Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001_Al__MO_049243498555_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.081654928624631
cohesive_energy=3.5802802150217286
mass=26.981538
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: 2.2204e-16 eV

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

Energy: 0.010855267197474941
Energy: 0.28305565430051344
Energy: 0.010855267197228943
Energy: 0.28305565430051344
Energy: 0.010855267197474941
Energy: 0.28305565430051344
Energy: 0.2830556543010054
Energy: 0.31385401667861695
Energy: 0.2830556543002674
Energy: 0.31385401667861695
Energy: 0.28305565430051344
Energy: 0.31385401667861695
Energy: 0.010855267197228943
Energy: 0.28305565430051344
Energy: 0.010855267197228943
Energy: 0.28305565430051344
Energy: 0.010855267197228943
Energy: 0.28305565430051344
Energy: 0.2830556543007594
Energy: 0.31385401667861695
Energy: 0.2830556543007594
Energy: 0.31385401667861695
Energy: 0.2830556543010054
Energy: 0.31385401667861695
Energy: 0.010855267197228943
Energy: 0.28305565430051344
Energy: 0.010855267197228943
Energy: 0.2830556543002674
Energy: 0.010855267197228943
Energy: 0.28305565430051344
Energy: 0.28305565430051344
Energy: 0.31385401667861695
Energy: 0.28305565430051344
Energy: 0.31385401667861695
Energy: 0.2830556543002674
Energy: 0.31385401667861695

minimum gb energy = 0.010855267197228943 eV
minimum distance =  2.84660524529355 Angstroms
sigma value = 1


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

Energy: 0.411780246094833
Energy: 0.4018207813608349
Energy: 0.4117802460930565
Energy: 0.4018207813608349
Energy: 0.4117802460954251
Energy: 0.4018207813608349
Energy: 0.4447327903808823
Energy: 0.3880686285565246
Energy: 0.44473279038206653
Energy: 0.3880686285565246
Energy: 0.44473279038147445
Energy: 0.3880686285565246
Energy: 0.3979623803868751
Energy: 0.4101987139342896
Energy: 0.3979623803868751
Energy: 0.4101987139342896
Energy: 0.39796238038628295
Energy: 0.4101987139336975
Energy: 0.41712618960436326
Energy: 0.39349883243868744
Energy: 0.4171261896037711
Energy: 0.39349883243868744
Energy: 0.41712618960613973
Energy: 0.39349883243868744
Energy: 0.39474900459981965
Energy: 0.42522404967992705
Energy: 0.3947490046015961
Energy: 0.42522404967992705
Energy: 0.3947490046021882
Energy: 0.42522404967992705
Energy: 0.41533464995025265
Energy: 0.3853134330119796
Energy: 0.41533464995084485
Energy: 0.3853134330119796
Energy: 0.41533464995084485
Energy: 0.3853134330119796
Energy: 0.3953779239697917
Energy: 0.40005028161024625
Energy: 0.3953779239715682
Energy: 0.4000502816114306
Energy: 0.3953779239715682
Energy: 0.4000502816114306
Energy: 0.39553055694680445
Energy: 0.4309827738797203
Energy: 0.39553055694976524
Energy: 0.43098277387912814
Energy: 0.39553055694976524
Energy: 0.43098277387912814
Energy: 0.41920027302279916
Energy: 0.4044245362884004
Energy: 0.41920027302398344
Energy: 0.4044245362884004
Energy: 0.41920027302339125
Energy: 0.4044245362884004
Energy: 0.3794156205812567
Energy: 0.4217995429584681
Energy: 0.3794156205818488
Energy: 0.42179954295906025
Energy: 0.3794156205806645
Energy: 0.4217995429584681
Energy: 0.4089081090591035
Energy: 0.3799997993310768
Energy: 0.40890810906028785
Energy: 0.3799997993310768
Energy: 0.4089081090596956
Energy: 0.379999799331669
Energy: 0.38652535125419996
Energy: 0.45144496087846414
Energy: 0.3865253512547922
Energy: 0.45144496087846414
Energy: 0.38652535125538434
Energy: 0.45144496087846414
Energy: 0.44441170479210307
Energy: 0.382515368648105
Energy: 0.4444117047962481
Energy: 0.382515368648105
Energy: 0.4444117047944717
Energy: 0.382515368648105
Energy: 0.3885760368952216
Energy: 0.39701912309641013
Energy: 0.3885760368940373
Energy: 0.39701912309581805
Energy: 0.3885760368952216
Energy: 0.39701912309581805
Energy: 0.45106771581401395
Energy: 0.3858635523062998
Energy: 0.45106771581460603
Energy: 0.3858635523062998
Energy: 0.4510677158151983
Energy: 0.38586355230689195
Energy: 0.4458282776900031
Energy: 0.41227037774278447
Energy: 0.44582827769059524
Energy: 0.41227037774278447
Energy: 0.4458282776900031
Energy: 0.41227037774278447
Energy: 0.3938471736046833
Energy: 0.4058693862614067
Energy: 0.3938471736058675
Energy: 0.4058693862614067
Energy: 0.3938471736058675
Energy: 0.4058693862614067
Energy: 0.39399026491481115
Energy: 0.3983862920333327
Energy: 0.39399026491481115
Energy: 0.3983862920339248
Energy: 0.3939902649136268
Energy: 0.3983862920333327
Energy: 0.3809058746373243
Energy: 0.39395254301218513
Energy: 0.38090587463673214
Energy: 0.39395254301277727
Energy: 0.3809058746385086
Energy: 0.39395254301159305
Energy: 0.42212126350169077
Energy: 0.3852481859403332
Energy: 0.4221212635022829
Energy: 0.3852481859403332
Energy: 0.4221212635022829
Energy: 0.3852481859403332
Energy: 0.3925004829799123
Energy: 0.43855947828510056
Energy: 0.39250048297872797
Energy: 0.4385594782845085
Energy: 0.39250048297932016
Energy: 0.43855947828391634
Energy: 0.41439854006084414
Energy: 0.4011072740793118
Energy: 0.4143985400614362
Energy: 0.4011072740793118
Energy: 0.4143985400620284
Energy: 0.4011072740793118
Energy: 0.38523921558975877
Energy: 0.44148151908563943
Energy: 0.4018072832561627
Energy: 0.44148151908563943
Energy: 0.38948708289303335
Energy: 0.44148151908563943

minimum gb energy = 0.3794156205806645 eV
minimum distance =  2.52661781795571 Angstroms
sigma value = 33


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

Energy: 0.4369154327176125
Energy: 0.42420538678143066
Energy: 0.4191021966199256
Energy: 0.424205386774725
Energy: 0.43691543270919225
Energy: 0.4242053867743882
Energy: 0.4410793349409766
Energy: 0.3907768381538221
Energy: 0.4410793349429975
Energy: 0.39077683814540176
Energy: 0.4410793349312091
Energy: 0.39077683814540176
Energy: 0.3940056205723987
Energy: 0.3898838683979341
Energy: 0.39400562056734656
Energy: 0.38988386840365985
Energy: 0.3940056205690305
Energy: 0.3898838684019758
Energy: 0.4414084373691816
Energy: 0.418218955600956
Energy: 0.4414084373738969
Energy: 0.4182189555948933
Energy: 0.44140843737457053
Energy: 0.4182189555952301
Energy: 0.404294426960949
Energy: 0.4212259352099344
Energy: 0.40429442695993856
Energy: 0.42122593520521895
Energy: 0.4042944269498342
Energy: 0.4212259352055558
Energy: 0.39626209693729497
Energy: 0.3906516575309314
Energy: 0.3962620969369582
Energy: 0.39065165752958414
Energy: 0.39626209693729497
Energy: 0.3906516575292473
Energy: 0.4234133538685763
Energy: 0.4235730768905432
Energy: 0.4234133538662186
Energy: 0.42357307689189044
Energy: 0.4234133538551039
Energy: 0.42357307689189044
Energy: 0.37803604855522294
Energy: 0.43580054066731516
Energy: 0.3780360485538757
Energy: 0.43580054067132623
Energy: 0.37803604855421247
Energy: 0.43580054067065266
Energy: 0.39359140812794347
Energy: 0.39378299151136403
Energy: 0.3935914081239017
Energy: 0.3937829915154058
Energy: 0.3935914081249121
Energy: 0.393782991515069
Energy: 0.38902696898472533
Energy: 0.459832227043646
Energy: 0.38902608498930646
Energy: 0.4598322270433092
Energy: 0.38902696898775657
Energy: 0.4598322270429724
Energy: 0.4471927439024163
Energy: 0.3863330019895705
Energy: 0.44719274390073227
Energy: 0.3863330019892337
Energy: 0.4471927439000586
Energy: 0.3863330019892337
Energy: 0.3924006853627879
Energy: 0.41774455929263093
Energy: 0.39239990278636283
Energy: 0.41774455929700943
Energy: 0.3924006853624511
Energy: 0.41774455929599896
Energy: 0.3939941173265807
Energy: 0.39023339197129703
Energy: 0.39399411732994877
Energy: 0.3902333919797173
Energy: 0.39399411733028555
Energy: 0.3902333919797173
Energy: 0.3994529160263327
Energy: 0.4191132967187305
Energy: 0.3994529160226277
Energy: 0.41911329672243536
Energy: 0.3994529160206069
Energy: 0.41911329672243536
Energy: 0.4153280706355064
Energy: 0.38775048752912317
Energy: 0.41532807063954813
Energy: 0.3877504875314808
Energy: 0.4153280706277598
Energy: 0.3877504875314808
Energy: 0.39355827735285737
Energy: 0.3877615552120554
Energy: 0.3935582773548782
Energy: 0.38776155521239225
Energy: 0.39355827734780513
Energy: 0.3877615552117186
Energy: 0.42707065137586725
Energy: 0.4054564445008678
Energy: 0.42707065137755135
Energy: 0.4054564444995207
Energy: 0.42707065138260353
Energy: 0.4054564444995207
Energy: 0.4040109836292625
Energy: 0.3935244591111316
Energy: 0.4040109836306098
Energy: 0.3935244591144998
Energy: 0.40401098361949495
Energy: 0.3935244591148366
Energy: 0.3948874132270641
Energy: 0.40101076479982456
Energy: 0.39488741323144266
Energy: 0.40101076479847736
Energy: 0.3948874132277377
Energy: 0.40101076479982456
Energy: 0.4291391908393602
Energy: 0.41320285935084095
Energy: 0.42912204110811447
Energy: 0.4132028593582508
Energy: 0.4291391908299294
Energy: 0.4132028593582508
Energy: 0.38621430701336396
Energy: 0.43670896795525393
Energy: 0.38622026597283327
Energy: 0.43670896796535824
Energy: 0.3862143070099958
Energy: 0.436708967964011
Energy: 0.3911228024566694
Energy: 0.3937828426900837
Energy: 0.39112280246003744
Energy: 0.39378284268941005
Energy: 0.3911228024509742
Energy: 0.39378284268941005
Energy: 0.3846384926934683
Energy: 0.45580101847373006
Energy: 0.38463906558689187
Energy: 0.4558010184727197
Energy: 0.38463849269245787
Energy: 0.4558010184706988
Energy: 0.44031609961176427
Energy: 0.4097180095721855
Energy: 0.4403160996110906
Energy: 0.40971800957083837
Energy: 0.4403160996070489
Energy: 0.40971800957117516
Energy: 0.3968111001169026
Energy: 0.3950520071348634
Energy: 0.3941488382089555
Energy: 0.39505200713014793
Energy: 0.3968111001145449
Energy: 0.39505200713014793
Energy: 0.4444264895293613
Energy: 0.4284100193697509
Energy: 0.4171163834175011
Energy: 0.4284100193670564
Energy: 0.4444264895286877
Energy: 0.4284100193670564
Energy: 0.43637397253385807
Energy: 0.41400318076834014
Energy: 0.4170534286500294
Energy: 0.41400318077406595
Energy: 0.43637397251536403
Energy: 0.41400318077372916
Energy: 0.39586737858442184
Energy: 0.3877850974192833
Energy: 0.39586737858139054
Energy: 0.38778509741894646
Energy: 0.3958673785773488
Energy: 0.38778509741860967
Energy: 0.45738250960458404
Energy: 0.3910260462277116
Energy: 0.4573825096049208
Energy: 0.3910260462209754
Energy: 0.4573825096032368
Energy: 0.3910260462213122
Energy: 0.3850797170988764
Energy: 0.4513271282771617
Energy: 0.3850797170988764
Energy: 0.4513271282627095
Energy: 0.3850797170901193
Energy: 0.4513271282630463
Energy: 0.4043211435909988
Energy: 0.3938611922311789
Energy: 0.4043211435967246
Energy: 0.39386119223421023
Energy: 0.40432114359335647
Energy: 0.39386119223421023
Energy: 0.38937822060590477
Energy: 0.41378669436690557
Energy: 0.3893782206075888
Energy: 0.4137866943588221
Energy: 0.38937822061799937
Energy: 0.4137866943605062
Energy: 0.4183944265660144
Energy: 0.41332366840951096
Energy: 0.4183944265687089
Energy: 0.41332366841119494
Energy: 0.41839442656129905
Energy: 0.41332366841119494
Energy: 0.3927880253166509
Energy: 0.41540905609261625
Energy: 0.3927880253112619
Energy: 0.4154090560855432
Energy: 0.39278802530991463
Energy: 0.41540905608588
Energy: 0.38859781456853953
Energy: 0.3942605735296971
Energy: 0.38859781456146636
Energy: 0.39426057353171806
Energy: 0.38859781455439335
Energy: 0.39426057353171806
Energy: 0.40728886989012725
Energy: 0.4194172802836838
Energy: 0.40728886989551616
Energy: 0.41941728028098935
Energy: 0.4072888698918113
Energy: 0.4194172802830102
Energy: 0.3937642083916786
Energy: 0.403943739224351
Energy: 0.3937831663458281
Energy: 0.4039437392253615
Energy: 0.3937642083879736
Energy: 0.403943739226035
Energy: 0.39887221195428635
Energy: 0.39343569456408706
Energy: 0.3988722119593079
Energy: 0.3934356945583613
Energy: 0.3988722119566134
Energy: 0.39343569455903493
Energy: 0.3994259541978579
Energy: 0.42134777535740087
Energy: 0.3994259541981947
Energy: 0.4213477753584113
Energy: 0.39942595419718424
Energy: 0.4213477753584113
Energy: 0.4372330027178512
Energy: 0.3772287640808025
Energy: 0.4372330027306499
Energy: 0.3772287640885185
Energy: 0.4372330027188616
Energy: 0.3772287640885185
Energy: 0.39245564071534517
Energy: 0.39151540994659606
Energy: 0.39245564071399797
Energy: 0.3915154099412071
Energy: 0.39245564071500844
Energy: 0.3915154099412071

minimum gb energy = 0.3772287640808025 eV
minimum distance =  2.67595081852382 Angstroms
sigma value = 51


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

Energy: 0.40447065682371786
Energy: 0.4090371881979369
Energy: 0.4044706568229374
Energy: 0.4090371881979369
Energy: 0.40447065682371786
Energy: 0.4090371881979369
Energy: 0.43891207078922956
Energy: 0.39415851080716824
Energy: 0.43891207078922956
Energy: 0.39415851080716824
Energy: 0.43891207078922956
Energy: 0.39415851080716824
Energy: 0.3802123268440066
Energy: 0.4041038086663598
Energy: 0.3802123268440066
Energy: 0.4041038086663598
Energy: 0.3802123268440066
Energy: 0.4041038086679205
Energy: 0.39801054446522965
Energy: 0.37581774318751643
Energy: 0.39801054446522965
Energy: 0.37581774318751643
Energy: 0.39801054446522965
Energy: 0.3758177431882968
Energy: 0.41545571421223443
Energy: 0.3863432127241033
Energy: 0.4154557142130148
Energy: 0.3863432127248838
Energy: 0.415455714211454
Energy: 0.3863432127248838
Energy: 0.4136567968906564
Energy: 0.38587533143207126
Energy: 0.413656796889876
Energy: 0.3858753314305105
Energy: 0.4136567968906564
Energy: 0.3858753314312909
Energy: 0.41049539654464984
Energy: 0.3858695549603938
Energy: 0.41049539654464984
Energy: 0.3858695549603938
Energy: 0.4104953965454302
Energy: 0.3858695549596135
Energy: 0.3795150790775689
Energy: 0.38702063436052797
Energy: 0.3795150790775689
Energy: 0.38702063436052797
Energy: 0.3795150790767885
Energy: 0.38702063436052797
Energy: 0.4322558340946799
Energy: 0.373583003297734
Energy: 0.4322558340946799
Energy: 0.373583003297734
Energy: 0.4322558340946799
Energy: 0.373583003297734
Energy: 0.3846724555652493
Energy: 0.4200844704125581
Energy: 0.3846724555652493
Energy: 0.4200844704117777
Energy: 0.38467245556602975
Energy: 0.4200844704125581
Energy: 0.42266634787294394
Energy: 0.37656202364642916
Energy: 0.4226663478737243
Energy: 0.37656202364642916
Energy: 0.4226663478737243
Energy: 0.37656202364642916
Energy: 0.40675063331030026
Energy: 0.4095652077797702
Energy: 0.4067506333110806
Energy: 0.4095652077797702
Energy: 0.4067506333110806
Energy: 0.4095652077805506
Energy: 0.4559324607874969
Energy: 0.3944937500365527
Energy: 0.4559324607867165
Energy: 0.3944937500365527
Energy: 0.4559324607874969
Energy: 0.3944937500365527
Energy: 0.38027301529688423
Energy: 0.38636273258770915
Energy: 0.38027301529688423
Energy: 0.38636273258770915
Energy: 0.38027301529688423
Energy: 0.38636273258770915
Energy: 0.39880372321855967
Energy: 0.4035864012924537
Energy: 0.39880372321934016
Energy: 0.4035864012924537
Energy: 0.3988037232201205
Energy: 0.4035864012924537
Energy: 0.41364496191211086
Energy: 0.3859355297553103
Energy: 0.41364496191211086
Energy: 0.3859355297553103
Energy: 0.41364496191133054
Energy: 0.3859355297553103
Energy: 0.41506281258093036
Energy: 0.4219046514546579
Energy: 0.41506281258171074
Energy: 0.42190465145387757
Energy: 0.41506281258093036
Energy: 0.42190465145387757
Energy: 0.39860692525931873
Energy: 0.3882599403864923
Energy: 0.3986069252600991
Energy: 0.3882599403864923
Energy: 0.3986069252600991
Energy: 0.38825994038571193

minimum gb energy = 0.373583003297734 eV
minimum distance =  2.52016127827602 Angstroms
sigma value = 19


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

Energy: 0.3405966652257461
Energy: 0.35415605740663997
Energy: 0.3405966652257461
Energy: 0.35415605740663997
Energy: 0.3405966652275977
Energy: 0.35415605740663997
Energy: 0.38282007483498076
Energy: 0.39559087566057155
Energy: 0.38282007483498076
Energy: 0.39559087566057155
Energy: 0.38282007483498076
Energy: 0.3955908756610344
Energy: 0.33115885729192046
Energy: 0.3953375393092455
Energy: 0.331158857294235
Energy: 0.39533753930878257
Energy: 0.33115885729377204
Energy: 0.39533753930878257
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.36250778506095954
Energy: 0.33119879366815064
Energy: 0.33509486787351683
Energy: 0.3406565820034531
Energy: 0.33509486787444265
Energy: 0.3406565820034531
Energy: 0.33509486787490556
Energy: 0.3406565820034531
Energy: 0.3351240352109552
Energy: 0.34061717060484537
Energy: 0.33512403521280676
Energy: 0.34061717060484537
Energy: 0.33512403521326967
Energy: 0.3406171706043825
Energy: 0.3625010800752773
Energy: 0.3311811372341088
Energy: 0.3625010800762031
Energy: 0.33118113723457177
Energy: 0.362501080076666
Energy: 0.3311811372341088
Energy: 0.3311497120167397
Energy: 0.39556668134161255
Energy: 0.3311497120176655
Energy: 0.395566681339761
Energy: 0.3311497120167397
Energy: 0.3955666813402238
Energy: 0.3828377279912717
Energy: 0.3954430465048598
Energy: 0.3828377279917346
Energy: 0.3954430465048598
Energy: 0.3828377279921974
Energy: 0.3954430465048598
Energy: 0.34059666522713483
Energy: 0.35415605740663997
Energy: 0.3405966652266719
Energy: 0.35415605740663997
Energy: 0.3405966652280606
Energy: 0.3541560574071029
Energy: 0.38282007483498076
Energy: 0.3955908756610344
Energy: 0.3828200748340549
Energy: 0.3955908756610344
Energy: 0.3828200748354436
Energy: 0.39559087566057155
Energy: 0.3311588572928463
Energy: 0.3953375393092455
Energy: 0.331158857294235
Energy: 0.39533753930878257
Energy: 0.33115885729377204
Energy: 0.39533753930878257
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.33509486787351683
Energy: 0.34065658200299026
Energy: 0.33509486787444265
Energy: 0.34065658200299026
Energy: 0.33509486787490556
Energy: 0.34065658200299026
Energy: 0.3351240352114181
Energy: 0.3406171706043825
Energy: 0.33512403521326967
Energy: 0.3406171706043825
Energy: 0.33512403521326967
Energy: 0.3406171706053083
Energy: 0.3625010800748144
Energy: 0.3311811372341088
Energy: 0.3625010800757403
Energy: 0.33118113723457177
Energy: 0.3625010800752773
Energy: 0.33118113723457177
Energy: 0.3311497120172026
Energy: 0.3955666813406868
Energy: 0.3311497120172026
Energy: 0.3955666813406868
Energy: 0.3311497120181284
Energy: 0.3955666813402238
Energy: 0.38283772799080873
Energy: 0.3954430465048598
Energy: 0.38283772799266036
Energy: 0.3954430465048598
Energy: 0.38283772799312327
Energy: 0.3954430465048598
Energy: 0.340596665226209
Energy: 0.35415605740663997
Energy: 0.3405966652257461
Energy: 0.35415605740663997
Energy: 0.3405966652280606
Energy: 0.35415605740663997
Energy: 0.3828200748359065
Energy: 0.39559087566057155
Energy: 0.3828200748345178
Energy: 0.3955908756610344
Energy: 0.3828200748359065
Energy: 0.3955908756610344
Energy: 0.33115885729238337
Energy: 0.39533753930970833
Energy: 0.3311588572946979
Energy: 0.39533753930878257
Energy: 0.3311588572933092
Energy: 0.39533753930878257
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.36250778506095954
Energy: 0.3311987936676878
Energy: 0.36250778506049663
Energy: 0.3311987936676878
Energy: 0.3350948678739798
Energy: 0.3406565820034531
Energy: 0.3350948678739798
Energy: 0.34065658200299026
Energy: 0.33509486787490556
Energy: 0.34065658200299026
Energy: 0.33512403521188094
Energy: 0.3406171706053083
Energy: 0.33512403521326967
Energy: 0.34061717060484537
Energy: 0.33512403521280676
Energy: 0.3406171706043825
Energy: 0.36250108007435156
Energy: 0.33118113723457177
Energy: 0.3625010800752773
Energy: 0.33118113723457177
Energy: 0.3625010800752773
Energy: 0.33118113723457177
Energy: 0.3311497120162768
Energy: 0.3955666813402238
Energy: 0.3311497120167397
Energy: 0.3955666813406868
Energy: 0.3311497120181284
Energy: 0.3955666813406868
Energy: 0.38283772799080873
Energy: 0.39544304650439693
Energy: 0.38283772799266036
Energy: 0.3954430465048598
Energy: 0.3828377279921974
Energy: 0.3954430465048598
Energy: 0.340596665226209
Energy: 0.35415605740663997
Energy: 0.3405966652275977
Energy: 0.35415605740663997
Energy: 0.3405966652275977
Energy: 0.35415605740663997
Energy: 0.3828200748340549
Energy: 0.3955908756610344
Energy: 0.3828200748354436
Energy: 0.39559087566057155
Energy: 0.38282007483498076
Energy: 0.3955908756610344
Energy: 0.33115885729238337
Energy: 0.39533753930970833
Energy: 0.331158857294235
Energy: 0.39533753930878257
Energy: 0.33115885729377204
Energy: 0.39533753930878257

minimum gb energy = 0.3311497120162768 eV
minimum distance =  2.5683313676409 Angstroms
sigma value = 27


