Model name: model_name=EAM_Dynamo_Foiles_1985_Cu__MO_831121933939_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.615000009536743
cohesive_energy=3.5402784121650406
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01369167437974611
Energy: 0.7592257895868253
Energy: 0.01369167437974611
Energy: 0.7592257895868253
Energy: 0.01369167437974611
Energy: 0.7592257895871042
Energy: 0.7592257895874176
Energy: 0.7856979416558709
Energy: 0.7592257895868253
Energy: 0.7856979416555572
Energy: 0.7592257895868253
Energy: 0.7856979416561843
Energy: 0.01369167437974611
Energy: 0.7592257895868253
Energy: 0.013691674380059719
Energy: 0.7592257895868253
Energy: 0.013691674380059719
Energy: 0.7592257895868253
Energy: 0.7592257895871042
Energy: 0.7856979416558709
Energy: 0.7592257895868253
Energy: 0.7856979416555572
Energy: 0.7592257895871042
Energy: 0.7856979416561843
Energy: 0.01369167437974611
Energy: 0.7592257895871042
Energy: 0.013691674380059719
Energy: 0.7592257895871042
Energy: 0.013691674380059719
Energy: 0.7592257895868253
Energy: 0.7592257895868253
Energy: 0.7856979416561843
Energy: 0.7592257895871042
Energy: 0.7856979416558709
Energy: 0.7592257895868253
Energy: 0.7856979416568117

minimum gb energy = 0.01369167437974611 eV
minimum distance =  2.35442196369691 Angstroms
sigma value = 1


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

Energy: 0.9066805178542369
Energy: 0.8524585876186076
Energy: 0.9066805178549918
Energy: 0.8524585876201173
Energy: 0.9066805178542369
Energy: 0.8524585876186076
Energy: 0.9768512597266459
Energy: 0.7917456099718168
Energy: 0.9768512597289106
Energy: 0.7917456099718168
Energy: 0.9768512597274011
Energy: 0.7917456099725717
Energy: 0.9024527621029951
Energy: 0.8972589533118518
Energy: 0.8884974032664994
Energy: 0.897258953314082
Energy: 0.9024527621029951
Energy: 0.8972589533155919
Energy: 0.9552262425164781
Energy: 0.8331978455925673
Energy: 0.9552262425164781
Energy: 0.8331978455925673
Energy: 0.9552262425149682
Energy: 0.8331978455933221
Energy: 0.8623149430322022
Energy: 0.9078841214142438
Energy: 0.862314943033712
Energy: 0.9078841214187733
Energy: 0.862314943033712
Energy: 0.9078841214187733
Energy: 0.9040263271268109
Energy: 0.810451675557284
Energy: 0.9040263271275658
Energy: 0.8104516755595144
Energy: 0.9040263271260559
Energy: 0.8104516755595144
Energy: 0.8321018480299147
Energy: 0.8910050638965709
Energy: 0.8321018480314246
Energy: 0.8910050638905317
Energy: 0.8321018480321795
Energy: 0.8910050638905317
Energy: 0.8327935070729152
Energy: 0.9600369465884817
Energy: 0.8327935070751799
Energy: 0.9600369465892366
Energy: 0.8327935070751799
Energy: 0.9600369465877269
Energy: 0.9220954602415125
Energy: 0.8978319532639292
Energy: 0.9220954602407576
Energy: 0.8978319532639292
Energy: 0.9220954602430221
Energy: 0.897831953264684
Energy: 0.7822787475409021
Energy: 0.9483184767289916
Energy: 0.7822787475409021
Energy: 0.9483184767350307
Energy: 0.7822787475401471
Energy: 0.9483184767274818
Energy: 0.8964304103158518
Energy: 0.8098944455567043
Energy: 0.8964304103143419
Energy: 0.8098944455567043
Energy: 0.8964304103120774
Energy: 0.8098944455574593
Energy: 0.7652755348330468
Energy: 0.9197833113609987
Energy: 0.7652755348338016
Energy: 0.9197833113579791
Energy: 0.7652755348330468
Energy: 0.919783311359489
Energy: 0.9871867691313372
Energy: 0.7593788148200925
Energy: 0.9871867691283176
Energy: 0.7593788148193376
Energy: 0.987186769132092
Energy: 0.7593788148200925
Energy: 0.8234323911680228
Energy: 0.839066112305041
Energy: 0.8234323911680228
Energy: 0.839066112305041
Energy: 0.8234323911687778
Energy: 0.8390661123035311
Energy: 1.0087036051512464
Energy: 0.793198512299567
Energy: 1.0087036051482265
Energy: 0.793198512298812
Energy: 1.0087036051482265
Energy: 0.793198512298812
Energy: 1.0085386502708715
Energy: 0.9067365806841439
Energy: 1.008538650269362
Energy: 0.9067365806856538
Energy: 1.0085386502701166
Energy: 0.9067365806886734
Energy: 0.8822984783311439
Energy: 0.8760244106415019
Energy: 0.8822984783334087
Energy: 0.8760244106407472
Energy: 0.8822984783341635
Energy: 0.8760244106422571
Energy: 0.8824565911306343
Energy: 0.8405906947377036
Energy: 0.8824565911344087
Energy: 0.8405906947399683
Energy: 0.8824565911366734
Energy: 0.8405906947384585
Energy: 0.8714165939947562
Energy: 0.8326397263157568
Energy: 0.8714165939962659
Energy: 0.8326397263172667
Energy: 0.8714165939955111
Energy: 0.8326397263180214
Energy: 0.9075852935102678
Energy: 0.8102614659741996
Energy: 0.9075852935080032
Energy: 0.8102614659741996
Energy: 0.9075852935087582
Energy: 0.8102614659772192
Energy: 0.8016436202631847
Energy: 0.9598562350745748
Energy: 0.8016436202616749
Energy: 0.9598562350730651
Energy: 0.8016436202631847
Energy: 0.9598562350708004
Energy: 0.9094957859625707
Energy: 0.8929547755762451
Energy: 0.9094957859603062
Energy: 0.8929547755762451
Energy: 0.9094957859625707
Energy: 0.8929547755762451
Energy: 0.7772919335269134
Energy: 0.9631133032001742
Energy: 0.777291933529178
Energy: 0.9631133032001742
Energy: 0.7772919335276682
Energy: 0.9631133032001742

minimum gb energy = 0.7593788148193376 eV
minimum distance =  2.29701788675903 Angstroms
sigma value = 33


