 0.9748768464552171
Energy: 1.4074255616534015
Energy: 0.9748768464487915
Energy: 1.4074255616559328
Energy: 0.9748768464487915
Energy: 1.4074255616546867
Energy: 1.4587901466312623
Energy: 1.0025044787345245
Energy: 1.4587901466291204
Energy: 1.0025044787349526
Energy: 1.4587901466278743
Energy: 1.0025044787336674
Energy: 0.9749347158471796
Energy: 1.4074291325580324
Energy: 0.9749347158514635
Energy: 1.4074291325520352
Energy: 0.9749347158458946
Energy: 1.407429132549465
Energy: 1.0540070294333397
Energy: 1.0724617005387227
Energy: 1.0540070294341966
Energy: 1.0724617005382941
Energy: 1.0540070294350532
Energy: 1.0724617005382941
Energy: 1.312617912193026
Energy: 1.2882044724893482
Energy: 1.3126179121938826
Energy: 1.2882044724816375
Energy: 1.3126179121925974
Energy: 1.2882044724863495
Energy: 1.0302800460978319
Energy: 1.1114597797514494
Energy: 1.0302800460961181
Energy: 1.1114597797505927
Energy: 1.0302800461029722
Energy: 1.1114597797514494
Energy: 1.0363723657893713
Energy: 1.1500096728290674
Energy: 1.0363723657906565
Energy: 1.1500096728282108
Energy: 1.036372365785516
Energy: 1.1500096728277824
Energy: 1.1397427795903246
Energy: 1.2438297706883767
Energy: 1.1397427795946082
Energy: 1.2438297706883767
Energy: 1.139742779597607
Energy: 1.243829770688805
Energy: 1.0984622555946506
Energy: 1.0823314466176286
Energy: 1.0984622555980774
Energy: 1.0823314466142018
Energy: 1.0984622555946506
Energy: 1.0823314466150584
Energy: 1.0449315058612243
Energy: 1.0902678674918167
Energy: 1.044931505862081
Energy: 1.090267867494387
Energy: 1.044931505862081
Energy: 1.0902678674883899
Energy: 1.0679555646756034
Energy: 1.0178532349955904
Energy: 1.0679555646734615
Energy: 1.0178532349951621
Energy: 1.0679555646777452
Energy: 1.0178532349951621
Energy: 1.155400685475806
Energy: 1.4588812784377057
Energy: 1.155400685477909
Energy: 1.4588812784269962
Energy: 1.1554006854770913
Energy: 1.4588812784342786
Energy: 1.3401873538228517
Energy: 1.0723241785995872
Energy: 1.340187353821995
Energy: 1.0723241785991589
Energy: 1.3401873538305626
Energy: 1.0723241785995872
Energy: 0.9792796686553283
Energy: 1.1843841242547735
Energy: 0.9792796686566135
Energy: 1.1843841242547735
Energy: 0.9792796686561851
Energy: 1.184384124255202
Energy: 1.0569305724287896
Energy: 1.1731632675264974
Energy: 1.0569305724287896
Energy: 1.1731632675277825
Energy: 1.0569305724356437
Energy: 1.173163267525641
Energy: 1.1243447065398555
Energy: 1.0884816198370233
Energy: 1.1243447065385703
Energy: 1.0884816198447342
Energy: 1.1243447065372854
Energy: 1.0884816198443057
Energy: 1.1137601840324103
Energy: 1.072300155952419
Energy: 1.1137601840324103
Energy: 1.072300155952419
Energy: 1.1137601840315534
Energy: 1.072300155952419
Energy: 1.0675395875074614
Energy: 1.011412822249667
Energy: 1.06753958750789
Energy: 1.0114128222526657
Energy: 1.0675395875074614
Energy: 1.011412822249667
Energy: 1.0079096617917271
Energy: 1.4460733041828782
Energy: 1.0079096617925838
Energy: 1.4460733041764524
Energy: 1.0079096617930123
Energy: 1.4460733041811646
Energy: 1.4948225118426028
Energy: 1.067281383640215
Energy: 1.4948225118408898
Energy: 1.0672813836397868
Energy: 1.4948225118408898
Energy: 1.0672813836397868
Energy: 1.1432713803725576
Energy: 1.1211988631272822
Energy: 1.1432713803738428
Energy: 1.1211988631277106
Energy: 1.1432713803725576
Energy: 1.1211988631272822
Energy: 1.4949040014937278
Energy: 1.0672696886002602
Energy: 1.4949040014945845
Energy: 1.0672696886006887
Energy: 1.4949040014924426
Energy: 1.0672696886006887
Energy: 1.0080215773471397
Energy: 1.4459431273418843
Energy: 1.0080215773424275
Energy: 1.445943127339314
Energy: 1.0080215773441408
Energy: 1.4459431273384575
Energy: 1.0675133511393318
Energy: 1.0111474488616752
Energy: 1.0675133511414736
Energy: 1.0111474488565348
Energy: 1.067513351138475
Energy: 1.0111474488586767
Energy: 1.1135646200689762
Energy: 1.0719994778388633
Energy: 1.1135646200672624
Energy: 1.0719994778388633
Energy: 1.1135646200659772
Energy: 1.0719994778392918

minimum gb energy = 0.9748768464487915 eV
minimum distance =  2.26628897435995 Angstroms
sigma value = 57


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

Energy: 0.49986139783346056
Energy: 0.5123718901021126
Energy: 0.49986139783346056
Energy: 0.5123718901021126
Energy: 0.49986139783346056
Energy: 0.5123718901021126
Energy: 0.6610623868492507
Energy: 0.5011214734240581
Energy: 0.6610623868492507
Energy: 0.5011214734240581
Energy: 0.6610623868492507
Energy: 0.501121473423083
Energy: 0.5716245445156541
Energy: 0.6362710609737006
Energy: 0.5716245445156541
Energy: 0.6362710609737006
Energy: 0.5716245445166291
Energy: 0.6362710609737006
Energy: 0.5132261006696759
Energy: 0.4992047300323476
Energy: 0.5132261006696759
Energy: 0.4992047300342979
Energy: 0.5132261006618749
Energy: 0.4992047300333228
Energy: 0.6605348003638507
Energy: 0.6678402592489973
Energy: 0.6605348003628755
Energy: 0.667840259248022
Energy: 0.6605348003628755
Energy: 0.6678402592489973
Energy: 0.4994015483084459
Energy: 0.5715634332844232
Energy: 0.4994015483084459
Energy: 0.5715634332805225
Energy: 0.499401548309421
Energy: 0.5715634332824728
Energy: 0.4994108346582729
Energy: 0.5716220989852464
Energy: 0.4994108346582729
Energy: 0.5716220989852464
Energy: 0.4994108346582729
Energy: 0.5716220989852464
Energy: 0.6606348769448461
Energy: 0.6679145374215416
Energy: 0.6606348769448461
Energy: 0.6679145374205666
Energy: 0.6606348769448461
Energy: 0.6679145374215416
Energy: 0.5132162488425203
Energy: 0.4991916058198105
Energy: 0.5132162488434954
Energy: 0.4991916058217607
Energy: 0.5132162488444706
Energy: 0.49919160582273586
Energy: 0.5718339302534875
Energy: 0.6356155618635334
Energy: 0.5718339302544625
Energy: 0.6356155618645085
Energy: 0.5718339302534875
Energy: 0.6356155618635334
Energy: 0.6608162434767467
Energy: 0.49930873961522787
Energy: 0.6608162434777218
Energy: 0.4993087396132776
Energy: 0.6608162434767467
Energy: 0.49930873961522787
Energy: 0.4998613978324854
Energy: 0.5123718901021126
Energy: 0.4998613978324854
Energy: 0.5123718901030877
Energy: 0.4998613978324854
Energy: 0.5123718901021126
Energy: 0.6610623868482755
Energy: 0.5011214734211328
Energy: 0.6610623868492507
Energy: 0.501121473423083
Energy: 0.6610623868482755
Energy: 0.5011214734240581
Energy: 0.5716245445166291
Energy: 0.6362710609737006
Energy: 0.5716245445156541
Energy: 0.6362710609727255
Energy: 0.5716245445166291
Energy: 0.6362710609727255
Energy: 0.5132261006706511
Energy: 0.4992047300342979
Energy: 0.5132261006716262
Energy: 0.4992047300342979
Energy: 0.5132261006687009
Energy: 0.4992047300342979
Energy: 0.6605348003638507
Energy: 0.6678402592489973
Energy: 0.6605348003638507
Energy: 0.6678402592489973
Energy: 0.6605348003638507
Energy: 0.6678402592489973
Energy: 0.499401548309421
Energy: 0.5715634332824728
Energy: 0.499401548309421
Energy: 0.5715634332814977
Energy: 0.499401548309421
Energy: 0.5715634332814977
Energy: 0.4994108346582729
Energy: 0.5716220989852464
Energy: 0.4994108346582729
Energy: 0.5716220989852464
Energy: 0.4994108346582729
Energy: 0.5716220989852464
Energy: 0.6606348769448461
Energy: 0.6679145374215416
Energy: 0.6606348769448461
Energy: 0.6679145374215416
Energy: 0.6606348769448461
Energy: 0.6679145374215416

minimum gb energy = 0.4991916058198105 eV
minimum distance =  2.41331229227128 Angstroms
sigma value = 11


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

Energy: 1.0227523608994513
Energy: 1.1006032384534685
Energy: 1.0227523608980227
Energy: 1.1006032384534685
Energy: 1.0227523609001654
Energy: 1.1006032384534685
Energy: 1.145895133068812
Energy: 1.056585590321811
Energy: 1.1458951330680978
Energy: 1.056585590321811
Energy: 1.145895133068812
Energy: 1.0565855903225254
Energy: 1.1089886158751292
Energy: 1.44076845492511
Energy: 1.1089886158737003
Energy: 1.4407684549315387
Energy: 1.1089886158758433
Energy: 1.44076845493511
Energy: 1.2320993759674004
Energy: 0.9012661713208057
Energy: 1.232099375966686
Energy: 0.9012661713200913
Energy: 1.2320993759659717
Energy: 0.9012661713200913
Energy: 1.0417978235610308
Energy: 0.8631992312844969
Energy: 1.0417978235610308
Energy: 0.8631992312837826
Energy: 1.0417978235617453
Energy: 0.8631992312844969
Energy: 1.0378704571143815
Energy: 1.16622680247082
Energy: 1.0378704571150958
Energy: 1.1662268024715343
Energy: 1.0378704571136672
Energy: 1.1662268024715343
Energy: 0.9420570459305996
Energy: 1.2020283704542138
Energy: 0.8648160534349744
Energy: 1.2020283704485646
Energy: 0.8648160534335457
Energy: 1.2020283704507073
Energy: 1.1044712639583776
Energy: 0.8280472647237888
Energy: 1.1044712639583776
Energy: 0.8280472647237888
Energy: 1.1044712639583776
Energy: 0.8280472647237888
Energy: 1.085739646797498
Energy: 0.8304319380946293
Energy: 1.085739646797498
Energy: 0.8304319380946293
Energy: 1.0857396467989264
Energy: 0.8304319380953437
Energy: 0.8532506311558034
Energy: 1.3316313960980843
Energy: 0.8532506311565176
Energy: 1.3316313960987984
Energy: 0.8532506311572319
Energy: 1.3316313960980843
Energy: 1.2615802239723244
Energy: 1.3190197112131727
Energy: 1.2615802239744671
Energy: 1.3190197112131727
Energy: 1.2615802239794676
Energy: 1.3190197112138873
Energy: 1.0431187503173778
Energy: 0.8655937090979722
Energy: 1.0431187503159491
Energy: 0.8655937090965435
Energy: 1.0431187503166632
Energy: 0.8655937090979722
Energy: 1.1219457156626282
Energy: 0.9062319199872185
Energy: 1.1219457156633423
Energy: 0.9062319199865042
Energy: 1.1219457156604853
Energy: 0.9062319199865042
Energy: 1.1658916843612326
Energy: 1.4121165584862159
Energy: 1.1658916843612326
Energy: 1.4121165584905015
Energy: 1.1658916843612326
Energy: 1.4121165584926443
Energy: 1.1470414931199902
Energy: 1.059237949933726
Energy: 1.1470414931214188
Energy: 1.059237949933012
Energy: 1.1470414931207042
Energy: 1.059237949933012
Energy: 0.9489533473818585
Energy: 1.0997587767539514
Energy: 0.9489533473804299
Energy: 1.0997587767539514
Energy: 0.9489533473811442
Energy: 1.0997587767539514
Energy: 0.9819296291218295
Energy: 1.0558336785517146
Energy: 0.9819296291246866
Energy: 1.0558336785517146
Energy: 0.981929629123258
Energy: 1.0558336785517146
Energy: 1.3549211276161717
Energy: 1.3783858825888482
Energy: 1.3549211276161717
Energy: 1.3783858825881337
Energy: 1.354921127616886
Energy: 1.3783858825867052
Energy: 1.2195485645882207
Energy: 0.8989095307215147
Energy: 1.2195485645882207
Energy: 0.8989095307222289
Energy: 1.2195485645917923
Energy: 0.8989095307215147
Energy: 1.0430735190102354
Energy: 0.9909066870496804
Energy: 1.043073519011664
Energy: 0.990906687048966
Energy: 1.043073519011664
Energy: 0.990906687048966
Energy: 0.8519194383869664
Energy: 1.1669757312453994
Energy: 0.8519194383862521
Energy: 1.1669757312453994
Energy: 0.8519194383876807
Energy: 1.1669757312453994
Energy: 1.0724831792803788
Energy: 1.2022190907709822
Energy: 1.0724831792818077
Energy: 1.2022190907716965
Energy: 1.072483179283236
Energy: 1.2022190907745538
Energy: 1.1939862034449191
Energy: 1.0040886727561964
Energy: 1.1939862034449191
Energy: 1.0040886727569107
Energy: 1.1939862034449191
Energy: 1.0040886727569107
Energy: 1.0855316832282689
Energy: 0.9502178891559081
Energy: 1.0855316832275546
Energy: 0.9502178891559081
Energy: 1.0855316832275546
Energy: 0.9502178891551939
Energy: 0.8521791241790548
Energy: 1.3308364677613675
Energy: 0.8521791241797692
Energy: 1.3308364677613675
Energy: 0.8521791241797692
Energy: 1.3308364677613675
Energy: 1.5277899237072534
Energy: 1.3241715503217604
Energy: 1.5277899237065393
Energy: 1.3241715503210458
Energy: 1.5277899237065393
Energy: 1.3241715503217604

minimum gb energy = 0.8280472647237888 eV
minimum distance =  2.27646105495707 Angstroms
sigma value = 41