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

Energy: 0.34877467318094746
Energy: 0.3339733125518001
Energy: 0.34877467318094746
Energy: 0.3339733125518001
Energy: 0.3487746731798136
Energy: 0.3339733125518001
Energy: 0.3557563095704332
Energy: 0.31903219138789257
Energy: 0.3557563095704332
Energy: 0.31903219139013456
Energy: 0.3557563095704332
Energy: 0.31903219139013456
Energy: 0.3238868615991245
Energy: 0.39439596793392384
Energy: 0.3238868615979906
Energy: 0.39439596793278986
Energy: 0.3238868615991245
Energy: 0.39439596793392384
Energy: 0.3698780834432031
Energy: 0.32234161481889306
Energy: 0.36987808344206924
Energy: 0.32234161481889306
Energy: 0.3698780834432031
Energy: 0.32234161481889306
Energy: 0.3938652577264065
Energy: 0.3222524614774263
Energy: 0.3938652577264065
Energy: 0.3222524614774263
Energy: 0.3938652577264065
Energy: 0.3222524614774263
Energy: 0.3799597582264413
Energy: 0.4013534550161389
Energy: 0.3799597582264413
Energy: 0.40135345501727276
Energy: 0.3799597582264413
Energy: 0.40135345501727276
Energy: 0.3239483885454023
Energy: 0.3484713920393166
Energy: 0.3239483885454023
Energy: 0.3484713920404505
Energy: 0.3239483885454023
Energy: 0.3484713920393166
Energy: 0.34858340160501944
Energy: 0.3362951646184168
Energy: 0.34858340160615325
Energy: 0.3362951646184168
Energy: 0.34858340160615325
Energy: 0.3362951646184168
Energy: 0.3624745185033927
Energy: 0.3458114558196343
Energy: 0.3624745185033927
Energy: 0.3458114558219021
Energy: 0.3624745185033927
Energy: 0.3458114558196343
Energy: 0.36859340635864335
Energy: 0.3860352485353119
Energy: 0.36859340635864335
Energy: 0.3860352485353119
Energy: 0.36859340635864335
Energy: 0.3860352485353119
Energy: 0.35123980374833313
Energy: 0.3222164397457547
Energy: 0.35123980374833313
Energy: 0.3222164397457547
Energy: 0.35123980374833313
Energy: 0.3222164397457547
Energy: 0.3920880602941291
Energy: 0.36148160377273986
Energy: 0.3920880602941291
Energy: 0.3614816037716059
Energy: 0.3920880602941291
Energy: 0.36148160377273986

minimum gb energy = 0.31903219138789257 eV
minimum distance =  2.50704715106063 Angstroms
sigma value = 9


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

Energy: 0.33828714564939705
Energy: 0.33444739822100217
Energy: 0.3382871456465297
Energy: 0.33444739822100217
Energy: 0.3382871456506714
Energy: 0.33444739822068353
Energy: 0.3323702735946019
Energy: 0.30425715708873485
Energy: 0.3323702735872743
Energy: 0.30425715708459317
Energy: 0.33237027359237176
Energy: 0.30425715708682327
Energy: 0.30844659035216915
Energy: 0.34643416442913755
Energy: 0.3084465903508948
Energy: 0.3464341644294561
Energy: 0.3084465903556736
Energy: 0.3464341644297747
Energy: 0.3199838177118173
Energy: 0.31278873370319266
Energy: 0.31998381771149875
Energy: 0.31278873370319266
Energy: 0.31998381771149875
Energy: 0.31278873370319266
Energy: 0.3334679034388529
Energy: 0.32104603129270015
Energy: 0.33346790343917154
Energy: 0.32104603129333736
Energy: 0.33346790343694144
Energy: 0.32104603129301873
Energy: 0.3377328156722198
Energy: 0.3262678264736023
Energy: 0.33773281566775953
Energy: 0.3262678264736023
Energy: 0.33773281566903385
Energy: 0.3262678264733127
Energy: 0.3173025730739903
Energy: 0.3535708418937514
Energy: 0.3173025730704857
Energy: 0.3535708418937514
Energy: 0.3173025730701672
Energy: 0.35357084189343274
Energy: 0.29843100436490005
Energy: 0.36081482030477946
Energy: 0.2984310043613955
Energy: 0.36081482030477946
Energy: 0.29843100436203274
Energy: 0.36081482030477946
Energy: 0.3486312945194876
Energy: 0.32381282000307365
Energy: 0.3486312945201248
Energy: 0.323812820002755
Energy: 0.34863129451630176
Energy: 0.3238128200024365
Energy: 0.33375627117570006
Energy: 0.3123092820411001
Energy: 0.33375627117442563
Energy: 0.31230928204333025
Energy: 0.3337562711741071
Energy: 0.3123092820414187
Energy: 0.31976817296291493
Energy: 0.3099150876355602
Energy: 0.3197681729651451
Energy: 0.309915087634923
Energy: 0.3197681729651451
Energy: 0.30991508763524156
Energy: 0.3176633504500604
Energy: 0.3228626263163607
Energy: 0.31766335045165345
Energy: 0.32286262631604207
Energy: 0.317663350450379
Energy: 0.3228626263163607
Energy: 0.3315821490549453
Energy: 0.32664291878000706
Energy: 0.3315821490485735
Energy: 0.32664291878000706
Energy: 0.3315821490501665
Energy: 0.32664291878000706
Energy: 0.33815616178804303
Energy: 0.33078465884759684
Energy: 0.3381561617791514
Energy: 0.3307846588485527
Energy: 0.33815616177947005
Energy: 0.33078465884823405
Energy: 0.3113562445680917
Energy: 0.3362195860597415
Energy: 0.31135624456649874
Energy: 0.33621958606006014
Energy: 0.3113562445636604
Energy: 0.33621958606006014
Energy: 0.31320519798026597
Energy: 0.3292414675726618
Energy: 0.31320519797803575
Energy: 0.32924146757298034
Energy: 0.31320519797739865
Energy: 0.3292414675726618
Energy: 0.3773769497074371
Energy: 0.3091220832100917
Energy: 0.37737694970775565
Energy: 0.3091220832059501
Energy: 0.3773769497061627
Energy: 0.3091220832081802
Energy: 0.31772872373788846
Energy: 0.3203658144152771
Energy: 0.31772872373629546
Energy: 0.3203658144149586
Energy: 0.3177287237353398
Energy: 0.3203658144152771
Energy: 0.30135054706700054
Energy: 0.33126640907373955
Energy: 0.3013505470654076
Energy: 0.33126640906418187
Energy: 0.3013505470625402
Energy: 0.3312664090530312
Energy: 0.3603710543028213
Energy: 0.3190732949514854
Energy: 0.3603710542967681
Energy: 0.3190732949514854
Energy: 0.3603710542910624
Energy: 0.31907329495116676
Energy: 0.30135077325349224
Energy: 0.3311963138572113
Energy: 0.3013507732531736
Energy: 0.3311963138680434
Energy: 0.30135077325189924
Energy: 0.3311963138537068
Energy: 0.3178764121087868
Energy: 0.32044414218740963
Energy: 0.31787641211037976
Energy: 0.320444142187091
Energy: 0.31787641210783096
Energy: 0.32044414218740963
Energy: 0.3773876105019674
Energy: 0.3091362814661976
Energy: 0.37738761050260455
Energy: 0.30913628146524186
Energy: 0.3773876105010116
Energy: 0.30913628146587907
Energy: 0.31315882111801285
Energy: 0.31789249172455025
Energy: 0.31315882111865
Energy: 0.3178924917242316
Energy: 0.31315882111737564
Energy: 0.3178924917229573
Energy: 0.3111732576840532
Energy: 0.33614522346260733
Energy: 0.31117325767895576
Energy: 0.33614522346260733
Energy: 0.31117325768150444
Energy: 0.33614522346260733
Energy: 0.3379549373393248
Energy: 0.3305934463230694
Energy: 0.33795493733136
Energy: 0.330593446323388
Energy: 0.3379549373304042
Energy: 0.3305934463211579
Energy: 0.3314075200617652
Energy: 0.3266292922614737
Energy: 0.33140752005698637
Energy: 0.3266292922617922
Energy: 0.3314075200579421
Energy: 0.3266292922614737
Energy: 0.3176087039047382
Energy: 0.3084559425725196
Energy: 0.3176087039037824
Energy: 0.30845594257379394
Energy: 0.31760870390633117
Energy: 0.3084559425728382
Energy: 0.3202477942667805
Energy: 0.3099907090583782
Energy: 0.32024779426964783
Energy: 0.3099907090580596
Energy: 0.3202477942690107
Energy: 0.3099907090580596
Energy: 0.3336857366427049
Energy: 0.30334671989593753
Energy: 0.3336857366407933
Energy: 0.30334671989561895
Energy: 0.33368573664238627
Energy: 0.3033467198962561
Energy: 0.3485603852328812
Energy: 0.3240511377404586
Energy: 0.3485603852284208
Energy: 0.3240511377404586
Energy: 0.3485603852312882
Energy: 0.3240511377404586
Energy: 0.29848262394760516
Energy: 0.36076037097940766
Energy: 0.29848262394696806
Energy: 0.3607603709797263
Energy: 0.29848262394696806
Energy: 0.3607603709797263
Energy: 0.31737570698129947
Energy: 0.3501324783975703
Energy: 0.3173757069787507
Energy: 0.3501324783975703
Energy: 0.31737570697683914
Energy: 0.3501324783972517
Energy: 0.337644705063714
Energy: 0.3166384155540245
Energy: 0.3376447050611653
Energy: 0.316638415555936
Energy: 0.33764470506148386
Energy: 0.3166384155517944
Energy: 0.33340441184384234
Energy: 0.3210704408065123
Energy: 0.33340441184256797
Energy: 0.3210704408065123
Energy: 0.33340441184065644
Energy: 0.3210704408065123
Energy: 0.3199653801853307
Energy: 0.31231624105076117
Energy: 0.3199653801811891
Energy: 0.3123162410504426
Energy: 0.31996538018596793
Energy: 0.3123162410504426
Energy: 0.30846130969956065
Energy: 0.3464324269915067
Energy: 0.3084613096982863
Energy: 0.3464324269924335
Energy: 0.3084613096979677
Energy: 0.3464324269921439
Energy: 0.3322587615405707
Energy: 0.3234491737990112
Energy: 0.3322587615166764
Energy: 0.323449173799967
Energy: 0.33225876151221606
Energy: 0.323449173799967
Energy: 0.33828714565258294
Energy: 0.33444739822578096
Energy: 0.33828714565258294
Energy: 0.33444739822546243
Energy: 0.3382871456506714
Energy: 0.33444739822578096
Energy: 0.3323702735879115
Energy: 0.3042571570842746
Energy: 0.332370273582814
Energy: 0.3042571570973368
Energy: 0.3323702735875929
Energy: 0.3042571570906464
Energy: 0.3084465903461159
Energy: 0.34643416442499586
Energy: 0.30844659034232175
Energy: 0.34643416442627023
Energy: 0.30844659034423333
Energy: 0.34643416442627023
Energy: 0.3199838177197821
Energy: 0.3127887337098831
Energy: 0.31998381771691475
Energy: 0.3127887337098831
Energy: 0.3199838177178706
Energy: 0.3127887337098831
Energy: 0.3334679034334369
Energy: 0.32104603128091225
Energy: 0.333467903435667
Energy: 0.3210460312812309
Energy: 0.33346790343056953
Energy: 0.32104603128154946

minimum gb energy = 0.2984310043613955 eV
minimum distance =  2.65592008526957 Angstroms
sigma value = 57


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

Energy: 0.14031178977119946
Energy: 0.14552292179088044
Energy: 0.14031178977119946
Energy: 0.14552292179088044
Energy: 0.14031178977264994
Energy: 0.14552292179160564
Energy: 0.20812235047548472
Energy: 0.1408592799767741
Energy: 0.20812235047475947
Energy: 0.1408592799767741
Energy: 0.20812235047620992
Energy: 0.14085927997604886
Energy: 0.1675075873263256
Energy: 0.19239972974150288
Energy: 0.1675075873263256
Energy: 0.19239972974150288
Energy: 0.1675075873263256
Energy: 0.19239972974150288
Energy: 0.14696877760585125
Energy: 0.14037146866881103
Energy: 0.14696877760512603
Energy: 0.14037146866953626
Energy: 0.14696877760367558
Energy: 0.14037146866881103
Energy: 0.20827859080564798
Energy: 0.20801734529005478
Energy: 0.20827859080637318
Energy: 0.20801734529005478
Energy: 0.20827859080637318
Energy: 0.20801734529005478
Energy: 0.14067639003403332
Energy: 0.16795570196329138
Energy: 0.1406763900333081
Energy: 0.16795570196256615
Energy: 0.14067639003475854
Energy: 0.16795570196329138
Energy: 0.1407135831801404
Energy: 0.16794497668901498
Energy: 0.1407135831808656
Energy: 0.16794497668901498
Energy: 0.1407135831801404
Energy: 0.16794497668901498
Energy: 0.20787230028498832
Energy: 0.20802093953570544
Energy: 0.20787230028426307
Energy: 0.20802093953570544
Energy: 0.20787230028426307
Energy: 0.2080209395364307
Energy: 0.14696481967429117
Energy: 0.14036743626244635
Energy: 0.14696481967429117
Energy: 0.1403674362631716
Energy: 0.1469648196750164
Energy: 0.1403674362631716
Energy: 0.167460846460434
Energy: 0.19239594343314945
Energy: 0.167460846460434
Energy: 0.19239594343314945
Energy: 0.16746084646188444
Energy: 0.19239594343314945
Energy: 0.20789213475446797
Energy: 0.1408731473815232
Energy: 0.20789213475519322
Energy: 0.1408731473815232
Energy: 0.20789213475446797
Energy: 0.1408731473815232
Energy: 0.14031178976974898
Energy: 0.14552292179160564
Energy: 0.14031178977047423
Energy: 0.14552292179160564
Energy: 0.14031178977119946
Energy: 0.14552292179160564
Energy: 0.2081223504725838
Energy: 0.1408592799767741
Energy: 0.20812235047475947
Energy: 0.1408592799767741
Energy: 0.20812235047330901
Energy: 0.1408592799767741
Energy: 0.16750758732487514
Energy: 0.19239972974077765
Energy: 0.16750758732487514
Energy: 0.19239972974077765
Energy: 0.16750758732560037
Energy: 0.1923997297400524
Energy: 0.14696877760512603
Energy: 0.14037146866953626
Energy: 0.14696877760585125
Energy: 0.14037146866953626
Energy: 0.14696877760585125
Energy: 0.14037146866881103
Energy: 0.20827859080564798
Energy: 0.20801734529005478
Energy: 0.20827859080637318
Energy: 0.20801734529005478
Energy: 0.20827859080637318
Energy: 0.20801734529005478
Energy: 0.14067639003403332
Energy: 0.16795570196256615
Energy: 0.14067639003403332
Energy: 0.16795570196329138
Energy: 0.14067639003475854
Energy: 0.16795570196256615
Energy: 0.14071358318155788
Energy: 0.16794497668901498
Energy: 0.1407135831808656
Energy: 0.16794497668901498
Energy: 0.1407135831808656
Energy: 0.16794497668901498
Energy: 0.20787230028353787
Energy: 0.20802093953570544
Energy: 0.20787230028353787
Energy: 0.20802093953570544
Energy: 0.20787230028353787
Energy: 0.20802093953570544

minimum gb energy = 0.14031178976974898 eV
minimum distance =  2.79281356980001 Angstroms
sigma value = 11


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

Energy: 0.30253050076079624
Energy: 0.33111875922214257
Energy: 0.3025305007618588
Energy: 0.3311187592216113
Energy: 0.30253050076079624
Energy: 0.3311187592210801
Energy: 0.3475185848537112
Energy: 0.2721037222681176
Energy: 0.3475185848495095
Energy: 0.2721037222686488
Energy: 0.34751858485269693
Energy: 0.27210372226918006
Energy: 0.30027757892914303
Energy: 0.3969652548305971
Energy: 0.30027757893228224
Energy: 0.3969652548305971
Energy: 0.3002775789302055
Energy: 0.3969652548321908
Energy: 0.3251026065423552
Energy: 0.28674646612189075
Energy: 0.3251026065412927
Energy: 0.28674646612189075
Energy: 0.3251026065428864
Energy: 0.28674646612189075
Energy: 0.31840853227797156
Energy: 0.26917841691864197
Energy: 0.3184085322743011
Energy: 0.2691784169181107
Energy: 0.3184085322743011
Energy: 0.26917841691864197
Energy: 0.2963370571082207
Energy: 0.28073831109128944
Energy: 0.29633705710768943
Energy: 0.28073831109182074
Energy: 0.2963370571092832
Energy: 0.28073831109128944
Energy: 0.2765755248371127
Energy: 0.30876287469021163
Energy: 0.2765755248381752
Energy: 0.30876287469021163
Energy: 0.2765755248344564
Energy: 0.30876287469021163
Energy: 0.310921411133908
Energy: 0.26117380580988847
Energy: 0.3109214111328455
Energy: 0.26117380580988847
Energy: 0.31092141113337673
Energy: 0.26117380580988847
Energy: 0.3098183454612987
Energy: 0.2607824679130768
Energy: 0.3098183454369097
Energy: 0.2607824679130768
Energy: 0.30981834543637843
Energy: 0.2607824679130768
Energy: 0.2714605401820595
Energy: 0.36313263299194654
Energy: 0.27146054018259075
Energy: 0.36313263299194654
Energy: 0.27146054018152826
Energy: 0.36313263299300896
Energy: 0.31835037026314766
Energy: 0.3478377200576235
Energy: 0.3183503702673976
Energy: 0.3478377200576235
Energy: 0.3183503702626164
Energy: 0.3478377200581548
Energy: 0.3186644064450671
Energy: 0.271022271319391
Energy: 0.3186644064429421
Energy: 0.27102227131992224
Energy: 0.3186644064434733
Energy: 0.27102227131992224
Energy: 0.2855484310036235
Energy: 0.28916975515445814
Energy: 0.2855484310014985
Energy: 0.28916975515445814
Energy: 0.28554843099937355
Energy: 0.28916975515498944
Energy: 0.3123953865661327
Energy: 0.3831914056877905
Energy: 0.31239538656985144
Energy: 0.38319140568832166
Energy: 0.3123953865682577
Energy: 0.38319140568725923
Energy: 0.35781864522277707
Energy: 0.2722401438391651
Energy: 0.3578186452238396
Energy: 0.2722401438391651
Energy: 0.35781864522437085
Energy: 0.27224014383969636
Energy: 0.3024038410261389
Energy: 0.3265483643812861
Energy: 0.3024038410256076
Energy: 0.32654836438075485
Energy: 0.3024038410250764
Energy: 0.3265483643812861
Energy: 0.2771653577152147
Energy: 0.29404573412512547
Energy: 0.2771653577194647
Energy: 0.29404573412512547
Energy: 0.27716535771787093
Energy: 0.2940457341256567
Energy: 0.40254091776212914
Energy: 0.3309195065029588
Energy: 0.4025409177615979
Energy: 0.3309195065024276
Energy: 0.4025409177610667
Energy: 0.3309195065018964
Energy: 0.3233503322532328
Energy: 0.28633498876890123
Energy: 0.3233503322500453
Energy: 0.28633498876890123
Energy: 0.32335033225110776
Energy: 0.28633498876890123
Energy: 0.3186687598653569
Energy: 0.2846743406285464
Energy: 0.31866875986695065
Energy: 0.2846743406274839
Energy: 0.31866875986641946
Energy: 0.2846743406285464
Energy: 0.26987660391895263
Energy: 0.2804094094059276
Energy: 0.26987660391682766
Energy: 0.28040940940486514
Energy: 0.26987660392054635
Energy: 0.2804094094053964
Energy: 0.2975529552205688
Energy: 0.30816550463333736
Energy: 0.29755295522003755
Energy: 0.3081655046322749
Energy: 0.29755295521738134
Energy: 0.30816550463174364
Energy: 0.3031313367205424
Energy: 0.2839915589179511
Energy: 0.3031313367194799
Energy: 0.2839915589179511
Energy: 0.30313133671894865
Energy: 0.2839915589184823
Energy: 0.30954896510690444
Energy: 0.29410320891267777
Energy: 0.30954896510584196
Energy: 0.29410320891214653
Energy: 0.30954896510849816
Energy: 0.29410320891214653
Energy: 0.2696802651094254
Energy: 0.31310993289030037
Energy: 0.2696802651057067
Energy: 0.3131099328881754
Energy: 0.269680265106238
Energy: 0.31310993288764416
Energy: 0.4467495425384959
Energy: 0.34922694680642435
Energy: 0.4467495425374335
Energy: 0.34922694680642435
Energy: 0.4467495425347773
Energy: 0.34922694680642435

minimum gb energy = 0.2607824679130768 eV
minimum distance =  2.60139650338906 Angstroms
sigma value = 41