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

Energy: 0.906314105448918
Energy: 0.9434314183444558
Energy: 0.906314105450206
Energy: 0.9434314183427384
Energy: 0.906314105448918
Energy: 0.9434314183427384
Energy: 0.9094515855789503
Energy: 0.8412947545091102
Energy: 0.9094515855806677
Energy: 0.8412947545082515
Energy: 0.9094515855815267
Energy: 0.8412947545086809
Energy: 0.7628185533488646
Energy: 0.8411148484960728
Energy: 0.7628185533501526
Energy: 0.8411148484960728
Energy: 0.7628185533488646
Energy: 0.8411148484965022
Energy: 0.9197275720573135
Energy: 0.9199437177074664
Energy: 0.9197275720573135
Energy: 0.9199437177066074
Energy: 0.9197275720581721
Energy: 0.9199437177087544
Energy: 0.8422719504837515
Energy: 0.8840991259214046
Energy: 0.8422719504850396
Energy: 0.8840991259214046
Energy: 0.8422719504846101
Energy: 0.8840991259192579
Energy: 0.8400092498622125
Energy: 0.7601708790647245
Energy: 0.8400092498630712
Energy: 0.7601708790647245
Energy: 0.8400092498626419
Energy: 0.760170879064295
Energy: 0.9439050756563734
Energy: 0.9062173054664057
Energy: 0.9439050756589497
Energy: 0.9062173054655468
Energy: 0.9439050756619553
Energy: 0.9062173054664057
Energy: 0.7573564724211487
Energy: 0.9067121395610179
Energy: 0.7573564724245837
Energy: 0.9067121395670292
Energy: 0.7573564724232955
Energy: 0.9067121395670292
Energy: 0.8032268733572351
Energy: 0.7619595824468703
Energy: 0.803226873358523
Energy: 0.7619595824468703
Energy: 0.8032268733576644
Energy: 0.7619595824468703
Energy: 0.7460639410650879
Energy: 0.8493834817217544
Energy: 0.7460639410668054
Energy: 0.8493834817144549
Energy: 0.7460639410676642
Energy: 0.8493834817170312
Energy: 0.8500554840802782
Energy: 0.7480920348777396
Energy: 0.8500554840751257
Energy: 0.7480920348785983
Energy: 0.8500554840768432
Energy: 0.7480920348773102
Energy: 0.760105162786188
Energy: 0.8006390628409212
Energy: 0.7601051627848998
Energy: 0.8006390628404918
Energy: 0.7601051627857585
Energy: 0.8006390628409212
Energy: 0.9076190833859591
Energy: 0.7562494483518943
Energy: 0.9076190833863884
Energy: 0.7562494483518943
Energy: 0.9076190833889648
Energy: 0.7562494483518943
Energy: 0.915176345087626
Energy: 0.9477536123432724
Energy: 0.9151763450880553
Energy: 0.9477536123445605
Energy: 0.9151763450884849
Energy: 0.9477536123458487
Energy: 0.8485149195368661
Energy: 0.8416258529077651
Energy: 0.8485149195385836
Energy: 0.8416258529060475
Energy: 0.8485149195360073
Energy: 0.8416258529077651
Energy: 0.7604416417106111
Energy: 0.8412837074827149
Energy: 0.7604416417101818
Energy: 0.8412837074818562
Energy: 0.7604416417084644
Energy: 0.8412837074801386
Energy: 0.9245028999967007
Energy: 0.9209256075669152
Energy: 0.9245028999954124
Energy: 0.9209256075660563
Energy: 0.9245028999967007
Energy: 0.9209256075669152
Energy: 0.8413949621325063
Energy: 0.7602192966770407
Energy: 0.841394962132077
Energy: 0.7602192966774701
Energy: 0.8413949621277832
Energy: 0.7602192966778994
Energy: 0.8438499438842557
Energy: 0.8486153824682464
Energy: 0.843849943884685
Energy: 0.84861538246567
Energy: 0.8438499438842557
Energy: 0.8486153824691051
Energy: 0.9444987383469178
Energy: 0.9087220155870738
Energy: 0.9444987383473471
Energy: 0.9087220155875031
Energy: 0.9444987383494942
Energy: 0.9087220155870738
Energy: 0.755490111181022
Energy: 0.9834135301309651
Energy: 0.7554901111801634
Energy: 0.9834135301288182
Energy: 0.7554901111814514
Energy: 0.9834135301318239
Energy: 0.8413253668740109
Energy: 0.7621252366398206
Energy: 0.8413253668757286
Energy: 0.7621252366402501
Energy: 0.8413253668731522
Energy: 0.7621252366393912
Energy: 0.7453466072040412
Energy: 0.8523692875492629
Energy: 0.7453466072040412
Energy: 0.8523692875531272
Energy: 0.7453466072044708
Energy: 0.8523692875423927
Energy: 0.8491036140944813
Energy: 0.8401920191907388
Energy: 0.8491036140901874
Energy: 0.8401920191903094
Energy: 0.84910361409534
Energy: 0.8401920191907388
Energy: 0.7660880417068556
Energy: 0.8902565561524505
Energy: 0.7660880417072852
Energy: 0.8902565561520212
Energy: 0.7660880417072852
Energy: 0.8902565561528799
Energy: 0.9062434981058161
Energy: 0.924903119848257
Energy: 0.906243498114833
Energy: 0.924903119857274
Energy: 0.9062434981139743
Energy: 0.924903119851692
Energy: 0.9064860432576708
Energy: 0.924738298535045
Energy: 0.9064860432546651
Energy: 0.9247382985389092
Energy: 0.9064860432593883
Energy: 0.9247382985384799
Energy: 0.7661536313293003
Energy: 0.8902805553497058
Energy: 0.7661536313305884
Energy: 0.8902805553505645
Energy: 0.7661536313297296
Energy: 0.8902805553514234
Energy: 0.8487100969524813
Energy: 0.8400594939746463
Energy: 0.8487100969499051
Energy: 0.8400594939746463
Energy: 0.8487100969477583
Energy: 0.840059493974217
Energy: 0.7453499601803171
Energy: 0.852647631838682
Energy: 0.7453499601803171
Energy: 0.8526476318459425
Energy: 0.7453499601811758
Energy: 0.8526476318429367
Energy: 0.8415154639226429
Energy: 0.7620958540657093
Energy: 0.8415154639243604
Energy: 0.7620958540661387
Energy: 0.8415154639273661
Energy: 0.7620958540657093
Energy: 0.7556547988689428
Energy: 0.9834400085383895
Energy: 0.7556547988689428
Energy: 0.9834400085379602
Energy: 0.7556547988689428
Energy: 0.9834400085371015
Energy: 0.9445147478709724
Energy: 0.908722175181815
Energy: 0.9445147478718312
Energy: 0.9087221751826736
Energy: 0.9445147478714019
Energy: 0.9087221751822443
Energy: 0.843853289996062
Energy: 0.8486623599617553
Energy: 0.843853289996062
Energy: 0.8486623599621848
Energy: 0.8438532899981699
Energy: 0.8486623599639022
Energy: 0.8413038048662113
Energy: 0.7601900295473069
Energy: 0.8413038048640645
Energy: 0.7601900295481656
Energy: 0.8413038048662113
Energy: 0.7601900295477363
Energy: 0.9245269433125454
Energy: 0.9209283488336836
Energy: 0.9245269433138337
Energy: 0.9209283488336836
Energy: 0.9245269433134041
Energy: 0.9209283488328249
Energy: 0.7605939116022873
Energy: 0.8412345342908115
Energy: 0.7605939116014286
Energy: 0.8412345342908115
Energy: 0.7605939116014286
Energy: 0.841234534292529
Energy: 0.8484159248979882
Energy: 0.8416191050800208
Energy: 0.8484159248997056
Energy: 0.8416191050795914
Energy: 0.8484159248997056
Energy: 0.8416191050787327
Energy: 0.9152187200764558
Energy: 0.9474733119576743
Energy: 0.9152187200768851
Energy: 0.9474733119559569
Energy: 0.9152187200764558
Energy: 0.9474733119542392
Energy: 0.9076333294304079
Energy: 0.7564219142957369
Energy: 0.9076333294325548
Energy: 0.7564219142961663
Energy: 0.9076333294278316
Energy: 0.7564219142965958
Energy: 0.7601076063207967
Energy: 0.8005554696544206
Energy: 0.7601076063207967
Energy: 0.80055546965485
Energy: 0.7601076063212261
Energy: 0.80055546965485

minimum gb energy = 0.7453466072040412 eV
minimum distance =  2.3984390611893 Angstroms
sigma value = 51