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

Energy: 1.149150617677269
Energy: 0.957432340041311
Energy: 1.149150617677269
Energy: 0.9574323400424368
Energy: 1.1491506176767061
Energy: 0.9574323400424368
Energy: 1.2124657833476375
Energy: 1.2371678941331161
Energy: 1.2124657833476375
Energy: 1.2371678941331161
Energy: 1.2124657833493264
Energy: 1.2371678941336792
Energy: 1.4438983112343282
Energy: 1.6545745083043808
Energy: 1.4438983112343282
Energy: 1.654574508304944
Energy: 1.4438983112337656
Energy: 1.6545745083043808
Energy: 1.107918195309992
Energy: 0.9542484653016758
Energy: 1.107918195309992
Energy: 0.954248465301113
Energy: 1.1079181953111181
Energy: 0.9542484653016758
Energy: 0.9128479747066089
Energy: 1.0066757913555473
Energy: 0.9128479747066089
Energy: 1.0066757913549844
Energy: 0.912847974706046
Energy: 1.0066757913549844
Energy: 1.183330453536887
Energy: 1.4085696447187817
Energy: 1.18333045353745
Energy: 1.4085696447187817
Energy: 1.183330453536887
Energy: 1.4085696447187817
Energy: 0.9549537269792173
Energy: 1.3993938769239482
Energy: 0.9549537269797803
Energy: 1.3993938769233851
Energy: 0.9549537269797803
Energy: 1.3993938769250742
Energy: 0.9406435704028757
Energy: 0.9544488182510749
Energy: 0.9406435704023127
Energy: 0.9544488182516377
Energy: 0.9406435704023127
Energy: 0.9544488182516377
Energy: 0.9326807066181849
Energy: 0.9876285391870209
Energy: 0.9326807066181849
Energy: 0.9876285391870209
Energy: 0.9326807066181849
Energy: 0.9876285391875841
Energy: 1.0269308098386694
Energy: 1.5059722345776725
Energy: 1.0269308098386694
Energy: 1.5059722345771094
Energy: 1.0269308098392325
Energy: 1.5059722345776725
Energy: 1.022934013476358
Energy: 1.5073671769857342
Energy: 1.022934013476358
Energy: 1.5073671769857342
Energy: 1.022934013475795
Energy: 1.5073671769857342
Energy: 0.9224961915195586
Energy: 1.113804785104799
Energy: 0.9224961915195586
Energy: 1.113804785104799
Energy: 0.9224961915201216
Energy: 1.113804785104799
Energy: 0.9371014738838305
Energy: 0.9544636858545962
Energy: 0.9371014738838305
Energy: 0.9544636858540331
Energy: 0.9371014738838305
Energy: 0.954463685855722
Energy: 0.8916640181501104
Energy: 1.3092556072730424
Energy: 0.8916640181512363
Energy: 1.3092556072702273
Energy: 0.8916640181506733
Energy: 1.3092556072707904
Energy: 1.1862815591421265
Energy: 1.4100605190263096
Energy: 1.1862815591415634
Energy: 1.4100605190263096
Energy: 1.1862815591421265
Energy: 1.4100605190263096
Energy: 0.8923241675234085
Energy: 1.1415208333924243
Energy: 0.8923241675228455
Energy: 1.1415208333924243
Energy: 0.8923241675239714
Energy: 1.1415208333918614
Energy: 0.9461032046363513
Energy: 0.9543610827436075
Energy: 0.9461032046346622
Energy: 0.9543610827436075
Energy: 0.9461032046380402
Energy: 0.9543610827391037
Energy: 1.2495856500396916
Energy: 1.6576248534263116
Energy: 1.2495856500385656
Energy: 1.6576248534263116
Energy: 1.2495856500391285
Energy: 1.6576248534280007
Energy: 1.2326518010734897
Energy: 1.2359185704889502
Energy: 1.2326518010734897
Energy: 1.2359185704889502
Energy: 1.2326518010706748
Energy: 1.235918570489513
Energy: 1.023105335307555
Energy: 1.048003001972635
Energy: 1.0231053353069919
Energy: 1.048003001972072
Energy: 1.0231053353081179
Energy: 1.0480030019731978
Energy: 0.9318549477692387
Energy: 1.2185467576213085
Energy: 0.9318549477692387
Energy: 1.2185467576213085
Energy: 0.9318549477714908
Energy: 1.2185467576218714
Energy: 1.0935635302627094
Energy: 1.5499300798794873
Energy: 1.0935635302632725
Energy: 1.5499300798789244
Energy: 1.0935635302621465
Energy: 1.5499300798828142
Energy: 1.1093414451955894
Energy: 0.9520731348111626
Energy: 1.1093414451955894
Energy: 0.9520731348105996
Energy: 1.1093414451995305
Energy: 0.9520731348111626
Energy: 0.8925305689684957
Energy: 1.1268253433901243
Energy: 0.8925305689701848
Energy: 1.1268253433895614
Energy: 0.8925305689713106
Energy: 1.1268253433906874
Energy: 0.8933334937547819
Energy: 1.321115555523867
Energy: 0.8933334937559079
Energy: 1.321115555523867
Energy: 0.8933334937553449
Energy: 1.321115555523867
Energy: 0.9548594789387282
Energy: 1.3029610364014905
Energy: 0.9548594789387282
Energy: 1.3029610364020534
Energy: 0.9548594789381653
Energy: 1.3029610364026165
Energy: 0.9364038058417833
Energy: 0.9517834520865174
Energy: 0.9364038058417833
Energy: 0.9517834520859544
Energy: 0.9364038058417833
Energy: 0.9517834520859544
Energy: 0.9330484440967565
Energy: 1.1084093318465396
Energy: 0.9330484440973195
Energy: 1.1084093318465396
Energy: 0.9330484440967565
Energy: 1.1084093318471024
Energy: 1.0234391020055738
Energy: 1.2624213893863416
Energy: 1.0234391020050109
Energy: 1.2624213893863416
Energy: 1.0234391020055738
Energy: 1.2624213893863416
Energy: 1.3755113749218093
Energy: 1.2514457264077006
Energy: 1.3755113749212462
Energy: 1.2514457264082635
Energy: 1.3755113749206833
Energy: 1.2514457264082635
Energy: 0.9161383174776867
Energy: 1.1154918653282064
Energy: 0.9161383174776867
Energy: 1.1154918653276436
Energy: 0.9161383174776867
Energy: 1.1154918653282064
Energy: 0.9490487156425299
Energy: 0.9699289580983212
Energy: 0.9490487156436559
Energy: 0.9699289580977583
Energy: 0.9490487156430929
Energy: 0.9699289580977583
Energy: 0.8929893004523344
Energy: 1.161754423693357
Energy: 0.8929893004523344
Energy: 1.1617544236939197
Energy: 0.8929893004523344
Energy: 1.1617544236939197

minimum gb energy = 0.8916640181501104 eV
minimum distance =  2.30525153418343 Angstroms
sigma value = 33


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

Energy: 1.1305184611821504
Energy: 1.0415621635268992
Energy: 1.0830464738567858
Energy: 1.0415621635268992
Energy: 1.1305184611825814
Energy: 1.0415621635308503
Energy: 1.169830271586845
Energy: 0.9991262922391739
Energy: 1.169830271590796
Energy: 0.9991262922387428
Energy: 1.169830271586845
Energy: 0.9991262922419037
Energy: 1.0858001821504781
Energy: 1.5353040847222628
Energy: 1.0858001821524896
Energy: 1.5353040847226938
Energy: 1.0858001821496879
Energy: 1.535304084720323
Energy: 1.1128698678587656
Energy: 1.023808769013001
Energy: 1.1128698678563949
Energy: 1.023808769013001
Energy: 1.1128698678599869
Energy: 1.0238087690106303
Energy: 1.039846731387833
Energy: 1.0255970426758105
Energy: 1.0399336580834238
Energy: 1.025597042677391
Energy: 1.039846731387833
Energy: 1.02559704267344
Energy: 1.337944581704059
Energy: 1.0093602212073074
Energy: 1.3379445817012572
Energy: 1.0093602212077386
Energy: 1.3379445817036277
Energy: 1.0093602212080977
Energy: 1.055192363188733
Energy: 1.1999448166383888
Energy: 1.0551923631871525
Energy: 1.1999448166395381
Energy: 1.0551923631890923
Energy: 1.199944816632067
Energy: 1.142928393426603
Energy: 1.0709131817795259
Energy: 1.1429283934293328
Energy: 1.0709131817791666
Energy: 1.1429283934273933
Energy: 1.070913181783477
Energy: 1.0863865506491261
Energy: 1.0758975354394207
Energy: 1.0864639528738311
Energy: 1.0758975354398517
Energy: 1.0863865506522872
Energy: 1.0758975354359006
Energy: 1.4054248661027
Energy: 1.0339621981093825
Energy: 1.4054248661011197
Energy: 1.0339621981093825
Energy: 1.4054248661034903
Energy: 1.0339621981022704
Energy: 1.1140790462931969
Energy: 1.0629338721562802
Energy: 1.1140790462884556
Energy: 1.0629338721570705
Energy: 1.1140790462924068
Energy: 1.0629338721531194
Energy: 1.623942583440696
Energy: 1.0239241348370298
Energy: 1.6239425834474488
Energy: 1.0239241348370298
Energy: 1.623942583440696
Energy: 1.0239241348224468
Energy: 1.026004344315805
Energy: 1.0863706000147437
Energy: 1.0260043443107043
Energy: 1.0863706000143842
Energy: 1.026004344315805
Energy: 1.0863706000100024
Energy: 1.0821311088189745
Energy: 1.1097623219276853
Energy: 1.082131108827236
Energy: 1.109762321926895
Energy: 1.0821311088197647
Energy: 1.1097623219383892
Energy: 1.0724196016499123
Energy: 1.0043282001823453
Energy: 1.0724196016507026
Energy: 1.0043282001827765
Energy: 1.0724196016503436
Energy: 1.0043282001878768
Energy: 1.063868918221651
Energy: 1.327242828021271
Energy: 1.0638689182153294
Energy: 1.3272428280220612
Energy: 1.0638689182220102
Energy: 1.3272428280268025
Energy: 0.9775430298822178
Energy: 1.0360065075331366
Energy: 0.9775430296262563
Energy: 1.0360065075335676
Energy: 0.9775430291523363
Energy: 1.0360065075335676
Energy: 1.0220180491713138
Energy: 1.0865233785017165
Energy: 1.0220175951224868
Energy: 1.0865233785017165
Energy: 1.0220180491716728
Energy: 1.0865233785032968
Energy: 1.538049296275573
Energy: 1.076357975066149
Energy: 1.5380492962732022
Energy: 1.0763579750187353
Energy: 1.538049296275573
Energy: 1.0763579750084626
Energy: 1.3281757614504688
Energy: 1.049937852846931
Energy: 1.3281757614433565
Energy: 1.049937852846931
Energy: 1.3281757614496785
Energy: 1.0499378528322758
Energy: 1.0316472829703884
Energy: 1.0827463329383091
Energy: 1.0316472829715377
Energy: 1.0827463329383091
Energy: 1.0316472829699574
Energy: 1.0827463329315563
Energy: 0.9966524021000093
Energy: 1.171034410017151
Energy: 0.9966531622752891
Energy: 1.1710344100167918
Energy: 0.9966524021000093
Energy: 1.171034410014421
Energy: 1.472510550956423
Energy: 1.3155016211130977
Energy: 1.4725105509536212
Energy: 1.3155016211135286
Energy: 1.4725105509559917
Energy: 1.3155016211087873
Energy: 1.027598363129309
Energy: 1.1116623904780065
Energy: 1.0275983631269385
Energy: 1.1116623904819576
Energy: 1.0275983631288783
Energy: 1.1116623904890697
Energy: 1.0249312620144433
Energy: 1.0359308227467257
Energy: 1.024931262020334
Energy: 1.0359308227467257
Energy: 1.0249312620112823
Energy: 1.0359308227483062
Energy: 1.0078371709523881
Energy: 1.2635377129184513
Energy: 1.0078371709531784
Energy: 1.263537712916871
Energy: 1.0078371709528193
Energy: 1.2635377129227618
Energy: 1.1215331910178883
Energy: 1.0555450822422316
Energy: 1.1215331910139372
Energy: 1.0555450822414414
Energy: 1.1215331910178883
Energy: 1.0555450822450334
Energy: 1.1236162809901202
Energy: 1.0273727134626958
Energy: 1.073062541792061
Energy: 1.0273727134626958
Energy: 1.1236162809901202
Energy: 1.0273727134694488
Energy: 1.0775864328652764
Energy: 1.0868106618860398
Energy: 1.0775864328736098
Energy: 1.08681066188683
Energy: 1.0775864328700178
Energy: 1.0868106618872613
Energy: 1.0323112449131848
Energy: 1.404513900398783
Energy: 1.0323112449202967
Energy: 1.4045139003995732
Energy: 1.0323112449128253
Energy: 1.4045139003893004
Energy: 1.027997187568414
Energy: 1.0229284217815033
Energy: 1.0279971875668334
Energy: 1.0229284217815033
Energy: 1.027997187568055
Energy: 1.0229284217960866
Energy: 1.0276248283855858
Energy: 1.6200156822916219
Energy: 1.0276282551039506
Energy: 1.6200156822911909
Energy: 1.0276248283855858
Energy: 1.6200156822959324
Energy: 1.0872430796361294
Energy: 1.0186648013747228
Energy: 1.0872430796404395
Energy: 1.0186648013747228
Energy: 1.0872430796369197
Energy: 1.018664801375513
Energy: 1.1077351951256282
Energy: 1.0761738879063678
Energy: 1.1077351951295793
Energy: 1.0761738879067269
Energy: 1.107735195125269
Energy: 1.0761738879095286
Energy: 1.0598947158927354
Energy: 1.0760292990380702
Energy: 1.0598947158927354
Energy: 1.0760292990376392
Energy: 1.0598947158962557
Energy: 1.0760292990463316
Energy: 1.328042285181678
Energy: 1.071018980863253
Energy: 1.3278101482402136
Energy: 1.0710189808636121
Energy: 1.328042285181678
Energy: 1.0710189808648336
Energy: 1.0279754618265649
Energy: 1.5715660782814196
Energy: 1.027975461820243
Energy: 1.5715660782814196
Energy: 1.0279754618261339
Energy: 1.571566078282641
Energy: 1.081020003897514
Energy: 1.0227448334617921
Energy: 1.0810200039022553
Energy: 1.0227448334617921
Energy: 1.0810200038983042
Energy: 1.0227448334551112
Energy: 1.0805153955775564
Energy: 1.3916113417775466
Energy: 1.0805133579827022
Energy: 1.3916113417775466
Energy: 1.0805153955767661
Energy: 1.391611341772015
Energy: 1.0265865492390194
Energy: 1.0863468399469187
Energy: 1.02658654923866
Energy: 1.0863468399465595
Energy: 1.02658654923866
Energy: 1.086346839955611
Energy: 1.0728873628774334
Energy: 1.025571113727462
Energy: 1.0728873628782236
Energy: 1.025571113727462
Energy: 1.0728873628774334
Energy: 1.0255711137243007
Energy: 1.1751400677009596
Energy: 1.0038173654464555
Energy: 1.175140067702971
Energy: 1.0038173654480358
Energy: 1.1751400677017498
Energy: 1.0038173654539266
Energy: 1.058562243384933
Energy: 1.3234854041231983
Energy: 1.0585622433822035
Energy: 1.3234854041235573
Energy: 1.0585622433853643
Energy: 1.3234854041227673
Energy: 0.972416971568514
Energy: 1.0382041699848752
Energy: 0.972416971571675
Energy: 1.0382041699848752
Energy: 0.9724169715677238
Energy: 1.0382041699825046
Energy: 1.0279781038455542
Energy: 1.079712634901805
Energy: 1.027977625105606
Energy: 1.0797126349037445
Energy: 1.0279781038459133
Energy: 1.0797126348986439
Energy: 1.4007489893874676
Energy: 1.2026348851982493
Energy: 1.400748989385887
Energy: 1.2026348851986086
Energy: 1.4007489893874676
Energy: 1.2026348851884077
Energy: 0.996612510572779
Energy: 1.1263301119588869
Energy: 0.9966125105724197
Energy: 1.1263301119588869
Energy: 0.9966125105719887
Energy: 1.126330111952565

minimum gb energy = 0.9724169715677238 eV
minimum distance =  2.28750481872875 Angstroms
sigma value = 67


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

Energy: 1.1260848482483263
Energy: 1.0382469453269128
Energy: 1.1260848482483263
Energy: 1.0382469453269128
Energy: 1.1260848482483263
Energy: 1.0382469453269128
Energy: 1.103989544225438
Energy: 1.0007378775034326
Energy: 1.103989544225438
Energy: 1.0007378775034326
Energy: 1.103989544225438
Energy: 1.0007378775034326
Energy: 1.6168729029411448
Energy: 1.2634650789125004
Energy: 0.9956417773932553
Energy: 1.2634650789125004
Energy: 0.9956417773932553
Energy: 1.2634650789125004
Energy: 1.1040082918509446
Energy: 1.0007033272075996
Energy: 1.1040082918509446
Energy: 1.0007033272049588
Energy: 1.1040082918509446
Energy: 1.0007033272075996
Energy: 1.1260848482483263
Energy: 1.038246945324272
Energy: 1.1260848482483263
Energy: 1.038246945324272
Energy: 1.1260848482483263
Energy: 1.038246945324272
Energy: 1.103989544225438
Energy: 1.0007378775034326
Energy: 1.103989544225438
Energy: 1.0007378775034326
Energy: 1.103989544225438
Energy: 1.0007378775034326
Energy: 1.6168729029411448
Energy: 1.2634650789125004
Energy: 0.995641777395896
Energy: 1.2634650789125004
Energy: 0.9956417773932553
Energy: 1.2634650789125004

minimum gb energy = 0.9956417773932553 eV
minimum distance =  2.29646030119521 Angstroms
sigma value = 3