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

Energy: 0.3246665678983638
Energy: 0.28811914683285506
Energy: 0.32466656789920123
Energy: 0.2881191468324364
Energy: 0.32466656789920123
Energy: 0.2881191468324364
Energy: 0.33577888586066623
Energy: 0.3014868149109261
Energy: 0.335778885861085
Energy: 0.30148681491050744
Energy: 0.33577888586024757
Energy: 0.30148681491216317
Energy: 0.31949661667623747
Energy: 0.3671703415055501
Energy: 0.319496616674144
Energy: 0.3671703415055501
Energy: 0.3194966166758188
Energy: 0.3671703415059688
Energy: 0.3182974627020054
Energy: 0.2881826384433535
Energy: 0.31829746270368026
Energy: 0.2881826384429348
Energy: 0.3182974627032615
Energy: 0.2881826384433535
Energy: 0.2743312599592009
Energy: 0.2979927476928158
Energy: 0.2743312599587821
Energy: 0.2979927476928158
Energy: 0.274331259960457
Energy: 0.2979927476928158
Energy: 0.31749192561099954
Energy: 0.3071795333096775
Energy: 0.31749192561225564
Energy: 0.3071795333096775
Energy: 0.3174919256126744
Energy: 0.3071795333092588
Energy: 0.2946625454532895
Energy: 0.38858509707011324
Energy: 0.2946625454545457
Energy: 0.3885850970692758
Energy: 0.2946625454545457
Energy: 0.3885850970692758
Energy: 0.28355234980070093
Energy: 0.2881064456991017
Energy: 0.28355234979986355
Energy: 0.2881064456991017
Energy: 0.28355234980028227
Energy: 0.2881064456991017
Energy: 0.27775997030545907
Energy: 0.29315145501917944
Energy: 0.27775997030545907
Energy: 0.29315145501917944
Energy: 0.2777599703046216
Energy: 0.29315145501917944
Energy: 0.3176606716482113
Energy: 0.332495182528022
Energy: 0.3176606716482113
Energy: 0.332495182528022
Energy: 0.31766067164863004
Energy: 0.332495182528022
Energy: 0.3190984647480935
Energy: 0.33308829871035306
Energy: 0.3190984647464186
Energy: 0.33308829870909695
Energy: 0.3190984647480935
Energy: 0.3330882987095156
Energy: 0.2762350933455141
Energy: 0.29897188091130117
Energy: 0.2762350933459329
Energy: 0.29897188091171994
Energy: 0.2762350933455141
Energy: 0.2989718809121386
Energy: 0.2838898052683608
Energy: 0.2879274361503953
Energy: 0.28388980526794205
Energy: 0.2879274361503953
Energy: 0.28388980526794205
Energy: 0.28792743615081395
Energy: 0.2755751477150513
Energy: 0.3345367552563326
Energy: 0.2755751477163075
Energy: 0.3345367552563326
Energy: 0.27557514771421393
Energy: 0.3345367552563326
Energy: 0.3189189510897864
Energy: 0.3070265432876762
Energy: 0.3189189510897864
Energy: 0.3070265432876762
Energy: 0.3189189510885303
Energy: 0.3070265432889323
Energy: 0.27362472612279354
Energy: 0.3157887111720675
Energy: 0.27362472612321226
Energy: 0.31578871117123014
Energy: 0.27362472612237476
Energy: 0.3157887111720675
Energy: 0.2874202276121507
Energy: 0.28794000346401344
Energy: 0.2874202276121507
Energy: 0.28794000346401344
Energy: 0.2874202276129881
Energy: 0.28794000346401344
Energy: 0.3045898171259003
Energy: 0.36671472179148806
Energy: 0.3045898171246441
Energy: 0.3667147217906506
Energy: 0.3045898171259003
Energy: 0.36671472178981324
Energy: 0.32743597362256466
Energy: 0.30157357550784064
Energy: 0.327435973622146
Energy: 0.3015735755049287
Energy: 0.3274359736242395
Energy: 0.30157357550409125
Energy: 0.32331056985282813
Energy: 0.295986549315108
Energy: 0.32331056985450296
Energy: 0.2959865493167828
Energy: 0.32331056985408424
Energy: 0.2959865493167828
Energy: 0.27803183488253924
Energy: 0.3409101374923601
Energy: 0.2780318348817018
Energy: 0.34091013749277876
Energy: 0.27803183488379535
Energy: 0.3409101374923601
Energy: 0.3021805348388621
Energy: 0.3658459437699362
Energy: 0.30218053484095564
Energy: 0.3658459437703549
Energy: 0.3021805348384434
Energy: 0.3658459437699362
Energy: 0.3182708026423414
Energy: 0.29060928259065033
Energy: 0.318270802641504
Energy: 0.29060928259065033
Energy: 0.31827080264359753
Energy: 0.29060928259065033
Energy: 0.27355621708635935
Energy: 0.30489168403913075
Energy: 0.2735562170846845
Energy: 0.30489168403913075
Energy: 0.27355621708635935
Energy: 0.3048916840395495
Energy: 0.2737589781205573
Energy: 0.30888566601754613
Energy: 0.2737589781197199
Energy: 0.30888566601712736
Energy: 0.2737589781201386
Energy: 0.30888566601712736
Energy: 0.294791151611832
Energy: 0.33371095075682666
Energy: 0.2947911516130692
Energy: 0.33371095075724544
Energy: 0.294791151611832
Energy: 0.33371095075724544
Energy: 0.2849230619362945
Energy: 0.29056663561703716
Energy: 0.28492306193378236
Energy: 0.29056663561703716
Energy: 0.28492306193587585
Energy: 0.29056663561703716
Energy: 0.2793323954324983
Energy: 0.2997903402240138
Energy: 0.2793323954308235
Energy: 0.2997903402240138
Energy: 0.2793323954320796
Energy: 0.2997903402240138
Energy: 0.3189837716053334
Energy: 0.3025076184987878
Energy: 0.3189837716065896
Energy: 0.30250761849711294
Energy: 0.3189837716065896
Energy: 0.30250761849711294
Energy: 0.35817102174666604
Energy: 0.31710182600540776
Energy: 0.3581710217449911
Energy: 0.31710182600498904
Energy: 0.3581710217454098
Energy: 0.31710182600540776
Energy: 0.27695579275848825
Energy: 0.2933207892187167
Energy: 0.2769557927605818
Energy: 0.29332078921829796
Energy: 0.2769557927593257
Energy: 0.2933207892187167
Energy: 0.2848225158256655
Energy: 0.28879226156323107
Energy: 0.2848225158244093
Energy: 0.28879226156323107
Energy: 0.2848225158256655
Energy: 0.28879226156323107
Energy: 0.2737204701450693
Energy: 0.3043070626910461
Energy: 0.2737204701467441
Energy: 0.3043070626914648
Energy: 0.2737204701450693
Energy: 0.3043070626910461

minimum gb energy = 0.2735562170846845 eV
minimum distance =  2.61872825361052 Angstroms
sigma value = 33


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

Energy: 0.3225970170565181
Energy: 0.2954421654850617
Energy: 0.32259701705769356
Energy: 0.2954421654850617
Energy: 0.32259701705504884
Energy: 0.29544216548535557
Energy: 0.3757149331120325
Energy: 0.29574531018035877
Energy: 0.37571493311026943
Energy: 0.29574531018035877
Energy: 0.37571493311056325
Energy: 0.29574531018035877
Energy: 0.32031861591038807
Energy: 0.3647123303217449
Energy: 0.32031861591097577
Energy: 0.3647123303226264
Energy: 0.32031861590715566
Energy: 0.3647123303223326
Energy: 0.350484860733627
Energy: 0.29442283871828173
Energy: 0.350484860733627
Energy: 0.29442283871916336
Energy: 0.35048486072980684
Energy: 0.29442283871828173
Energy: 0.295825756906009
Energy: 0.3423984978943863
Energy: 0.29582575690365814
Energy: 0.342398497892917
Energy: 0.295825756901895
Energy: 0.3423984978952679
Energy: 0.347229259249591
Energy: 0.29995667729350817
Energy: 0.3472292592501788
Energy: 0.29995667729350817
Energy: 0.34722925926369613
Energy: 0.29995667729321435
Energy: 0.31595748253016337
Energy: 0.34820825721460147
Energy: 0.3159574825289879
Energy: 0.34820825721460147
Energy: 0.31595748252751865
Energy: 0.34820825721489534
Energy: 0.3254788348829704
Energy: 0.3398112642590787
Energy: 0.32547883488414586
Energy: 0.3398112642590787
Energy: 0.32547883488150114
Energy: 0.3398112642590787
Energy: 0.3532906548634698
Energy: 0.30308047725349885
Energy: 0.35329065486435135
Energy: 0.303080477253205
Energy: 0.3532906548614128
Energy: 0.30308047725349885
Energy: 0.3733638734459596
Energy: 0.30247100895581797
Energy: 0.37336387344213945
Energy: 0.30247100895581797
Energy: 0.3733638734377317
Energy: 0.3024710089561119
Energy: 0.3286692447778163
Energy: 0.33067212559225895
Energy: 0.32866924477869786
Energy: 0.33067212559225895
Energy: 0.32866924477869786
Energy: 0.33067212559225895
Energy: 0.32157478845593007
Energy: 0.29440114531445694
Energy: 0.32157478833873504
Energy: 0.29440114531445694
Energy: 0.3215747884512284
Energy: 0.29440114531504474
Energy: 0.30190072164492887
Energy: 0.3538591798543974
Energy: 0.3019007216463982
Energy: 0.35385917985380966
Energy: 0.3019007216443412
Energy: 0.35385917985380966
Energy: 0.33775857927719166
Energy: 0.3255601836503654
Energy: 0.3377585792757224
Energy: 0.3255601836506592
Energy: 0.3377585792733716
Energy: 0.3255601836506592
Energy: 0.3373815802040158
Energy: 0.3176360839990054
Energy: 0.3373815802022794
Energy: 0.3176360839990054
Energy: 0.33738158019875314
Energy: 0.31763608399871157
Energy: 0.29942571414210567
Energy: 0.3500608416533463
Energy: 0.2994257141406364
Energy: 0.35006084165657864
Energy: 0.2994257141400487
Energy: 0.3500608416612803
Energy: 0.3489388520915145
Energy: 0.29509525008599163
Energy: 0.34893885209327763
Energy: 0.29509525008628545
Energy: 0.3489388520879882
Energy: 0.29509525008599163
Energy: 0.29592860258707854
Energy: 0.34805360919415773
Energy: 0.29592860258707854
Energy: 0.3480536091938639
Energy: 0.29592860258472775
Energy: 0.3480536091938639
Energy: 0.3631189485803677
Energy: 0.3203568330809982
Energy: 0.36311894857742916
Energy: 0.3203568330809982
Energy: 0.36311894857331517
Energy: 0.3203568330807044
Energy: 0.4206217016646046
Energy: 0.3038268828257537
Energy: 0.4206217016640168
Energy: 0.303826882825166
Energy: 0.42062170166372304
Energy: 0.303826882825166
Energy: 0.2951516737908255
Energy: 0.3217098834107176
Energy: 0.2951516737902378
Energy: 0.3217098834101298
Energy: 0.29515167378965007
Energy: 0.3217098834101298
Energy: 0.2969390089593005
Energy: 0.37329741696463675
Energy: 0.2969390089607698
Energy: 0.37329741696463675
Energy: 0.29693900895724357
Energy: 0.3732974169643429
Energy: 0.3372974535916689
Energy: 0.3008206763091413
Energy: 0.33729745358931806
Energy: 0.3008206763082597
Energy: 0.33729745358873037
Energy: 0.3008206763088474
Energy: 0.2941206448680795
Energy: 0.3417263987111231
Energy: 0.2941206448671979
Energy: 0.3417263987111231
Energy: 0.2941206448642594
Energy: 0.341726398711417
Energy: 0.3545277867623426
Energy: 0.29512862168662746
Energy: 0.3545277867641057
Energy: 0.29512862168662746
Energy: 0.354527786759404
Energy: 0.2951286216863336
Energy: 0.3019884819616287
Energy: 0.3368026942320718
Energy: 0.3019884819619226
Energy: 0.33680269423119025
Energy: 0.3019884819601594
Energy: 0.33680269423089637
Energy: 0.3493424447065147
Energy: 0.3147030871041738
Energy: 0.34934244470710246
Energy: 0.31470308710446765
Energy: 0.34934244470827786
Energy: 0.3147030871041738
Energy: 0.3208449578759034
Energy: 0.29447455843989667
Energy: 0.3208449578797235
Energy: 0.2944745584401905
Energy: 0.3208449578761972
Energy: 0.29447455843989667
Energy: 0.3039721672502954
Energy: 0.3537537041406255
Energy: 0.3039721672500016
Energy: 0.3537537041406255
Energy: 0.3039721672488262
Energy: 0.35375370414091944
Energy: 0.3040611053295877
Energy: 0.362349225845356
Energy: 0.3040611053304692
Energy: 0.36234922585270235
Energy: 0.30406110532929387
Energy: 0.3623492258268431
Energy: 0.32281492760244396
Energy: 0.29806059094742104
Energy: 0.32281492760244396
Energy: 0.29806059094712717
Energy: 0.32281492760244396
Energy: 0.29806059094712717
Energy: 0.29418267311518786
Energy: 0.35847578140810493
Energy: 0.2941826731140124
Energy: 0.35847578140986813
Energy: 0.29418267311489404
Energy: 0.3584757814092803
Energy: 0.35273886126781295
Energy: 0.3003211498460021
Energy: 0.35273886126957615
Energy: 0.3003211498460021
Energy: 0.35273886126548887
Energy: 0.3003211498460021
Energy: 0.3267119481716516
Energy: 0.33675922863669877
Energy: 0.32671194817194543
Energy: 0.3367592286358172
Energy: 0.32671194817077004
Energy: 0.3367592286358172
Energy: 0.3267043364731283
Energy: 0.336942271986027
Energy: 0.32670433647489144
Energy: 0.336942271986027
Energy: 0.3267043364740099
Energy: 0.336942271986027
Energy: 0.3524561774450462
Energy: 0.3003599303467499
Energy: 0.35245617743887525
Energy: 0.3003599303467499
Energy: 0.35245617743887525
Energy: 0.3003599303467499
Energy: 0.2941830674334667
Energy: 0.35865218513866254
Energy: 0.29418306743317285
Energy: 0.3586521851430704
Energy: 0.29418306743229133
Energy: 0.3586521851380749
Energy: 0.32269949794069913
Energy: 0.298336291142419
Energy: 0.3226994979430499
Energy: 0.298336291142419
Energy: 0.32269949794011143
Energy: 0.2983362911421252
Energy: 0.3040117882464899
Energy: 0.36229387608889857
Energy: 0.3040117882473714
Energy: 0.3622938760909555
Energy: 0.3040117882464899
Energy: 0.36229387609007396
Energy: 0.3038764355728589
Energy: 0.3539845266670969
Energy: 0.30387643557315275
Energy: 0.35398452666386454
Energy: 0.3038764355740344
Energy: 0.353984526666803
Energy: 0.32087836045868645
Energy: 0.29459991811570446
Energy: 0.32087836045662943
Energy: 0.2945999181159983
Energy: 0.3208783604551602
Energy: 0.2945999181154106
Energy: 0.3495047978686999
Energy: 0.31465942222560517
Energy: 0.3495047978684061
Energy: 0.31465942222560517
Energy: 0.3495047978675246
Energy: 0.31465942222560517
Energy: 0.3019396347441324
Energy: 0.3368176005250188
Energy: 0.30193963474501395
Energy: 0.33681760053354065
Energy: 0.3019396347441324
Energy: 0.3368176005288389
Energy: 0.3542803419586456
Energy: 0.2951124572184491
Energy: 0.3542803419598211
Energy: 0.2951124572184491
Energy: 0.35428034195600094
Energy: 0.29511245721874296
Energy: 0.2941135336386852
Energy: 0.34175645346090006
Energy: 0.29411353364015447
Energy: 0.3417564534623693
Energy: 0.2941135336366282
Energy: 0.3417564534606062
Energy: 0.33731000266690203
Energy: 0.30082514634954627
Energy: 0.33731000266516564
Energy: 0.3008251463498401
Energy: 0.3373100026639902
Energy: 0.30082514634954627
Energy: 0.2971587943006686
Energy: 0.37307776332442244
Energy: 0.2971587943015502
Energy: 0.37307776332442244
Energy: 0.2971587942989055
Energy: 0.37307776332412856

minimum gb energy = 0.2941135336366282 eV
minimum distance =  2.58039482748688 Angstroms
sigma value = 67


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

Energy: 0.3146928827307287
Energy: 0.304396583386476
Energy: 0.3146928827305278
Energy: 0.3043965833862975
Energy: 0.3146928827307287
Energy: 0.3043965833862975
Energy: 0.306995486017381
Energy: 0.295760326662638
Energy: 0.3069954860177604
Energy: 0.295760326662638
Energy: 0.3069954860171802
Energy: 0.2957603266624595
Energy: 0.42012376633108056
Energy: 0.3784526181736951
Energy: 0.42012376633125903
Energy: 0.37845261817389597
Energy: 0.42012376633108056
Energy: 0.3784526181736951
Energy: 0.30695268656524977
Energy: 0.29577732667591977
Energy: 0.3069526865656515
Energy: 0.29577732667591977
Energy: 0.3069526865654506
Energy: 0.29577732667612067
Energy: 0.3146928827299253
Energy: 0.304396583387458
Energy: 0.31469288273032703
Energy: 0.304396583387458
Energy: 0.31469288273032703
Energy: 0.3043965833872795
Energy: 0.30699548601639903
Energy: 0.29576032666324065
Energy: 0.30699548601677845
Energy: 0.29576032666303975
Energy: 0.3069954860169793
Energy: 0.29576032666303975
Energy: 0.4201237663308797
Energy: 0.3784526181736951
Energy: 0.42012376633108056
Energy: 0.37845261817389597
Energy: 0.4201237663308797
Energy: 0.37845261817389597

minimum gb energy = 0.2957603266624595 eV
minimum distance =  2.68333374367745 Angstroms
sigma value = 3