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

Energy: 0.8865891004514773
Energy: 0.8991011506371351
Energy: 0.8865891004514773
Energy: 0.8991011506371351
Energy: 0.8865891004514773
Energy: 0.89910115063813
Energy: 0.9504824818929409
Energy: 0.8422302410527351
Energy: 0.9504824818929409
Energy: 0.8422302410527351
Energy: 0.9504824818929409
Energy: 0.8422302410517402
Energy: 0.8490919946585346
Energy: 0.8876720685106888
Energy: 0.8490919946585346
Energy: 0.8876720685116839
Energy: 0.8490919946585346
Energy: 0.8876720685116839
Energy: 0.8817656726512031
Energy: 0.7761441220037131
Energy: 0.8817656726531927
Energy: 0.7761441220037131
Energy: 0.8817656726541876
Energy: 0.7761441220037131
Energy: 0.8975431981281151
Energy: 0.8595838898531679
Energy: 0.8975431981271201
Energy: 0.8595838898531679
Energy: 0.8975431981281151
Energy: 0.8595838898531679
Energy: 0.8974774864318447
Energy: 0.8593258967310924
Energy: 0.8974774864308497
Energy: 0.8593258967300974
Energy: 0.8974774864298549
Energy: 0.8593258967300974
Energy: 0.8800297061990087
Energy: 0.8593432225133488
Energy: 0.8800297061980591
Energy: 0.8593432225123542
Energy: 0.8800297061960694
Energy: 0.8593432225113593
Energy: 0.8144860424175554
Energy: 0.8604447784328525
Energy: 0.8144860424175554
Energy: 0.8604447784328525
Energy: 0.8144860424165606
Energy: 0.8604447784348422
Energy: 1.014408618027366
Energy: 0.7724910529975307
Energy: 1.014408618027366
Energy: 0.7724910529975307
Energy: 1.0144086180263707
Energy: 0.7724910529975307
Energy: 0.7907605226244012
Energy: 0.9049765936575634
Energy: 0.7907605226244012
Energy: 0.9049765935968764
Energy: 0.7907605226253962
Energy: 0.9049765934974349
Energy: 0.9329586955014096
Energy: 0.7738575908780035
Energy: 0.9329586955033996
Energy: 0.7738575908780035
Energy: 0.9329586955014096
Energy: 0.7738575908780035
Energy: 0.8878010802854397
Energy: 0.9013462383325863
Energy: 0.8878010802844448
Energy: 0.9013462383325863
Energy: 0.8878010802844448
Energy: 0.9013462383335813
Energy: 0.9478664142679535
Energy: 0.8414033647045971
Energy: 0.9478664142759125
Energy: 0.8414033647045971
Energy: 0.9478664142749176
Energy: 0.8414033647045971
Energy: 0.8492619250597707
Energy: 0.827283995276656
Energy: 0.8492619250597707
Energy: 0.8272839952746663
Energy: 0.849261925057781
Energy: 0.8272839952746663
Energy: 0.8889729591546949
Energy: 0.890963139246083
Energy: 0.8889729591566847
Energy: 0.890963139246083
Energy: 0.8889729591556897
Energy: 0.8909631392450881
Energy: 0.8964738579888434
Energy: 0.8592056777195963
Energy: 0.8964738579878486
Energy: 0.8592056777195963
Energy: 0.8964738579898383
Energy: 0.8592056777195963
Energy: 0.8979350720975595
Energy: 0.9324506903563011
Energy: 0.8979350720975595
Energy: 0.9324506903563011
Energy: 0.8979350720985545
Energy: 0.9324506903572958
Energy: 0.8793042439285991
Energy: 0.8632753890167902
Energy: 0.8793042439276041
Energy: 0.8632753890157956
Energy: 0.8793042439285991
Energy: 0.8632753890157956

minimum gb energy = 0.7724910529975307 eV
minimum distance =  2.29445022949555 Angstroms
sigma value = 19


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

Energy: 0.7358003493838282
Energy: 0.7468515741909418
Energy: 0.7358003493844182
Energy: 0.7468515741909418
Energy: 0.7358003493844182
Energy: 0.7468515741903519
Energy: 0.8183910054907022
Energy: 0.8930600698725069
Energy: 0.8183910054918825
Energy: 0.893060069873687
Energy: 0.8183910054960133
Energy: 0.8930600698725069
Energy: 0.7053505840159663
Energy: 0.8910383535570409
Energy: 0.7053505840159663
Energy: 0.8910383535558607
Energy: 0.705350584014786
Energy: 0.8910383535558607
Energy: 0.7717368575794936
Energy: 0.7054339402828638
Energy: 0.7717368575800837
Energy: 0.7054339402834539
Energy: 0.7717368575800837
Energy: 0.7054339402840439
Energy: 0.7254072951635333
Energy: 0.7334007374652611
Energy: 0.7254072951641236
Energy: 0.733400737464671
Energy: 0.7254072951635333
Energy: 0.7334007374652611
Energy: 0.7253592715178788
Energy: 0.7333799941823291
Energy: 0.7253592715184689
Energy: 0.7333799941811489
Energy: 0.7253592715184689
Energy: 0.7333799941817389
Energy: 0.7716400027000584
Energy: 0.7054052211331453
Energy: 0.7716400026988781
Energy: 0.7054052211331453
Energy: 0.7716400026994683
Energy: 0.7054052211331453
Energy: 0.7053952838203759
Energy: 0.8910390871370912
Energy: 0.7053952838197859
Energy: 0.8910390871376815
Energy: 0.7053952838197859
Energy: 0.8910390871370912
Energy: 0.8182879948433939
Energy: 0.8929250007013073
Energy: 0.8182879948428038
Energy: 0.8929250007013073
Energy: 0.8182879948433939
Energy: 0.8929250007013073
Energy: 0.7358003493838282
Energy: 0.7468515741903519
Energy: 0.7358003493844182
Energy: 0.7468515741909418
Energy: 0.7358003493838282
Energy: 0.7468515741909418
Energy: 0.8183910054960133
Energy: 0.8930600698730969
Energy: 0.8183910054930628
Energy: 0.8930600698713266
Energy: 0.8183910054948331
Energy: 0.8930600698725069
Energy: 0.7053505840153762
Energy: 0.8910383535558607
Energy: 0.7053505840153762
Energy: 0.8910383535558607
Energy: 0.7053505840159663
Energy: 0.8910383535564508
Energy: 0.7717368575794936
Energy: 0.7054339402834539
Energy: 0.7717368575806738
Energy: 0.7054339402840439
Energy: 0.7717368575794936
Energy: 0.7054339402846341
Energy: 0.7254072951635333
Energy: 0.7334007374652611
Energy: 0.7254072951641236
Energy: 0.733400737464671
Energy: 0.7254072951641236
Energy: 0.733400737464671
Energy: 0.7253592715178788
Energy: 0.7333799941817389
Energy: 0.7253592715178788
Energy: 0.7333799941817389
Energy: 0.7253592715184689
Energy: 0.7333799941817389
Energy: 0.7716400026994683
Energy: 0.7054052211325551
Energy: 0.7716400026994683
Energy: 0.7054052211331453
Energy: 0.7716400026994683
Energy: 0.7054052211325551
Energy: 0.7053952838197859
Energy: 0.8910390871370912
Energy: 0.7053952838197859
Energy: 0.8910390871376815
Energy: 0.7053952838197859
Energy: 0.891039087136501
Energy: 0.8182879948428038
Energy: 0.8929250007007172
Energy: 0.8182879948428038
Energy: 0.8929250007013073
Energy: 0.8182879948433939
Energy: 0.8929250007013073
Energy: 0.7358003493838282
Energy: 0.7468515741909418
Energy: 0.7358003493844182
Energy: 0.746851574191532
Energy: 0.7358003493838282
Energy: 0.7468515741909418
Energy: 0.8183910054948331
Energy: 0.8930600698730969
Energy: 0.8183910054948331
Energy: 0.8930600698730969
Energy: 0.8183910054930628
Energy: 0.8930600698725069
Energy: 0.7053505840159663
Energy: 0.8910383535570409
Energy: 0.7053505840159663
Energy: 0.8910383535558607
Energy: 0.7053505840153762
Energy: 0.8910383535558607
Energy: 0.7717368575800837
Energy: 0.7054339402840439
Energy: 0.7717368575794936
Energy: 0.7054339402834539
Energy: 0.7717368575800837
Energy: 0.7054339402840439
Energy: 0.7254072951635333
Energy: 0.733400737464671
Energy: 0.7254072951635333
Energy: 0.7334007374652611
Energy: 0.7254072951623531
Energy: 0.7334007374652611
Energy: 0.7253592715184689
Energy: 0.7333799941811489
Energy: 0.7253592715178788
Energy: 0.7333799941811489
Energy: 0.7253592715184689
Energy: 0.7333799941817389
Energy: 0.7716400026988781
Energy: 0.7054052211337354
Energy: 0.7716400027000584
Energy: 0.7054052211325551
Energy: 0.7716400027000584
Energy: 0.7054052211337354
Energy: 0.7053952838197859
Energy: 0.8910390871370912
Energy: 0.7053952838197859
Energy: 0.8910390871370912
Energy: 0.7053952838191956
Energy: 0.891039087135911
Energy: 0.8182879948422137
Energy: 0.8929250007013073
Energy: 0.8182879948445743
Energy: 0.8929250007013073
Energy: 0.8182879948422137
Energy: 0.8929250007013073
Energy: 0.7358003493844182
Energy: 0.7468515741909418
Energy: 0.7358003493844182
Energy: 0.746851574191532
Energy: 0.7358003493844182
Energy: 0.7468515741903519
Energy: 0.8183910054942429
Energy: 0.8930600698725069
Energy: 0.8183910054936528
Energy: 0.8930600698713266
Energy: 0.8183910054930628
Energy: 0.8930600698730969
Energy: 0.7053505840159663
Energy: 0.8910383535570409
Energy: 0.7053505840153762
Energy: 0.8910383535564508
Energy: 0.7053505840153762
Energy: 0.8910383535547073

minimum gb energy = 0.705350584014786 eV
minimum distance =  2.30664230722965 Angstroms
sigma value = 27