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

Energy: 1.3872778190924084
Energy: 1.220685948872182
Energy: 1.3872778190924084
Energy: 1.220685948872182
Energy: 1.3872778190888149
Energy: 1.220685948872182
Energy: 1.2976994173611958
Energy: 1.159574248065987
Energy: 1.2976994173611958
Energy: 1.159574248065987
Energy: 1.2976994173611958
Energy: 1.159574248065987
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Energy: 1.3081645780086009
Energy: 1.2584362451256093
Energy: 1.3081645312169954
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Energy: 1.3081644295520276
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Energy: 1.190898184579165
Energy: 1.3105300880908124
Energy: 1.190898184579165
Energy: 1.3105300880836255
Energy: 1.190898184579165
Energy: 1.310530088087219
Energy: 1.4574591917121205
Energy: 1.1475879686630528
Energy: 1.4574591917157138
Energy: 1.1475879686666464
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Energy: 1.473353406015333
Energy: 1.1658617802386593
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Energy: 1.1658617802386593
Energy: 1.4733534060117397
Energy: 1.3021400102781242
Energy: 1.159497240897193
Energy: 1.3021400102745304
Energy: 1.159497240897193
Energy: 1.3021400102638154
Energy: 1.1594972408935997
Energy: 1.2676448265866982
Energy: 1.2631961004333305
Energy: 1.2676448265831044
Energy: 1.263196093048449
Energy: 1.2676448265831044
Energy: 1.2631960797512325
Energy: 1.349608589212463
Energy: 1.16650503795801
Energy: 1.349608589212463
Energy: 1.16650503795801
Energy: 1.349608589212463
Energy: 1.16650503795801
Energy: 1.202645354822557
Energy: 1.3464324555786102
Energy: 1.202645354822557
Energy: 1.346432455575017
Energy: 1.202645354822557
Energy: 1.346432455575017
Energy: 1.2502023737155723
Energy: 1.1695475596528346
Energy: 1.2502023737155723
Energy: 1.1695475596528346
Energy: 1.2502023737155723
Energy: 1.1695475596528346
Energy: 1.1901674686886157
Energy: 1.2688071676983264
Energy: 1.1901674686850223
Energy: 1.2688071676911392
Energy: 1.1901674686886157
Energy: 1.2688071676911392
Energy: 1.2684874676491145
Energy: 1.2703563124519985
Energy: 1.2684874676527078
Energy: 1.2703563124519985
Energy: 1.2684874676491145
Energy: 1.2703563124519985
Energy: 1.202621714853472
Energy: 1.2570432890724732
Energy: 1.202621714853472
Energy: 1.2570432890653516
Energy: 1.2026217148570657
Energy: 1.2570432890689451

minimum gb energy = 1.1405166375160707 eV
minimum distance =  2.20864407436872 Angstroms
sigma value = 81


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

Energy: 1.318188741513365
Energy: 1.2188615628298574
Energy: 1.3181887415143514
Energy: 1.2188615628298574
Energy: 1.318188741513365
Energy: 1.2188615628298574
Energy: 1.194984575179569
Energy: 1.1677969455384398
Energy: 1.1949845751771029
Energy: 1.167796945543865
Energy: 1.1949845751780894
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Energy: 1.3485598284463205
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Energy: 1.1277005850428743
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Energy: 1.2855953230093986
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Energy: 1.3377948510647502
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Energy: 1.300355319322644
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Energy: 1.3003553193211643
Energy: 1.469764031992968
Energy: 1.1343704147022748
Energy: 1.219474863622697
Energy: 1.1343704147022748
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Energy: 1.1343704147027682
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Energy: 1.1734554296959414
Energy: 1.1281340480436575
Energy: 1.1734554297023534
Energy: 1.1281340480461235
Energy: 1.1734554296984077
Energy: 1.1281340480436575
Energy: 1.237015972394755
Energy: 1.1940155882743448
Energy: 1.2370159724041259
Energy: 1.1940155882738515
Energy: 1.2370159724031395
Energy: 1.1940155882743448
Energy: 1.3487355258095186
Energy: 1.0964181617328386
Energy: 1.3487355258095186
Energy: 1.0964181617303725
Energy: 1.3487355258090254
Energy: 1.0964181617328386
Energy: 1.2483347313105602
Energy: 1.3008303727129955
Energy: 1.2483347313105602
Energy: 1.3008303727139818
Energy: 1.2483347313120396
Energy: 1.3008303727134884
Energy: 1.1639102007233593
Energy: 1.2230707240509753
Energy: 1.163910200722866
Energy: 1.2230707240519616
Energy: 1.1639102007238524
Energy: 1.223070724048016
Energy: 1.1289502221561216
Energy: 1.2131904223651462
Energy: 1.128950222155135
Energy: 1.2131867806135674
Energy: 1.1289502221556285
Energy: 1.2129188293936268
Energy: 1.1293320866424246
Energy: 1.110783306113775
Energy: 1.1293320866419314
Energy: 1.1107833061142685
Energy: 1.1293320866424246
Energy: 1.110783306113282
Energy: 1.1847487028273316
Energy: 1.5962336274731557
Energy: 1.1847487028248653
Energy: 1.5962336274771012
Energy: 1.184748702828811
Energy: 1.5962336274756217
Energy: 1.37235081777727
Energy: 1.2485432803622962
Energy: 1.372350817774311
Energy: 1.2485432803558845
Energy: 1.3723508177708583
Energy: 1.2485432803661969
Energy: 1.236937040140178
Energy: 1.1799242354202948
Energy: 1.2369370401382052
Energy: 1.1799242354198014
Energy: 1.236937040140178
Energy: 1.1799242354173354
Energy: 1.1547820116797571
Energy: 1.133546476164861
Energy: 1.154782011679264
Energy: 1.1335464761638747
Energy: 1.154782011679264
Energy: 1.1335464761643677

minimum gb energy = 1.0960655405851356 eV
minimum distance =  2.3097295421483 Angstroms
sigma value = 43


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

Energy: 1.4188116839361162
Energy: 1.2008714048694518
Energy: 1.4188116839355105
Energy: 1.2008714048694518
Energy: 1.4188116839361162
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Energy: 1.2620764457382245
Energy: 1.1893247622422083
Energy: 1.2620764457388303
Energy: 1.2917795397827794
Energy: 1.1369158595937439
Energy: 1.2917795397815677
Energy: 1.1369158595913205
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Energy: 1.1369158595937439
Energy: 1.2979643870955992
Energy: 1.1989979886668887
Energy: 1.297964387096811
Energy: 1.1989979886674944
Energy: 1.297964387096205
Energy: 1.1989979886674944
Energy: 1.2584473619402643
Energy: 1.157977965595832
Energy: 1.2584473619390526
Energy: 1.157977965596438
Energy: 1.2584473619378411
Energy: 1.1579779655946205
Energy: 1.29170665711485
Energy: 1.2477984928551231
Energy: 1.2917066571160618
Energy: 1.2477984928557289
Energy: 1.2917066571160618
Energy: 1.2477984928563346
Energy: 1.1891506627523212
Energy: 1.200183598890528
Energy: 1.1891506627529271
Energy: 1.200183598889922
Energy: 1.1891506627523212
Energy: 1.2001835988881047
Energy: 1.2596864378982728
Energy: 1.2356243997365117
Energy: 1.259686437899484
Energy: 1.2356243997365117
Energy: 1.259686437899484
Energy: 1.2356243997365117
Energy: 1.1117641968931182
Energy: 1.2602000438838226
Energy: 1.1117641968937242
Energy: 1.2602000438838226
Energy: 1.1117641968931182
Energy: 1.2602000438838226
Energy: 1.2766624824564035
Energy: 1.231015196657773
Energy: 1.27666248245398
Energy: 1.231015196657773
Energy: 1.2766624824557975
Energy: 1.231015196657167
Energy: 1.1778783205347851
Energy: 1.178491986311961
Energy: 1.1778783205329677
Energy: 1.178491986311961
Energy: 1.1778783205335734
Energy: 1.178491986311961
Energy: 1.2973059507979177
Energy: 1.216520639532636
Energy: 1.2973059507985234
Energy: 1.2165206395344534
Energy: 1.297305950797312
Energy: 1.2165206395314245
Energy: 1.2149451795765276
Energy: 1.3252285606961485
Energy: 1.214945179577133
Energy: 1.3252285606961485
Energy: 1.214945179577133
Energy: 1.3252285606961485
Energy: 1.3260783395136946
Energy: 1.2093076995608838
Energy: 1.3260783395136946
Energy: 1.2093076995608838
Energy: 1.3260783395130886
Energy: 1.2093076995614898
Energy: 1.177762304553691
Energy: 1.276400102108531
Energy: 1.1777623045530852
Energy: 1.276400102107925
Energy: 1.1777623045542966
Energy: 1.276400102107925
Energy: 1.2460337310518221
Energy: 1.270465519758594
Energy: 1.2460337310512162
Energy: 1.270465519758594
Energy: 1.2460337310512162
Energy: 1.270465519758594
Energy: 1.1710221701008792
Energy: 1.2316317169528879
Energy: 1.1710221701057253
Energy: 1.2316317169540998
Energy: 1.1710221701051198
Energy: 1.2316317169528879

minimum gb energy = 1.1105627338852173 eV
minimum distance =  2.25964117302974 Angstroms
sigma value = 57


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

Energy: 1.3353863069493301
Energy: 1.1652550847133034
Energy: 1.2465860066668035
Energy: 1.1652550847156566
Energy: 1.3353863069493301
Energy: 1.1652550847156566
Energy: 1.2742169725690204
Energy: 1.1176414703048612
Energy: 1.2742169725698052
Energy: 1.1176414703017237
Energy: 1.2742169725682362
Energy: 1.1176414703017237
Energy: 1.2780437067567716
Energy: 1.309441768602303
Energy: 1.2109473112222187
Energy: 1.309441768598381
Energy: 1.278043701667515
Energy: 1.309441768598381
Energy: 1.5152122441264282
Energy: 1.2570854416601407
Energy: 1.5152122441272127
Energy: 1.2570854416601407
Energy: 1.5152122441272127
Energy: 1.2570854416601407
Energy: 1.2570778206926454
Energy: 1.2151987710172918
Energy: 1.2570778206942141
Energy: 1.2151987710180763
Energy: 1.2570778206926454
Energy: 1.2151987710180763
Energy: 1.2910310880409563
Energy: 1.1171141651212546
Energy: 1.2910310880378189
Energy: 1.117114165118117
Energy: 1.2910310880386031
Energy: 1.117114165118117
Energy: 1.2525812001015282
Energy: 1.2460241106909946
Energy: 1.2525812001030971
Energy: 1.2460241106862884
Energy: 1.2525812001070191
Energy: 1.246024110685504
Energy: 1.2482640491720334
Energy: 1.170216556859488
Energy: 1.2482640491751709
Energy: 1.1702165568579193
Energy: 1.248264049173602
Energy: 1.1702165568579193
Energy: 1.297984808469284
Energy: 1.1160181895021646
Energy: 1.2979848084700685
Energy: 1.1160181895037335
Energy: 1.297984808467715
Energy: 1.116018189502949
Energy: 1.1124856790749948
Energy: 1.1709854980156467
Energy: 1.1124921876341596
Energy: 1.1709854980156467
Energy: 1.1124856790749948
Energy: 1.1709854980156467
Energy: 1.2140575329448382
Energy: 1.2612252353645519
Energy: 1.214057532946407
Energy: 1.2612252353582765
Energy: 1.214057532946407
Energy: 1.2612252353590612
Energy: 1.253894042210349
Energy: 1.2633159052846854
Energy: 1.2538940422111335
Energy: 1.2633159052791945
Energy: 1.2538940422087803
Energy: 1.2633159052713505
Energy: 1.2646056614320902
Energy: 1.1165386419563188
Energy: 1.2646056614360122
Energy: 1.116538641959456
Energy: 1.2646056614344432
Energy: 1.116538641959456
Energy: 1.3008934072129754
Energy: 1.1271227919114328
Energy: 1.1991249371917754
Energy: 1.127122791912217
Energy: 1.3008934072114067
Energy: 1.1271227919114328
Energy: 1.2968104141579202
Energy: 1.119947626039653
Energy: 1.1985967977048444
Energy: 1.1199476260412218
Energy: 1.2968104141579202
Energy: 1.1199476260412218
Energy: 1.2975114621031905
Energy: 1.2284856269892208
Energy: 1.2975114621031905
Energy: 1.2284856269892208
Energy: 1.297511462104759
Energy: 1.2284856269892208
Energy: 1.1102261742504358
Energy: 1.1673918311108604
Energy: 1.1103504855981343
Energy: 1.167391831113998
Energy: 1.110226174252789
Energy: 1.167391831113998
Energy: 1.2111160066896631
Energy: 1.052691848710065
Energy: 1.21111600668731
Energy: 1.0526918487132026
Energy: 1.2111160066865259
Energy: 1.0526918487132026
Energy: 1.1105134576271871
Energy: 1.1671898298674868
Energy: 1.1105134576279718
Energy: 1.167189829872193
Energy: 1.1105134576256186
Energy: 1.167189829872193
Energy: 1.2140443804264838
Energy: 1.2284243787913556
Energy: 1.2140443804241308
Energy: 1.228424378794493
Energy: 1.2140443804233463
Energy: 1.228424378794493
Energy: 1.1987184796462393
Energy: 1.1241262825226261
Energy: 1.1987184796454549
Energy: 1.1241262825187042
Energy: 1.1987184796423174
Energy: 1.1241262825187042
Energy: 1.338246296492192
Energy: 1.2153965343276394
Energy: 1.3382462964953294
Energy: 1.2153965343229332
Energy: 1.3382462964929762
Energy: 1.2153965343237176
Energy: 1.2041718178546796
Energy: 1.1164244740307319
Energy: 1.2052232274875907
Energy: 1.1164244740330853
Energy: 1.2047107195163371
Energy: 1.1164244740330853
Energy: 1.2600063871330893
Energy: 1.2659892446444783
Energy: 1.259763239687017
Energy: 1.2659892444390384
Energy: 1.2600063871346578
Energy: 1.2659892441144418

minimum gb energy = 1.052691848710065 eV
minimum distance =  2.17369607386716 Angstroms
sigma value = 17