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

Energy: 0.4333844963441871
Energy: 0.36625186769643503
Energy: 0.4333844963401539
Energy: 0.36625186769643503
Energy: 0.433384496342049
Energy: 0.36625186769614354
Energy: 0.3722642144406585
Energy: 0.35692209324570984
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Energy: 0.3569220932454668
Energy: 0.37226421443662533
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Energy: 0.3660597147929627
Energy: 0.38732914787695194
Energy: 0.36605971479670435
Energy: 0.38732914787772943
Energy: 0.3660597147921366
Energy: 0.38732914787719497
Energy: 0.37330592903973947
Energy: 0.3515227009750651
Energy: 0.3733059290437726
Energy: 0.35152270097423904
Energy: 0.37330592903813586
Energy: 0.35152270097399607
Energy: 0.38652029115491815
Energy: 0.39003405409221537
Energy: 0.3865202911524885
Energy: 0.39003405409192377
Energy: 0.3865202911551611
Energy: 0.39003405409192377
Energy: 0.36558595494461316
Energy: 0.3739294738807297
Energy: 0.3655859549432526
Energy: 0.37392947387990355
Energy: 0.36558595494461316
Energy: 0.37392947388043807
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Energy: 0.39235065261736407
Energy: 0.37313422900869603
Energy: 0.3923506526168295
Energy: 0.3731342290073841
Energy: 0.39235065261629504
Energy: 0.35758359196212963
Energy: 0.35071569355739085
Energy: 0.357583591960769
Energy: 0.3507156935563218
Energy: 0.3575835919575619
Energy: 0.35071569355661336
Energy: 0.37535659160746443
Energy: 0.3830178749568001
Energy: 0.3753565916130525
Energy: 0.3830178749568001
Energy: 0.3753565916098454
Energy: 0.3830178749570916
Energy: 0.3683903651531683
Energy: 0.37441958625254945
Energy: 0.3683903651512732
Energy: 0.3744195862522579
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Energy: 0.37426557192747284
Energy: 0.3952081187248846
Energy: 0.37426557193413
Energy: 0.3952081187248846
Energy: 0.3742655719284933
Energy: 0.39520811872435013
Energy: 0.367188392698824
Energy: 0.3617647058823656
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Energy: 0.3617647058823656
Energy: 0.367188392700962
Energy: 0.3617647058826085
Energy: 0.3651801352612583
Energy: 0.3561637149638485
Energy: 0.3651801352609668
Energy: 0.3561637149640915
Energy: 0.3651801352609668
Energy: 0.3561637149643831
Energy: 0.37220548399097325
Energy: 0.37846511556057927
Energy: 0.37220548399043873
Energy: 0.3784651155634949
Energy: 0.3722054839880091
Energy: 0.3784651155600448
Energy: 0.3871627882283372
Energy: 0.37592810291082895
Energy: 0.38716278823183586
Energy: 0.375928102910586
Energy: 0.38716278822755973
Energy: 0.3759281029102945
Energy: 0.39447107829838385
Energy: 0.35566586733612626
Energy: 0.3944710782973148
Energy: 0.35566586733505723
Energy: 0.39447107829517675
Energy: 0.3556658673355918
Energy: 0.3845978616326152
Energy: 0.37909547717285497
Energy: 0.3845978616310117
Energy: 0.37909547717285497
Energy: 0.38459786162916515
Energy: 0.37909547717261205
Energy: 0.35575316617104985
Energy: 0.3752812656576056
Energy: 0.355753166174014
Energy: 0.37528126567840303
Energy: 0.35575316617134145
Energy: 0.37528126569604203
Energy: 0.38051426151955253
Energy: 0.3880252944232993
Energy: 0.3805142615219336
Energy: 0.38802529442359085
Energy: 0.38051426151741446
Energy: 0.3880252944230563
Energy: 0.3673080363529928
Energy: 0.3762234617611066
Energy: 0.3673080363490082
Energy: 0.3762234617611066
Energy: 0.3673080363508547
Energy: 0.37622346176086363
Energy: 0.3841760964039753
Energy: 0.42124396246798695
Energy: 0.3841760964048014
Energy: 0.42124396246823
Energy: 0.3841760964015943
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Energy: 0.345915168649676
Energy: 0.4035297168155412
Energy: 0.34591516865045346
Energy: 0.40352971681661015
Energy: 0.34591516865205696
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Energy: 0.358641501968857
Energy: 0.34803057093232176
Energy: 0.35864150197148104
Energy: 0.34803057093232176
Energy: 0.35864150197255
Energy: 0.3480305709320788
Energy: 0.3512259187169588
Energy: 0.3724142896879606
Energy: 0.35122591872551095
Energy: 0.3724142896884951
Energy: 0.35122591871856224
Energy: 0.37241428968878665
Energy: 0.37798434288475496
Energy: 0.42136092096554545
Energy: 0.3779843428876704
Energy: 0.4213609209653025
Energy: 0.37798434288606697
Energy: 0.42136092096554545
Energy: 0.3627214632370169
Energy: 0.38696416579224435
Energy: 0.3627214632386204
Energy: 0.3869641657924873
Energy: 0.36272146323808585
Energy: 0.38696416579224435
Energy: 0.3771314055642071
Energy: 0.36868190692062097
Energy: 0.3771314055684832
Energy: 0.36868190692086394
Energy: 0.37713140556605357
Energy: 0.3686819069203295
Energy: 0.35380042273737533
Energy: 0.3418727927220766
Energy: 0.3538004227379098
Energy: 0.3418727927223196
Energy: 0.3538004227376669
Energy: 0.3418727927226111
Energy: 0.37224941540604556
Energy: 0.37891766410899136
Energy: 0.37224941540390755
Energy: 0.37891766410899136
Energy: 0.3722494154047336
Energy: 0.3789176641092343
Energy: 0.3876085468752885
Energy: 0.3663834750533011
Energy: 0.38760854687047785
Energy: 0.3663834750533011
Energy: 0.3876085468726159
Energy: 0.36638347505383567
Energy: 0.39509902184885054
Energy: 0.3533222598737475
Energy: 0.395099021845109
Energy: 0.35332225987564253
Energy: 0.3950990218437969
Energy: 0.35332225987403904
Energy: 0.364720786055263
Energy: 0.3518604722345138
Energy: 0.36472078605336794
Energy: 0.3518604722345138
Energy: 0.36472078605259045
Energy: 0.35186047223475675
Energy: 0.35433757001738836
Energy: 0.37641937039705275
Energy: 0.3543375700170968
Energy: 0.3764193703968098
Energy: 0.3543375700189919
Energy: 0.3764193703968098
Energy: 0.38899376834362764
Energy: 0.37762087035467196
Energy: 0.38899376834547406
Energy: 0.37762087035467196
Energy: 0.3889937683414896
Energy: 0.37762087035467196
Energy: 0.3772387055968761
Energy: 0.3732960554940923
Energy: 0.37723870559823675
Energy: 0.3732960554938493
Energy: 0.3772387055960987
Energy: 0.3732960554940923
Energy: 0.3734785314779476
Energy: 0.3818528349954836
Energy: 0.373478531479551
Energy: 0.3818528349960181
Energy: 0.3734785314766355
Energy: 0.381852834996261
Energy: 0.34363523136671303
Energy: 0.3868982168638825
Energy: 0.3436352313674905
Energy: 0.3868982168638825
Energy: 0.3436352313640405
Energy: 0.386898216864417
Energy: 0.38737849970456223
Energy: 0.35510239342129585
Energy: 0.3873784997189942
Energy: 0.35510239342129585
Energy: 0.3873784997061658
Energy: 0.35510239342207334
Energy: 0.3510131757932675
Energy: 0.39502876925231567
Energy: 0.35101317579273306
Energy: 0.3950287692517811
Energy: 0.35101317579244146
Energy: 0.395028769248574
Energy: 0.39074208758708984
Energy: 0.38190564482694267
Energy: 0.3907420875841742
Energy: 0.3819056448266997
Energy: 0.3907420875876243
Energy: 0.3819056448261652
Energy: 0.35975906871107
Energy: 0.38998584497502853
Energy: 0.3597590687102925
Energy: 0.3899858449752715
Energy: 0.35975906870815444
Energy: 0.38998584497556305
Energy: 0.4205885789142799
Energy: 0.3459160809779551
Energy: 0.42058857891374546
Energy: 0.3459160809784896
Energy: 0.420588578916661
Energy: 0.34591608097717763
Energy: 0.35024052285709234
Energy: 0.3761256429996994
Energy: 0.3502405228584043
Energy: 0.37612564299833884
Energy: 0.35024052285733526
Energy: 0.3761256430004769
Energy: 0.3871249070203781
Energy: 0.35178037375955407
Energy: 0.38712490701906616
Energy: 0.35178037375926247
Energy: 0.38712490701906616
Energy: 0.3517803737600886
Energy: 0.3840111616944747
Energy: 0.3812690474978115
Energy: 0.38401116168728316
Energy: 0.3812690474978115
Energy: 0.3840111616891296
Energy: 0.3812690474975686
Energy: 0.4073905356672375
Energy: 0.35308452808454593
Energy: 0.40739053566456485
Energy: 0.35308452808454593
Energy: 0.40739053566670297
Energy: 0.3530845280848374
Energy: 0.36366974268268876
Energy: 0.37740652161368826
Energy: 0.3636697426842923
Energy: 0.3774065216145143
Energy: 0.3636697426842923
Energy: 0.3774065216147573
Energy: 0.3691996571132886
Energy: 0.3507311821542341
Energy: 0.36919965711649566
Energy: 0.3507311821542341
Energy: 0.3691996571156696
Energy: 0.3507311821544771
Energy: 0.35965936775860025
Energy: 0.3784376259999703
Energy: 0.3596593677575312
Energy: 0.3784376259999703
Energy: 0.35965936775592766
Energy: 0.3784376259997273
Energy: 0.38405684862069356
Energy: 0.37215461020786766
Energy: 0.3840568486151055
Energy: 0.37215461020786766
Energy: 0.3840568486135019
Energy: 0.3721546102076247
Energy: 0.35964296897726766
Energy: 0.38623235495449815
Energy: 0.35964296898154374
Energy: 0.38623235495396363
Energy: 0.35964296897537246
Energy: 0.38623235495396363

minimum gb energy = 0.3418727927220766 eV
minimum distance =  2.557293848688 Angstroms
sigma value = 81


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

Energy: 0.4319350939645452
Energy: 0.38680366155639584
Energy: 0.3914715424485978
Energy: 0.3868036615549286
Energy: 0.43193509396527885
Energy: 0.38680366155236096
Energy: 0.3931720658637032
Energy: 0.368322351109159
Energy: 0.3931720658651705
Energy: 0.3684699238199407
Energy: 0.39317206586883857
Energy: 0.36832235111135986
Energy: 0.3982776823320162
Energy: 0.3328485997066043
Energy: 0.387596659724207
Energy: 0.33284859970953873
Energy: 0.3982776823338503
Energy: 0.33284859970550384
Energy: 0.35430157049757893
Energy: 0.36822881313703226
Energy: 0.35430157049867933
Energy: 0.3682288131344646
Energy: 0.3543015704997798
Energy: 0.36822881313409783
Energy: 0.36752320441178166
Energy: 0.35720452149671056
Energy: 0.3675232044154497
Energy: 0.3572045214963438
Energy: 0.36752320441471603
Energy: 0.35720452149817783
Energy: 0.37120297989618656
Energy: 0.37546313888455457
Energy: 0.37120297989141804
Energy: 0.36271798563853824
Energy: 0.3712029798950861
Energy: 0.37546313888455457
Energy: 0.3490802275484465
Energy: 0.3809495048198561
Energy: 0.34807655679611277
Energy: 0.3556580277189022
Energy: 0.34908022753964313
Energy: 0.38094950482132334
Energy: 0.36665887431543515
Energy: 0.40185063819355527
Energy: 0.3665642401408636
Energy: 0.4018506381968565
Energy: 0.3666588743150684
Energy: 0.40185063819905736
Energy: 0.3837425139340691
Energy: 0.3810286556142034
Energy: 0.38374251392930064
Energy: 0.38102865561053534
Energy: 0.3837425139263662
Energy: 0.3810286556171379
Energy: 0.38726216111682715
Energy: 0.3868617682751873
Energy: 0.38726216112269607
Energy: 0.38686176828105623
Energy: 0.38726216111719397
Energy: 0.38686176827592095
Energy: 0.3947815531897335
Energy: 0.38229157714980666
Energy: 0.39478155319230124
Energy: 0.3822915771520075
Energy: 0.39478155319560243
Energy: 0.38229157715017353
Energy: 0.37912983191175076
Energy: 0.38111534672805064
Energy: 0.3792823985513777
Energy: 0.38150886881368135
Energy: 0.3791298319143184
Energy: 0.38111534672915104
Energy: 0.3928767917119616
Energy: 0.3666094716387829
Energy: 0.3928767917090271
Energy: 0.366670392479276
Energy: 0.3928767917104944
Energy: 0.36660947164208413
Energy: 0.365277713689563
Energy: 0.33241714876038675
Energy: 0.3652777136880958
Energy: 0.3324171487622208
Energy: 0.3652777136884626
Energy: 0.33241714876548867
Energy: 0.3348378290367793
Energy: 0.35807123088937737
Energy: 0.3348378290382465
Energy: 0.3580712308912114
Energy: 0.33483782904301496
Energy: 0.35807123089377907
Energy: 0.366687484518717
Energy: 0.3353745939625341
Energy: 0.3666874845201842
Energy: 0.33537459396583535
Energy: 0.3666874845227519
Energy: 0.3353745939599998
Energy: 0.38413473791939157
Energy: 0.3827641630787005
Energy: 0.3841347379179243
Energy: 0.403795472781707
Energy: 0.3841347379182911
Energy: 0.38276416308420264
Energy: 0.3872294275334726
Energy: 0.4220776730432943
Energy: 0.3783997130200733
Energy: 0.42207767304402793
Energy: 0.38722942752870415
Energy: 0.4220776730454951
Energy: 0.3326543599255104
Energy: 0.37686695498637973
Energy: 0.33265435992881165
Energy: 0.38372402009983914
Energy: 0.3326543599266108
Energy: 0.37686695498307843
Energy: 0.3718890655233013
Energy: 0.3825550663193177
Energy: 0.3718890655229345
Energy: 0.38255506631748365
Energy: 0.3718890655203669
Energy: 0.3825550663182173
Energy: 0.3585491616006849
Energy: 0.36665625570589094
Energy: 0.3585491615944493
Energy: 0.3666562557062578
Energy: 0.3585491615988509
Energy: 0.3666562557110263
Energy: 0.39207227470838624
Energy: 0.38421132318460605
Energy: 0.36365050322476195
Energy: 0.3842113231875404
Energy: 0.3920722747102203
Energy: 0.3842113231893745
Energy: 0.39297317409312726
Energy: 0.32934794353424396
Energy: 0.35436962968157326
Energy: 0.32934794353974606
Energy: 0.3929731741004634
Energy: 0.3293479435364448
Energy: 0.3966871191997579
Energy: 0.4259329208654039
Energy: 0.39668711919498945
Energy: 0.42580411680437225
Energy: 0.3966871191913214
Energy: 0.42593292086026857
Energy: 0.36552791632076775
Energy: 0.3842743264141931
Energy: 0.36552791632663667
Energy: 0.384274326416394
Energy: 0.3655279163255362
Energy: 0.38427432641456
Energy: 0.33257561336682506
Energy: 0.4192185022631219
Energy: 0.3325756133682923
Energy: 0.4192185022631219
Energy: 0.3325756133712267
Energy: 0.41921850226092106
Energy: 0.3972015641575326
Energy: 0.3573095234980641
Energy: 0.3972015641608339
Energy: 0.3573095235002649
Energy: 0.39720156416266783
Energy: 0.35730952349843087
Energy: 0.3821051604149217
Energy: 0.4042371187126763
Energy: 0.3824162603785055
Energy: 0.38309289636514293
Energy: 0.3821051604112537
Energy: 0.404237118711209
Energy: 0.36822434525708486
Energy: 0.3929622418630952
Energy: 0.36819503696408107
Energy: 0.39296224186676326
Energy: 0.36822434525268316
Energy: 0.39296224186566286
Energy: 0.33472323266245685
Energy: 0.3567605782778837
Energy: 0.33472323265915566
Energy: 0.3567374589614315
Energy: 0.33472323266135645
Energy: 0.3567605782808182
Energy: 0.3800193140623753
Energy: 0.33870993988210624
Energy: 0.3800193140645762
Energy: 0.33870993988100584
Energy: 0.38001931406604345
Energy: 0.33870993987953857
Energy: 0.3708339273973468
Energy: 0.36725104173472983
Energy: 0.3708339274017485
Energy: 0.36725104173619705
Energy: 0.3708339273955128
Energy: 0.36725104173472983
Energy: 0.3947574310215989
Energy: 0.38696467955496366
Energy: 0.3946072781930113
Energy: 0.3872553730358354
Energy: 0.39475743101903127
Energy: 0.38696467955166236
Energy: 0.3775769851792136
Energy: 0.3476071596921338
Energy: 0.37757792547976643
Energy: 0.34767221719000524
Energy: 0.37757698518214805
Energy: 0.3476071596961686
Energy: 0.3988142247964851
Energy: 0.4309697717807043
Energy: 0.38510153879509823
Energy: 0.430969771785106
Energy: 0.3988142247961182
Energy: 0.43096977178987445
Energy: 0.3844121602956865
Energy: 0.396379262450067
Energy: 0.3844121603037562
Energy: 0.39637926245043387
Energy: 0.3844121602982541
Energy: 0.3963792624533683
Energy: 0.3682058158160854
Energy: 0.3696832673746876
Energy: 0.3682058158193867
Energy: 0.3696832673754211
Energy: 0.36820581581828626
Energy: 0.36968326736995244
Energy: 0.38210274165059027
Energy: 0.35909167522149216
Energy: 0.3821027416553588
Energy: 0.37650877853317477
Energy: 0.3821027416527911
Energy: 0.359091675223693

minimum gb energy = 0.32934794353424396 eV
minimum distance =  2.58830257000349 Angstroms
sigma value = 43


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

Energy: 0.42330376205870385
Energy: 0.3658218525301803
Energy: 0.42330376205960496
Energy: 0.3658218525301803
Energy: 0.4233037620591544
Energy: 0.3658218525301803
Energy: 0.3576623463989391
Energy: 0.3365422461384443
Energy: 0.3576623463989391
Energy: 0.3365422461388949
Energy: 0.357662346398038
Energy: 0.3365422461388949
Energy: 0.3713283305650684
Energy: 0.3975083637042239
Energy: 0.37132833056642006
Energy: 0.3975083637042239
Energy: 0.3713283305668707
Energy: 0.3975083637042239
Energy: 0.33466658705994673
Energy: 0.3434568030033891
Energy: 0.33466658706084784
Energy: 0.34345680300383963
Energy: 0.3346665870603973
Energy: 0.34345680300383963
Energy: 0.3841638316886458
Energy: 0.35497344348838944
Energy: 0.38416383168819523
Energy: 0.35497344348838944
Energy: 0.38416383168909635
Energy: 0.35497344348838944
Energy: 0.34374528560652146
Energy: 0.3660922025412149
Energy: 0.34374528560607087
Energy: 0.3660922025412149
Energy: 0.343745285606972
Energy: 0.3660922025412149
Energy: 0.3544589051989669
Energy: 0.3908931791560582
Energy: 0.3544589051989669
Energy: 0.39089317915650873
Energy: 0.3544589051989669
Energy: 0.39089317915650873
Energy: 0.34813177773889675
Energy: 0.36084506984404213
Energy: 0.3481317777384461
Energy: 0.36084506984449266
Energy: 0.3481317777384461
Energy: 0.36084506984404213
Energy: 0.36032727401167075
Energy: 0.3292410726434688
Energy: 0.36032727401302256
Energy: 0.3292410726430182
Energy: 0.3603272740080869
Energy: 0.3292410726430182
Energy: 0.346692286837771
Energy: 0.36475066162343944
Energy: 0.3466922868395732
Energy: 0.36475066162388997
Energy: 0.3466922868386721
Energy: 0.36475066162388997
Energy: 0.3532533597039728
Energy: 0.34096907719033986
Energy: 0.3532533597035223
Energy: 0.34096907718943875
Energy: 0.3532533597035223
Energy: 0.34096907718988934
Energy: 0.3482075804099725
Energy: 0.3855790204507773
Energy: 0.3482075804086209
Energy: 0.38557902045032677
Energy: 0.3482075804086209
Energy: 0.38557902045032677
Energy: 0.3857248799615264
Energy: 0.3660884079302958
Energy: 0.3857248799610758
Energy: 0.36608840792984515
Energy: 0.3857248799624275
Energy: 0.36608840792984515
Energy: 0.333616685913275
Energy: 0.3650737253047193
Energy: 0.3336166859128245
Energy: 0.3650737253047193
Energy: 0.333616685913275
Energy: 0.3650737253047193
Energy: 0.3532209174724356
Energy: 0.35490939008500827
Energy: 0.3532209174719851
Energy: 0.3549093900859094
Energy: 0.3532209174715345
Energy: 0.3549093900859094
Energy: 0.3481083795666064
Energy: 0.3874030113257796
Energy: 0.34810837956525476
Energy: 0.3874030113257796
Energy: 0.3481083795670569
Energy: 0.3874030113257796
Energy: 0.36522327170295804
Energy: 0.33678676413155473
Energy: 0.3652232717038592
Energy: 0.3367867641320053
Energy: 0.36522327170250757
Energy: 0.33678676413110414
Energy: 0.37960151952568666
Energy: 0.35306767050728205
Energy: 0.37960151952658766
Energy: 0.35306767050728205
Energy: 0.37960151952658766
Energy: 0.35306767050773263
Energy: 0.37950467173415864
Energy: 0.3413551993640388
Energy: 0.3795046717337081
Energy: 0.3413551993644894
Energy: 0.37950467173415864
Energy: 0.3413551993649399
Energy: 0.36523505462039674
Energy: 0.3778911241730017
Energy: 0.36523505462039674
Energy: 0.3778911241730017
Energy: 0.36523505462039674
Energy: 0.3778911241730017
Energy: 0.3486725793560092
Energy: 0.36095978561279624
Energy: 0.34867257935645973
Energy: 0.3609597856132468
Energy: 0.3486725793555587
Energy: 0.36095978561279624
Energy: 0.3808978508920152
Energy: 0.3738608302087083
Energy: 0.3808978508915647
Energy: 0.3738608302087083
Energy: 0.3808978508915647
Energy: 0.3738608302087083
Energy: 0.3313225657590013
Energy: 0.3658206884036862
Energy: 0.3313225657590013
Energy: 0.3658206884036862
Energy: 0.33132256576125413
Energy: 0.3658206884036862
Energy: 0.3759760926322847
Energy: 0.4072337919007206
Energy: 0.37597609263183424
Energy: 0.4072337919007206
Energy: 0.3759760926322847
Energy: 0.4072337919007206
Energy: 0.3484748921987809
Energy: 0.34636045180978176
Energy: 0.34847489219744965
Energy: 0.34636045180978176
Energy: 0.3484748921978798
Energy: 0.34636045180978176
Energy: 0.3810399026064551
Energy: 0.36991500057649496
Energy: 0.3810399026069057
Energy: 0.36991500057649496
Energy: 0.3810399026069057
Energy: 0.36991500057604443
Energy: 0.34477865003994496
Energy: 0.3361586217444566
Energy: 0.34477865003994496
Energy: 0.3361586217444566
Energy: 0.3447786500394944
Energy: 0.33615862174400607
Energy: 0.36008823225117975
Energy: 0.32931274824153267
Energy: 0.36008823225027864
Energy: 0.32931274824198326
Energy: 0.3600882322516303
Energy: 0.32931274824153267
Energy: 0.34845627435237214
Energy: 0.36084771303153657
Energy: 0.34845627435192156
Energy: 0.36084771303153657
Energy: 0.34845627435282267
Energy: 0.3608477130319871
Energy: 0.3679248768629551
Energy: 0.368414113190824
Energy: 0.3679248768629551
Energy: 0.3684141131903734
Energy: 0.3679248768625045
Energy: 0.368414113190824
Energy: 0.34429999589084775
Energy: 0.3663329461345065
Energy: 0.3442999958926499
Energy: 0.3663329461345065
Energy: 0.34429999589039717
Energy: 0.3663329461345065

minimum gb energy = 0.3292410726430182 eV
minimum distance =  2.62834787519492 Angstroms
sigma value = 57