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

Energy: 0.7281579686339533
Energy: 0.7061512978557967
Energy: 0.7281579686353989
Energy: 0.7061512978557967
Energy: 0.7281579686339533
Energy: 0.7061512978557967
Energy: 0.8307741549051166
Energy: 0.7313962629883124
Energy: 0.8307741549051166
Energy: 0.7313962629883124
Energy: 0.8307741549036711
Energy: 0.7313962629883124
Energy: 0.7312465525299642
Energy: 0.8091375445050002
Energy: 0.7312465525588744
Energy: 0.8091375445021093
Energy: 0.7312465525270733
Energy: 0.8091375445050002
Energy: 0.8160747828815423
Energy: 0.6859654584026228
Energy: 0.8160747828815423
Energy: 0.6859654584026228
Energy: 0.8160747828800968
Energy: 0.6859654584011772
Energy: 0.8142301198811785
Energy: 0.6858711506617624
Energy: 0.8142301198811785
Energy: 0.6858711506617624
Energy: 0.8142301198826241
Energy: 0.6858711506617624
Energy: 0.8272274776207766
Energy: 0.8622050517702905
Energy: 0.8272274776207766
Energy: 0.8622050517702905
Energy: 0.8272274776222223
Energy: 0.862205051768845
Energy: 0.7744869182793066
Energy: 0.7338451850069656
Energy: 0.7744869182793066
Energy: 0.7338451850069656
Energy: 0.7744869182807521
Energy: 0.7338451850069656
Energy: 0.7236278618118818
Energy: 0.709727132638553
Energy: 0.7236278618104364
Energy: 0.709727132638553
Energy: 0.7236278618118818
Energy: 0.7097271326399984
Energy: 0.8304188716090751
Energy: 0.731060570753858
Energy: 0.8304188716090751
Energy: 0.731060570748076
Energy: 0.8304188716090751
Energy: 0.731060570748076
Energy: 0.7929144816249126
Energy: 0.8319269495240246
Energy: 0.7929144816249126
Energy: 0.8319269495240246
Energy: 0.7929144816249126
Energy: 0.8319269495254702
Energy: 0.7644325714130423
Energy: 0.6867125786933734
Energy: 0.7644325714130423
Energy: 0.6867125786933734
Energy: 0.8257699919727437
Energy: 0.6867125786933734
Energy: 0.859299407218802
Energy: 0.7875887036737386
Energy: 0.859299407218802
Energy: 0.7875887036751841
Energy: 0.859299407218802
Energy: 0.7875887036737386

minimum gb energy = 0.6858711506617624 eV
minimum distance =  2.28868707361317 Angstroms
sigma value = 9


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

Energy: 0.7291033981656916
Energy: 0.6959696317809453
Energy: 0.7291033981673163
Energy: 0.6959696317809453
Energy: 0.7291033981660978
Energy: 0.6959696317817575
Energy: 0.6934306741406975
Energy: 0.6520581478217249
Energy: 0.693430674134605
Energy: 0.7203996023164674
Energy: 0.693430674141916
Energy: 0.6685029544284283
Energy: 0.6368635127294463
Energy: 0.7098061834296456
Energy: 0.6368635127298525
Energy: 0.709806183430458
Energy: 0.6368635127274156
Energy: 0.7098061834300518
Energy: 0.6573578444924968
Energy: 0.6312062325806571
Energy: 0.657357844490466
Energy: 0.631206232580251
Energy: 0.6573578444924968
Energy: 0.6312062325794386
Energy: 0.7008922919259295
Energy: 0.6776208279287292
Energy: 0.7008922919275541
Energy: 0.6776208279283231
Energy: 0.7008922919255234
Energy: 0.6776208279287292
Energy: 0.7099911172338748
Energy: 0.7184570597826019
Energy: 0.7099911172387485
Energy: 0.7184570597886942
Energy: 0.7099911172359055
Energy: 0.7230332928101606
Energy: 0.6700011494959096
Energy: 0.727463994905572
Energy: 0.6700011494955034
Energy: 0.7274639949051659
Energy: 0.6700011494946911
Energy: 0.7274639949047597
Energy: 0.6181314840625453
Energy: 0.7028385533211327
Energy: 0.6181314840617329
Energy: 0.7028385533203203
Energy: 0.6181314840633575
Energy: 0.7028385533247881
Energy: 0.7059504271870035
Energy: 0.6773984389505134
Energy: 0.705950427183348
Energy: 0.6773984389501073
Energy: 0.7059504271845666
Energy: 0.6773984389492951
Energy: 0.6922902602512961
Energy: 0.8102375320283592
Energy: 0.6922902602521084
Energy: 0.8102375320238915
Energy: 0.6922902602517023
Energy: 0.8102375320238915
Energy: 0.65594208724952
Energy: 0.6371537955723091
Energy: 0.6559420872507384
Energy: 0.6371537955714968
Energy: 0.6559420872515508
Energy: 0.6371537955714968
Energy: 0.6602697335350415
Energy: 0.7177587348907083
Energy: 0.6602697335374784
Energy: 0.7177587348915205
Energy: 0.6602697335358538
Energy: 0.7177587348919267
Energy: 0.6904734715097102
Energy: 0.6853116719091582
Energy: 0.6904734715113348
Energy: 0.6853116719095644
Energy: 0.6904734715097102
Energy: 0.6853116719091582
Energy: 0.7248146756071636
Energy: 0.65135121309772
Energy: 0.7248146756059451
Energy: 0.6513512131054
Energy: 0.7248146756031022
Energy: 0.6513512130997509
Energy: 0.642678847139134
Energy: 0.7041152189748267
Energy: 0.6426788471379157
Energy: 0.7041152189744204
Energy: 0.6426788471375096
Energy: 0.7041152189744204
Energy: 0.6426690324721794
Energy: 0.7207378366118918
Energy: 0.6426690324705547
Energy: 0.7207378366114856
Energy: 0.6426690324733979
Energy: 0.7207378366086425
Energy: 0.8362932850532844
Energy: 0.6318097495455551
Energy: 0.8362932850528781
Energy: 0.6318097495447429
Energy: 0.8362932850528781
Energy: 0.6318097495443367
Energy: 0.6523431431699361
Energy: 0.6756586199490394
Energy: 0.6523431431670932
Energy: 0.6756586199490394
Energy: 0.65234314316953
Energy: 0.6756586199490394
Energy: 0.6230865268196117
Energy: 0.8442304480371229
Energy: 0.6230865268208302
Energy: 0.8442304480346859
Energy: 0.6230865268171749
Energy: 0.8442304480354982
Energy: 0.7585901349600378
Energy: 0.6996230144102216
Energy: 0.7585901349608501
Energy: 0.6996230144102216
Energy: 0.7585901349608501
Energy: 0.7525060494879429
Energy: 0.6149840970470408
Energy: 0.8443718450129465
Energy: 0.6149840970458224
Energy: 0.8443718450214757
Energy: 0.6149840970462285
Energy: 0.8443718450149772
Energy: 0.651843274360815
Energy: 0.6758310964119717
Energy: 0.6518432743587843
Energy: 0.6758310964123777
Energy: 0.651843274357972
Energy: 0.6758310964115656
Energy: 0.8364689381584607
Energy: 0.6316471106236966
Energy: 0.8364689381584607
Energy: 0.6316471106236966
Energy: 0.8364689381576482
Energy: 0.6316471106232904
Energy: 0.6428802389589247
Energy: 0.7125153775680045
Energy: 0.6428802389577062
Energy: 0.7125153775667861
Energy: 0.6428802389589247
Energy: 0.712515377569223
Energy: 0.6426511170926584
Energy: 0.7038892692749564
Energy: 0.6426511170918461
Energy: 0.7038892692741441
Energy: 0.6426511170930646
Energy: 0.7038892692745503
Energy: 0.7251093334652495
Energy: 0.7037703126250144
Energy: 0.7251093334644372
Energy: 0.7037703126282637
Energy: 0.7251093334648433
Energy: 0.7037703126274514
Energy: 0.6905846014700266
Energy: 0.6854679000895518
Energy: 0.6905846014720574
Energy: 0.6854679000915826
Energy: 0.6905846014696205
Energy: 0.6854679000919889
Energy: 0.6605365789584626
Energy: 0.691897932520299
Energy: 0.6605365789580565
Energy: 0.6918979325190805
Energy: 0.6605365789584626
Energy: 0.691897932520299
Energy: 0.6566440912424337
Energy: 0.6368329502872655
Energy: 0.6566440912440584
Energy: 0.6368329502864533
Energy: 0.6566440912420276
Energy: 0.6368329502864533
Energy: 0.6952329329524057
Energy: 0.6645264597567478
Energy: 0.6952329329503749
Energy: 0.6645264597774246
Energy: 0.6952329329515934
Energy: 0.6645264597445631
Energy: 0.7058287732061704
Energy: 0.6776431847674814
Energy: 0.7058287732053581
Energy: 0.6776431847678507
Energy: 0.7058287732033274
Energy: 0.6776431847678507
Energy: 0.6182934459499114
Energy: 0.7028404957592086
Energy: 0.6182934459499114
Energy: 0.7028404957494608
Energy: 0.6182934459490992
Energy: 0.7028404957490546
Energy: 0.6701292473825194
Energy: 0.7275610560991356
Energy: 0.6701292473793071
Energy: 0.7275610560987295
Energy: 0.6701292473829256
Energy: 0.7275610560983232
Energy: 0.7100766287239623
Energy: 0.6920073390826426
Energy: 0.7100766287263992
Energy: 0.7003316119860931
Energy: 0.7100766287259931
Energy: 0.7003316119394223
Energy: 0.7011707418888583
Energy: 0.6776505527099306
Energy: 0.7011707418896707
Energy: 0.6776505527099306
Energy: 0.7011707418868276
Energy: 0.6776505527091182
Energy: 0.657550097394091
Energy: 0.6311599931198028
Energy: 0.6575500973961218
Energy: 0.6311599931198028
Energy: 0.6575500973924663
Energy: 0.6311599931210212
Energy: 0.6369839057991592
Energy: 0.7097538166342947
Energy: 0.6369839057987531
Energy: 0.7097538166355133
Energy: 0.6369839057955037
Energy: 0.7097538166351071
Energy: 0.6933149184175047
Energy: 0.628263630078038
Energy: 0.69331491848164
Energy: 0.6282636300776319
Energy: 0.6933149184073508
Energy: 0.6428349819091465
Energy: 0.7291033981673163
Energy: 0.6959696317837882
Energy: 0.7291033981673163
Energy: 0.6959696317825699
Energy: 0.7291033981673163
Energy: 0.6959696317817575
Energy: 0.6934306741386667
Energy: 0.6685029544272099
Energy: 0.6934306741378543
Energy: 0.6685029544272099
Energy: 0.6934306741382604
Energy: 0.6685029544280222
Energy: 0.6368635127270094
Energy: 0.7098061834328948
Energy: 0.6368635127282278
Energy: 0.7098061834324887
Energy: 0.636863512726197
Energy: 0.709806183433301
Energy: 0.6573578444892475
Energy: 0.6312062325765956
Energy: 0.6573578444900599
Energy: 0.6312062325765956
Energy: 0.657357844490466
Energy: 0.6312062325774079
Energy: 0.7008922919174002
Energy: 0.6776208279287292
Energy: 0.7008922919165879
Energy: 0.6776208279283231
Energy: 0.700892291916994
Energy: 0.6776208279283231