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

Energy: 1.1720641181252005
Energy: 1.0439846671761543
Energy: 1.1720641181252005
Energy: 1.0439846671761543
Energy: 1.1720641181252005
Energy: 1.0439846671761543
Energy: 1.0029781068733454
Energy: 0.9914454173864603
Energy: 1.0029781068755643
Energy: 0.9914454173864603
Energy: 1.0029781068755643
Energy: 0.9914454173875696
Energy: 1.1705212980181299
Energy: 1.1739887099689543
Energy: 1.1705212980181299
Energy: 1.1739887099689543
Energy: 1.1705212980181299
Energy: 1.1739887099689543
Energy: 0.942058076711868
Energy: 1.1799295115723905
Energy: 0.9420580767107587
Energy: 1.1799295115734996
Energy: 0.9420580767107587
Energy: 1.1799295115723905
Energy: 1.1644311489792996
Energy: 1.1057123515687706
Energy: 1.1644311489781904
Energy: 1.1057123515687706
Energy: 1.1644311489781904
Energy: 1.1057123515687706
Energy: 1.0698562667371543
Energy: 1.138949708930412
Energy: 1.069856266736045
Energy: 1.138949708930412
Energy: 1.069856266736045
Energy: 1.138949708930412
Energy: 1.0895719616840915
Energy: 1.0027533662916315
Energy: 1.0895719616863102
Energy: 1.0027533662927408
Energy: 1.0895719616863102
Energy: 1.0027533662927408
Energy: 0.9419884925252546
Energy: 1.1735459615046229
Energy: 0.9419884925252546
Energy: 1.1735430420442152
Energy: 0.9419884925252546
Energy: 1.1735402061513296
Energy: 1.1470672334379048
Energy: 0.9913625497014928
Energy: 1.1470672334379048
Energy: 0.9913625497014928
Energy: 1.1470672334379048
Energy: 0.9913625497014928
Energy: 1.0686650031479006
Energy: 1.005432752611207
Energy: 1.06866500314901
Energy: 1.005432752611207
Energy: 1.06866500314901
Energy: 1.005432752611207
Energy: 1.0512321365450787
Energy: 1.0520841216377996
Energy: 1.0512321365439694
Energy: 1.0520841216377996
Energy: 1.051232136546188
Energy: 1.0520841216377996
Energy: 1.1355590696125084
Energy: 1.1132187493630359
Energy: 1.1355590695160496
Energy: 1.1132187493641454
Energy: 1.1355590692776507
Energy: 1.1132187493630359
Energy: 0.9422598915238816
Energy: 1.1373096452876446
Energy: 0.9422598915238816
Energy: 1.1373096452876446
Energy: 0.9422598915238816
Energy: 1.1373096452876446
Energy: 1.067617820188072
Energy: 1.1518700930159367
Energy: 1.067617820188072
Energy: 1.1518700930159367
Energy: 1.0676178201891815
Energy: 1.1518700930159367
Energy: 1.0677251593092765
Energy: 1.115047532566167
Energy: 1.0677251593092765
Energy: 1.115047532566167
Energy: 1.0677251593092765
Energy: 1.115047532566167
Energy: 1.0676753240641566
Energy: 1.407502128575875
Energy: 1.0676753240652659
Energy: 1.4075021285747658
Energy: 1.0676753240652659
Energy: 1.407502128575875
Energy: 1.0660481611791557
Energy: 1.1498227651426949
Energy: 1.0660481611791557
Energy: 1.1498227651438042
Energy: 1.0660481611791557
Energy: 1.1498227651426949

minimum gb energy = 0.9419884925252546 eV
minimum distance =  2.30193500183401 Angstroms
sigma value = 17


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

Energy: 1.0625287473587537
Energy: 0.9503263105285157
Energy: 1.0625287473587537
Energy: 0.9503263105285157
Energy: 1.0625287473583254
Energy: 0.9503263105285157
Energy: 0.9827248527197388
Energy: 1.0296718754465324
Energy: 0.9827248527171684
Energy: 1.0296718754456753
Energy: 0.9827248527180251
Energy: 1.0296718754431053
Energy: 1.019424903277853
Energy: 1.0253018168411046
Energy: 1.0194249032757112
Energy: 1.0253018168415327
Energy: 1.0194249032748548
Energy: 1.0253018168415327
Energy: 0.987978925871104
Energy: 1.060604507495576
Energy: 0.9879789258736743
Energy: 1.0730246747143788
Energy: 0.9879789258728175
Energy: 1.060604507492149
Energy: 0.9586838379929733
Energy: 0.9118854636960764
Energy: 0.9586838379916883
Energy: 0.9118854636956478
Energy: 0.9586838379921168
Energy: 0.9118854636960764
Energy: 1.02107080426383
Energy: 1.0005525439975749
Energy: 1.021070804262545
Energy: 1.0005525439842955
Energy: 1.0210708042642584
Energy: 1.0005525439842955
Energy: 0.9610957602700314
Energy: 0.9600095121020971
Energy: 0.9610957602687463
Energy: 0.9600095121012403
Energy: 0.9610957602687463
Energy: 0.9600095121025254
Energy: 1.067738337052745
Energy: 1.0698829871869415
Energy: 1.067738337052745
Energy: 1.0698829871856566
Energy: 1.067738337053173
Energy: 1.0698829871877982
Energy: 1.0008934791925208
Energy: 1.0129955955409475
Energy: 1.000893479192949
Energy: 1.0129955955409475
Energy: 1.000893479192949
Energy: 1.0129955955422327
Energy: 0.9626118685394829
Energy: 0.8690611924973093
Energy: 0.9626118685399112
Energy: 0.8690611924973093
Energy: 0.9626118685411963
Energy: 0.8690611924977377
Energy: 0.88367198496027
Energy: 0.9288721720059648
Energy: 0.8836719849598416
Energy: 0.9288430014379161
Energy: 0.8836719849589849
Energy: 0.9291669573184261
Energy: 1.07891849031654
Energy: 0.9330190043288871
Energy: 1.07891849031654
Energy: 0.9330190043284585
Energy: 1.0789184903161118
Energy: 0.9330190043288871
Energy: 0.9649346653338549
Energy: 0.9375653663570641
Energy: 0.9649346653308563
Energy: 0.9375653663562075
Energy: 0.9649346653334265
Energy: 0.9375653663566359
Energy: 0.978238766834199
Energy: 0.9526325650485085
Energy: 0.9782387668337705
Energy: 0.95263256504808
Energy: 0.978238766834199
Energy: 0.9526325650489367
Energy: 1.0435877364132875
Energy: 1.036532031971139
Energy: 1.0435877364150008
Energy: 1.0365320319707108
Energy: 1.0435877364120023
Energy: 1.0365320319707108
Energy: 0.8841148197888062
Energy: 0.9966090663237149
Energy: 0.8841148197875212
Energy: 0.9966090663241434
Energy: 0.8841148197866644
Energy: 0.9966090663241434
Energy: 0.9768012973868668
Energy: 1.0144270039101106
Energy: 0.9768012973872952
Energy: 1.0144270039096825
Energy: 0.9768012973868668
Energy: 1.0144270039105392
Energy: 1.0252660350071718
Energy: 1.0121001737167783
Energy: 1.0252660350054583
Energy: 1.0121001737167783
Energy: 1.0252660350063152
Energy: 1.0121001737167783
Energy: 0.9746862738456917
Energy: 0.9949975848951219
Energy: 0.9746862738461199
Energy: 0.994997584897692
Energy: 0.9746862738461199
Energy: 0.9949975848964068
Energy: 0.9753657682550488
Energy: 0.9085009559989122
Energy: 0.975365768255477
Energy: 0.8722592314270515
Energy: 0.975365768255477
Energy: 0.8722592314270515
Energy: 0.9746593690600182
Energy: 0.9951237721532581
Energy: 0.9746593690613032
Energy: 0.995123772151116
Energy: 0.9746593690625884
Energy: 0.9951237721558283
Energy: 1.025201692149422
Energy: 1.0121118986605877
Energy: 1.0252016921468519
Energy: 1.0121118986605877
Energy: 1.0252016921485654
Energy: 1.0121118986601594
Energy: 0.976671585827894
Energy: 1.0140861853941692
Energy: 0.9766715858287509
Energy: 1.0140861853945977
Energy: 0.9766715858287509
Energy: 1.0140861853945977
Energy: 0.8838969906543985
Energy: 1.0799872123705543
Energy: 0.8838969906548267
Energy: 1.079987212370126
Energy: 0.8838969906548267
Energy: 1.079987212370126
Energy: 1.0436005055691369
Energy: 1.0366104671553718
Energy: 1.0436005055622828
Energy: 1.0366104671553718
Energy: 1.0436005055687085
Energy: 1.0366104671553718
Energy: 0.9783851783806523
Energy: 0.9523976087875331
Energy: 0.9783851783819375
Energy: 0.9523976087875331
Energy: 0.9783851783827943
Energy: 0.9523976087875331
Energy: 0.9650012311569968
Energy: 0.9375949438377043
Energy: 0.9650012311578537
Energy: 0.9375949438381325
Energy: 0.9650012311574252
Energy: 0.9375949438385609
Energy: 1.0789310424894198
Energy: 0.933146313368569
Energy: 1.0789310424894198
Energy: 0.9331463133689973
Energy: 1.0789310424915617
Energy: 0.9331463133694258
Energy: 0.8834894790934057
Energy: 0.9280318052358834
Energy: 0.8834894790946907
Energy: 0.9284603099221688
Energy: 0.883489479093834
Energy: 0.9291848477438546
Energy: 0.9628702147579313
Energy: 0.8704601864562241
Energy: 0.9628702147587882
Energy: 0.8704601864553672
Energy: 0.9628702147592164
Energy: 0.8704601864557956
Energy: 1.0009340407950782
Energy: 1.0128729112974766
Energy: 1.0009340407950782
Energy: 1.0128729112979047
Energy: 1.0009340407955065
Energy: 1.0128729112974766
Energy: 1.0676373851782177
Energy: 1.0697903353056017
Energy: 1.067637385179503
Energy: 1.0697903353060303
Energy: 1.0676373851790748
Energy: 1.069790335301318
Energy: 0.963456351354321
Energy: 0.9594381188210552
Energy: 0.963456351354321
Energy: 0.9594381188231973
Energy: 0.963456351354321
Energy: 0.9594381188219122
Energy: 1.0208519528963103
Energy: 0.9276185318285809
Energy: 1.0208519528971667
Energy: 0.9276185318290093
Energy: 1.0208519528971667
Energy: 0.9276185318290093
Energy: 0.9586156449757602
Energy: 0.911752694526504
Energy: 0.9586156449744752
Energy: 0.9117526945273606
Energy: 0.958615644971905
Energy: 0.9117526945252189
Energy: 0.9882641839115921
Energy: 1.029240725315602
Energy: 0.9882641839115921
Energy: 1.029240725315602
Energy: 0.9882641839128772
Energy: 1.029240725315602
Energy: 1.0199069821878046
Energy: 1.0250589440711886
Energy: 1.0199069821886615
Energy: 1.0250589440716171
Energy: 1.0199069821843774
Energy: 1.0250589440716171
Energy: 0.9828166421510407
Energy: 0.9265017318691406
Energy: 0.9828166421531827
Energy: 0.9265017318687122
Energy: 0.9828166421501839
Energy: 0.9265017318682839
Energy: 1.0625287473574685
Energy: 0.9503263105280875
Energy: 1.0625287473578968
Energy: 0.9503263105280875
Energy: 1.0625287473570402
Energy: 0.9503263105280875
Energy: 0.9827248527150266
Energy: 0.9189950003152859
Energy: 0.9827248527150266
Energy: 0.9189950003152859
Energy: 0.9827248527150266
Energy: 0.9189950003148575
Energy: 1.019424903275283
Energy: 1.0253018168423895
Energy: 1.0194249032688574
Energy: 1.0253018168423895
Energy: 1.019424903270571
Energy: 1.0253018168423895
Energy: 0.9879789258736743
Energy: 1.0138660001785238
Energy: 0.9879789258741027
Energy: 1.0138660001780957
Energy: 0.9879789258741027
Energy: 1.0138660001789523
Energy: 0.9586838380036828
Energy: 0.9118854636917925
Energy: 0.9586838379972572
Energy: 0.9118854636917925
Energy: 0.9586838379998274
Energy: 0.9118854636926494

minimum gb energy = 0.8690611924973093 eV
minimum distance =  2.3001996145415 Angstroms
sigma value = 57


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

Energy: 0.9805046886342589
Energy: 0.8818852541203936
Energy: 0.9805046886342589
Energy: 0.8818852541183011
Energy: 0.9805046886349562
Energy: 0.8818852541183011
Energy: 0.89276322651214
Energy: 0.8669817667582532
Energy: 0.8927632265128375
Energy: 0.8669817667582532
Energy: 0.89276322651214
Energy: 0.8669817667575557
Energy: 1.0291129238774355
Energy: 0.9510189841241071
Energy: 1.0291129238774355
Energy: 0.9510189841241071
Energy: 1.0291129238760404
Energy: 0.9510189841234097
Energy: 0.9245581989078346
Energy: 0.9800592118030149
Energy: 0.9245581989085321
Energy: 0.9800592118037124
Energy: 0.9245581989085321
Energy: 0.9800592118044099
Energy: 0.8824711499107516
Energy: 0.8588694338805674
Energy: 0.8824711499148732
Energy: 0.8588694338805674
Energy: 0.8824711499134782
Energy: 0.8588694338805674
Energy: 0.9752640950811262
Energy: 0.8657026390275343
Energy: 0.9752640950811262
Energy: 0.8657026390275343
Energy: 0.9752640950825212
Energy: 0.8657026390268371
Energy: 0.8290717437611821
Energy: 0.936176715560648
Energy: 0.8290717437618795
Energy: 0.9361767155613454
Energy: 0.8290717437618795
Energy: 0.9361767155613454
Energy: 1.0016549270625499
Energy: 0.9018277802247704
Energy: 1.0016549270632473
Energy: 0.9018277802261654
Energy: 1.0016549270653399
Energy: 0.9018277802254678
Energy: 0.8794443295397036
Energy: 0.8680909570606044
Energy: 0.8794443295397036
Energy: 0.8680909570606044
Energy: 0.8794443295390062
Energy: 0.8680909570613019
Energy: 0.8874824825158751
Energy: 0.8919658789857887
Energy: 0.8874824825192993
Energy: 0.8919658789857887
Energy: 0.8874824825151776
Energy: 0.8919658789857887
Energy: 0.8254218685481091
Energy: 1.002438070086855
Energy: 0.825421868550899
Energy: 1.0024380700875524
Energy: 0.8254218685488066
Energy: 1.0024380700826698
Energy: 0.9251169542675967
Energy: 0.9170954481972545
Energy: 0.9251169542662017
Energy: 0.9170954481972545
Energy: 0.9251169542662017
Energy: 0.9170954481972545
Energy: 0.8855407241386698
Energy: 0.9800572287533439
Energy: 0.8855407241407621
Energy: 0.9800572287540413
Energy: 0.8855407241386698
Energy: 0.9800572287554363
Energy: 0.8853681301727373
Energy: 0.9092612950916874
Energy: 0.8853681301741323
Energy: 0.9092612950930824
Energy: 0.8853681301741323
Energy: 0.9092612950937798
Energy: 0.9977732491957891
Energy: 0.9294849715891425
Energy: 0.9977732491971841
Energy: 0.9294849715905372
Energy: 0.9977732491964867
Energy: 0.92948497158984
Energy: 0.9791426531269173
Energy: 1.0048773834594271
Energy: 0.9791426531262197
Energy: 1.0048773834594271
Energy: 0.9791426531283123
Energy: 1.0048773834594271
Energy: 0.9096021070410298
Energy: 1.0080747497382694
Energy: 0.9096021070403323
Energy: 1.0080747497389668
Energy: 0.9096021070396348
Energy: 1.0080747497389668
Energy: 0.9549239922237042
Energy: 0.9661469421696579
Energy: 0.9549239922306791
Energy: 0.9661469421703555
Energy: 0.9549239922285867
Energy: 0.9661469421703555
Energy: 0.8402961995733887
Energy: 0.944128596213102
Energy: 0.8402961995747837
Energy: 0.944128596211707
Energy: 0.8402961995740862
Energy: 0.9441285962124044
Energy: 0.843153737559722
Energy: 0.982462489127983
Energy: 0.843153737559722
Energy: 0.9824624891286804
Energy: 0.8431537375590246
Energy: 0.9824624891286804
Energy: 0.9732399801809437
Energy: 0.9382799239769261
Energy: 0.9732399801823387
Energy: 0.9382799239769261
Energy: 0.9732399801802463
Energy: 0.9382799239769261
Energy: 0.8278851763667889
Energy: 0.945040457153527
Energy: 0.8278851763653939
Energy: 0.9450404571528295
Energy: 0.8278851763660914
Energy: 0.9450404571528295
Energy: 0.9073595189227773
Energy: 0.9194763715160847
Energy: 0.9073595189227773
Energy: 0.9194763715160847
Energy: 0.9073595189241724
Energy: 0.9194763715167822
Energy: 0.9067619853154183
Energy: 1.1709226339900602
Energy: 0.9067619853154183
Energy: 1.1709226339900602
Energy: 0.9067619853147207
Energy: 1.1709226339802956
Energy: 0.9079086641811775
Energy: 0.9603980708513061
Energy: 0.9079086641832701
Energy: 0.9603980708513061
Energy: 0.9079086641797826
Energy: 0.9603980708513061
Energy: 0.8827478648804167
Energy: 0.9201438397810845
Energy: 0.8827478648790217
Energy: 0.920143839781782
Energy: 0.8827478648790217
Energy: 0.9201438397810845
Energy: 0.8274322693496211
Energy: 0.9438102106769857
Energy: 0.8274322693496211
Energy: 0.9438102106721031
Energy: 0.8274322693489238
Energy: 0.9438102106790782

minimum gb energy = 0.8254218685481091 eV
minimum distance =  2.27303450913141 Angstroms
sigma value = 43