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

Energy: 0.40097349824581013
Energy: 0.3293658393250946
Energy: 0.40097349824522666
Energy: 0.3293658393250946
Energy: 0.4009734982469768
Energy: 0.3293658393250946
Energy: 0.3480920679525457
Energy: 0.3081202819011866
Energy: 0.34809206795662934
Energy: 0.30812028190060325
Energy: 0.348092067953129
Energy: 0.30812028190060325
Energy: 0.3666260246071493
Energy: 0.39266077484024536
Energy: 0.3666260246088995
Energy: 0.39266077484024536
Energy: 0.3666260246083161
Energy: 0.39266077483966194
Energy: 0.3413791870412233
Energy: 0.3469405794997483
Energy: 0.34137918704472353
Energy: 0.3469405794997483
Energy: 0.3413791870418067
Energy: 0.34694057950033175
Energy: 0.3602308035684031
Energy: 0.34642027325717306
Energy: 0.3602308035678197
Energy: 0.34642027325717306
Energy: 0.3602308035678197
Energy: 0.34642027325717306
Energy: 0.36819469834173707
Energy: 0.34802205071992337
Energy: 0.36819469834232044
Energy: 0.34802205071992337
Energy: 0.36819469834115365
Energy: 0.34802205072050674
Energy: 0.3636248783713849
Energy: 0.37503565509226555
Energy: 0.3636248783696348
Energy: 0.37503565509226555
Energy: 0.3636248783713849
Energy: 0.375035655092849
Energy: 0.3423272517771631
Energy: 0.344256468497656
Energy: 0.3423272517771631
Energy: 0.344256468497656
Energy: 0.34232725177541296
Energy: 0.3442564684970727
Energy: 0.3617040141946352
Energy: 0.3091860974067222
Energy: 0.3617040141934685
Energy: 0.3091860974067222
Energy: 0.36170401419521864
Energy: 0.3091860974067222
Energy: 0.31538095374397174
Energy: 0.3486382158806589
Energy: 0.31538095374630515
Energy: 0.3486382158800755
Energy: 0.3153809537451384
Energy: 0.3486382158806589
Energy: 0.3634353779614566
Energy: 0.3465780861416073
Energy: 0.3634353779614566
Energy: 0.3465780861416073
Energy: 0.3634353779608733
Energy: 0.3465780861416073
Energy: 0.3599147985222337
Energy: 0.38673785653206977
Energy: 0.35991479852165026
Energy: 0.38673785653206977
Energy: 0.35991479852165026
Energy: 0.38673785653206977
Energy: 0.35461764594378753
Energy: 0.30904127136598697
Energy: 0.35461764594378753
Energy: 0.3090412713665703
Energy: 0.35461764594437084
Energy: 0.3090412713665703
Energy: 0.3873557783456755
Energy: 0.31179608200008463
Energy: 0.3873557783456755
Energy: 0.31179608200008463
Energy: 0.38735577834625884
Energy: 0.31179608200008463
Energy: 0.3593040740399241
Energy: 0.3117365098157781
Energy: 0.3593040740405074
Energy: 0.3117365098157781
Energy: 0.3593040740387573
Energy: 0.31173650981519474
Energy: 0.3700991617530296
Energy: 0.37144439747252483
Energy: 0.3700991617524462
Energy: 0.37144439747252483
Energy: 0.3700991617524462
Energy: 0.37144439747252483
Energy: 0.3127802645130724
Energy: 0.35121645702641896
Energy: 0.3127802645136558
Energy: 0.35121645702641896
Energy: 0.3127802645130724
Energy: 0.35121645702641896
Energy: 0.3626102451003859
Energy: 0.35486496413596835
Energy: 0.3626102450986358
Energy: 0.35486496413596835
Energy: 0.36261024510096923
Energy: 0.35486496413596835
Energy: 0.31280748357399396
Energy: 0.3478322568180406
Energy: 0.31280748357107707
Energy: 0.3478322568180406
Energy: 0.31280748357399396
Energy: 0.34783225681745716
Energy: 0.37008476841822324
Energy: 0.37141127344007985
Energy: 0.37008476841763993
Energy: 0.37141127344007985
Energy: 0.37008476841763993
Energy: 0.37141127344007985
Energy: 0.359198592940775
Energy: 0.31166112683077973
Energy: 0.35919859294427525
Energy: 0.31166112683019637
Energy: 0.35919859294135836
Energy: 0.31166112683077973
Energy: 0.3873607396177433
Energy: 0.3359449060262451
Energy: 0.3873607396165766
Energy: 0.3359449060262451
Energy: 0.3873607396165766
Energy: 0.33594490602682847
Energy: 0.35466813140184544
Energy: 0.3090891397784416
Energy: 0.35466813140067877
Energy: 0.3090891397784416
Energy: 0.35466813140126213
Energy: 0.3090891397784416
Energy: 0.35991595785417696
Energy: 0.3867671873180432
Energy: 0.3599159578524268
Energy: 0.3867671873180432
Energy: 0.35991595785417696
Energy: 0.3867671873180432

minimum gb energy = 0.30812028190060325 eV
minimum distance =  2.59695293280399 Angstroms
sigma value = 17


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

Energy: 0.42196533247902857
Energy: 0.31981362668938385
Energy: 0.42196533247985357
Energy: 0.3198136266885588
Energy: 0.42196533247902857
Energy: 0.31981362668938385
Energy: 0.3468254845301687
Energy: 0.29846822858711475
Energy: 0.3468254845285187
Energy: 0.29846822858793975
Energy: 0.3468254845293437
Energy: 0.29846822858711475
Energy: 0.3428310565675786
Energy: 0.36015151635705234
Energy: 0.3428310565675786
Energy: 0.36015151635622733
Energy: 0.3428310565675786
Energy: 0.36015151635705234
Energy: 0.2847308832490887
Energy: 0.3386867591826103
Energy: 0.2847308832499137
Energy: 0.3386867591809603
Energy: 0.2847308832490887
Energy: 0.3386867591817853
Energy: 0.3153226098633424
Energy: 0.32652539853683893
Energy: 0.31532260986169236
Energy: 0.32652539853683893
Energy: 0.3153226098608674
Energy: 0.32652539853683893
Energy: 0.3155126190480827
Energy: 0.2983148775216577
Energy: 0.31551261904971395
Energy: 0.2983148775224827
Energy: 0.31551261904888894
Energy: 0.2983148775224827
Energy: 0.28457341320564583
Energy: 0.30986543009424344
Energy: 0.28457341320399576
Energy: 0.30986543009341844
Energy: 0.2845734132048208
Energy: 0.30986543009341844
Energy: 0.28476711527868004
Energy: 0.3840125491048455
Energy: 0.28476711527868004
Energy: 0.3840125491048455
Energy: 0.2847671152795051
Energy: 0.3840125491048455
Energy: 0.3300274185973449
Energy: 0.29791230058104645
Energy: 0.3300274185973449
Energy: 0.29791230058104645
Energy: 0.3300274185973449
Energy: 0.29791230058104645
Energy: 0.32913895751706823
Energy: 0.30822412367132773
Energy: 0.32913895751706823
Energy: 0.30822412367132773
Energy: 0.32913895751706823
Energy: 0.30822412367132773
Energy: 0.3223655738497172
Energy: 0.35541450800177804
Energy: 0.3223655738505422
Energy: 0.35541450800177804
Energy: 0.3223655738505422
Energy: 0.35541450800177804
Energy: 0.34012899537277896
Energy: 0.2990511708144426
Energy: 0.34012899537277896
Energy: 0.2990511708144426
Energy: 0.34012899537277896
Energy: 0.2990511708144426
Energy: 0.28451705731261473
Energy: 0.3521506171189356
Energy: 0.28451705731261473
Energy: 0.3521506171189356
Energy: 0.2845170573117897
Energy: 0.35215061711811046
Energy: 0.3287701446839435
Energy: 0.3359205541024063
Energy: 0.3287701446839435
Energy: 0.3359205541024063
Energy: 0.3287701446839435
Energy: 0.3359205541024063
Energy: 0.31505711553822
Energy: 0.39519390958150397
Energy: 0.315057115537395
Energy: 0.39519390958150397
Energy: 0.315057115537395
Energy: 0.39519390958150397
Energy: 0.3148832496406562
Energy: 0.29813698107901965
Energy: 0.3148832496406562
Energy: 0.29813698107901965
Energy: 0.3148832496406562
Energy: 0.29813698107901965
Energy: 0.3279316036003675
Energy: 0.3361494459011502
Energy: 0.3279316036011925
Energy: 0.3361494459011502
Energy: 0.3279316036003675
Energy: 0.3361494459011502

minimum gb energy = 0.2845170573117897 eV
minimum distance =  2.63617918049138 Angstroms
sigma value = 17


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

Energy: 0.4181948120340422
Energy: 0.3043077569936503
Energy: 0.4181948120343608
Energy: 0.3043077569936503
Energy: 0.4181948120305377
Energy: 0.30430775699333174
Energy: 0.35354766104239427
Energy: 0.28861788094216695
Energy: 0.3535476610382525
Energy: 0.28861788094184837
Energy: 0.35354766103634105
Energy: 0.28861788094216695
Energy: 0.32376141010654347
Energy: 0.31471039909015397
Energy: 0.32376141010590626
Energy: 0.31471039909015397
Energy: 0.3237614101024017
Energy: 0.31471039909015397
Energy: 0.2776839896204816
Energy: 0.30388740827781824
Energy: 0.2776839896137912
Energy: 0.30388740827781824
Energy: 0.2776839896086937
Energy: 0.30388740827781824
Energy: 0.34937490001993615
Energy: 0.2885982951462838
Energy: 0.3493749000173874
Energy: 0.2885982951462838
Energy: 0.349374900019299
Energy: 0.2885982951462838
Energy: 0.31154606849407807
Energy: 0.29400557706288555
Energy: 0.3115460684966268
Energy: 0.2940055770632041
Energy: 0.31154606849280375
Energy: 0.29400557706288555
Energy: 0.30901634655410193
Energy: 0.29375144195641245
Energy: 0.30901634655091603
Energy: 0.29375144195641245
Energy: 0.3090163465550577
Energy: 0.2937514419560939
Energy: 0.298093424233399
Energy: 0.37312862701503785
Energy: 0.29809342423212465
Energy: 0.37312862701503785
Energy: 0.2980934242302131
Energy: 0.37312862701503785
Energy: 0.31051612830068787
Energy: 0.32199286359915563
Energy: 0.3105161283013251
Energy: 0.3219928635994742
Energy: 0.3105161282994135
Energy: 0.32199286359819984
Energy: 0.30858895888140464
Energy: 0.2741169657048507
Energy: 0.3085889588817232
Energy: 0.2741169657051693
Energy: 0.30858895888013027
Energy: 0.2741169657048507
Energy: 0.2765426171634885
Energy: 0.3631837842948138
Energy: 0.27654261716157696
Energy: 0.3631837842941766
Energy: 0.27654261716157696
Energy: 0.3631837842941766
Energy: 0.32330657854437206
Energy: 0.29160828193323873
Energy: 0.3233065785446907
Energy: 0.2916082819326015
Energy: 0.3233065785440535
Energy: 0.2916082819326015
Energy: 0.3086746206216638
Energy: 0.2958039413333814
Energy: 0.30867462062102663
Energy: 0.29580394133369997
Energy: 0.30867462062134526
Energy: 0.2958039413340186
Energy: 0.3014862034397202
Energy: 0.3335589059675574
Energy: 0.3014862034365343
Energy: 0.3335589059672388
Energy: 0.30148620343940163
Energy: 0.33355890596787596
Energy: 0.3214258486644833
Energy: 0.2900278594702638
Energy: 0.32142584866607626
Energy: 0.290027859470901
Energy: 0.3214258486635276
Energy: 0.2900278594721754
Energy: 0.2753204096793596
Energy: 0.3350578987032844
Energy: 0.27532040967744803
Energy: 0.3350578987032844
Energy: 0.27532040967649224
Energy: 0.3350578987032844
Energy: 0.30817682191121487
Energy: 0.3045351760200537
Energy: 0.3081768219089847
Energy: 0.3045351760200537
Energy: 0.30817682191121487
Energy: 0.3045351760200537
Energy: 0.3074704435324782
Energy: 0.375295398986346
Energy: 0.30747044353152236
Energy: 0.37529539898666464
Energy: 0.3074704435321596
Energy: 0.37529539898666464
Energy: 0.2978171280104443
Energy: 0.3560388522532333
Energy: 0.2978171280094885
Energy: 0.3560388522522775
Energy: 0.2978171280063026
Energy: 0.3560388522567378
Energy: 0.30772129404804816
Energy: 0.3062578542804892
Energy: 0.3077212940499597
Energy: 0.3062578542804892
Energy: 0.30772129404677373
Energy: 0.30625785428017066
Energy: 0.2979210435211188
Energy: 0.35587308267216455
Energy: 0.29792104351984444
Energy: 0.35587308267280177
Energy: 0.2979210435214374
Energy: 0.3558730826724832
Energy: 0.30759073421418703
Energy: 0.37530333847554503
Energy: 0.3075907342192845
Energy: 0.37530333847554503
Energy: 0.30759073421578004
Energy: 0.3753033384758636
Energy: 0.3081050804859612
Energy: 0.30446173963839046
Energy: 0.3081050804878728
Energy: 0.3044617396387091
Energy: 0.30810508048373103
Energy: 0.30446173963839046
Energy: 0.2752817922304872
Energy: 0.3485890406152486
Energy: 0.275281792231443
Energy: 0.34858904061492996
Energy: 0.27528179222921284
Energy: 0.34858904061492996
Energy: 0.3214158337968257
Energy: 0.28988672476052396
Energy: 0.32141583379746286
Energy: 0.2898867247602054
Energy: 0.3214158337968257
Energy: 0.2898867247602054
Energy: 0.3014789530891165
Energy: 0.3335608646824458
Energy: 0.3014789530913466
Energy: 0.3335608646824458
Energy: 0.3014789530919838
Energy: 0.3335608646824458
Energy: 0.3086999837924196
Energy: 0.2957996697833396
Energy: 0.3086999837924196
Energy: 0.2957996697827025
Energy: 0.3086999837933753
Energy: 0.2957996697827025
Energy: 0.32337014892517607
Energy: 0.29187166342860266
Energy: 0.3233701489232645
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Energy: 0.32337014892422034
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Energy: 0.2766317532760113
Energy: 0.3633544108374435
Energy: 0.2766317532750556
Energy: 0.3633544108377621
Energy: 0.2766317532753741
Energy: 0.3633544108377621
Energy: 0.3085645213096163
Energy: 0.3227528540924956
Energy: 0.3085645213112092
Energy: 0.322752854092177
Energy: 0.3085645213070675
Energy: 0.3227528540924956
Energy: 0.31079472827853294
Energy: 0.3218912644906138
Energy: 0.31079472827694
Energy: 0.3218912644909324
Energy: 0.31079472827598426
Energy: 0.321891264491251
Energy: 0.2981462737880282
Energy: 0.3731573682886
Energy: 0.298146273788984
Energy: 0.3731573682886
Energy: 0.2981462737867538
Energy: 0.3731573682886
Energy: 0.30903688179161576
Energy: 0.2937930461861871
Energy: 0.30903688179320865
Energy: 0.2937930461852314
Energy: 0.30903688179097855
Energy: 0.2937930461849128
Energy: 0.31137987341023515
Energy: 0.29429354219111686
Energy: 0.311379873415014
Energy: 0.29429354218984244
Energy: 0.3113798734115095
Energy: 0.2942935421907983
Energy: 0.34945212822928695
Energy: 0.28874508336686866
Energy: 0.34945212822387084
Energy: 0.2887450833678245
Energy: 0.3494521282286498
Energy: 0.2887450833678245
Energy: 0.27556277723646266
Energy: 0.3039160879978532
Energy: 0.27556277723327677
Energy: 0.3039160879978532
Energy: 0.27556277723295813
Energy: 0.3039160879978532
Energy: 0.3238959431130629
Energy: 0.31472620004897095
Energy: 0.32389594311338155
Energy: 0.31472620004865237
Energy: 0.3238959431101956
Energy: 0.31472620004865237
Energy: 0.3535786848652233
Energy: 0.28885292138256924
Energy: 0.3535786848652233
Energy: 0.2888529213860737
Energy: 0.35357868486203736
Energy: 0.288852921381932
Energy: 0.4181948120321307
Energy: 0.30430775699333174
Energy: 0.4181948120314935
Energy: 0.3043077569936503
Energy: 0.4181948120305377
Energy: 0.3043077569939689
Energy: 0.35354766102359736
Energy: 0.2886178809386625
Energy: 0.35354766102200447
Energy: 0.28861788093898105
Energy: 0.35354766102200447
Energy: 0.2886178809392997
Energy: 0.32376141010622483
Energy: 0.31471039908824244
Energy: 0.3237614101074992
Energy: 0.314710399088561
Energy: 0.3237614101046319
Energy: 0.31471039908887966
Energy: 0.2776839896102867
Energy: 0.31450907572341147
Energy: 0.2776839896029591
Energy: 0.31450907572341147
Energy: 0.27768398960359625
Energy: 0.3145090757240486
Energy: 0.3493749000110156
Energy: 0.288598295150107
Energy: 0.3493749000116528
Energy: 0.28859829515074414
Energy: 0.34937490001420146
Energy: 0.288598295150107

minimum gb energy = 0.2741169657048507 eV
minimum distance =  2.65923697368995 Angstroms
sigma value = 57


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

Energy: 0.4100107371210426
Energy: 0.28828252657910364
Energy: 0.4100107371215614
Energy: 0.28828252657910364
Energy: 0.41001073711948643
Energy: 0.28828252657910364
Energy: 0.3290163171527568
Energy: 0.2806976000242116
Energy: 0.3290163171486069
Energy: 0.28069760002524907
Energy: 0.3290163171527568
Energy: 0.2806976000257678
Energy: 0.3165217500137565
Energy: 0.3017593982008382
Energy: 0.31652175001479393
Energy: 0.3017593982008382
Energy: 0.3165217500116815
Energy: 0.3017593982008382
Energy: 0.27268746654814663
Energy: 0.2966626646222297
Energy: 0.2726874665491841
Energy: 0.296662664621711
Energy: 0.2726874665465904
Energy: 0.296662664621711
Energy: 0.3295265238185201
Energy: 0.2609494090132176
Energy: 0.3295265238200763
Energy: 0.2609494090137363
Energy: 0.32952652382215125
Energy: 0.2609494090132176
Energy: 0.29851225042888413
Energy: 0.28117324277924005
Energy: 0.2985122504294029
Energy: 0.2811732427797588
Energy: 0.2985122504278467
Energy: 0.28117324277924005
Energy: 0.2715890507688572
Energy: 0.29210542470164297
Energy: 0.2715890507641885
Energy: 0.2921054247021617
Energy: 0.27158905076470724
Energy: 0.2921054247021617
Energy: 0.3560063895306097
Energy: 0.2866786294186602
Energy: 0.35600638952905356
Energy: 0.28667862941658523
Energy: 0.3560063895274973
Energy: 0.28667862941814143
Energy: 0.27950762783628874
Energy: 0.2823652646879923
Energy: 0.2795076278404387
Energy: 0.2823652646879923
Energy: 0.27950762783577
Energy: 0.2823652646874735
Energy: 0.291392756497318
Energy: 0.28363624284493927
Energy: 0.2913927564921306
Energy: 0.2836362428454581
Energy: 0.29139275649368684
Energy: 0.2836362428444205
Energy: 0.27032586945924425
Energy: 0.3582740345962222
Energy: 0.27032586945301934
Energy: 0.3582740345957034
Energy: 0.27032586945198184
Energy: 0.3582740345962222
Energy: 0.2899322585969581
Energy: 0.27077993495676445
Energy: 0.28993225859903304
Energy: 0.27077993495780195
Energy: 0.2899322585985143
Energy: 0.27077993495780195
Energy: 0.2898784994056143
Energy: 0.31472914245276845
Energy: 0.2898784994076892
Energy: 0.31472914245276845
Energy: 0.2898784994045768
Energy: 0.31472914245276845
Energy: 0.26860462673135344
Energy: 0.34012883666644006
Energy: 0.26860462673394714
Energy: 0.3401288366669588
Energy: 0.26860462673135344
Energy: 0.3401288366669588
Energy: 0.31204116237305973
Energy: 0.2839195283015514
Energy: 0.31204116237046603
Energy: 0.2839195283015514
Energy: 0.3120411623709847
Energy: 0.2839195283015514
Energy: 0.2887652232507362
Energy: 0.29010848044507637
Energy: 0.2887652232465863
Energy: 0.29010848044455767
Energy: 0.2887652232528112
Energy: 0.29010848044507637
Energy: 0.2875181725676759
Energy: 0.3284986833834102
Energy: 0.2875181725676759
Energy: 0.3284986833828915
Energy: 0.28751817256611967
Energy: 0.3284986833828915
Energy: 0.305213014261252
Energy: 0.2854243349326425
Energy: 0.30521301425969577
Energy: 0.28542433492849256
Energy: 0.3052130142602145
Energy: 0.2854243349279738
Energy: 0.27452927758800477
Energy: 0.3445561093528516
Energy: 0.27452927758904233
Energy: 0.3445561093528516
Energy: 0.2745292775869673
Energy: 0.3445561093533703
Energy: 0.26820258558610616
Energy: 0.29955352614987274
Energy: 0.26820258558454996
Energy: 0.2995535261503915
Energy: 0.2682025855866249
Energy: 0.2995535261503915
Energy: 0.29599838216026525
Energy: 0.3662763686519399
Energy: 0.295998382160784
Energy: 0.3662763686519399
Energy: 0.29599838216026525
Energy: 0.3662763686524587
Energy: 0.26727549279750146
Energy: 0.3491921220849078
Energy: 0.26727549279905766
Energy: 0.3491921220833516
Energy: 0.26727549280061386
Energy: 0.3491921220849078
Energy: 0.29317852568311026
Energy: 0.2897045586041917
Energy: 0.29317852568518527
Energy: 0.2897045586041917
Energy: 0.2931785256825915
Energy: 0.2897045586041917
Energy: 0.28691767152173997
Energy: 0.3599313337403941
Energy: 0.2869176715258899
Energy: 0.35993133374091285
Energy: 0.28691767152018377
Energy: 0.35993133374091285
Energy: 0.2867563960255106
Energy: 0.3652825279702009
Energy: 0.28675639602291697
Energy: 0.3652825279712384
Energy: 0.2867563960223982
Energy: 0.3652825279712384
Energy: 0.2885964084876203
Energy: 0.28974651207678537
Energy: 0.28859640848606405
Energy: 0.28974651207678537
Energy: 0.28859640848658286
Energy: 0.28974651207678537
Energy: 0.27398351747419925
Energy: 0.3454333784547894
Energy: 0.27398351747419925
Energy: 0.34543337845427063
Energy: 0.2739835174736805
Energy: 0.3454333784547894

minimum gb energy = 0.2609494090132176 eV
minimum distance =  2.60559529290727 Angstroms
sigma value = 43