minimum gb energy = 0.6149840970458224 eV
minimum distance =  2.35777776860818 Angstroms
sigma value = 57


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

Energy: 0.31992187126098187
Energy: 0.3273567261445641
Energy: 0.31992187126005733
Energy: 0.3273567261445641
Energy: 0.31992187126005733
Energy: 0.32735672614271505
Energy: 0.3978349614534672
Energy: 0.3208295338844895
Energy: 0.3978349614534672
Energy: 0.32082953388264035
Energy: 0.39783496145254266
Energy: 0.32082953388356494
Energy: 0.3565901909380558
Energy: 0.392564723136731
Energy: 0.3565901909362067
Energy: 0.39256472313765556
Energy: 0.3565901909362067
Energy: 0.392564723136731
Energy: 0.3295698423634375
Energy: 0.3197572617785252
Energy: 0.3295698423634375
Energy: 0.3197572617812988
Energy: 0.329569842362513
Energy: 0.3197572617812988
Energy: 0.3971940921507284
Energy: 0.40337488307210667
Energy: 0.3971940921525775
Energy: 0.40337488307395575
Energy: 0.39719409214980383
Energy: 0.4033748830730312
Energy: 0.319845642690879
Energy: 0.3568099878990306
Energy: 0.319845642690879
Energy: 0.35680998789995516
Energy: 0.319845642690879
Energy: 0.35680998790180424
Energy: 0.3198557511449397
Energy: 0.35629951664144643
Energy: 0.31985575114401515
Energy: 0.35629951664144643
Energy: 0.3198557511449397
Energy: 0.35629951664052184
Energy: 0.39797434768370643
Energy: 0.4035085993952292
Energy: 0.39797434768463097
Energy: 0.4035085993952292
Energy: 0.39797434768370643
Energy: 0.4035085993952292
Energy: 0.32959121663468594
Energy: 0.3196913184572019
Energy: 0.3295912166337614
Energy: 0.3196913184553528
Energy: 0.32959121663283686
Energy: 0.3196913184507301
Energy: 0.3565613401143373
Energy: 0.39224520524320405
Energy: 0.3565613401143373
Energy: 0.3922452052441286
Energy: 0.3565613401143373
Energy: 0.39224520524320405
Energy: 0.39781635899240164
Energy: 0.3210787199158537
Energy: 0.39781635898962797
Energy: 0.32107871991677817
Energy: 0.39781635899147705
Energy: 0.3210787199158537
Energy: 0.31992187126098187
Energy: 0.32735672614548866
Energy: 0.31992187126098187
Energy: 0.3273567261436396
Energy: 0.31992187126098187
Energy: 0.3273567261445641
Energy: 0.39783496145439173
Energy: 0.32082953388171587
Energy: 0.39783496145254266
Energy: 0.32082953388356494
Energy: 0.3978349614534672
Energy: 0.32082953388264035
Energy: 0.3565901909371312
Energy: 0.392564723136731
Energy: 0.3565901909371312
Energy: 0.39256472313765556
Energy: 0.3565901909380558
Energy: 0.39256472313488194
Energy: 0.3295698423634375
Energy: 0.3197572617812988
Energy: 0.3295698423634375
Energy: 0.31975726177944974
Energy: 0.329569842362513
Energy: 0.31975726177944974
Energy: 0.3971940921507284
Energy: 0.40337488307210667
Energy: 0.3971940921525775
Energy: 0.4033748830730312
Energy: 0.3971940921507284
Energy: 0.4033748830730312
Energy: 0.319845642690879
Energy: 0.3568099879008797
Energy: 0.319845642690879
Energy: 0.35680998789995516
Energy: 0.319845642690879
Energy: 0.35680998789995516
Energy: 0.31985575114401515
Energy: 0.356299516642371
Energy: 0.31985575114401515
Energy: 0.35629951664144643
Energy: 0.31985575114401515
Energy: 0.356299516642371
Energy: 0.39797434768370643
Energy: 0.40350859939707845
Energy: 0.39797434768463097
Energy: 0.40350859939615374
Energy: 0.39797434768370643
Energy: 0.40350859939615374

minimum gb energy = 0.3196913184507301 eV
minimum distance =  2.4461411040345 Angstroms
sigma value = 11