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

Energy: 0.9737408010468712
Energy: 0.804891068331689
Energy: 0.9737408010473794
Energy: 0.804891068331689
Energy: 0.9737408010463632
Energy: 0.804891068331689
Energy: 0.8863058460598802
Energy: 0.8126244727343215
Energy: 0.8863058460593721
Energy: 0.8126244727343215
Energy: 0.8863058460603884
Energy: 0.8126244727348296
Energy: 0.9537025239547042
Energy: 0.8794530793841272
Energy: 0.9537025239547042
Energy: 0.8794530793841272
Energy: 0.9537025239552124
Energy: 0.8794530793841272
Energy: 0.9130559052868753
Energy: 0.8511569635509144
Energy: 0.9130559052868753
Energy: 0.851156963550406
Energy: 0.913055905286367
Energy: 0.8511569635498979
Energy: 0.7861951171660176
Energy: 0.7750023734286509
Energy: 0.7861951171680504
Energy: 0.7750023734286509
Energy: 0.7861951171634765
Energy: 0.775002373429159
Energy: 0.8618117420725758
Energy: 0.7870625933321066
Energy: 0.8618117420725758
Energy: 0.787062593330582
Energy: 0.8618117420720678
Energy: 0.787062593330582
Energy: 0.7955584277846953
Energy: 0.830524402733508
Energy: 0.7955584277841871
Energy: 0.8305244027314752
Energy: 0.7955584277841871
Energy: 0.8305244027314752
Energy: 1.0659480144795346
Energy: 0.7646481973895382
Energy: 1.0659480144790265
Energy: 0.7646481973875053
Energy: 1.065948014482584
Energy: 0.76464819738903
Energy: 0.8049984609460207
Energy: 0.7775818087437483
Energy: 0.8049984609460207
Energy: 0.7775818087432401
Energy: 0.8049984609455126
Energy: 0.7775818087437483
Energy: 0.7948331263146055
Energy: 0.7808748782526681
Energy: 0.7948331263140973
Energy: 0.78087487825216
Energy: 0.7948331263146055
Energy: 0.78087487825216
Energy: 0.8858095139411775
Energy: 0.8573603209678263
Energy: 0.8858095139416857
Energy: 0.8573603209683345
Energy: 0.8858095139411775
Energy: 0.8573603209683345
Energy: 0.7507343655355088
Energy: 0.7763749474585796
Energy: 0.750734365536017
Energy: 0.7763749474585796
Energy: 0.750734365536017
Energy: 0.7763749474585796
Energy: 0.7945859053620263
Energy: 0.7416373435439129
Energy: 0.7945859053635508
Energy: 0.7416373435439129
Energy: 0.7945859053625345
Energy: 0.7416373435428963
Energy: 0.8847422586051477
Energy: 0.85843199311577
Energy: 0.8847422586046395
Energy: 0.8584319931167864
Energy: 0.8847422586051477
Energy: 0.8584319931167864
Energy: 0.7806475813721999
Energy: 0.7760772941863967
Energy: 0.7806475813721999
Energy: 0.7760772941848723
Energy: 0.7806475813716919
Energy: 0.7760772941863967
Energy: 0.8192039764917116
Energy: 0.8315333605530045
Energy: 0.8192039764932362
Energy: 0.83153336055148
Energy: 0.8192039764922197
Energy: 0.8315333605530045
Energy: 0.7967385358173406
Energy: 0.8540205651126365
Energy: 0.7967385358178489
Energy: 0.8540205651126365
Energy: 0.7967385358168324
Energy: 0.8540205651126365
Energy: 0.8120513309242695
Energy: 0.7761456320613602
Energy: 0.8120513309237615
Energy: 0.776145632060852
Energy: 0.8120513309237615
Energy: 0.776145632060852
Energy: 0.7897915138007076
Energy: 0.8799800395128783
Energy: 0.7897915138012158
Energy: 0.8799800395128783
Energy: 0.7897915138001995
Energy: 0.8799800395128783
Energy: 0.8196628691022211
Energy: 0.8589000908954643
Energy: 0.8196628691037456
Energy: 0.8589000908959725
Energy: 0.8196628691032375
Energy: 0.8589000908949561
Energy: 0.8728339831841088
Energy: 0.8122099242603191
Energy: 0.872833983184617
Energy: 0.8122099242613355
Energy: 0.8728339831851252
Energy: 0.8122099242608273
Energy: 0.8077944661936848
Energy: 0.8038682598371661
Energy: 0.80779446619216
Energy: 0.8038682598402153
Energy: 0.8077944661926683
Energy: 0.8038682598351333
Energy: 0.9287442590419893
Energy: 0.8786066807147498
Energy: 0.9287442590424977
Energy: 0.8786066807147498
Energy: 0.9287442590419893
Energy: 0.8786066807147498
Energy: 0.8318994529635833
Energy: 0.9200244033838733
Energy: 0.831899452960534
Energy: 0.9200244033833651
Energy: 0.8318994529645997
Energy: 0.9200244033833651
Energy: 0.8310459210351648
Energy: 0.7623283282644208
Energy: 0.8310459210341484
Energy: 0.7623283282634044
Energy: 0.8310459210341484
Energy: 0.7623283282639126
Energy: 0.7696285251406917
Energy: 0.8509280054712705
Energy: 0.7696285251422164
Energy: 0.8509280054707622
Energy: 0.7696285251422164
Energy: 0.8509280054712705
Energy: 0.8601086721610038
Energy: 0.8706770410475466
Energy: 0.8601086721579545
Energy: 0.8706770410480549
Energy: 0.8527190870529471
Energy: 0.8706770410480549
Energy: 0.7892448533180254
Energy: 0.759689432711758
Energy: 0.7892448533185336
Energy: 0.7596894327087089
Energy: 0.7892448533180254
Energy: 0.7596894327097252
Energy: 0.7687391692330121
Energy: 0.8053110715682706
Energy: 0.7687391692335204
Energy: 0.8053110715682706
Energy: 0.7687391692330121
Energy: 0.8053110715682706
Energy: 0.7769056791507403
Energy: 0.8450306636253736
Energy: 0.7769056791497239
Energy: 0.8450306636253736
Energy: 0.7769056791517567
Energy: 0.8450306636253736
Energy: 0.7625712928526204
Energy: 1.067751217381081
Energy: 0.7625712928546533
Energy: 1.067751217381081
Energy: 0.7625712928516042
Energy: 1.0677512173826056
Energy: 0.7693214984010841
Energy: 0.7695225036251642
Energy: 0.7693214984010841
Energy: 0.7695225036241939
Energy: 0.7693214984005758
Energy: 0.7695225036241939
Energy: 0.7489173685112753
Energy: 0.762814544357297
Energy: 0.7489173685112753
Energy: 0.762814544357297
Energy: 0.7489173685112753
Energy: 0.762814544357297
Energy: 0.888358157524662
Energy: 0.964585174624887
Energy: 0.888358157524662
Energy: 0.9645851746253954
Energy: 0.8883581575236457
Energy: 0.9645851746253954
Energy: 0.7705548254691973
Energy: 0.7446845637470777
Energy: 0.7705548254681808
Energy: 0.744684563747586
Energy: 0.7705548254671645
Energy: 0.744684563747586
Energy: 0.6941608700280038
Energy: 0.7628275958103335
Energy: 0.6941608700274956
Energy: 0.7628275958123663
Energy: 0.6941608700274956
Energy: 0.7628275958083006

minimum gb energy = 0.6941608700274956 eV
minimum distance =  2.26869279854605 Angstroms
sigma value = 81


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

Energy: 0.08670511156861783
Energy: 0.13705728944184933
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.8854367320098372
Energy: 0.08788874975973068
Energy: 0.8854367320098372
Energy: 0.08788874975599623
Energy: 0.8854367320098372
Energy: 0.08788874975786345
Energy: 0.8854380611330332
Energy: 0.08750370167004949
Energy: 0.8854380611330332
Energy: 0.08750370167004949
Energy: 0.8854380611330332
Energy: 0.08750370167004949
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.8854367320117045
Energy: 0.08788874975599623
Energy: 0.8854367320098372
Energy: 0.08788874975226176
Energy: 0.8854367320098372
Energy: 0.08788874975226176
Energy: 0.8854380611330332
Energy: 0.0875037016756512
Energy: 0.8854380611330332
Energy: 0.08750370167191673
Energy: 0.8854380611349005
Energy: 0.08750370167191673
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.8854367320117045
Energy: 0.087888749754129
Energy: 0.8854367320098372
Energy: 0.08788874975039451
Energy: 0.8854367320098372
Energy: 0.08788874975226176
Energy: 0.8854380611349005
Energy: 0.0875037016756512
Energy: 0.8854380611349005
Energy: 0.08750370167378396
Energy: 0.8854380611349005
Energy: 0.0875037016756512
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166
Energy: 0.08670511156861783
Energy: 0.1370572894437166

minimum gb energy = 0.08670511156861783 eV
minimum distance =  2.46549074175921 Angstroms
sigma value = 3


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

Energy: 0.9376147160496324
Energy: 0.7750692121030949
Energy: 0.9376147160513089
Energy: 0.7750692121030949
Energy: 0.9376147160496324
Energy: 0.7750692121030949
Energy: 0.7827836399697639
Energy: 0.8055752058325368
Energy: 0.7827836399703226
Energy: 0.8055752058353307
Energy: 0.7827836399697639
Energy: 0.8055752058314194
Energy: 0.8143029384934821
Energy: 0.805795545796932
Energy: 0.8143029384929236
Energy: 0.8057955457952558
Energy: 0.8143029384929236
Energy: 0.8057955457935795
Energy: 0.8815064178097105
Energy: 0.7952827612850754
Energy: 0.8815064178091516
Energy: 0.7952827612850754
Energy: 0.8815064178097105
Energy: 0.7952827612856341
Energy: 0.667330523644864
Energy: 0.7864441273945058
Energy: 0.6673305236454229
Energy: 0.7864441273995346
Energy: 0.667330523644864
Energy: 0.786444127386124
Energy: 0.8213885879976903
Energy: 0.8632053350103257
Energy: 0.8213885879982491
Energy: 0.8632053350097669
Energy: 0.8213885879971315
Energy: 0.8632053350064142
Energy: 0.8348386318991932
Energy: 0.8787152037583938
Energy: 0.834838631899752
Energy: 0.8787152037589527
Energy: 0.8348386318991932
Energy: 0.8787152037589527
Energy: 0.6630088497213636
Energy: 0.78588914863659
Energy: 0.6630088497191287
Energy: 0.7858891486377075
Energy: 0.6630088497196873
Energy: 0.7858891486343549
Energy: 0.8350039343186266
Energy: 0.8412928792750383
Energy: 0.8350039343186266
Energy: 0.8412928792744795
Energy: 0.8350039343203028
Energy: 0.8412928792750383
Energy: 0.7607279109941268
Energy: 0.8187100728177948
Energy: 0.7607279109930092
Energy: 0.8187100728189123
Energy: 0.760727910996362
Energy: 0.8187100728200299
Energy: 0.718871076668524
Energy: 0.788085646905074
Energy: 0.718871076668524
Energy: 0.7880856469045152
Energy: 0.718871076668524
Energy: 0.7880856469056327
Energy: 0.8642757852750306
Energy: 0.8714674468343694
Energy: 0.8642757852744719
Energy: 0.8714674468338105
Energy: 0.864275785276148
Energy: 0.8714674468343694
Energy: 0.7949798745495409
Energy: 0.8003885203547234
Energy: 0.7949798745579224
Energy: 0.8003885203547234
Energy: 0.7949798745679804
Energy: 0.8003885203552823
Energy: 0.7366358825805911
Energy: 0.847550167426909
Energy: 0.736635882578356
Energy: 0.8475501674285855
Energy: 0.7366358825755621
Energy: 0.8475501674274679
Energy: 0.8807480434009941
Energy: 0.8384824480077624
Energy: 0.8807480434004352
Energy: 0.8384824480083212
Energy: 0.8807480434009941
Energy: 0.8384824480099974
Energy: 0.7662333481892455
Energy: 0.6625757996121486
Energy: 0.7662333481881279
Energy: 0.6625757996127074
Energy: 0.7662333481881279
Energy: 0.6625757996132662
Energy: 0.788569390015379
Energy: 0.8715933009346223
Energy: 0.788569390015379
Energy: 0.8715933009340635
Energy: 0.788569390015379
Energy: 0.8715933009340635
Energy: 0.8245184556128332
Energy: 0.8103197085189191
Energy: 0.8245184556128332
Energy: 0.8103197085172429
Energy: 0.8245184556122747
Energy: 0.8103197085150078
Energy: 0.8248824074722523
Energy: 0.9004925314211132
Energy: 0.8248824074722523
Energy: 0.9004925314211132
Energy: 0.82488240747337
Energy: 0.9004925314216718
Energy: 0.7726772060141249
Energy: 0.9208047891817976
Energy: 0.7726772060141249
Energy: 0.920804789181239
Energy: 0.7726772060141249
Energy: 0.920804789183474
Energy: 0.8620408928375684
Energy: 0.7877641472111615
Energy: 0.8620408928398036
Energy: 0.7877641472117203
Energy: 0.8620408928398036
Energy: 0.7877641472106027
Energy: 0.8477067840441407
Energy: 0.7856033959565782
Energy: 0.8477067838581703
Energy: 0.785603395957137
Energy: 0.8477067840502872
Energy: 0.7856033959576958
Energy: 0.7979475177954855
Energy: 0.8973875515844983
Energy: 0.7979475177921329
Energy: 0.8973875515844983
Energy: 0.7979475177898977
Energy: 0.8973875515844983
Energy: 0.815751429245358
Energy: 0.7850700645512537
Energy: 0.8157514292459167
Energy: 0.785070064550695
Energy: 0.8157514292470344
Energy: 0.7850700645512537
Energy: 0.8774686261164872
Energy: 0.8187398535289296
Energy: 0.8774686261164872
Energy: 0.8187398535289296
Energy: 0.8774686261164872
Energy: 0.8187398535261358
Energy: 0.7603495395779463
Energy: 0.8572999365915541
Energy: 0.7603495395757113
Energy: 0.8572999365898779
Energy: 0.7603495395835341
Energy: 0.8572999365898779
Energy: 0.9179563287152878
Energy: 0.6728736494988318
Energy: 0.9179563287158464
Energy: 0.6728736494988318
Energy: 0.9179563287158464
Energy: 0.6728736494988318
Energy: 0.8350494234259004
Energy: 0.8347697969655463
Energy: 0.8350494234259004
Energy: 0.8347697969655463
Energy: 0.8350494234253417
Energy: 0.8347697969655463
Energy: 0.7352020254478536
Energy: 0.7854334522367161
Energy: 0.7352020254489713
Energy: 0.7854334522372749
Energy: 0.7352020254495302
Energy: 0.7854334522411864
Energy: 0.9119250780193406
Energy: 0.7346688356731252
Energy: 0.9119250780193406
Energy: 0.734668835673684
Energy: 0.9119250780198995
Energy: 0.7346688356731252
Energy: 0.8621470218233873
Energy: 0.8274995767904963
Energy: 0.8621470218250638
Energy: 0.8274995767899377
Energy: 0.8621470218250638
Energy: 0.8274995767904963
Energy: 0.8163803661409823
Energy: 0.7743506949632614
Energy: 0.8163803661398648
Energy: 0.7743506949649376
Energy: 0.8163803661398648
Energy: 0.7743506949654964
Energy: 0.8382313486831586
Energy: 0.8853293477100805
Energy: 0.8382313486831586
Energy: 0.8853293477100805
Energy: 0.8382313486831586
Energy: 0.8853293477100805

minimum gb energy = 0.6625757996121486 eV
minimum distance =  2.33257702295366 Angstroms
sigma value = 67