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

Energy: 0.2709153653439054
Energy: 0.2675127214751675
Energy: 0.2709153653412597
Energy: 0.2675127214751675
Energy: 0.2709153653423936
Energy: 0.26751272147554545
Energy: 0.29473359049072434
Energy: 0.263703575822716
Energy: 0.2947335904899685
Energy: 0.263703575822716
Energy: 0.2947335904899685
Energy: 0.263703575822338
Energy: 0.282741350812359
Energy: 0.2800072091346813
Energy: 0.28274135081311497
Energy: 0.2800072091346813
Energy: 0.2827413508119811
Energy: 0.2800072091346813
Energy: 0.26303661711807413
Energy: 0.26877902833017703
Energy: 0.26303661711694026
Energy: 0.26877902833017703
Energy: 0.26303661711580645
Energy: 0.2687790283297991
Energy: 0.29445786543928126
Energy: 0.2549442347851351
Energy: 0.29445786543928126
Energy: 0.25494423478551304
Energy: 0.29445786544003727
Energy: 0.25494423478475714
Energy: 0.26375368729784304
Energy: 0.2564264031648248
Energy: 0.263753687298221
Energy: 0.2564264031648248
Energy: 0.2637536872967092
Energy: 0.2564264031648248
Energy: 0.24296101428647346
Energy: 0.25951547876235004
Energy: 0.24296101428647346
Energy: 0.25951547876348385
Energy: 0.24296101428647346
Energy: 0.25951547876235004
Energy: 0.29541822233332543
Energy: 0.2346330759547354
Energy: 0.29541822233219156
Energy: 0.2346330759547354
Energy: 0.29541822233219156
Energy: 0.2346330759547354
Energy: 0.254653666136309
Energy: 0.25558034370487204
Energy: 0.25465366613517515
Energy: 0.25558034370487204
Energy: 0.254653666135931
Energy: 0.25558034370487204
Energy: 0.28965339030070236
Energy: 0.24916963617352675
Energy: 0.2896533903033481
Energy: 0.2491696361750386
Energy: 0.2896533903003244
Energy: 0.24916963617201487
Energy: 0.3192102541589308
Energy: 0.3052500614499169
Energy: 0.31921025415779697
Energy: 0.3052500614499169
Energy: 0.3192102541593088
Energy: 0.3052500614499169
Energy: 0.2455206880313663
Energy: 0.2565421653228079
Energy: 0.2455206880313663
Energy: 0.25654216532318586
Energy: 0.2455206880313663
Energy: 0.25654216532318586
Energy: 0.26310233405523015
Energy: 0.24004388131093013
Energy: 0.26310233405485217
Energy: 0.24004388131055218
Energy: 0.2631023340529624
Energy: 0.24004388131055218
Energy: 0.3143007833463789
Energy: 0.3067652569503866
Energy: 0.31430078334751277
Energy: 0.3067652569507646
Energy: 0.31430078334713485
Energy: 0.3067652569507646
Energy: 0.25224338244050415
Energy: 0.2544049061658845
Energy: 0.2522433824419816
Energy: 0.25440490616626243
Energy: 0.2522433824408821
Energy: 0.2544049061658845
Energy: 0.26865944662769614
Energy: 0.26133973962463103
Energy: 0.2686594466261843
Energy: 0.2613397396242531
Energy: 0.2686594466269402
Energy: 0.2613397396242531
Energy: 0.24240355892920076
Energy: 0.3060435521459857
Energy: 0.24240355892731097
Energy: 0.3060435521459857
Energy: 0.24240355892844484
Energy: 0.30604355214636364
Energy: 0.2560611870163487
Energy: 0.2560192143013567
Energy: 0.2560611870182385
Energy: 0.2560192143006009
Energy: 0.2560611870171046
Energy: 0.25601921430173474
Energy: 0.2575920306160682
Energy: 0.27903111077468273
Energy: 0.25759203061682423
Energy: 0.2790311107743047
Energy: 0.25759203061720215
Energy: 0.2790311107743047
Energy: 0.26658811871505805
Energy: 0.2821875934561782
Energy: 0.266588118715436
Energy: 0.28218759345769007
Energy: 0.26658811871354615
Energy: 0.28218759345769007
Energy: 0.27842890573682816
Energy: 0.2546575993038867
Energy: 0.27842890573456036
Energy: 0.25465759930350873
Energy: 0.27842890573531626
Energy: 0.2546575993038867
Energy: 0.26306687159783076
Energy: 0.28819898424335
Energy: 0.26306687159783076
Energy: 0.288198984242972
Energy: 0.26306687159783076
Energy: 0.28819898424335
Energy: 0.27016195438638435
Energy: 0.291305028442793
Energy: 0.27016195438638435
Energy: 0.291305028442415
Energy: 0.2701619543878962
Energy: 0.291305028442415
Energy: 0.2757341930405436
Energy: 0.31725123998102045
Energy: 0.2757341930420554
Energy: 0.31725123998177646
Energy: 0.2757341930405436
Energy: 0.31725123998177646
Energy: 0.2423944375602796
Energy: 0.2836536489177169
Energy: 0.24239443755876774
Energy: 0.2836536489177169
Energy: 0.2423944375602796
Energy: 0.2836536489177169
Energy: 0.25158218929516757
Energy: 0.2696373789470565
Energy: 0.25158218929630144
Energy: 0.2696373789474345
Energy: 0.2515821892959235
Energy: 0.2696373789470565
Energy: 0.27540959336972315
Energy: 0.25100344266012997
Energy: 0.2754095933674554
Energy: 0.25100344266012997
Energy: 0.2754095933678333
Energy: 0.25100344266012997
Energy: 0.23137144296339726
Energy: 0.2837211215481396
Energy: 0.23137144296453113
Energy: 0.2837211215488955
Energy: 0.231371442965665
Energy: 0.2837211215488955
Energy: 0.25155617807489794
Energy: 0.2538108265403896
Energy: 0.25155617807489794
Energy: 0.2538108265403896
Energy: 0.251556178074142
Energy: 0.2538108265403896
Energy: 0.2489752654867632
Energy: 0.2876613665637495
Energy: 0.2489752654837395
Energy: 0.28766136656715113
Energy: 0.2489752654856293
Energy: 0.28766136656526137
Energy: 0.22958150745672826
Energy: 0.2844929537176261
Energy: 0.2295815074582401
Energy: 0.2844929537172482
Energy: 0.2295815074574842
Energy: 0.2844929537172482
Energy: 0.25176891407611085
Energy: 0.24938327527707382
Energy: 0.25176891407913454
Energy: 0.24938327527707382
Energy: 0.25176891407724467
Energy: 0.24938327527707382
Energy: 0.24304791594239275
Energy: 0.2828479945289843
Energy: 0.24304791594314865
Energy: 0.2828479945289843
Energy: 0.24304791594125888
Energy: 0.2828479945289843
Energy: 0.31077658953440124
Energy: 0.32215680771509725
Energy: 0.31077658953326737
Energy: 0.3221568077154752
Energy: 0.31077658953440124
Energy: 0.32215680771509725
Energy: 0.25239210971658793
Energy: 0.24403846921109065
Energy: 0.2523921097154541
Energy: 0.24403846921109065
Energy: 0.2523921097154541
Energy: 0.2440384692088229
Energy: 0.22916151023843476
Energy: 0.2824923797024065
Energy: 0.22916151023805678
Energy: 0.2824923797031624
Energy: 0.22916151023843476
Energy: 0.28249237970278446

minimum gb energy = 0.22916151023805678 eV
minimum distance =  2.60958090433388 Angstroms
sigma value = 81


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

Energy: 0.03891494574618369
Energy: 0.06084395169463216
Energy: 0.03891494574618369
Energy: 0.06084395169463216
Energy: 0.038914945744794975
Energy: 0.06084395169463216
Energy: 0.1922102578678755
Energy: 0.03924405889064967
Energy: 0.1922102578734303
Energy: 0.03924405889064967
Energy: 0.1922102578678755
Energy: 0.03924405889203837
Energy: 0.19221369221880044
Energy: 0.03924210235477313
Energy: 0.19221369221880044
Energy: 0.03924210235477313
Energy: 0.19221369221880044
Energy: 0.03924210235477313
Energy: 0.03891494574618369
Energy: 0.06084395169463216
Energy: 0.03891494574618369
Energy: 0.06084395169463216
Energy: 0.03891494574618369
Energy: 0.06084395169463216
Energy: 0.1922102578678755
Energy: 0.03924405889203837
Energy: 0.1922102578678755
Energy: 0.03924405889203837
Energy: 0.19221025786926418
Energy: 0.03924405889203837
Energy: 0.19221369221880044
Energy: 0.03924210235616184
Energy: 0.19221369221880044
Energy: 0.03924210235616184
Energy: 0.19221369221880044
Energy: 0.03924210235616184
Energy: 0.03891494574618369
Energy: 0.06084395169463216
Energy: 0.038914945744794975
Energy: 0.06084395169463216
Energy: 0.038914945744794975
Energy: 0.06084395169463216
Energy: 0.1922102578678755
Energy: 0.03924405889203837
Energy: 0.1922102578678755
Energy: 0.03924405889203837
Energy: 0.1922102578678755
Energy: 0.03924405889203837
Energy: 0.19221369221880044
Energy: 0.03924210235616184
Energy: 0.19221369221880044
Energy: 0.03924210235616184
Energy: 0.19221369221880044
Energy: 0.03924210235616184
Energy: 0.038914945744794975
Energy: 0.06084395169463216
Energy: 0.038914945744794975
Energy: 0.06084395169463216
Energy: 0.038914945744794975
Energy: 0.06084395169463216

minimum gb energy = 0.038914945744794975 eV
minimum distance =  2.85489727382405 Angstroms
sigma value = 3


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

Energy: 0.3180113520612757
Energy: 0.25759254387431113
Energy: 0.3180113520612757
Energy: 0.25759254387431113
Energy: 0.3180113520608601
Energy: 0.25759254387472674
Energy: 0.2718817634572309
Energy: 0.24324437979898408
Energy: 0.2718817634559842
Energy: 0.24324437979898408
Energy: 0.27188176345681536
Energy: 0.2432443797985685
Energy: 0.2901867103923815
Energy: 0.24261263369266078
Energy: 0.290186710392797
Energy: 0.24261263369266078
Energy: 0.290186710392797
Energy: 0.24261263369266078
Energy: 0.297629893903725
Energy: 0.25961375871486386
Energy: 0.2976298939041406
Energy: 0.25961375871486386
Energy: 0.2976298939041406
Energy: 0.25961375871486386
Energy: 0.22805631929439546
Energy: 0.2690324452671056
Energy: 0.2280563192960577
Energy: 0.26903244526253434
Energy: 0.22805631929397985
Energy: 0.26903244526669007
Energy: 0.2796269606067283
Energy: 0.28938070716824743
Energy: 0.2796269606088062
Energy: 0.28938070716824743
Energy: 0.2796269606071439
Energy: 0.28938070716783193
Energy: 0.29862532295467104
Energy: 0.2627529849917463
Energy: 0.29862532295467104
Energy: 0.2627529849921619
Energy: 0.2986253229550866
Energy: 0.2627529849925775
Energy: 0.23139735737752537
Energy: 0.2671406244666318
Energy: 0.23139735737627865
Energy: 0.2671406244666318
Energy: 0.23139735737794095
Energy: 0.2671406244666318
Energy: 0.2841031133862913
Energy: 0.23073365039018656
Energy: 0.2841031133862913
Energy: 0.23073365039018656
Energy: 0.28410311338670685
Energy: 0.23073365039060215
Energy: 0.25936218870740146
Energy: 0.23795899755160702
Energy: 0.2593621887078171
Energy: 0.23795899755160702
Energy: 0.2593621887078171
Energy: 0.2379589975520226
Energy: 0.24605014308138304
Energy: 0.2804482684425496
Energy: 0.24605014308221418
Energy: 0.2804482684425496
Energy: 0.24605014308262976
Energy: 0.2804482684425496
Energy: 0.27039541284651347
Energy: 0.2968684729112537
Energy: 0.2703954128473446
Energy: 0.2968684729108381
Energy: 0.2703954128473446
Energy: 0.2968684729108381
Energy: 0.2710474160374043
Energy: 0.2305801146603188
Energy: 0.27104741603698873
Energy: 0.23058011466073436
Energy: 0.2710474160365732
Energy: 0.23058011466073436
Energy: 0.24443921814579447
Energy: 0.2315873714687059
Energy: 0.24443921814579447
Energy: 0.2315873714691215
Energy: 0.24443921814621003
Energy: 0.2315873714691215
Energy: 0.2501008460298137
Energy: 0.28617834120074787
Energy: 0.2501008460298137
Energy: 0.28617834120074787
Energy: 0.2501008460298137
Energy: 0.28617834120074787
Energy: 0.27212817158792457
Energy: 0.2259378319672908
Energy: 0.27212817158792457
Energy: 0.2259378319677064
Energy: 0.27212817158792457
Energy: 0.2259378319672908
Energy: 0.2671207200908003
Energy: 0.29207138802827226
Energy: 0.2671207200908003
Energy: 0.2920713880286878
Energy: 0.2671207200912158
Energy: 0.29207138802827226
Energy: 0.27162523885313106
Energy: 0.2750178219156969
Energy: 0.27162523885437784
Energy: 0.27501782191528124
Energy: 0.2716252388527155
Energy: 0.27501782191528124
Energy: 0.2725697545304196
Energy: 0.23281721724251636
Energy: 0.2725697545295884
Energy: 0.23281721724750332
Energy: 0.2725697545312507
Energy: 0.23281721724459428
Energy: 0.2597102477607963
Energy: 0.3101173077131141
Energy: 0.2597102477612119
Energy: 0.3101173077131141
Energy: 0.2597102477616275
Energy: 0.3101173077131141
Energy: 0.2555336841375647
Energy: 0.26569775618875424
Energy: 0.25553368413798033
Energy: 0.26569775618875424
Energy: 0.25553368413798033
Energy: 0.26569775618875424
Energy: 0.2552624397269204
Energy: 0.2708416850730636
Energy: 0.2552624397269204
Energy: 0.27084168507347917
Energy: 0.25526243972567364
Energy: 0.27084168507347917
Energy: 0.27462818129421984
Energy: 0.3253202863395236
Energy: 0.2746281812958822
Energy: 0.3253202863395236
Energy: 0.274628181295051
Energy: 0.3253202863395236
Energy: 0.2731991000386649
Energy: 0.23110325925292052
Energy: 0.2731991000382493
Energy: 0.23110325925292052
Energy: 0.2731991000386649
Energy: 0.23110325925292052
Energy: 0.29392833338284147
Energy: 0.25401977716328517
Energy: 0.2939283333836726
Energy: 0.25401977716368185
Energy: 0.29392833338201024
Energy: 0.25401977716409746
Energy: 0.25703485062914544
Energy: 0.2906117428820924
Energy: 0.2570348506299766
Energy: 0.2906117428820924
Energy: 0.257034850629561
Energy: 0.29061174288250796
Energy: 0.2987042996501275
Energy: 0.23742761442045335
Energy: 0.29870429965054307
Energy: 0.23742761442045335
Energy: 0.29870429965054307
Energy: 0.23742761442045335
Energy: 0.2830105631064011
Energy: 0.2605134378731256
Energy: 0.2830105631072323
Energy: 0.26051343787271003
Energy: 0.28301056310681677
Energy: 0.2605134378731256
Energy: 0.24405300211041847
Energy: 0.26867608979709395
Energy: 0.24405300210958733
Energy: 0.26867608979750945
Energy: 0.24405300210958733
Energy: 0.26867608979750945
Energy: 0.29841531221794637
Energy: 0.25024102498560774
Energy: 0.29841531221836193
Energy: 0.25024102498560774
Energy: 0.29841531221836193
Energy: 0.2502410249851922
Energy: 0.2943176997793191
Energy: 0.28422538925116836
Energy: 0.29431769977765676
Energy: 0.2842253892515839
Energy: 0.29431769977973465
Energy: 0.2842253892515839
Energy: 0.23590823519708679
Energy: 0.26608690159079235
Energy: 0.23590823519667126
Energy: 0.266086901591208
Energy: 0.23590823519791795
Energy: 0.266086901591208
Energy: 0.22808760347192833
Energy: 0.2610741378149978
Energy: 0.22808760347109716
Energy: 0.2610741378149978
Energy: 0.22808760347192833
Energy: 0.2610741378149978

minimum gb energy = 0.2259378319672908 eV
minimum distance =  2.63773758409557 Angstroms
sigma value = 67


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

Energy: 0.37258659680287204
Energy: 0.31700295461737854
Energy: 0.3725865968016877
Energy: 0.31700295461737854
Energy: 0.3725865968016877
Energy: 0.31700295461737854
Energy: 0.3117414861739205
Energy: 0.31605964318743973
Energy: 0.3117414861739205
Energy: 0.31605964318743973
Energy: 0.3117414861756969
Energy: 0.31605964318743973
Energy: 0.3314879004984649
Energy: 0.31802746673911825
Energy: 0.33148790049787275
Energy: 0.31802746674089466
Energy: 0.331487900499057
Energy: 0.3180274667403026
Energy: 0.3407168508226063
Energy: 0.30639329106144775
Energy: 0.340716850821422
Energy: 0.30639329106203994
Energy: 0.3407168508226063
Energy: 0.30639329106144775
Energy: 0.26988389999007234
Energy: 0.3011845405429307
Energy: 0.2698838999882959
Energy: 0.3011845405429307
Energy: 0.26988389998888807
Energy: 0.3011845405435229
Energy: 0.32740516253697044
Energy: 0.30587794092070814
Energy: 0.32740516253697044
Energy: 0.30587794092070814
Energy: 0.327405162539339
Energy: 0.30587794092070814
Energy: 0.30789358133109607
Energy: 0.29581772918686744
Energy: 0.3078935813299118
Energy: 0.29581772918686744
Energy: 0.30789358133050393
Energy: 0.29581772918686744
Energy: 0.30066614074748693
Energy: 0.30802251943677855
Energy: 0.30066614074748693
Energy: 0.30802251943618647
Energy: 0.30066614074867126
Energy: 0.30802251943677855
Energy: 0.3378332926936069
Energy: 0.34888773882093954
Energy: 0.3378332926947912
Energy: 0.34888773882093954
Energy: 0.3378332926953833
Energy: 0.34888773882034746
Energy: 0.30860740399594133
Energy: 0.27793462749473574
Energy: 0.30860740399534914
Energy: 0.27793462749473574
Energy: 0.3086074039971256
Energy: 0.27793462749473574
Energy: 0.30909483995014275
Energy: 0.33967633576171974
Energy: 0.309094839951327
Energy: 0.33967633576171974
Energy: 0.30909483995251136
Energy: 0.33967633576171974
Energy: 0.30821861497078673
Energy: 0.3224157938308858
Energy: 0.3082186149696024
Energy: 0.3224157938308858
Energy: 0.3082186149713788
Energy: 0.3224157938302937
Energy: 0.32472240954486464
Energy: 0.27160212372139697
Energy: 0.3247224095442725
Energy: 0.2716021237202127
Energy: 0.32472240954486464
Energy: 0.27160212372080483
Energy: 0.3027766621122095
Energy: 0.34899965927911764
Energy: 0.30277666211102516
Energy: 0.34899965927911764
Energy: 0.3027766621133938
Energy: 0.34899965927911764
Energy: 0.31160096634528817
Energy: 0.3066857019178803
Energy: 0.3116009663458803
Energy: 0.3066857019178803
Energy: 0.31160096634528817
Energy: 0.3066857019178803
Energy: 0.2781765738579352
Energy: 0.3184013897327608
Energy: 0.27817657385734307
Energy: 0.3184013897327608
Energy: 0.27817657385734307
Energy: 0.3184013897327608
Energy: 0.3107326428266865
Energy: 0.3355884754221793
Energy: 0.31073264282787083
Energy: 0.3355884754221793
Energy: 0.3107326428284629
Energy: 0.3355884754221793
Energy: 0.3249910762378632
Energy: 0.27489410795094654
Energy: 0.3249910762378632
Energy: 0.27489410795094654
Energy: 0.3249910762378632
Energy: 0.27489410795094654
Energy: 0.3270628059900159
Energy: 0.3090818328265255
Energy: 0.32706280599060805
Energy: 0.3090818328253681
Energy: 0.32706280599060805
Energy: 0.3090818328259333
Energy: 0.27133528506637133
Energy: 0.31704881372389865
Energy: 0.27133528506518706
Energy: 0.31704881372389865
Energy: 0.27133528506518706
Energy: 0.31704881372389865
Energy: 0.3477896875360034
Energy: 0.28694640630026114
Energy: 0.34778968753422695
Energy: 0.28694640630026114
Energy: 0.3477896875360034
Energy: 0.28694640630026114
Energy: 0.3441259036422582
Energy: 0.3514313743864359
Energy: 0.34412590364166606
Energy: 0.35143137438584376
Energy: 0.3441259036422582
Energy: 0.3514313743864359
Energy: 0.2837844324319247
Energy: 0.3340546144378857
Energy: 0.3092003390262118
Energy: 0.3340546144378857
Energy: 0.2851336966691404
Energy: 0.33405461443847784

minimum gb energy = 0.2698838999882959 eV
minimum distance =  2.63552339093726 Angstroms
sigma value = 33