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

Energy: 0.5630577729956178
Energy: 0.6866639230191124
Energy: 0.563057772996295
Energy: 0.6866639230191124
Energy: 0.5630577729969721
Energy: 0.6866639230197896
Energy: 0.6972760495585978
Energy: 0.5924906875808914
Energy: 0.697276049559275
Energy: 0.5924906875802142
Energy: 0.6972760495579206
Energy: 0.5924906875795369
Energy: 0.7033912033314914
Energy: 0.7865341510066356
Energy: 0.703391203333523
Energy: 0.7865341510079901
Energy: 0.703391203333523
Energy: 0.7865341510086673
Energy: 0.7244014206423445
Energy: 0.529266379918311
Energy: 0.7244014206430217
Energy: 0.529266379918311
Energy: 0.7244014206464079
Energy: 0.5292663799176338
Energy: 0.6658698032807124
Energy: 0.5128297106982163
Energy: 0.6658698032800352
Energy: 0.5128297106975389
Energy: 0.6658698032800352
Energy: 0.5128297106982163
Energy: 0.6352725521575946
Energy: 0.5230127135011838
Energy: 0.6352725521589492
Energy: 0.5230127135005067
Energy: 0.6352725521569174
Energy: 0.5230127135011838
Energy: 0.5103560004120586
Energy: 0.5543233912994664
Energy: 0.5103560004120586
Energy: 0.5543233913014981
Energy: 0.5103560004113814
Energy: 0.5543233912994664
Energy: 0.6960877043426447
Energy: 0.4889205214636218
Energy: 0.6960877043439992
Energy: 0.4889205214649763
Energy: 0.6960877043446765
Energy: 0.48892052146429904
Energy: 0.6950556433519323
Energy: 0.49288990240595504
Energy: 0.6950556433526095
Energy: 0.4928899024066323
Energy: 0.6950556433526095
Energy: 0.4928899024066323
Energy: 0.49933909100597723
Energy: 0.738834478296429
Energy: 0.49933909100597723
Energy: 0.7388344782943972
Energy: 0.4993390910066545
Energy: 0.7388344782923654
Energy: 0.641486118997002
Energy: 0.6460292956680438
Energy: 0.6414861189915839
Energy: 0.6460292956700756
Energy: 0.6414861189963248
Energy: 0.6460292956714301
Energy: 0.5292726702341631
Energy: 0.5157909637618325
Energy: 0.5292726702375495
Energy: 0.5157909637618325
Energy: 0.5292726702334859
Energy: 0.5157909637618325
Energy: 0.6218443130659217
Energy: 0.5337833209298797
Energy: 0.6218443130665989
Energy: 0.5337833209285253
Energy: 0.6218443130659217
Energy: 0.5337833209292024
Energy: 0.6896557477644181
Energy: 0.7650534859610542
Energy: 0.6896557477657727
Energy: 0.7650534859617314
Energy: 0.6896557477650954
Energy: 0.7650534859590223
Energy: 0.6964620085678268
Energy: 0.6023984810821165
Energy: 0.6964620085671495
Energy: 0.6023984810821165
Energy: 0.6964620085678268
Energy: 0.6023984810814392
Energy: 0.5434716854879256
Energy: 0.6947708488148201
Energy: 0.5434716854845393
Energy: 0.6947708488148201
Energy: 0.5434716854886028
Energy: 0.6947708488148201
Energy: 0.5673422874422543
Energy: 0.5915834904595935
Energy: 0.5673422874449633
Energy: 0.5915834904582389
Energy: 0.5673422874449633
Energy: 0.5915834904595935
Energy: 0.8623288003194213
Energy: 0.5828777132398608
Energy: 0.862328800316035
Energy: 0.5828777132405382
Energy: 0.8623288003187439
Energy: 0.5828777132418926
Energy: 0.639614505066254
Energy: 0.5259815187126964
Energy: 0.6396145050703175
Energy: 0.5259815187113419
Energy: 0.6396145050669312
Energy: 0.5259815187113419
Energy: 0.5296058895442695
Energy: 0.6155356720029771
Energy: 0.5296058895435922
Energy: 0.6155356720022999
Energy: 0.5296058895415604
Energy: 0.6155356720022999
Energy: 0.5006219743801406
Energy: 0.5257378924919082
Energy: 0.5006219743821723
Energy: 0.5257378924898765
Energy: 0.5006219743821723
Energy: 0.5257378924919082
Energy: 0.5319091325066257
Energy: 0.5540898134871776
Energy: 0.5319091325066257
Energy: 0.5540898134878549
Energy: 0.5319091325120439
Energy: 0.5540898134912411
Energy: 0.6079738877774217
Energy: 0.6175487669644777
Energy: 0.6079738877760671
Energy: 0.6175487669638003
Energy: 0.6079738877760671
Energy: 0.6175487669631231
Energy: 0.6938273883449827
Energy: 0.5882249296834537
Energy: 0.6938273883443054
Energy: 0.5882249296827765
Energy: 0.6938273883436282
Energy: 0.5882249296848082
Energy: 0.5007333562152942
Energy: 0.737724741694491
Energy: 0.5007333562159716
Energy: 0.7377247416931365
Energy: 0.5007333562173261
Energy: 0.7377247416978774
Energy: 0.9696244014838356
Energy: 0.6459290487627366
Energy: 0.9696244014845128
Energy: 0.6459290487620593
Energy: 0.9696244014845128
Energy: 0.6459290487620593

minimum gb energy = 0.4889205214636218 eV
minimum distance =  2.35030294150697 Angstroms
sigma value = 41