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

Energy: 1.0870029038164395
Energy: 0.9501830517011406
Energy: 1.0870029038164395
Energy: 0.9501830516995482
Energy: 1.0870029038172355
Energy: 0.9501830516995482
Energy: 0.9479312820234967
Energy: 0.9736583933021867
Energy: 0.9479312820234967
Energy: 0.9736583933029831
Energy: 0.9479312820234967
Energy: 0.9736583933029831
Energy: 1.0159907950681835
Energy: 0.9846274587206814
Energy: 1.0159907950681835
Energy: 0.9846274587214777
Energy: 1.0159907950689795
Energy: 0.9846274587230702
Energy: 1.0396657450335984
Energy: 0.9345330556160644
Energy: 1.0396657450328022
Energy: 0.9345330556176568
Energy: 1.0396657450320061
Energy: 0.9345330556049177
Energy: 0.8277624298324318
Energy: 0.9278493849727749
Energy: 0.8277624298316356
Energy: 0.9278493849735711
Energy: 0.8277624298324318
Energy: 0.9278493849735711
Energy: 1.0167943996305744
Energy: 1.017387562209044
Energy: 1.0167943996305744
Energy: 1.017387562209044
Energy: 1.0167943996297781
Energy: 1.0173875622098403
Energy: 0.9411587080636609
Energy: 1.038026082820129
Energy: 0.9411587080620685
Energy: 1.0380260828217216
Energy: 0.9411587080636609
Energy: 1.0380260828209251
Energy: 0.9137351898977134
Energy: 0.9178496357853136
Energy: 0.9137351898475535
Energy: 0.9178496357845175
Energy: 0.9137351898626811
Energy: 0.9178496357837213
Energy: 1.077063868099495
Energy: 1.0678177663012969
Energy: 1.0770638680986988
Energy: 1.067817766302093
Energy: 1.077063868099495
Energy: 1.067817766302093
Energy: 0.9409394544951899
Energy: 1.0164125476694814
Energy: 0.9409394544967824
Energy: 1.0164125476694814
Energy: 0.9409394544983747
Energy: 1.0164125476694814
Energy: 1.043822494920229
Energy: 1.0167633665743832
Energy: 1.043822494920229
Energy: 1.016763366573587
Energy: 1.0438224949194328
Energy: 1.0167633665743832
Energy: 0.9465599332474313
Energy: 0.9995457489174531
Energy: 0.9465599332474313
Energy: 0.999545748916657
Energy: 0.9465599332482273
Energy: 0.999545748916657
Energy: 0.945482823677447
Energy: 0.9339804582894515
Energy: 0.945482823681428
Energy: 0.9339804582886554
Energy: 0.945482823677447
Energy: 0.9339804582886554
Energy: 0.9323895306292416
Energy: 1.0443957245082929
Energy: 0.9323895306268529
Energy: 1.0443957245090891
Energy: 0.9323895306268529
Energy: 1.0443957245090891
Energy: 0.9576025461032086
Energy: 0.9439737411575274
Energy: 0.9576025461024122
Energy: 0.9439737411575274
Energy: 0.9576025461016162
Energy: 0.9439737411575274
Energy: 0.9734566979942718
Energy: 0.9686578655459478
Energy: 0.973456697995068
Energy: 0.9686578655451517
Energy: 0.9734566979958641
Energy: 0.9686578655467439
Energy: 0.9714356067658266
Energy: 1.0341800218615946
Energy: 0.9714356067666228
Energy: 1.0341800218615946
Energy: 0.9714356067658266
Energy: 1.0341800218615946
Energy: 0.9821266571451234
Energy: 0.9268415479230222
Energy: 0.9821266571459196
Energy: 0.9268415479238185
Energy: 0.9821266571459196
Energy: 0.9268415479238185
Energy: 1.0226119615690759
Energy: 1.0209911461254082
Energy: 1.022611961569872
Energy: 1.0209911461246122
Energy: 1.022611961569872
Energy: 1.0209911461254082
Energy: 1.0798738554710432
Energy: 0.9279829072973448
Energy: 1.0798738554710432
Energy: 0.9279829072981409
Energy: 1.0798738554718397
Energy: 0.9279829072981409
Energy: 1.1166266155707807
Energy: 0.9402271103768761
Energy: 1.1166266155707807
Energy: 0.9402271103776725
Energy: 1.1166266155707807
Energy: 0.9402271103768761
Energy: 1.045353754944354
Energy: 1.1085553390226268
Energy: 1.045353754944354
Energy: 1.1085553390226268
Energy: 1.0453537549451501
Energy: 1.1085553390218308
Energy: 1.0474599657053052
Energy: 0.9287618007614733
Energy: 1.01347230566723
Energy: 0.9287618007614733
Energy: 1.0134723056688224
Energy: 0.9287618007614733

minimum gb energy = 0.8277624298316356 eV
minimum distance =  2.3300120667709 Angstroms
sigma value = 33


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

Energy: 1.2458021717372292
Energy: 1.0682676565033404
Energy: 1.193498266518315
Energy: 1.0682676565038456
Energy: 1.245802171734199
Energy: 1.0682676565038456
Energy: 1.0934194722174573
Energy: 1.1146583305358664
Energy: 1.0934194722149315
Energy: 1.1146583305313205
Energy: 1.0934194722149315
Energy: 1.1146583305318256
Energy: 1.1282799407079749
Energy: 1.106971298422719
Energy: 1.128279940709995
Energy: 1.106971298416658
Energy: 1.1282799407115103
Energy: 1.106971298416658
Energy: 1.1643176550965402
Energy: 1.0903605437217982
Energy: 1.1643176550930043
Energy: 1.0903605437263442
Energy: 1.1643176550904788
Energy: 1.0903605437263442
Energy: 1.089783899489769
Energy: 1.0681083683776875
Energy: 1.089783899489769
Energy: 1.068108368379662
Energy: 1.0897838994872435
Energy: 1.068108368379662
Energy: 1.231850884685967
Energy: 1.0898819104870916
Energy: 1.2318508846839467
Energy: 1.2296711930064905
Energy: 1.2318508846779315
Energy: 1.0898819104835558
Energy: 1.047841508758854
Energy: 1.0127028980088286
Energy: 1.0478415087603692
Energy: 1.012702898006303
Energy: 1.047841508758854
Energy: 1.0127028980123642
Energy: 1.1821256435887064
Energy: 1.1439256132534297
Energy: 1.1821256435902217
Energy: 1.1439256132498938
Energy: 1.1821256435897165
Energy: 1.1439256132503992
Energy: 1.097780118839343
Energy: 1.1369072713048514
Energy: 1.0977704435688702
Energy: 1.1369072713073767
Energy: 1.0977801188454042
Energy: 1.1369072713073767
Energy: 1.1116664417404836
Energy: 1.105308298598809
Energy: 1.111666441737958
Energy: 1.1053082985993141
Energy: 1.1116664417339175
Energy: 1.0848332430218106
Energy: 1.1677881788195463
Energy: 1.168135218585612
Energy: 1.16779458927905
Energy: 1.1681352185830867
Energy: 1.1677881788139903
Energy: 1.1681352185830867
Energy: 1.0484966037834156
Energy: 1.1143853511746404
Energy: 1.0484966037813952
Energy: 1.1143853511756505
Energy: 1.0484966037813952
Energy: 1.1143853511756505
Energy: 1.1955344256188483
Energy: 1.0723367890983737
Energy: 1.1955344256213734
Energy: 1.0723367890988786
Energy: 1.1955344256218785
Energy: 1.0723367890983737
Energy: 1.1169828116001763
Energy: 1.1721994322588452
Energy: 1.1169828115976508
Energy: 1.1721994322623808
Energy: 1.1169828116016915
Energy: 1.1721994322618756
Energy: 1.08152755397364
Energy: 1.1139802384047262
Energy: 1.0815275539771756
Energy: 1.1139802384057362
Energy: 1.0815275539812166
Energy: 1.1139802384057362
Energy: 1.1608212241355993
Energy: 1.1088306496378435
Energy: 1.1608212241361044
Energy: 1.1088306496433995
Energy: 1.1608212241355993
Energy: 1.1088306496454197
Energy: 1.203734561181462
Energy: 1.0639897713218092
Energy: 1.2037345611839874
Energy: 1.063989771321304
Energy: 1.2037345611819672
Energy: 1.063989771320294
Energy: 1.1628975120780105
Energy: 1.2046803113794031
Energy: 1.16289751207498
Energy: 1.2046803113768778
Energy: 1.1628975120724547
Energy: 1.2046803113824338
Energy: 1.048519644106871
Energy: 1.1589182573771217
Energy: 1.0485196441038405
Energy: 1.1589182591295013
Energy: 1.048519644107881
Energy: 1.158918257783534
Energy: 1.237255180005729
Energy: 1.07524472635359
Energy: 1.237255180006234
Energy: 1.0752447263556104
Energy: 1.2372551800087594
Energy: 1.0752447263551053
Energy: 1.1263573857802893
Energy: 1.2167536394498828
Energy: 1.1263577736992745
Energy: 1.2167536394448322
Energy: 1.1263573857757434
Energy: 1.216753639443317
Energy: 1.0882281832138507
Energy: 1.0795823119284043
Energy: 1.0882281832118303
Energy: 1.0795823119304246
Energy: 1.08822818320981
Energy: 1.0795823119309296
Energy: 1.1670905395393558
Energy: 1.1670902502828975
Energy: 1.0737448460399068
Energy: 1.1670902502874432
Energy: 1.1670905395454167
Energy: 1.1670902502874432
Energy: 1.1885689230825487
Energy: 1.1107386280832885
Energy: 1.1415269322019241
Energy: 1.1107386280928848
Energy: 1.1885689230830536
Energy: 1.1107386280928848
Energy: 1.0929978905986604
Energy: 1.1168467053490752
Energy: 1.0487789587270768
Energy: 1.1168467053414988
Energy: 1.0929978905941147
Energy: 1.1168467053414988
Energy: 1.1417158707439787
Energy: 1.175155391281172
Energy: 1.1417158707379178
Energy: 1.1751553912801618
Energy: 1.1417158707439787
Energy: 1.175155391280667
Energy: 1.0478604402060585
Energy: 1.0752375322032857
Energy: 1.0478604402065637
Energy: 1.0752375322037908
Energy: 1.0478604402060585
Energy: 1.0752375322037908
Energy: 1.1270042245503753
Energy: 1.217998702869841
Energy: 1.1270042245569416
Energy: 1.2179987028628156
Energy: 1.1270042245584566
Energy: 1.2117801451955241
Energy: 1.1254488956125452
Energy: 1.0757867772762697
Energy: 1.1254488956085047
Energy: 1.075786777271724
Energy: 1.1254488956105249
Energy: 1.0757867772722292
Energy: 1.0458490750464322
Energy: 1.0459520543304985
Energy: 1.045849075050978
Energy: 1.045952054326963
Energy: 1.0458490750580491
Energy: 1.045952054328983
Energy: 1.2373895736672045
Energy: 1.2204914569815448
Energy: 1.2373895736677096
Energy: 1.2204914569815448
Energy: 1.2373895736727603
Energy: 1.2204914569810397
Energy: 1.0522908689505315
Energy: 1.0748820297674875
Energy: 1.0523043165052504
Energy: 1.0748820297614263
Energy: 1.052290868959118
Energy: 1.0748820297609214
Energy: 1.1609040495085492
Energy: 1.2312475669291063
Energy: 1.1609065605541162
Energy: 1.2312475669245606
Energy: 1.1609040495040033
Energy: 1.2312475669240555
Energy: 1.1486503301587307
Energy: 1.1181758178906085
Energy: 1.1486503301551951
Energy: 1.1181758178936392
Energy: 1.148650330154185
Energy: 1.1181758178936392
Energy: 1.0528012664143103
Energy: 1.1071396296731297
Energy: 1.0528012664168358
Energy: 1.1071396296766653
Energy: 1.0528012664198663
Energy: 1.1071396296766653
Energy: 1.1966142434168823
Energy: 1.0707887912773077
Energy: 1.1966142434148619
Energy: 1.0707887912818537
Energy: 1.1966142434123366
Energy: 1.0707887912818537
Energy: 1.094910975339535
Energy: 1.117938302586197
Energy: 1.0949109753385249
Energy: 1.117938302586702
Energy: 1.094910975340545
Energy: 1.117938302586702

minimum gb energy = 1.012702898006303 eV
minimum distance =  2.18662728873843 Angstroms
sigma value = 41


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

Energy: 1.3174871486063777
Energy: 1.207116182321043
Energy: 1.3174871486049986
Energy: 1.207116182321043
Energy: 1.3174871486063777
Energy: 1.207116182321043
Energy: 1.1992723780915449
Energy: 1.249753534758129
Energy: 1.1992723780915449
Energy: 1.249753534758129
Energy: 1.1992723780915449
Energy: 1.249753534758129
Energy: 1.3993339898693553
Energy: 1.3032857907600703
Energy: 1.393574251807002
Energy: 1.3032857907600703
Energy: 1.393574251807002
Energy: 1.3032857907600703
Energy: 1.2755291605233345
Energy: 1.3303582016452058
Energy: 1.2755291605233345
Energy: 1.3303582016452058
Energy: 1.2755291605233345
Energy: 1.3303582016452058
Energy: 1.3204575355536288
Energy: 1.2378747776395256
Energy: 1.3204575355522494
Energy: 1.2378747776395256
Energy: 1.3204575355522494
Energy: 1.2378747776395256
Energy: 1.3751574834907472
Energy: 1.3433915098456268
Energy: 1.3751574834921263
Energy: 1.3433915098456268
Energy: 1.3751574834935052
Energy: 1.3433915098456268
Energy: 1.284160934533493
Energy: 1.1905277150077915
Energy: 1.284160934533493
Energy: 1.1905277150077915
Energy: 1.284160934533493
Energy: 1.1905277150077915
Energy: 1.2775356117029955
Energy: 1.2784851479950472
Energy: 1.2775356117029955
Energy: 1.2784851479936683
Energy: 1.2775356117029955
Energy: 1.2784851479950472
Energy: 1.2038402565217166
Energy: 1.206435691874081
Energy: 1.2038402565203374
Energy: 1.206435691874081
Energy: 1.2038402565217166
Energy: 1.206435691874081
Energy: 1.3390938240357093
Energy: 1.211920083975358
Energy: 1.3390938240343304
Energy: 1.211920083975358
Energy: 1.3390938240343304
Energy: 1.211920083975358
Energy: 1.2010834988136494
Energy: 1.2869046955924288
Energy: 1.2010834988136494
Energy: 1.28690469559105
Energy: 1.2010834988136494
Energy: 1.2869046955924288
Energy: 1.2646811475489816
Energy: 1.2488027402338542
Energy: 1.2646811475489816
Energy: 1.2488027402338542
Energy: 1.2646811475476027
Energy: 1.2488027402338542
Energy: 1.3028891534587066
Energy: 1.3309086892262416
Energy: 1.3028891534587066
Energy: 1.3309086892248625
Energy: 1.3028891534587066
Energy: 1.3309086892248625
Energy: 1.3179469026632298
Energy: 1.2506033162991794
Energy: 1.3179469026632298
Energy: 1.2506033162991794
Energy: 1.3179469026632298
Energy: 1.2506033162978

minimum gb energy = 1.1905277150077915 eV
minimum distance =  2.23263012415324 Angstroms
sigma value = 11