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

Energy: 0.3810176768649664
Energy: 0.32282803202499705
Energy: 0.381017676865342
Energy: 0.3228280320246214
Energy: 0.38101767686459076
Energy: 0.32282803202499705
Energy: 0.32858128653552626
Energy: 0.3392637301792874
Energy: 0.32858128653439933
Energy: 0.33926373017966305
Energy: 0.3285812865328967
Energy: 0.33926373017966305
Energy: 0.35882032969898214
Energy: 0.35014557859359774
Energy: 0.35882032969898214
Energy: 0.35014557859322204
Energy: 0.35882032970010913
Energy: 0.35014557859322204
Energy: 0.3583884685394803
Energy: 0.319688583401347
Energy: 0.35838846853910467
Energy: 0.319688583401347
Energy: 0.3583884685383534
Energy: 0.319688583401347
Energy: 0.3144753386550055
Energy: 0.3454257772889813
Energy: 0.31447533865350286
Energy: 0.3454257772889813
Energy: 0.3144753386557567
Energy: 0.3454257772889813
Energy: 0.33986257717658963
Energy: 0.3686561222500773
Energy: 0.33986257717546264
Energy: 0.3686561222489504
Energy: 0.3398625771758383
Energy: 0.3651542683145562
Energy: 0.3277544683983214
Energy: 0.30700639995589857
Energy: 0.3277544683975701
Energy: 0.3070063999555229
Energy: 0.3277544683990727
Energy: 0.30700639995589857
Energy: 0.3192515825630311
Energy: 0.35664355087988736
Energy: 0.3192515825573964
Energy: 0.35664355088026295
Energy: 0.3192515825611529
Energy: 0.35664355087988736
Energy: 0.3344440242396831
Energy: 0.3535752345134194
Energy: 0.3344440242396831
Energy: 0.3535752345134194
Energy: 0.3344440242411857
Energy: 0.3535752345134194
Energy: 0.3703635843229599
Energy: 0.2998643776400785
Energy: 0.37036358432145733
Energy: 0.2998643776393272
Energy: 0.3703635843233356
Energy: 0.2998643776393272
Energy: 0.33688754452713765
Energy: 0.360136059185435
Energy: 0.33688754452525943
Energy: 0.360136059185435
Energy: 0.336887544527889
Energy: 0.360136059185435
Energy: 0.3310354289311488
Energy: 0.3324484177362674
Energy: 0.33103542892964627
Energy: 0.3324484177362674
Energy: 0.3310354289311488
Energy: 0.3324484177362674
Energy: 0.37083827503314726
Energy: 0.3335678054357054
Energy: 0.37083827503277167
Energy: 0.33356780543608106
Energy: 0.3708382750320204
Energy: 0.33356780543532977
Energy: 0.3347053989332641
Energy: 0.3508017198937514
Energy: 0.3347053989325128
Energy: 0.3508017198941271
Energy: 0.3347053989328885
Energy: 0.3508017198941271
Energy: 0.34329172331306085
Energy: 0.3377783905667019
Energy: 0.3432917233156904
Energy: 0.3377783905667019
Energy: 0.34329172331306085
Energy: 0.3377783905670775
Energy: 0.3585270666989011
Energy: 0.35446755536584945
Energy: 0.3585270666981498
Energy: 0.35446755536584945
Energy: 0.3585270666996524
Energy: 0.35446755536584945
Energy: 0.2999596203275069
Energy: 0.35056648709898464
Energy: 0.29995962032900947
Energy: 0.35056648709860905
Energy: 0.29995962032900947
Energy: 0.35056648709898464
Energy: 0.3631714604357198
Energy: 0.35672132568273407
Energy: 0.3631714604338416
Energy: 0.35672132568310977
Energy: 0.36317146043609544
Energy: 0.35672132568273407
Energy: 0.3292563489309445
Energy: 0.35570025323349075
Energy: 0.3292563489309445
Energy: 0.35570025323349075
Energy: 0.3292563489305689
Energy: 0.35570025323386645
Energy: 0.3221306464418963
Energy: 0.3381855395716571
Energy: 0.32213064644264766
Energy: 0.3381855395716571
Energy: 0.32213064644227196
Energy: 0.3381855395712814
Energy: 0.36032894560881024
Energy: 0.35111459920389076
Energy: 0.3603289456110641
Energy: 0.35111459920389076
Energy: 0.3603289456091859
Energy: 0.35111459920389076
Energy: 0.34579163957905573
Energy: 0.29346154930976853
Energy: 0.3457916395764262
Energy: 0.29346154930976853
Energy: 0.34579163957830444
Energy: 0.29346154930939283
Energy: 0.3356666428429752
Energy: 0.3600131974456032
Energy: 0.33566664284259956
Energy: 0.3600131974456032
Energy: 0.33566664284335085
Energy: 0.3600131974456032
Energy: 0.36931257550326724
Energy: 0.3557054151618979
Energy: 0.3693125755047698
Energy: 0.36227719145899523
Energy: 0.3693125755028916
Energy: 0.33150497874245566
Energy: 0.3280106506234802
Energy: 0.33190544814770856
Energy: 0.3280106506231045
Energy: 0.33190544814770856
Energy: 0.32801065062535845
Energy: 0.3319054481473329
Energy: 0.33691192636255984
Energy: 0.36580312289874145
Energy: 0.336911926360306
Energy: 0.36580312289874145
Energy: 0.3369119263618086
Energy: 0.36580312289874145
Energy: 0.32759966058273915
Energy: 0.29020641941059666
Energy: 0.32759966058574436
Energy: 0.2902064194109723
Energy: 0.3275996605834905
Energy: 0.2902064194109723
Energy: 0.32778103025190014
Energy: 0.37024234590924715
Energy: 0.32778103025377836
Energy: 0.37024234590924715
Energy: 0.3277810302526514
Energy: 0.37024234590924715
Energy: 0.3299206005527741
Energy: 0.3457391340193054
Energy: 0.3299206005508959
Energy: 0.3457391340193054
Energy: 0.3299206005505202
Energy: 0.34573913401892975
Energy: 0.3321433943289313
Energy: 0.30684448741278353
Energy: 0.33214339432742873
Energy: 0.3068444874131592
Energy: 0.33214339432780443
Energy: 0.3068444874131592
Energy: 0.3714799225206218
Energy: 0.3675003253626354
Energy: 0.3714799225198705
Energy: 0.3675003253630111
Energy: 0.3714799225209974
Energy: 0.3675003253630111
Energy: 0.3104238271769413
Energy: 0.33815280332675846
Energy: 0.31042382717806816
Energy: 0.33815280332675846
Energy: 0.31042382717919514
Energy: 0.33815280332713404
Energy: 0.35750550321190144
Energy: 0.3414871643457857
Energy: 0.3575055032088962
Energy: 0.3414871643457857
Energy: 0.3575055032088962
Energy: 0.34148716434616133
Energy: 0.342137799947043
Energy: 0.33858355417125374
Energy: 0.34213779994779425
Energy: 0.3385835541708781
Energy: 0.3421377999455404
Energy: 0.33858355417125374
Energy: 0.33357324855369197
Energy: 0.3500816642261072
Energy: 0.3335732485533163
Energy: 0.3500816642264829
Energy: 0.3335732485529407
Energy: 0.3500816642261072
Energy: 0.37703925808751027
Energy: 0.32315254812622146
Energy: 0.3770392580893885
Energy: 0.32315254812622146
Energy: 0.3770392580860077
Energy: 0.3231525481265971
Energy: 0.32944093484278036
Energy: 0.33680676997754566
Energy: 0.32944093483902387
Energy: 0.33680676997754566
Energy: 0.3294409348393995
Energy: 0.33680676997754566

minimum gb energy = 0.29020641941059666 eV
minimum distance =  2.61200364236752 Angstroms
sigma value = 41


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

Energy: 0.39018070661724646
Energy: 0.3732208195432516
Energy: 0.39018070661724646
Energy: 0.3732208195432516
Energy: 0.39018070661622084
Energy: 0.3732208195432516
Energy: 0.36291309398370986
Energy: 0.3804631317637214
Energy: 0.36291309398370986
Energy: 0.3804631317637214
Energy: 0.36291309398370986
Energy: 0.3804631317637214
Energy: 0.39068421605484077
Energy: 0.3776506081696503
Energy: 0.39068421605484077
Energy: 0.3776506081696503
Energy: 0.39068421605484077
Energy: 0.3776506081696503
Energy: 0.3949835068950841
Energy: 0.37989797779056644
Energy: 0.3949835068950841
Energy: 0.37989797779056644
Energy: 0.3949835068961098
Energy: 0.37989797779056644
Energy: 0.3479675098146541
Energy: 0.37643344312923765
Energy: 0.3479675098136285
Energy: 0.3764334431302633
Energy: 0.3479675098146541
Energy: 0.3764334431302633
Energy: 0.417033316067472
Energy: 0.3900182658591176
Energy: 0.41703331606849764
Energy: 0.3900182658601432
Energy: 0.417033316067472
Energy: 0.3900182658591176
Energy: 0.3919167537023433
Energy: 0.35332446642126525
Energy: 0.39191675370336887
Energy: 0.35332446642126525
Energy: 0.3919167537023433
Energy: 0.35332446642126525
Energy: 0.3902996989115663
Energy: 0.3796898408954439
Energy: 0.39029969891054056
Energy: 0.3796898408954439
Energy: 0.39029969891054056
Energy: 0.3796898408954439
Energy: 0.36461534934700424
Energy: 0.35941669906206497
Energy: 0.3646153493459786
Energy: 0.35941669906206497
Energy: 0.3646153493459786
Energy: 0.35941669906206497
Energy: 0.3920688462112446
Energy: 0.37499810331640493
Energy: 0.3920688462102189
Energy: 0.37499810331743055
Energy: 0.3920688462112446
Energy: 0.37499810331640493
Energy: 0.3643134775329177
Energy: 0.37749569708752145
Energy: 0.364313477531892
Energy: 0.37749569708752145
Energy: 0.364313477531892
Energy: 0.37749569708752145
Energy: 0.3854150756916614
Energy: 0.37974890673266065
Energy: 0.38541507569063577
Energy: 0.37974890673266065
Energy: 0.3854150756916614
Energy: 0.37974890673266065
Energy: 0.3967591774824808
Energy: 0.3751083764152715
Energy: 0.39675917748145517
Energy: 0.3751083764162971
Energy: 0.3967591774824808
Energy: 0.3751083764152715
Energy: 0.35541977233722905
Energy: 0.38149977629796195
Energy: 0.35541977233722905
Energy: 0.38149977629796195
Energy: 0.35541977233722905
Energy: 0.38149977629796195

minimum gb energy = 0.3479675098136285 eV
minimum distance =  2.55548376125433 Angstroms
sigma value = 11


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

Energy: 0.43301878931770055
Energy: 0.4249436702727117
Energy: 0.43301878931544774
Energy: 0.4249436702727117
Energy: 0.43301878931724996
Energy: 0.4249436702727117
Energy: 0.38797349952182925
Energy: 0.410996494909038
Energy: 0.38797349952182925
Energy: 0.410996494909038
Energy: 0.3879734995222798
Energy: 0.410996494909038
Energy: 0.42620538046116746
Energy: 0.4075310706645879
Energy: 0.4262053804616181
Energy: 0.4075310706645879
Energy: 0.42620538046116746
Energy: 0.4075310706645879
Energy: 0.415229930007167
Energy: 0.38754266251945785
Energy: 0.4152299300076176
Energy: 0.38754266251945785
Energy: 0.41522993000671654
Energy: 0.38754266251945785
Energy: 0.4076392740812979
Energy: 0.40432431082062675
Energy: 0.40763927408174844
Energy: 0.40432431082062675
Energy: 0.4076392740808473
Energy: 0.40432431082062675
Energy: 0.39733476210755836
Energy: 0.4241064833057288
Energy: 0.39733476210755836
Energy: 0.4241064833057288
Energy: 0.39733476210755836
Energy: 0.4241064833057288
Energy: 0.4120723905616419
Energy: 0.39666003001393063
Energy: 0.4120723905616419
Energy: 0.39666003001348005
Energy: 0.41207239056074085
Energy: 0.39666003001348005
Energy: 0.4041672607619285
Energy: 0.41625832545695113
Energy: 0.4041672607610274
Energy: 0.41625832545695113
Energy: 0.404167260762379
Energy: 0.41625832545695113
Energy: 0.41176107825664027
Energy: 0.40873683697484087
Energy: 0.41176107825664027
Energy: 0.40873683697529145
Energy: 0.41176107825664027
Energy: 0.40873683697484087
Energy: 0.4036578443974775
Energy: 0.4069409881228069
Energy: 0.40365784439657637
Energy: 0.4069409881228069
Energy: 0.4036578443974775
Energy: 0.4069409881228069
Energy: 0.3904006182906973
Energy: 0.40438399560788946
Energy: 0.3904006182906973
Energy: 0.40438399560788946
Energy: 0.3904006182911478
Energy: 0.4043839956074389
Energy: 0.4161102221159754
Energy: 0.41764424534026096
Energy: 0.41611022211552473
Energy: 0.41764424533981037
Energy: 0.41611022211552473
Energy: 0.41764424534026096
Energy: 0.41443415785641985
Energy: 0.4061229945351664
Energy: 0.4144341578573005
Energy: 0.406122994535617
Energy: 0.41443415785641985
Energy: 0.406122994535617
Energy: 0.4035841163204937
Energy: 0.4201170264317565
Energy: 0.40358411632004315
Energy: 0.4201170264313059
Energy: 0.40358411632094426
Energy: 0.4201170264317565
Energy: 0.3888273031601762
Energy: 0.410698292611826
Energy: 0.3888273031601762
Energy: 0.410698292611826
Energy: 0.3888273031601762
Energy: 0.410698292611826
Energy: 0.4113533071081326
Energy: 0.3958819685283731
Energy: 0.4113533071081326
Energy: 0.3958819685279225
Energy: 0.4113533071081326
Energy: 0.3958819685279225
Energy: 0.3887811346096525
Energy: 0.4093873325662044
Energy: 0.3887811346096525
Energy: 0.4093873325662044
Energy: 0.38878113460920194
Energy: 0.4093873325662044
Energy: 0.41066543199153893
Energy: 0.4172628224799232
Energy: 0.41066543199153893
Energy: 0.4172628224799232
Energy: 0.41066543199153893
Energy: 0.4172628224799232
Energy: 0.4017862346109643
Energy: 0.3845136045189226
Energy: 0.4017862346100632
Energy: 0.3845136045189226
Energy: 0.4017862346114149
Energy: 0.3845136045189226
Energy: 0.39897324404144696
Energy: 0.40416951626779213
Energy: 0.39897324404054585
Energy: 0.40416951626779213
Energy: 0.3989732440409964
Energy: 0.40416951626779213
Energy: 0.3929586361958987
Energy: 0.4020188438753739
Energy: 0.3929586361954482
Energy: 0.4020188438753739
Energy: 0.39295863619409643
Energy: 0.4020188438753739
Energy: 0.4332605628845612
Energy: 0.423555126797384
Energy: 0.43326056288546233
Energy: 0.423555126797384
Energy: 0.43326056288501175
Energy: 0.423555126797384
Energy: 0.41128816642622346
Energy: 0.4046024680377286
Energy: 0.41128816642712457
Energy: 0.4046024680377286
Energy: 0.4112881664275752
Energy: 0.4046024680377286
Energy: 0.4212112977079778
Energy: 0.40753954296369665
Energy: 0.42121129770842836
Energy: 0.40753954296369665
Energy: 0.42121129770842836
Energy: 0.40753954296324607
Energy: 0.4034161792899278
Energy: 0.4042966877499436
Energy: 0.4034161792890267
Energy: 0.4042966877499436
Energy: 0.40341617928859663
Energy: 0.4042966877499436
Energy: 0.393172049240433
Energy: 0.40474669905413646
Energy: 0.39317204924088356
Energy: 0.4047466990536858
Energy: 0.393172049240433
Energy: 0.40474669905413646
Energy: 0.396751324777322
Energy: 0.4225652906786462
Energy: 0.3967513247768714
Energy: 0.42256529067909676
Energy: 0.3967513247768714
Energy: 0.42256529067909676
Energy: 0.4144745085516824
Energy: 0.40199098366818964
Energy: 0.4144745085525835
Energy: 0.40199098366818964
Energy: 0.4144745085525835
Energy: 0.40199098366818964
Energy: 0.40365724001517117
Energy: 0.42079849714370304
Energy: 0.4036572400165228
Energy: 0.42079849714370304
Energy: 0.40365724001562175
Energy: 0.42079849714370304
Energy: 0.4032974005982604
Energy: 0.3852435246514729
Energy: 0.4032974005991615
Energy: 0.3852435246514729
Energy: 0.4032974005991615
Energy: 0.3852435246514729
Energy: 0.405125000990571
Energy: 0.4187926637934029
Energy: 0.405125000990571
Energy: 0.4187926637934029
Energy: 0.405125000990571
Energy: 0.4187926637934029

minimum gb energy = 0.3845136045189226 eV
minimum distance =  2.54359101408432 Angstroms
sigma value = 57


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

Energy: 0.37625763598537465
Energy: 0.38026491377673693
Energy: 0.3762576359861764
Energy: 0.38026491377673693
Energy: 0.37625763598537465
Energy: 0.38026491377673693
Energy: 0.38140408873002374
Energy: 0.3865199761697029
Energy: 0.3814040887308255
Energy: 0.3865199761697029
Energy: 0.3814040887308255
Energy: 0.3865199761697029
Energy: 0.4125111573107284
Energy: 0.39385741585975564
Energy: 0.4125111573107284
Energy: 0.39385741585975564
Energy: 0.4125111573107284
Energy: 0.39385741585975564
Energy: 0.38270127867953446
Energy: 0.44372216180099927
Energy: 0.38270127867953446
Energy: 0.44372216180099927
Energy: 0.38270127867953446
Energy: 0.44372216180099927
Energy: 0.4125366713346504
Energy: 0.3938666383380811
Energy: 0.4125366713346504
Energy: 0.3938666383380811
Energy: 0.4125366713346504
Energy: 0.3938666383388829
Energy: 0.38139781759723007
Energy: 0.4004267791748453
Energy: 0.38139781759723007
Energy: 0.4004267791740436
Energy: 0.38139781759723007
Energy: 0.4004267791748453
Energy: 0.3762576359837711
Energy: 0.38026491377433164
Energy: 0.37625763598296924
Energy: 0.3802649137751335
Energy: 0.3762576359837711
Energy: 0.38026491377433164
Energy: 0.3814040887308255
Energy: 0.38651997617130646
Energy: 0.3814040887308255
Energy: 0.38651997617130646
Energy: 0.3814040887308255
Energy: 0.38651997617130646
Energy: 0.41251115730992666
Energy: 0.3938574158589538
Energy: 0.4125111573107284
Energy: 0.3938574158581521
Energy: 0.41251115730912485
Energy: 0.3938574158589538
Energy: 0.3827012786811379
Energy: 0.41172624329905333
Energy: 0.38270127868033615
Energy: 0.43534635158847634
Energy: 0.3827012786811379
Energy: 0.4130394915532712
Energy: 0.41253667133545213
Energy: 0.3938666383380811
Energy: 0.41253667133545213
Energy: 0.3938666383380811
Energy: 0.41253667133545213
Energy: 0.3938666383380811
Energy: 0.3813978175988336
Energy: 0.37391044152773106
Energy: 0.3813978175980318
Energy: 0.37391044152773106
Energy: 0.3813978175980318
Energy: 0.3739104415285329
Energy: 0.37625763598537465
Energy: 0.38026491377673693
Energy: 0.37625763598537465
Energy: 0.38026491377673693
Energy: 0.37625763598537465
Energy: 0.38026491377673693
Energy: 0.3814040887308255
Energy: 0.3865199761697029
Energy: 0.38140408873002374
Energy: 0.3865199761697029
Energy: 0.3814040887308255
Energy: 0.3865199761697029
Energy: 0.4125111573107284
Energy: 0.39385741585975564
Energy: 0.4125111573115302
Energy: 0.3938574158589538
Energy: 0.41251115730992666
Energy: 0.39385741585975564
Energy: 0.38270127867953446
Energy: 0.4117262433006569
Energy: 0.3827012786787326
Energy: 0.454965197462197
Energy: 0.38270127867953446
Energy: 0.3733953697700083
Energy: 0.41253667133545213
Energy: 0.3938666383388829
Energy: 0.4125366713346504
Energy: 0.3938666383380811
Energy: 0.41253667133384864
Energy: 0.3938666383388829

minimum gb energy = 0.3733953697700083 eV
minimum distance =  2.58609685822947 Angstroms
sigma value = 9