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

Energy: 0.6747559451580317
Energy: 0.5691490641355149
Energy: 0.6747559451585656
Energy: 0.5691490641344474
Energy: 0.6747559451564304
Energy: 0.5691490641355149
Energy: 0.6011501703190442
Energy: 0.6024718643288639
Energy: 0.6011501703195781
Energy: 0.6024718643336681
Energy: 0.6011501703147739
Energy: 0.6024718643416749
Energy: 0.664041496711181
Energy: 0.6526416263767786
Energy: 0.6640414967613573
Energy: 0.6526416263767786
Energy: 0.6640414967469449
Energy: 0.6526416263789139
Energy: 0.591657878517711
Energy: 0.5611868689107115
Energy: 0.5916578785139743
Energy: 0.5611868689107115
Energy: 0.5916578785129069
Energy: 0.5611868689107115
Energy: 0.5464466646401505
Energy: 0.5942371315486045
Energy: 0.5464466646396166
Energy: 0.5942371315486045
Energy: 0.5464466646406841
Energy: 0.5942371315486045
Energy: 0.7326824232639838
Energy: 0.6073595850496233
Energy: 0.7326824232629163
Energy: 0.607359585050157
Energy: 0.7326824232623825
Energy: 0.6073595850677721
Energy: 0.5506633780563878
Energy: 0.8144606846478127
Energy: 0.5506633780574552
Energy: 0.8144606846472787
Energy: 0.5506633780569214
Energy: 0.8144606846472787
Energy: 0.5345515907274773
Energy: 0.561272902322225
Energy: 0.5345515907269435
Energy: 0.561272902322225
Energy: 0.5345515907258759
Energy: 0.5612729023216911
Energy: 0.5563580476359946
Energy: 0.5878618392389885
Energy: 0.556358047634927
Energy: 0.5878618392389885
Energy: 0.5563580476354608
Energy: 0.5878618392384546
Energy: 0.5940975212765177
Energy: 0.6028759694446106
Energy: 0.5940975212765177
Energy: 0.602875969443543
Energy: 0.5940975212770515
Energy: 0.6028759694446106
Energy: 0.5885145785800132
Energy: 0.6079974156861809
Energy: 0.5885145785800132
Energy: 0.6079974156824444
Energy: 0.5885145785800132
Energy: 0.6079974156872484
Energy: 0.5304925412772012
Energy: 0.6964189530551804
Energy: 0.530492541277735
Energy: 0.6964189530546465
Energy: 0.5304925412772012
Energy: 0.6964189530546465
Energy: 0.5343225807531311
Energy: 0.5523343980658786
Energy: 0.5343225807520636
Energy: 0.5523343980653447
Energy: 0.5343225807520636
Energy: 0.5523343980658786
Energy: 0.5200033210477853
Energy: 0.6033740183453324
Energy: 0.5200033210477853
Energy: 0.6033740184002886
Energy: 0.5200033210467179
Energy: 0.6033740183794708
Energy: 0.7315958229922083
Energy: 0.7178961694397066
Energy: 0.7315958229911406
Energy: 0.7178961694402404
Energy: 0.7315958229911406
Energy: 0.7178961694391728
Energy: 0.5169786446934771
Energy: 0.7955462233398564
Energy: 0.5169786446934771
Energy: 0.7955462233419914
Energy: 0.5169786446945448
Energy: 0.567036394216331
Energy: 0.5406845908435214
Energy: 0.5525156268779106
Energy: 0.540684590844589
Energy: 0.5525156268768431
Energy: 0.540684590844589
Energy: 0.5525156268773769
Energy: 0.5552834128856524
Energy: 0.6532398804572861
Energy: 0.55528341288672
Energy: 0.6532398804546171
Energy: 0.5552834128899227
Energy: 0.6532398804546171
Energy: 0.6032443215410258
Energy: 0.7088632868597986
Energy: 0.6032443215410258
Energy: 0.7088632868592649
Energy: 0.603244321540492
Energy: 0.7088632868592649
Energy: 0.5869816378820604
Energy: 0.5571478987095985
Energy: 0.5869816378788819
Energy: 0.5571478987090647
Energy: 0.586981637883128
Energy: 0.5571478987101322
Energy: 0.5428327255357644
Energy: 0.6031561061876701
Energy: 0.5428327255352307
Energy: 0.603156106185535
Energy: 0.5428327255346967
Energy: 0.6031561061919404
Energy: 0.5698732877141919
Energy: 0.7949149940864129
Energy: 0.5698732877088538
Energy: 0.7949149940874806
Energy: 0.5698732877045836
Energy: 0.7949149940885482
Energy: 0.595460762416072
Energy: 0.5552600615995302
Energy: 0.5954607624155384
Energy: 0.5552600616000641
Energy: 0.595460762416072
Energy: 0.5552600615989965
Energy: 0.5168385597884632
Energy: 0.5996744404806192
Energy: 0.5168385597895307
Energy: 0.5996744404795517
Energy: 0.5168385597879294
Energy: 0.5996744404790177
Energy: 0.5170219150186695
Energy: 0.7318701310276409
Energy: 0.5170219150192032
Energy: 0.7318701310271312
Energy: 0.517021915019737
Energy: 0.7318701310265975
Energy: 0.5502719782394891
Energy: 0.5999202862922753
Energy: 0.5502719782400228
Energy: 0.599920286275728
Energy: 0.5502719782410904
Energy: 0.5999202862735927
Energy: 0.5423217202385658
Energy: 0.5553569373341426
Energy: 0.542321720240701
Energy: 0.5553569373346764
Energy: 0.5423217202385658
Energy: 0.5553569373341426
Energy: 0.5554054914042882
Energy: 0.5945061262077346
Energy: 0.5554054914037543
Energy: 0.5945061262072007
Energy: 0.555405491404822
Energy: 0.5945061262082684
Energy: 0.5862991117030911
Energy: 0.7181988515287359
Energy: 0.5862991117025574
Energy: 0.7181988515276683
Energy: 0.586299111703625
Energy: 0.7181988515292697
Energy: 0.6431416618102731
Energy: 0.5705238236346272
Energy: 0.6431416618102731
Energy: 0.5705238236367624
Energy: 0.6431416618108069
Energy: 0.5705238236378299
Energy: 0.536585173243237
Energy: 0.6959624356542581
Energy: 0.536585173242703
Energy: 0.6959624356542581
Energy: 0.5365851732437706
Energy: 0.6959624356537243
Energy: 0.560673872451613
Energy: 0.5806100084285827
Energy: 0.560673872451613
Energy: 0.5806100084291164
Energy: 0.560673872451613
Energy: 0.5806100084291164
Energy: 0.5259435958198915
Energy: 0.5641060230487807
Energy: 0.5259435958188239
Energy: 0.5641060230498482
Energy: 0.5259435958188239
Energy: 0.564106023050382

minimum gb energy = 0.5168385597879294 eV
minimum distance =  2.38362806770956 Angstroms
sigma value = 33