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

Energy: 1.4621921451704734
Energy: 1.4354527590259476
Energy: 1.4621921451716846
Energy: 1.4354527590259476
Energy: 1.4621921451692617
Energy: 1.4354527590259476
Energy: 1.3221599603542329
Energy: 1.4176457850956454
Energy: 1.3221599603542329
Energy: 1.4176457850956454
Energy: 1.3221599603536272
Energy: 1.4176457850956454
Energy: 1.4603838314105206
Energy: 1.4091549208376404
Energy: 1.4603838314111264
Energy: 1.4091549208376404
Energy: 1.4102094287408298
Energy: 1.4091549208376404
Energy: 1.40615056053561
Energy: 1.3516491080874866
Energy: 1.40615056053561
Energy: 1.3516491080868809
Energy: 1.40615056053561
Energy: 1.3516491080874866
Energy: 1.4431712039249958
Energy: 1.3844943630153932
Energy: 1.4431712039256017
Energy: 1.3844943630153932
Energy: 1.44317120392439
Energy: 1.3844943630153932
Energy: 1.366342932603719
Energy: 1.4216493732653734
Energy: 1.366342932603719
Energy: 1.4216493732653734
Energy: 1.366342932604325
Energy: 1.4216493732653734
Energy: 1.4041212706207271
Energy: 1.4000826709236005
Energy: 1.4041212706201214
Energy: 1.4000826709236005
Energy: 1.4041212706207271
Energy: 1.4000826709236005
Energy: 1.3823014795483848
Energy: 1.4050780597688461
Energy: 1.3823014795495965
Energy: 1.4050780597700576
Energy: 1.3823014795483848
Energy: 1.4050780597700576
Energy: 1.4052507153571172
Energy: 1.3817186339083525
Energy: 1.4052507153565117
Energy: 1.3817186339083525
Energy: 1.4052507153571172
Energy: 1.3817186339083525
Energy: 1.3816580369259728
Energy: 1.4190603273802915
Energy: 1.3816580369259728
Energy: 1.4190603273802915
Energy: 1.3816580369265785
Energy: 1.4190603273802915
Energy: 1.3819664713557764
Energy: 1.4038163652056403
Energy: 1.3819664713563822
Energy: 1.4038163652056403
Energy: 1.3819664713563822
Energy: 1.4038163652056403
Energy: 1.4101919780775567
Energy: 1.4317335324075784
Energy: 1.4101919780793741
Energy: 1.4317335324075784
Energy: 1.4101919780787684
Energy: 1.431733532408184
Energy: 1.41429364774817
Energy: 1.3752399902060712
Energy: 1.41429364774817
Energy: 1.375239990206677
Energy: 1.41429364774817
Energy: 1.3752399902060712
Energy: 1.3786236533550404
Energy: 1.4380631176609677
Energy: 1.3786236533556462
Energy: 1.4380631176609677
Energy: 1.3786236533520113
Energy: 1.4380631176609677
Energy: 1.3590980790276974
Energy: 1.3741664810708574
Energy: 1.3590980790276974
Energy: 1.3741664810708574
Energy: 1.3590980790276974
Energy: 1.3741664810702516
Energy: 1.397745029421306
Energy: 1.3999750599308538
Energy: 1.3977450294200946
Energy: 1.3999750599314595
Energy: 1.3977450294207003
Energy: 1.3999750599320653
Energy: 1.341594753776157
Energy: 1.4135969018005308
Energy: 1.341594753776157
Energy: 1.4135969017999248
Energy: 1.3415947537755513
Energy: 1.4135969018005308
Energy: 1.4584775267995052
Energy: 1.4481329802563083
Energy: 1.4584775268001111
Energy: 1.4481329677876102
Energy: 1.4584775267995052
Energy: 1.4481329490303572
Energy: 1.3630915235264205
Energy: 1.3308918950548356
Energy: 1.3630915235270262
Energy: 1.3308918950548356
Energy: 1.3630915235264205
Energy: 1.3308918950548356
Energy: 1.4119555060711901
Energy: 1.3862892267547455
Energy: 1.4119555060724016
Energy: 1.3862892267547455
Energy: 1.4119555060736135
Energy: 1.3862892267553513
Energy: 1.33310701360178
Energy: 1.359381263886969
Energy: 1.3331070136023857
Energy: 1.359381263886969
Energy: 1.3331070136023857
Energy: 1.359381263886969
Energy: 1.4830299402013563
Energy: 1.4341739124190045
Energy: 1.4830299402013563
Energy: 1.4341739124190045
Energy: 1.4830299402007505
Energy: 1.4341739124190045
Energy: 1.385760066582138
Energy: 1.409230972201704
Energy: 1.385760066582138
Energy: 1.409230972201704
Energy: 1.385760066582138
Energy: 1.40923097220231
Energy: 1.4466109547752979
Energy: 1.4169609137864578
Energy: 1.4466109547759036
Energy: 1.416960913785852
Energy: 1.4466109547752979
Energy: 1.4169609137864578
Energy: 1.3770589304449874
Energy: 1.3933091944081006
Energy: 1.3770589304443817
Energy: 1.3933091944081006
Energy: 1.3770589304449874
Energy: 1.3933091944081006
Energy: 1.378835054118174
Energy: 1.3893081159418663
Energy: 1.3788350541187797
Energy: 1.3893081159400489
Energy: 1.3788350541199914
Energy: 1.3893081159412608
Energy: 1.3644850331154528
Energy: 1.4413829839127414
Energy: 1.3644850331154528
Energy: 1.4413829839121357
Energy: 1.3644850331154528
Energy: 1.4413829839121357
Energy: 1.4248975620545494
Energy: 1.3576607763558803
Energy: 1.4248975620545494
Energy: 1.3576607763558803
Energy: 1.424897562055155
Energy: 1.3576607763558803
Energy: 1.3798589045889698
Energy: 1.450381614096115
Energy: 1.3798589045889698
Energy: 1.450381614095509
Energy: 1.3798589045889698
Energy: 1.450381614095509
Energy: 1.361473172919311
Energy: 1.3151913252467196
Energy: 1.361473172919311
Energy: 1.3151913252467196
Energy: 1.361473172919311
Energy: 1.3151913252461138
Energy: 1.388984348305093
Energy: 1.4475068349966285
Energy: 1.388984348305093
Energy: 1.4475068349972344
Energy: 1.388984348305093
Energy: 1.4475068349966285

minimum gb energy = 1.3151913252461138 eV
minimum distance =  2.20725993308943 Angstroms
sigma value = 57


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

Energy: 1.343515580572859
Energy: 1.325066327985667
Energy: 1.3435155805717807
Energy: 1.325066327985667
Energy: 1.343515580572859
Energy: 1.325066327985667
Energy: 1.4267837810536954
Energy: 1.4077010030515442
Energy: 1.4267837810547734
Energy: 1.4077010030515442
Energy: 1.4267837810536954
Energy: 1.4077010030515442
Energy: 1.430786773200452
Energy: 1.3851263480973017
Energy: 1.43078677320153
Energy: 1.3851263480973017
Energy: 1.430786773200452
Energy: 1.3851263480973017
Energy: 1.360978191891742
Energy: 1.4878950115007368
Energy: 1.360978191891742
Energy: 1.4878950114996587
Energy: 1.360978191891742
Energy: 1.4878950114996587
Energy: 1.4306481106229452
Energy: 1.3851398035975266
Energy: 1.4306481106229452
Energy: 1.3851398035975266
Energy: 1.4306481106229452
Energy: 1.3851398035975266
Energy: 1.4269000643790275
Energy: 1.4111030441295886
Energy: 1.4269000643779495
Energy: 1.4111030441306667
Energy: 1.4269000643790275
Energy: 1.4111030441306667
Energy: 1.343515580572859
Energy: 1.325066327985667
Energy: 1.3435155805717807
Energy: 1.325066327985667
Energy: 1.343515580572859
Energy: 1.325066327985667
Energy: 1.4267837810536954
Energy: 1.4077010030483101
Energy: 1.4267837810536954
Energy: 1.4077010030483101
Energy: 1.4267837810536954
Energy: 1.4077010030483101
Energy: 1.430786773202608
Energy: 1.3851263480919114
Energy: 1.43078677320153
Energy: 1.3851263480929894
Energy: 1.43078677320153
Energy: 1.3851263480919114
Energy: 1.360978191890664
Energy: 1.487895011502893
Energy: 1.360978191890664
Energy: 1.4878950115018148
Energy: 1.360978191890664
Energy: 1.4878950115018148
Energy: 1.4306481106197109
Energy: 1.3851398035996827
Energy: 1.430648110620789
Energy: 1.3851398035986047
Energy: 1.430648110620789
Energy: 1.3851398035996827
Energy: 1.4269000643790275
Energy: 1.4111030441306667
Energy: 1.4269000643790275
Energy: 1.4111030441306667
Energy: 1.4269000643790275
Energy: 1.4111030441306667
Energy: 1.343515580572859
Energy: 1.325066327985667
Energy: 1.343515580572859
Energy: 1.325066327985667
Energy: 1.343515580573937
Energy: 1.325066327985667
Energy: 1.4267837810547734
Energy: 1.4077010030515442
Energy: 1.4267837810547734
Energy: 1.4077010030515442
Energy: 1.4267837810547734
Energy: 1.4077010030515442
Energy: 1.43078677320153
Energy: 1.3851263480973017
Energy: 1.43078677320153
Energy: 1.3851263480973017
Energy: 1.430786773200452
Energy: 1.3851263480973017
Energy: 1.360978191891742
Energy: 1.4878950114996587
Energy: 1.360978191891742
Energy: 1.4878950114996587
Energy: 1.360978191891742
Energy: 1.4878950114996587
Energy: 1.430648110621867
Energy: 1.3851398035975266
Energy: 1.4306481106229452
Energy: 1.3851398035986047
Energy: 1.4306481106229452
Energy: 1.3851398035975266

minimum gb energy = 1.325066327985667 eV
minimum distance =  2.26634229481008 Angstroms
sigma value = 9


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

Energy: 1.440503440397489
Energy: 1.5355051737152845
Energy: 1.440503440397489
Energy: 1.5355051737152845
Energy: 1.440503440397489
Energy: 1.5355051737152845
Energy: 1.470991934968397
Energy: 1.4491361553936029
Energy: 1.4709919349692775
Energy: 1.4491361553936029
Energy: 1.470991934968397
Energy: 1.4491361553936029
Energy: 1.5082116029558643
Energy: 1.4303413921817225
Energy: 1.5082116029567447
Energy: 1.4303413921817225
Energy: 1.5082116029567447
Energy: 1.4303413921817225
Energy: 1.4110566336674206
Energy: 1.5595383855022247
Energy: 1.4110566336665407
Energy: 1.5595383855031046
Energy: 1.4110566336665407
Energy: 1.5595383855022247
Energy: 1.4352323258087478
Energy: 1.4454558891198834
Energy: 1.435232325809628
Energy: 1.4454558891198834
Energy: 1.435232325809628
Energy: 1.4454558891198834
Energy: 1.4460486493589964
Energy: 1.4175733998210958
Energy: 1.4460486493589964
Energy: 1.4175733998210958
Energy: 1.4460486493589964
Energy: 1.4175733998210958
Energy: 1.4141884447332853
Energy: 1.487384927801958
Energy: 1.4141884447332853
Energy: 1.487384927801958
Energy: 1.4141884447324051
Energy: 1.487384927801958
Energy: 1.4406128616904623
Energy: 1.4662966511009639
Energy: 1.4406128616913427
Energy: 1.4662966511009639
Energy: 1.4406128616904623
Energy: 1.4662966511009639
Energy: 1.6139338544006945
Energy: 1.4538924498044588
Energy: 1.6139338544006945
Energy: 1.4538924498044588
Energy: 1.6139338543989343
Energy: 1.4538924498044588
Energy: 1.4106589350465613
Energy: 1.457577811831287
Energy: 1.4106589350448009
Energy: 1.457577811831287
Energy: 1.410658935045681
Energy: 1.457577811831287
Energy: 1.4428570965957954
Energy: 1.4623694428848835
Energy: 1.4428570965957954
Energy: 1.4623694428848835
Energy: 1.4428570965957954
Energy: 1.4623694428848835
Energy: 1.5308802341998515
Energy: 1.431415278245306
Energy: 1.5308802341998515
Energy: 1.431415278245306
Energy: 1.5308802341972108
Energy: 1.431415278245306
Energy: 1.4142635177889242
Energy: 1.481400300338366
Energy: 1.4142635177889242
Energy: 1.4814003003392464
Energy: 1.4142635177889242
Energy: 1.4814003003392464
Energy: 1.4561436788981934
Energy: 1.509653671524351
Energy: 1.4561436788981934
Energy: 1.509653671524351
Energy: 1.4561436788981934
Energy: 1.509653671524351
Energy: 1.477327555987654
Energy: 1.4285201839013018
Energy: 1.477327555987654
Energy: 1.4285201839021822
Energy: 1.53223464809004
Energy: 1.4285201839004218
Energy: 1.4415049375875433
Energy: 1.4661074404331897
Energy: 1.4415049375866629
Energy: 1.4661074404323096
Energy: 1.4415049375875433
Energy: 1.4661074404323096
Energy: 1.4647614777467932
Energy: 1.4601864091910253
Energy: 1.4647614777467932
Energy: 1.4601864091910253
Energy: 1.4647614777476736
Energy: 1.4601864091910253
Energy: 1.6140406248210193
Energy: 1.4306377750024186
Energy: 1.6140406248210193
Energy: 1.4306377750032988
Energy: 1.6140406248218993
Energy: 1.4306377750032988
Energy: 1.41836907426652
Energy: 1.4629913755657227
Energy: 1.41836907426652
Energy: 1.4629913755657227
Energy: 1.41836907426652
Energy: 1.4629913755657227
Energy: 1.419787442870614
Energy: 1.4745051327440284
Energy: 1.419787442870614
Energy: 1.4745051327440284
Energy: 1.419787442870614
Energy: 1.4745051327440284
Energy: 1.533208241742588
Energy: 1.4271068266130722
Energy: 1.533208241742588
Energy: 1.4271068266121918
Energy: 1.5332082417417077
Energy: 1.4271068266130722

minimum gb energy = 1.4106589350448009 eV
minimum distance =  2.24394560836179 Angstroms
sigma value = 27


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

Energy: 1.395578493283564
Energy: 1.448811285333121
Energy: 1.395578493283564
Energy: 1.448811285333121
Energy: 1.395578493283564
Energy: 1.448811285333121
Energy: 1.4080571569990898
Energy: 1.3861904255980928
Energy: 1.4080571569990898
Energy: 1.3861904255980928
Energy: 1.4080571569998317
Energy: 1.3861904255980928
Energy: 1.4906901637674501
Energy: 1.3475208062234127
Energy: 1.4906901637674501
Energy: 1.3475208062234127
Energy: 1.4906901637674501
Energy: 1.3475208062241548
Energy: 1.3301215369860557
Energy: 1.4496889300534828
Energy: 1.3301215369853139
Energy: 1.4496889300542248
Energy: 1.3301215369867978
Energy: 1.4496889300534828
Energy: 1.3813299015499854
Energy: 1.419328292144197
Energy: 1.3813299015499854
Energy: 1.419328292143455
Energy: 1.3813299015499854
Energy: 1.419328292144197
Energy: 1.3885393793422685
Energy: 1.3301286712900784
Energy: 1.3885393793422685
Energy: 1.3301286712900784
Energy: 1.3885393793422685
Energy: 1.3301286712908202
Energy: 1.3637499567341664
Energy: 1.4682702631420514
Energy: 1.3637499567334244
Energy: 1.4682702631427933
Energy: 1.3637499567341664
Energy: 1.4682702631420514
Energy: 1.4519599349305379
Energy: 1.487525360080719
Energy: 1.4519599349305379
Energy: 1.487525360080719
Energy: 1.4519599349305379
Energy: 1.487525360080719
Energy: 1.43539705944339
Energy: 1.3301835316133213
Energy: 1.43539705944339
Energy: 1.3301835316140636
Energy: 1.435397059444132
Energy: 1.3301835316140636
Energy: 1.330151261195769
Energy: 1.4637519522384517
Energy: 1.330151261195769
Energy: 1.4637519522391935
Energy: 1.330151261196511
Energy: 1.4637519522377096
Energy: 1.330149938548508
Energy: 1.4493239818253763
Energy: 1.330149938548508
Energy: 1.449323981826118
Energy: 1.330149938548508
Energy: 1.449323981826118
Energy: 1.4642752591237427
Energy: 1.365272532727274
Energy: 1.4642752591237427
Energy: 1.365272532728016
Energy: 1.4642752591237427
Energy: 1.365272532727274
Energy: 1.4462124973748893
Energy: 1.4149110957433688
Energy: 1.4462124973741475
Energy: 1.4149110957433688
Energy: 1.4462124973748893
Energy: 1.4149110957426267
Energy: 1.3304421285947523
Energy: 1.4340542467557604
Energy: 1.3304421285940102
Energy: 1.4340542467565023
Energy: 1.3304421285947523
Energy: 1.4340542467565023
Energy: 1.388844592516244
Energy: 1.3301145557922305
Energy: 1.388844592515502
Energy: 1.3301145557922305
Energy: 1.388844592515502
Energy: 1.3301145557922305
Energy: 1.3876640631929804
Energy: 1.3649747715176992
Energy: 1.3876640631929804
Energy: 1.3649747715169573
Energy: 1.3876640631922381
Energy: 1.3649747715176992
Energy: 1.361214326520332
Energy: 1.4769180994797613
Energy: 1.3612143265210739
Energy: 1.476918099479019
Energy: 1.3612143265210739
Energy: 1.4769180994797613
Energy: 1.4119817179633927
Energy: 1.348071246741515
Energy: 1.4119817179626508
Energy: 1.348071246741515
Energy: 1.4119817179626508
Energy: 1.348071246741515
Energy: 1.3831950680022476
Energy: 1.3805408173312859
Energy: 1.3831950680007639
Energy: 1.3805408173312859
Energy: 1.3831950680022476
Energy: 1.3805408173305438
Energy: 1.3955784932857898
Energy: 1.448811285331637
Energy: 1.395578493284306
Energy: 1.448811285330895
Energy: 1.3955784932857898
Energy: 1.448811285331637
Energy: 1.4080571569976055
Energy: 1.3861904255943829
Energy: 1.4080571569976055
Energy: 1.3861904255951247
Energy: 1.4080571569976055
Energy: 1.3861904255943829
Energy: 1.4906901637681922
Energy: 1.3475208062219286
Energy: 1.4906901637674501
Energy: 1.3475208062219286
Energy: 1.4906901637674501
Energy: 1.3475208062219286
Energy: 1.3301215369882817
Energy: 1.4496889300534828
Energy: 1.3301215369875397
Energy: 1.4496889300534828
Energy: 1.3301215369882817
Energy: 1.4496889300534828
Energy: 1.3813299015492435
Energy: 1.4193282921449388
Energy: 1.3813299015492435
Energy: 1.419328292145681
Energy: 1.3813299015492435
Energy: 1.419328292145681
Energy: 1.3885393793437524
Energy: 1.330128671291562
Energy: 1.3885393793430103
Energy: 1.330128671291562
Energy: 1.3885393793444942
Energy: 1.330128671291562

minimum gb energy = 1.3301145557922305 eV
minimum distance =  2.29042597780256 Angstroms
sigma value = 19