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

Energy: 0.42150725321416116
Energy: 0.43608694268366943
Energy: 0.4215072532121972
Energy: 0.43608694268366943
Energy: 0.4215072532128519
Energy: 0.43608694268301473
Energy: 0.4152514369862246
Energy: 0.4063324763730615
Energy: 0.4152514369855699
Energy: 0.4063324763730615
Energy: 0.4152514369849153
Energy: 0.4063324763730615
Energy: 0.40761043399084856
Energy: 0.4082261209270864
Energy: 0.40761043399084856
Energy: 0.4082261209270864
Energy: 0.40761043399084856
Energy: 0.40822612092774097
Energy: 0.40457981741654614
Energy: 0.43827760269459043
Energy: 0.4045798174178554
Energy: 0.4382776026939358
Energy: 0.4045798174178554
Energy: 0.4382776026939358
Energy: 0.41029065721096
Energy: 0.39733803886417435
Energy: 0.41029065721357855
Energy: 0.39733803886417435
Energy: 0.4102906572096507
Energy: 0.39733803886417435
Energy: 0.4195867091697575
Energy: 0.4139755278857041
Energy: 0.4195867091697575
Energy: 0.4139755278857041
Energy: 0.41958670916910284
Energy: 0.4139755278857041
Energy: 0.40366042596440993
Energy: 0.419395035584781
Energy: 0.4036604259657192
Energy: 0.419395035584781
Energy: 0.4036604259650645
Energy: 0.4193950355841263
Energy: 0.4067194370337956
Energy: 0.4230484110548535
Energy: 0.4067194370337956
Energy: 0.4230484110548535
Energy: 0.4067194370351049
Energy: 0.4230484110548535
Energy: 0.4451423465970963
Energy: 0.4157565566135088
Energy: 0.445142346597751
Energy: 0.4157565566135088
Energy: 0.4451423465970963
Energy: 0.4157565566135088
Energy: 0.40215312381650825
Energy: 0.406907999020383
Energy: 0.40215312381650825
Energy: 0.406907999020383
Energy: 0.4021531238178176
Energy: 0.406907999020383
Energy: 0.40739537111255014
Energy: 0.41642509713210546
Energy: 0.40739537111385943
Energy: 0.41642509713276005
Energy: 0.40739537111385943
Energy: 0.41642509713210546
Energy: 0.43359038679094336
Energy: 0.41162993212985394
Energy: 0.43359038679225265
Energy: 0.41162993212985394
Energy: 0.43359038679159795
Energy: 0.41162993212985394
Energy: 0.40574038749829944
Energy: 0.4299383781919771
Energy: 0.4057403874976448
Energy: 0.4299383781913225
Energy: 0.40574038749699015
Energy: 0.4299383781919771
Energy: 0.4111276426864147
Energy: 0.4152026095261884
Energy: 0.41112764268772395
Energy: 0.4152026095268431
Energy: 0.41112764268837865
Energy: 0.4152026095268431
Energy: 0.42036859240658364
Energy: 0.41242506057347
Energy: 0.42036859240527435
Energy: 0.41242506057347
Energy: 0.420368592405929
Energy: 0.41242506057347
Energy: 0.4270550556062575
Energy: 0.4192398429205121
Energy: 0.4270550556062575
Energy: 0.4192398429205121
Energy: 0.4270550556062575
Energy: 0.4192398429205121
Energy: 0.4101876541744461
Energy: 0.4231301943727222
Energy: 0.4101876541731368
Energy: 0.4231301943733768
Energy: 0.4101876541724821
Energy: 0.4231301943727222
Energy: 0.4466596519572642
Energy: 0.4130331585677203
Energy: 0.4466596519566096
Energy: 0.4130331585677203
Energy: 0.4466596519585735
Energy: 0.4130331585677203
Energy: 0.4005678302322307
Energy: 0.4112973294045191
Energy: 0.40056783023354
Energy: 0.4112973294045191
Energy: 0.4005678302322307
Energy: 0.41129732940517366
Energy: 0.40694920459853723
Energy: 0.397172177468051
Energy: 0.4069492045991918
Energy: 0.397172177468051
Energy: 0.40694920459853723
Energy: 0.3971721774673964
Energy: 0.4351968728361564
Energy: 0.410927845939613
Energy: 0.43519687283746566
Energy: 0.410927845939613
Energy: 0.43519687283874525
Energy: 0.4109278459402676

minimum gb energy = 0.3971721774673964 eV
minimum distance =  2.55537833874457 Angstroms
sigma value = 27


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

Energy: 0.4418946711189954
Energy: 0.4016468906571268
Energy: 0.4323879221589406
Energy: 0.40164689065547127
Energy: 0.4418946711189954
Energy: 0.40164689065326403
Energy: 0.4295480860124781
Energy: 0.3936367977307731
Energy: 0.4295480860124781
Energy: 0.3936367977307731
Energy: 0.4295480860130299
Energy: 0.39363679773132493
Energy: 0.4018963993644561
Energy: 0.39444884765670596
Energy: 0.4018963993644561
Energy: 0.39444884765670596
Energy: 0.4018963993644561
Energy: 0.39444884765670596
Energy: 0.39164005297249826
Energy: 0.41637436584916493
Energy: 0.39164005297249826
Energy: 0.41637436584916493
Energy: 0.39164005297249826
Energy: 0.41637436584422366
Energy: 0.38936692003670165
Energy: 0.41645205398613794
Energy: 0.3893669200350462
Energy: 0.41645205398613794
Energy: 0.38936692003670165
Energy: 0.4164520539866897
Energy: 0.4159619465807237
Energy: 0.42028262176932013
Energy: 0.41596194658127555
Energy: 0.4202826217698719
Energy: 0.4159619465807237
Energy: 0.42028262176821646
Energy: 0.382189552108624
Energy: 0.42897802575568533
Energy: 0.3821895521075203
Energy: 0.42897802575568533
Energy: 0.382189552108624
Energy: 0.4289780257523744
Energy: 0.4149052422913348
Energy: 0.3988458627869181
Energy: 0.41490524229299025
Energy: 0.39884586278636625
Energy: 0.4149052422902311
Energy: 0.39884586278912537
Energy: 0.4383220556685167
Energy: 0.3919245167730332
Energy: 0.4381307215279815
Energy: 0.3919245167730332
Energy: 0.4383220556690685
Energy: 0.391924516773585
Energy: 0.41782444515988804
Energy: 0.4172351494097812
Energy: 0.41786865000837564
Energy: 0.4172351494097812
Energy: 0.41782444515933626
Energy: 0.41723514940757395
Energy: 0.4153783643463944
Energy: 0.4084706254519189
Energy: 0.41539189820007877
Energy: 0.4084706254519189
Energy: 0.4153783643469463
Energy: 0.4084706254557817
Energy: 0.42328717744040956
Energy: 0.3836955686217755
Energy: 0.4232871774398577
Energy: 0.38369556862232734
Energy: 0.42328717744040956
Energy: 0.3836955686195683
Energy: 0.41093820003305565
Energy: 0.4303153868069489
Energy: 0.41093820003305565
Energy: 0.4303153868069489
Energy: 0.41093820003305565
Energy: 0.43031538680253445
Energy: 0.39043076584180236
Energy: 0.39981433676268474
Energy: 0.39043076583959513
Energy: 0.39981433676268474
Energy: 0.39043076584180236
Energy: 0.39981433676654743
Energy: 0.42030461311201917
Energy: 0.4305505191649904
Energy: 0.42086172687551854
Energy: 0.4305505191655422
Energy: 0.4203046131114674
Energy: 0.43055051916443854
Energy: 0.3892388997892076
Energy: 0.4164389923478724
Energy: 0.3892388997892076
Energy: 0.4164389923478724
Energy: 0.3892388997892076
Energy: 0.4164389923506316
Energy: 0.3800655304543137
Energy: 0.39905490748912154
Energy: 0.38006553045157965
Energy: 0.39905490748912154
Energy: 0.3800655304543137
Energy: 0.399054907490777
Energy: 0.41699549781804207
Energy: 0.4084768259465686
Energy: 0.41699549782024936
Energy: 0.4084768259465686
Energy: 0.41699549781804207
Energy: 0.4084768259471204
Energy: 0.40378526126847125
Energy: 0.39912714881712497
Energy: 0.38988419534210633
Energy: 0.39912714881712497
Energy: 0.40378526126847125
Energy: 0.39912714881767686
Energy: 0.44189467112561726
Energy: 0.4016468906571268
Energy: 0.43238792216169974
Energy: 0.4016468906587822
Energy: 0.44189467112616904
Energy: 0.40164689065657494
Energy: 0.4295480860124781
Energy: 0.3936367977296694
Energy: 0.42954808601082267
Energy: 0.39363679773022126
Energy: 0.4295480860124781
Energy: 0.3936367977324285
Energy: 0.40189639936004157
Energy: 0.3944488476556024
Energy: 0.4018963993578343
Energy: 0.3944488476556024
Energy: 0.4018963993594898
Energy: 0.3944488476561542
Energy: 0.3916400529730501
Energy: 0.41637436584753457
Energy: 0.3916400529730501
Energy: 0.4163743658480864
Energy: 0.3916400529730501
Energy: 0.41637436584477544
Energy: 0.3893669200411162
Energy: 0.4164520539811715
Energy: 0.3893669200411162
Energy: 0.4164520539811715
Energy: 0.3893669200411162
Energy: 0.41645205398282703
Energy: 0.4159619465752056
Energy: 0.420282621772631
Energy: 0.4159619465741019
Energy: 0.420282621772631
Energy: 0.4159619465746538
Energy: 0.42028262177318276

minimum gb energy = 0.38006553045157965 eV
minimum distance =  2.5607912654789 Angstroms
sigma value = 19


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

Energy: 0.3975611278296517
Energy: 0.40424147960336027
Energy: 0.3975611278296517
Energy: 0.40424147960336027
Energy: 0.397561127828699
Energy: 0.40424147960383655
Energy: 0.40067983747644537
Energy: 0.3811177985729374
Energy: 0.4006798374778743
Energy: 0.38111779857198474
Energy: 0.4006798374783506
Energy: 0.38111779857198474
Energy: 0.40965148104641125
Energy: 0.3707777544667455
Energy: 0.40965148104784027
Energy: 0.3707777544667455
Energy: 0.4096514810468876
Energy: 0.3707777544667455
Energy: 0.3772617726017011
Energy: 0.4089918064402361
Energy: 0.3772617726017011
Energy: 0.4089918064402361
Energy: 0.37726177260074845
Energy: 0.4089918064402361
Energy: 0.3862274154011035
Energy: 0.39957215603590607
Energy: 0.3862274153996746
Energy: 0.3995721560354298
Energy: 0.3862274154011035
Energy: 0.39957215603590607
Energy: 0.4138251799997241
Energy: 0.38180274306963236
Energy: 0.41382517999924784
Energy: 0.38180274306963236
Energy: 0.41382517999924784
Energy: 0.38180274306963236
Energy: 0.36726007816599615
Energy: 0.40494526740214215
Energy: 0.3672600781645672
Energy: 0.40494526740214215
Energy: 0.36726007816599615
Energy: 0.4049452674026185
Energy: 0.3847231771953081
Energy: 0.4080365108613519
Energy: 0.3847231771962607
Energy: 0.4080365108613519
Energy: 0.38472317719483173
Energy: 0.4080365108613519
Energy: 0.41732006701949165
Energy: 0.3688863726343158
Energy: 0.4173200670213969
Energy: 0.3688863726343158
Energy: 0.4173200670204443
Energy: 0.3688863726343158
Energy: 0.3931645221750284
Energy: 0.39531127948360045
Energy: 0.39316452217407577
Energy: 0.39531127948360045
Energy: 0.3931645221750284
Energy: 0.39531127948360045
Energy: 0.3771720655095746
Energy: 0.4065609759843455
Energy: 0.37717206551005095
Energy: 0.4065609759862508
Energy: 0.3771720655090983
Energy: 0.4065609759838691
Energy: 0.3953197537391444
Energy: 0.36891242831258436
Energy: 0.3953197537391444
Energy: 0.368912428312108
Energy: 0.3953197537386681
Energy: 0.368912428312108
Energy: 0.3867928500940356
Energy: 0.38245121533178655
Energy: 0.3867928500945119
Energy: 0.3824512153313102
Energy: 0.3867928500935593
Energy: 0.38245121533178655
Energy: 0.3794073155680931
Energy: 0.40907121124824086
Energy: 0.3794073155690457
Energy: 0.4090712112477645
Energy: 0.3794073155680931
Energy: 0.4090712112477645
Energy: 0.4010848902288741
Energy: 0.3692834923445844
Energy: 0.4010848902283978
Energy: 0.3692834923445844
Energy: 0.40108489022935045
Energy: 0.3692834923445844
Energy: 0.4015391599474822
Energy: 0.3666790544130647
Energy: 0.40153915994843487
Energy: 0.3666790544130647
Energy: 0.40153915994938744
Energy: 0.3666790544130647
Energy: 0.3763504711274318
Energy: 0.3910001346940693
Energy: 0.3763504711269555
Energy: 0.3910001346940693
Energy: 0.3763504711274318
Energy: 0.3910001346940693
Energy: 0.3988122739463489
Energy: 0.40213605796778906
Energy: 0.39881227394682517
Energy: 0.40213605796778906
Energy: 0.39881227394682517
Energy: 0.40213605796778906
Energy: 0.39708272102801384
Energy: 0.3805283205735336
Energy: 0.3970827210265848
Energy: 0.3805283205735336
Energy: 0.41160657157295916
Energy: 0.3805283205735336
Energy: 0.37671788867162614
Energy: 0.41127192350552044
Energy: 0.3767178886711498
Energy: 0.4112719235059968
Energy: 0.37671788867162614
Energy: 0.4112719235059968
Energy: 0.36429545744989694
Energy: 0.4235032672858804
Energy: 0.36429545744989694
Energy: 0.4235032672858804
Energy: 0.36429545744942066
Energy: 0.4235032672858804
Energy: 0.41831407896090284
Energy: 0.3694949961903916
Energy: 0.4183140789618555
Energy: 0.3694949961903916
Energy: 0.4183140789613792
Energy: 0.3694949961903916
Energy: 0.4164533056330326
Energy: 0.3966495580356469
Energy: 0.4164533056325563
Energy: 0.3966495580356469
Energy: 0.4164533056325563
Energy: 0.3966495580356469
Energy: 0.39557340272427827
Energy: 0.40579036886986525
Energy: 0.39557340272427827
Energy: 0.40579036886986525
Energy: 0.3955734027233257
Energy: 0.40579036886986525
Energy: 0.4032377131953423
Energy: 0.3695563145940533
Energy: 0.4032377131953423
Energy: 0.3695563145945297
Energy: 0.4032377131948659
Energy: 0.3695563145945297
Energy: 0.38857850041186776
Energy: 0.37351321683390054
Energy: 0.38857850041186776
Energy: 0.37351321683390054
Energy: 0.3885785004113914
Energy: 0.3735132168334242
Energy: 0.36941424079863455
Energy: 0.40509244852755544
Energy: 0.3643739282604684
Energy: 0.40509244852755544
Energy: 0.3694142407991109
Energy: 0.40509244852755544
Energy: 0.40108440136492024
Energy: 0.3812210592375082
Energy: 0.4010844013653966
Energy: 0.3812210592375082
Energy: 0.40108440136349127
Energy: 0.3812210592375082
Energy: 0.4123896270660479
Energy: 0.3816062699042158
Energy: 0.4123896270655716
Energy: 0.3816062699042158
Energy: 0.4123896270665242
Energy: 0.38160626990469215

minimum gb energy = 0.36429545744942066 eV
minimum distance =  2.56400964720733 Angstroms
sigma value = 101


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

Energy: 0.3733066699973197
Energy: 0.41267292264094313
Energy: 0.37330666999606354
Energy: 0.41267292264094313
Energy: 0.37330666999648227
Energy: 0.4126729226405244
Energy: 0.3851216507177596
Energy: 0.3802523576048573
Energy: 0.38512165071817833
Energy: 0.3802523576048573
Energy: 0.3851216507190157
Energy: 0.3802523576048573
Energy: 0.39917317462915736
Energy: 0.3575684334247196
Energy: 0.3991731746299948
Energy: 0.3575684334247196
Energy: 0.39917317462915736
Energy: 0.3575684334247196
Energy: 0.3480516680809884
Energy: 0.3852908767555779
Energy: 0.34805166808182586
Energy: 0.38529087675892754
Energy: 0.3480516680805697
Energy: 0.38529087675850887
Energy: 0.3706073183455847
Energy: 0.384113121106213
Energy: 0.3706073183485156
Energy: 0.384113121106213
Energy: 0.3706073183455847
Energy: 0.384113121106213
Energy: 0.40374770628038253
Energy: 0.35699773121039785
Energy: 0.4037477062833135
Energy: 0.35699773121039785
Energy: 0.4037477062812199
Energy: 0.35699773121039785
Energy: 0.36867856918146286
Energy: 0.3779035931586526
Energy: 0.3686785691823004
Energy: 0.3779035931586526
Energy: 0.3686785691818816
Energy: 0.3779035931586526
Energy: 0.35069995074859034
Energy: 0.37950858536116383
Energy: 0.35069995074859034
Energy: 0.37950858536032644
Energy: 0.3506999507494278
Energy: 0.37950858536032644
Energy: 0.40145313245484593
Energy: 0.35529048431647425
Energy: 0.40145313245484593
Energy: 0.35529048431647425
Energy: 0.40145313245484593
Energy: 0.35529048431647425
Energy: 0.37111165756328474
Energy: 0.3791149671173163
Energy: 0.3711116575649597
Energy: 0.3791149671173163
Energy: 0.3711116575649597
Energy: 0.3791149671173163
Energy: 0.3497907503567342
Energy: 0.4275347097764322
Energy: 0.34979075035631546
Energy: 0.4275347097768509
Energy: 0.34979075035797125
Energy: 0.4275347097768509
Energy: 0.391473576904378
Energy: 0.3682745820605555
Energy: 0.39147357690605294
Energy: 0.3682745820605555
Energy: 0.3914735769047967
Energy: 0.3682745820605555
Energy: 0.39536146206455813
Energy: 0.3571971362450385
Energy: 0.395361462063302
Energy: 0.3571971362450385
Energy: 0.3953614620637207
Energy: 0.3571971362450385
Energy: 0.37574613526750167
Energy: 0.39058458781188704
Energy: 0.37574613526792044
Energy: 0.39058458781188704
Energy: 0.375746135267083
Energy: 0.3905845878123057
Energy: 0.3860854135134827
Energy: 0.3842558222344055
Energy: 0.3860854135126453
Energy: 0.3842558222344055
Energy: 0.3860854135134827
Energy: 0.3842558222344055
Energy: 0.3740950761928097
Energy: 0.3561331034256378
Energy: 0.3740950761919723
Energy: 0.3561331034256378
Energy: 0.3740950761928097
Energy: 0.3561331034256378
Energy: 0.348479528623774
Energy: 0.3935182258978626
Energy: 0.34847952862544884
Energy: 0.3935182258978626
Energy: 0.3484795286250301
Energy: 0.3935182258978626
Energy: 0.3498112112510567
Energy: 0.3822840859560901
Energy: 0.3498112112498005
Energy: 0.3822840859560901
Energy: 0.3498112112510567
Energy: 0.3822840859560901
Energy: 0.40196263701748125
Energy: 0.35544057856700867
Energy: 0.40196263701706253
Energy: 0.35544057856700867
Energy: 0.40196263701748125
Energy: 0.35544057856700867
Energy: 0.3719858341467244
Energy: 0.359648286682739
Energy: 0.3719858341483993
Energy: 0.359648286682739
Energy: 0.3719858341483993
Energy: 0.359648286682739
Energy: 0.3491837455712185
Energy: 0.42807785652621294
Energy: 0.3491837455707998
Energy: 0.42807785652621294
Energy: 0.34918374557205595
Energy: 0.42807785652621294
Energy: 0.39968841773128716
Energy: 0.3556619368904259
Energy: 0.3996884177308685
Energy: 0.3556619368904259
Energy: 0.3996884177308685
Energy: 0.3556619368904259
Energy: 0.40228898719677364
Energy: 0.3572275042208849
Energy: 0.40228898719593625
Energy: 0.3572275042208849
Energy: 0.40228898719593625
Energy: 0.3572275042208849
Energy: 0.34810636033777753
Energy: 0.4049700190000487
Energy: 0.34810636033819625
Energy: 0.4049700190000487
Energy: 0.34810636033819625
Energy: 0.4049700190000487
Energy: 0.3929512399181645
Energy: 0.3674704059552647
Energy: 0.3929512399198393
Energy: 0.3674704059552647
Energy: 0.3929512399177458
Energy: 0.367470405954846
Energy: 0.39550882596365167
Energy: 0.35620795937312366
Energy: 0.3955088259628143
Energy: 0.35620795937312366
Energy: 0.39550882596365167
Energy: 0.35620795937312366
Energy: 0.3734382557424924
Energy: 0.3907822971583969
Energy: 0.37343825574291106
Energy: 0.3907822971583969
Energy: 0.3734382557433298
Energy: 0.3907822971583969
Energy: 0.37354035900347843
Energy: 0.3961674641991574
Energy: 0.373540359002641
Energy: 0.3961674641991574
Energy: 0.37354035900347843
Energy: 0.3961674641991574
Energy: 0.4049784720324095
Energy: 0.3544200593445148
Energy: 0.4049784720336656
Energy: 0.3544200593445148
Energy: 0.4049784720340843
Energy: 0.35442005934493354
Energy: 0.3497271571190577
Energy: 0.3705961285370204
Energy: 0.34972715711947644
Energy: 0.370596128539114
Energy: 0.34972715712073255
Energy: 0.3705961285374392
Energy: 0.3489607973900814
Energy: 0.38900560833921727
Energy: 0.3489607973905002
Energy: 0.38900560833921727
Energy: 0.3489607973905002
Energy: 0.38900560833921727
Energy: 0.3992288570008345
Energy: 0.35582388149008676
Energy: 0.3992288569983223
Energy: 0.3558238814905055
Energy: 0.3992288570004158
Energy: 0.3558238814905055
Energy: 0.4043355324983472
Energy: 0.3570090630204297
Energy: 0.4043355324979284
Energy: 0.35700906302001095
Energy: 0.4043355324983472
Energy: 0.35700906302001095

minimum gb energy = 0.3480516680805697 eV
minimum distance =  2.58108060752588 Angstroms
sigma value = 33


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

Energy: 0.012276977126658437
Energy: 0.3066949842012089
Energy: 0.012276977126658437
Energy: 0.30669498420153746
Energy: 0.012276977126658437
Energy: 0.3066949842012089
Energy: 0.012676522515234118
Energy: 0.182656927860514
Energy: 0.012676522515234118
Energy: 0.18265692786084256
Energy: 0.012676522514886225
Energy: 0.18265692786084256
Energy: 0.515726774328041
Energy: 0.18234856021462095
Energy: 0.515726774328041
Energy: 0.18234856021531679
Energy: 0.515726774328041
Energy: 0.18234856021564533
Energy: 0.012676522513533304
Energy: 0.18265692786119048
Energy: 0.012676522514209764
Energy: 0.182656927861519
Energy: 0.012676522513861869
Energy: 0.182656927861519

minimum gb energy = 0.012276977126658437 eV
minimum distance =  2.87020805160783 Angstroms
sigma value = 1