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

Energy: 1.3263043285742422
Energy: 1.5383857886625876
Energy: 1.3263043285742422
Energy: 1.5383857886619472
Energy: 1.3263043285742422
Energy: 1.5383857886619472
Energy: 1.4452831846072933
Energy: 1.3292943930562202
Energy: 1.4452831846072933
Energy: 1.3292943930562202
Energy: 1.4452831846072933
Energy: 1.3292943930562202
Energy: 1.5542812178193026
Energy: 1.2674422649449462
Energy: 1.490597703808895
Energy: 1.2674422649455868
Energy: 1.490597703807614
Energy: 1.2674422649455868
Energy: 1.2875757475083645
Energy: 1.4628559402754266
Energy: 1.2875757475083645
Energy: 1.4628559402754266
Energy: 1.2875757475083645
Energy: 1.4628559402754266
Energy: 1.370310599937065
Energy: 1.432527238744402
Energy: 1.370310599937065
Energy: 1.432527238744402
Energy: 1.370310599937065
Energy: 1.432527238744402
Energy: 1.4281544445180612
Energy: 1.2902543400489659
Energy: 1.4281544445180612
Energy: 1.2902543400489659
Energy: 1.4281544445180612
Energy: 1.2902543400489659
Energy: 1.2739026722244604
Energy: 1.4256110611685575
Energy: 1.2739026722244604
Energy: 1.4256110611685575
Energy: 1.2739026722244604
Energy: 1.4256110611685575
Energy: 1.3348752853351742
Energy: 1.4315427872660018
Energy: 1.3348752853351742
Energy: 1.4315427872666422
Energy: 1.3348752853351742
Energy: 1.4315427872660018
Energy: 1.5384648405209895
Energy: 1.2667441034309137
Energy: 1.5384648405209895
Energy: 1.2667441034309137
Energy: 1.5384648405209895
Energy: 1.2667441034309137
Energy: 1.4006210427478232
Energy: 1.3978461956682755
Energy: 1.4006210427478232
Energy: 1.3978461956682755
Energy: 1.4006210427478232
Energy: 1.3978461956682755
Energy: 1.2684094898861376
Energy: 1.5832447625425918
Energy: 1.2684094898854974
Energy: 1.5832447625425918
Energy: 1.2684094898861376
Energy: 1.5832447625438726
Energy: 1.500357586658253
Energy: 1.290804272653463
Energy: 1.5003575866576124
Energy: 1.2908042726541034
Energy: 1.5003575866576124
Energy: 1.290804272653463
Energy: 1.3507030667905475
Energy: 1.315728494002452
Energy: 1.3507030667899071
Energy: 1.315728494003733
Energy: 1.3507030667905475
Energy: 1.3157284940050138
Energy: 1.2881565735576774
Energy: 1.4435318579642948
Energy: 1.2881565735576774
Energy: 1.4435318579636545
Energy: 1.2881565735576774
Energy: 1.4435318579636545
Energy: 1.4634193961589335
Energy: 1.267681084314181
Energy: 1.4634193961595738
Energy: 1.2676810843135404
Energy: 1.4634193961582929
Energy: 1.267681084314181
Energy: 1.433746987691243
Energy: 1.2669228511928925
Energy: 1.4337469876918834
Energy: 1.2669228511928925
Energy: 1.4337469876970068
Energy: 1.2669228511928925
Energy: 1.3025078144975542
Energy: 1.4711560326564812
Energy: 1.3025078144975542
Energy: 1.4711560326571218
Energy: 1.3025078144975542
Energy: 1.4711560326564812
Energy: 1.4144145708775906
Energy: 1.4011228462532417
Energy: 1.41441457087695
Energy: 1.4011228462532417
Energy: 1.41441457087695
Energy: 1.4011228462532417
Energy: 1.5073684242303573
Energy: 1.2882788687128386
Energy: 1.5073684242322494
Energy: 1.2882788687128386
Energy: 1.474643205416714
Energy: 1.2882788687128386
Energy: 1.2887477642160778
Energy: 1.461122643330693
Energy: 1.288747764217359
Energy: 1.4611226433300526
Energy: 1.2887477642160778
Energy: 1.4611226433300526
Energy: 1.2720046647133447
Energy: 1.5015941983256471
Energy: 1.2720046647133447
Energy: 1.5015941983262875
Energy: 1.2720046647133447
Energy: 1.501594198325007
Energy: 1.5467425454996164
Energy: 1.2902820098088952
Energy: 1.5467425454989758
Energy: 1.2902820098082546
Energy: 1.5467425455008972
Energy: 1.2902820098082546
Energy: 1.3770853940495262
Energy: 1.3315018461486916
Energy: 1.3770853940508074
Energy: 1.3315018461486916
Energy: 1.3770853940501668
Energy: 1.3315018461499726
Energy: 1.3204798754020142
Energy: 1.4864972658194233
Energy: 1.3204798754026548
Energy: 1.4864972658194233
Energy: 1.3204798754020142
Energy: 1.4864972658194233
Energy: 1.4194377828810643
Energy: 1.2936358684873563
Energy: 1.4194377828817046
Energy: 1.2936358684873563
Energy: 1.4194377828810643
Energy: 1.2936358684873563
Energy: 1.3334793536089575
Energy: 1.300797638782372
Energy: 1.3334793536076768
Energy: 1.300797638781732
Energy: 1.3334793536089575
Energy: 1.300797638781732
Energy: 1.2647859475055458
Energy: 1.45500691168588
Energy: 1.2647859475055458
Energy: 1.45500691168588
Energy: 1.2647859475055458
Energy: 1.45500691168588
Energy: 1.460506028502845
Energy: 1.2883059741135807
Energy: 1.460506028502845
Energy: 1.2883059741135807
Energy: 1.4605060285022045
Energy: 1.2883059741135807
Energy: 1.4308463939576028
Energy: 1.2882013443608813
Energy: 1.4308463939576028
Energy: 1.2882013443615217
Energy: 1.4308463939576028
Energy: 1.288201344362162

minimum gb energy = 1.2647859475055458 eV
minimum distance =  2.25134899165504 Angstroms
sigma value = 101


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

Energy: 1.2457519405420867
Energy: 1.4538107710482149
Energy: 1.2457519405415238
Energy: 1.4538107710476518
Energy: 1.2457519405420867
Energy: 1.453810771047089
Energy: 1.3816926874944724
Energy: 1.2551483909210268
Energy: 1.3816926874939095
Energy: 1.2551483909210268
Energy: 1.3816926874939095
Energy: 1.2551483909210268
Energy: 1.4403507237671107
Energy: 1.2276713709039042
Energy: 1.4403507237676738
Energy: 1.2276713709039042
Energy: 1.4403507237671107
Energy: 1.2276713709039042
Energy: 1.1981956423942335
Energy: 1.4499633860522496
Energy: 1.1981956423947966
Energy: 1.4499633860522496
Energy: 1.1981956423947966
Energy: 1.4499633860528125
Energy: 1.3115401409143648
Energy: 1.260174499867016
Energy: 1.3115401409138019
Energy: 1.2601744998658901
Energy: 1.3115401409138019
Energy: 1.2601744998658901
Energy: 1.4314138442684965
Energy: 1.2092438661810567
Energy: 1.4314138442684965
Energy: 1.2092438661810567
Energy: 1.4314138442684965
Energy: 1.2092438661816198
Energy: 1.2558863809498866
Energy: 1.3794844065699303
Energy: 1.2558863809470717
Energy: 1.3794844065682415
Energy: 1.2558863809487608
Energy: 1.3794844065693674
Energy: 1.197749995416522
Energy: 1.4306802487068129
Energy: 1.197749995417085
Energy: 1.4306802487101908
Energy: 1.197749995417085
Energy: 1.4306802487068129
Energy: 1.430467186114803
Energy: 1.2112158326692362
Energy: 1.430467186115929
Energy: 1.2112158326692362
Energy: 1.430467186115929
Energy: 1.2112158326692362
Energy: 1.3113146412482606
Energy: 1.3074614528621398
Energy: 1.3113146412482606
Energy: 1.307461452861577
Energy: 1.3113146412482606
Energy: 1.3074614528621398
Energy: 1.1972127735806857
Energy: 1.5825749181363664
Energy: 1.1972127735801228
Energy: 1.5825749181363664
Energy: 1.1972127735812488
Energy: 1.5825749181335516
Energy: 1.3055418158814314
Energy: 1.2571535155937679
Energy: 1.3055418158814314
Energy: 1.2571535155943308
Energy: 1.3055418158819942
Energy: 1.2571535155937679
Energy: 1.4059467403603636
Energy: 1.227771744029195
Energy: 1.4059467403598005
Energy: 1.227771744029195
Energy: 1.4059467403603636
Energy: 1.227771744029195
Energy: 1.2457188473958438
Energy: 1.6617654236598427
Energy: 1.2457188473958438
Energy: 1.450293837716653
Energy: 1.2457188473958438
Energy: 1.4502938377105115
Energy: 1.2459718349452005
Energy: 1.3190012251270362
Energy: 1.2459718349452005
Energy: 1.319001225126473
Energy: 1.2459718349446374
Energy: 1.3190012251247842
Energy: 1.4394270320469047
Energy: 1.230674132686664
Energy: 1.4394270320469047
Energy: 1.230674132686664
Energy: 1.4394270320474678
Energy: 1.2306741326861008
Energy: 1.1920720537730933
Energy: 1.397969865491259
Energy: 1.1920720537736562
Energy: 1.3979698654946369
Energy: 1.1920720537730933
Energy: 1.397969865501956
Energy: 1.1919490063874254
Energy: 1.3938658825818528
Energy: 1.1919490063891143
Energy: 1.3938658825818528
Energy: 1.1919490063874254
Energy: 1.39386588258129
Energy: 1.431783484229531
Energy: 1.20945127758184
Energy: 1.4317834842300938
Energy: 1.209451277582403
Energy: 1.4317834842300938
Energy: 1.209451277582403
Energy: 1.254961366798222
Energy: 1.3303716295884516
Energy: 1.2549613667965331
Energy: 1.3303716295884516
Energy: 1.25496136679597
Energy: 1.3303716295878887
Energy: 1.216397614490586
Energy: 1.5925717527017196
Energy: 1.2163976144888968
Energy: 1.5925717527000305
Energy: 1.216397614490586
Energy: 1.5925717527005936
Energy: 1.4161539699379986
Energy: 1.209037638473419
Energy: 1.4161539699368724
Energy: 1.209037638473419
Energy: 1.4161539699368724
Energy: 1.209037638473419
Energy: 1.4066807464377193
Energy: 1.2090649894928645
Energy: 1.4066807464371565
Energy: 1.2090649894934273
Energy: 1.4066807464382824
Energy: 1.2090649894928645
Energy: 1.1983251927862362
Energy: 1.4667410082358783
Energy: 1.198325192785673
Energy: 1.4667410082364412
Energy: 1.198325192785673
Energy: 1.4667410082358783
Energy: 1.3494658576685041
Energy: 1.2624549492779582
Energy: 1.3494658576685041
Energy: 1.2624549492785213
Energy: 1.349465857669067
Energy: 1.2624549492768322
Energy: 1.4055408727881067
Energy: 1.2307202457092428
Energy: 1.4055408727875434
Energy: 1.2307202457086799
Energy: 1.4055408727881067
Energy: 1.230720245708117
Energy: 1.2457240656023543
Energy: 1.4878864949064257
Energy: 1.2457240656029172
Energy: 1.4878864949058628
Energy: 1.2457240656023543
Energy: 1.4878864949058628
Energy: 1.2456807566996921
Energy: 1.3685512677142972
Energy: 1.2456807566991293
Energy: 1.3685512677142972
Energy: 1.2456807566991293
Energy: 1.3685512677142972
Energy: 1.4667535116477266
Energy: 1.2277034793001966
Energy: 1.4667535116477266
Energy: 1.2277034793001966
Energy: 1.4667535116471635
Energy: 1.2277034793001966
Energy: 1.1920445339705747
Energy: 1.3678622763478805
Energy: 1.1920445339705747
Energy: 1.3678622763473176
Energy: 1.1920445339705747
Energy: 1.3678622763478805
Energy: 1.1915729459056363
Energy: 1.4237449977170795
Energy: 1.1915729459061992
Energy: 1.4237449977165164
Energy: 1.1915729459056363
Energy: 1.4237449977170795
Energy: 1.468152101431295
Energy: 1.2090078853780368
Energy: 1.4681521014318581
Energy: 1.2090078853780368
Energy: 1.468152101432421
Energy: 1.2090078853774742
Energy: 1.4173926725049495
Energy: 1.2090511056365034
Energy: 1.4173926725055126
Energy: 1.2090511056365034
Energy: 1.4173926725055126
Energy: 1.2090511056365034

minimum gb energy = 1.1915729459056363 eV
minimum distance =  2.27195770375228 Angstroms
sigma value = 33


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

Energy: 0.02043308553196897
Energy: 1.1769992364052078
Energy: 0.02043308553196897
Energy: 1.1769992364060915
Energy: 0.02043308553243674
Energy: 1.1769992364056237
Energy: 0.02159043778587676
Energy: 0.42789101242340105
Energy: 0.02159043778540899
Energy: 0.42789101242340105
Energy: 0.02159043778540899
Energy: 0.42789101242340105
Energy: 1.177186458621144
Energy: 0.42855087688178445
Energy: 1.1771864588364749
Energy: 0.42855087688318777
Energy: 1.1771864601229503
Energy: 0.42855087688318777
Energy: 0.02159043778769587
Energy: 0.42789101242293326
Energy: 0.021590437788163643
Energy: 0.42789101242293326
Energy: 0.021590437788163643
Energy: 0.42789101242340105

minimum gb energy = 0.02043308553196897 eV
minimum distance =  2.47852798103955 Angstroms
sigma value = 1