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

Energy: 0.6471751290247897
Energy: 0.5837876293130447
Energy: 0.6471751290244151
Energy: 0.5837876293145432
Energy: 0.6471751290270374
Energy: 0.5837876293134193
Energy: 0.6468554627983972
Energy: 0.5564271157418087
Energy: 0.6468554628017689
Energy: 0.5564271157418087
Energy: 0.6468554628010196
Energy: 0.5564271157418087
Energy: 0.5941500470080532
Energy: 0.6666413366414036
Energy: 0.5941500470058054
Energy: 0.6666413366417783
Energy: 0.594150047009177
Energy: 0.6666413366429021
Energy: 0.5909550018008695
Energy: 0.5727327961606427
Energy: 0.5909550018001202
Energy: 0.5727327961606427
Energy: 0.590955001807204
Energy: 0.572732796160268
Energy: 0.6126287976426306
Energy: 0.6285550322707408
Energy: 0.612628797642256
Energy: 0.6285550322677439
Energy: 0.6126287976415068
Energy: 0.6285550322714901
Energy: 0.8328049414858804
Energy: 0.5887396319391885
Energy: 0.8328049414847566
Energy: 0.5887396319391885
Energy: 0.8328049414873787
Energy: 0.5887396319395631
Energy: 0.5786614620511445
Energy: 0.6355007949969592
Energy: 0.5786614620511445
Energy: 0.6355007949973338
Energy: 0.5786614620533922
Energy: 0.6355007949973338
Energy: 0.6126556708021244
Energy: 0.6116845566151273
Energy: 0.6126556708010005
Energy: 0.6116845566147527
Energy: 0.6126556708002512
Energy: 0.6116845566147527
Energy: 0.6731034099893307
Energy: 0.606008058886245
Energy: 0.6731034099904546
Energy: 0.6060080588858704
Energy: 0.6731034099897053
Energy: 0.6060080588858704
Energy: 0.8758152617063838
Energy: 0.5736150767945634
Energy: 0.8758152617015137
Energy: 0.5736150767938142
Energy: 0.8758152617056347
Energy: 0.5736150767949381
Energy: 0.6126138346567622
Energy: 0.610283876760087
Energy: 0.612613834656013
Energy: 0.610283876761211
Energy: 0.6126138346537653
Energy: 0.6102838767608364
Energy: 0.62843908293059
Energy: 0.5727306250810631
Energy: 0.6284390829141068
Energy: 0.5727306250791899
Energy: 0.6284390821232514
Energy: 0.5727306250799393
Energy: 0.607141964040807
Energy: 0.6737301888196628
Energy: 0.6071419640434295
Energy: 0.6737301888275298
Energy: 0.6071419640396832
Energy: 0.673730188821536
Energy: 0.6280303519466028
Energy: 0.6194862483374216
Energy: 0.6280303519458535
Energy: 0.6194862483362977
Energy: 0.6280303519462282
Energy: 0.6194862483362977
Energy: 0.6176672592679259
Energy: 0.5762799022791512
Energy: 0.6176672592675513
Energy: 0.5762799022791512
Energy: 0.6176672592683006
Energy: 0.5762799022791512
Energy: 0.5940474886633919
Energy: 0.6720736241372358
Energy: 0.5940474886615188
Energy: 0.6720736241151333
Energy: 0.594047488662268
Energy: 0.6720736239627313
Energy: 0.6283030901319053
Energy: 0.5625967649353726
Energy: 0.6283030901349022
Energy: 0.5625967649293787
Energy: 0.6283030901278186
Energy: 0.5625967649361219
Energy: 0.5681049778271818
Energy: 0.591767459635898
Energy: 0.5681049778290549
Energy: 0.591767459635898
Energy: 0.5681049778286802
Energy: 0.5917674596355235
Energy: 0.6699077283547071
Energy: 0.5935707193490756
Energy: 0.6699077283528341
Energy: 0.5935707193528217
Energy: 0.6699077283528341
Energy: 0.5935707193539456
Energy: 0.6776966107249637
Energy: 0.5947283083491796
Energy: 0.677696610729459
Energy: 0.5947283083499287
Energy: 0.677696610726462
Energy: 0.5947283083484644
Energy: 0.5638543876787466
Energy: 0.6189290239230845
Energy: 0.5638543876798704
Energy: 0.6189290239230845
Energy: 0.563854387677248
Energy: 0.6189290239234589
Energy: 0.5525535563637938
Energy: 0.6468477418551307
Energy: 0.5525535563615461
Energy: 0.6468477418543815
Energy: 0.5525535563615461
Energy: 0.646847741854007
Energy: 0.6182598415773431
Energy: 0.5453534891823001
Energy: 0.6182598415769687
Energy: 0.5453534891826748
Energy: 0.618259841576594
Energy: 0.5453534891826748
Energy: 0.5787000092919509
Energy: 0.6211242892084182
Energy: 0.5787000092908269
Energy: 0.6211242892072943
Energy: 0.5787000092930747
Energy: 0.6211242892050467
Energy: 0.6283359048546587
Energy: 0.5624368713723605
Energy: 0.6283359048632411
Energy: 0.5624368713734843
Energy: 0.6283359048613679
Energy: 0.5624368713731097
Energy: 0.5844384863737289
Energy: 0.8309159025851774
Energy: 0.5844384863748527
Energy: 0.8309159025960414
Energy: 0.5844384863744781
Energy: 0.8309159025900476
Energy: 0.644519886305335
Energy: 0.5819680382302401
Energy: 0.6445198863049604
Energy: 0.5819680382309893
Energy: 0.6445198863038366
Energy: 0.581968038229491
Energy: 0.6186005675429681
Energy: 0.5788213586116221
Energy: 0.6186005675474635
Energy: 0.5788213586116221
Energy: 0.6186005675459652
Energy: 0.5788213586112474
Energy: 0.6085768036110275
Energy: 0.6738006470191973
Energy: 0.608576803613275
Energy: 0.6738006470240674
Energy: 0.6085768036106528
Energy: 0.6738006470263151
Energy: 0.5703599260294563
Energy: 0.872968306505034
Energy: 0.5703599260275832
Energy: 0.8729683065054086
Energy: 0.5703599260302056
Energy: 0.8729683065054086
Energy: 0.5891168499510862
Energy: 0.5649537096282584
Energy: 0.5891168499503368
Energy: 0.564953709627509
Energy: 0.5891168499499622
Energy: 0.564953709627509
Energy: 0.5789778830206952
Energy: 0.6281373898960024
Energy: 0.5789778830203206
Energy: 0.628137159779651
Energy: 0.5789778830199459
Energy: 0.628137489919496
Energy: 0.6779870262283823
Energy: 0.5807390140845227
Energy: 0.6779870262302554
Energy: 0.5807390140845227
Energy: 0.677987026228757
Energy: 0.5807390140848974
Energy: 0.6151606233493199
Energy: 0.6222620270863223
Energy: 0.6151606233493199
Energy: 0.6222620270863223
Energy: 0.6151606233493199
Energy: 0.6222620270870715
Energy: 0.6152820625627783
Energy: 0.6221854897701264
Energy: 0.6152820625627783
Energy: 0.6221854897701264
Energy: 0.6152820625631529
Energy: 0.6221854897693773
Energy: 0.6783120589664186
Energy: 0.580718332510923
Energy: 0.678312058966044
Energy: 0.580718332510923
Energy: 0.6783120589634216
Energy: 0.5807183325112976
Energy: 0.5790246339354042
Energy: 0.6281925024048419
Energy: 0.5790246339339058
Energy: 0.6281925024119596
Energy: 0.5790246339357789
Energy: 0.6281925024213252
Energy: 0.5890744504838814
Energy: 0.5650517802117992
Energy: 0.5890744504857545
Energy: 0.5650517802117992
Energy: 0.5890744504850053
Energy: 0.5650517802144217
Energy: 0.5703508954387211
Energy: 0.8729669271302849
Energy: 0.5703508954390958
Energy: 0.8729669271291611
Energy: 0.5703508954379719
Energy: 0.8729669271302849
Energy: 0.6087626918331194
Energy: 0.6739666614728752
Energy: 0.6087626918323702
Energy: 0.6739666614732498
Energy: 0.6087626918327448
Energy: 0.6739666614725005
Energy: 0.6185391861892331
Energy: 0.5788689643860183
Energy: 0.6185391861899824
Energy: 0.5788689643863929
Energy: 0.6185391861866107
Energy: 0.5788689643871422
Energy: 0.6448471910679738
Energy: 0.5819144673803179
Energy: 0.6448471910683483
Energy: 0.5819144673848133
Energy: 0.6448471910694722
Energy: 0.5819144673840642
Energy: 0.584438474315244
Energy: 0.8312088862415264
Energy: 0.5844384743133708
Energy: 0.8312088862437741
Energy: 0.584438474315993
Energy: 0.8312088862415264
Energy: 0.6283386080150777
Energy: 0.5624265943470452
Energy: 0.6283386080218208
Energy: 0.5624265943485437
Energy: 0.6283386080191985
Energy: 0.5624265943496676
Energy: 0.578588689171524
Energy: 0.6210750223875047
Energy: 0.5785886891730224
Energy: 0.6210750223957463
Energy: 0.5785886891748955
Energy: 0.6210750223897523
Energy: 0.6180766893178141
Energy: 0.5451723658277814
Energy: 0.6180766893245231
Energy: 0.5451723658274067
Energy: 0.6180766893234334
Energy: 0.5451723658285305
Energy: 0.5525557248547879
Energy: 0.646907141547472
Energy: 0.5525557248532894
Energy: 0.646907141547472
Energy: 0.5525557248540386
Energy: 0.6469071415459736

minimum gb energy = 0.5451723658274067 eV
minimum distance =  2.37602922813719 Angstroms
sigma value = 67


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

Energy: 0.6856480965179707
Energy: 0.6346274101320666
Energy: 0.6856480965174869
Energy: 0.6346274101315544
Energy: 0.6856480965167188
Energy: 0.6346274101318105
Energy: 0.6474910276358734
Energy: 0.5655821634761633
Energy: 0.647491027636357
Energy: 0.5655821634741717
Energy: 0.6474910276358734
Energy: 0.5655821634746839
Energy: 0.7552122348274767
Energy: 0.7324975466141065
Energy: 0.7552122348222416
Energy: 0.7324975466141065
Energy: 0.9251256216467589
Energy: 0.7324975466143625
Energy: 0.6474105828189509
Energy: 0.5652671016441989
Energy: 0.647410582819463
Energy: 0.565267101642947
Energy: 0.647410582819463
Energy: 0.5652671016441989
Energy: 0.6856480965154669
Energy: 0.6346274101273152
Energy: 0.6856480965164911
Energy: 0.6346274101273152
Energy: 0.6856480965172309
Energy: 0.6346274101273152
Energy: 0.6474910276341094
Energy: 0.565582163473688
Energy: 0.6474910276353611
Energy: 0.5655821634741717
Energy: 0.6474910276343654
Energy: 0.5655821634741717
Energy: 0.6162754235516168
Energy: 0.7324975466093551
Energy: 0.6162754235518728
Energy: 0.7324975466096112
Energy: 0.616275423550877
Energy: 0.7324975466096112

minimum gb energy = 0.565267101642947 eV
minimum distance =  2.38574098012417 Angstroms
sigma value = 3


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

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Energy: 0.7604970946992039
Energy: 0.7935770530560735
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Energy: 0.8132381680476042
Energy: 0.7271012781134477
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Energy: 0.7239098770830599
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Energy: 0.742075397670209
Energy: 0.7467015858124695
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Energy: 0.7420753976801205
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Energy: 0.7637909356086564
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Energy: 0.7287775313087824
Energy: 0.7281124201634661
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Energy: 0.7281124201549175
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Energy: 0.6786470703419254
Energy: 0.8042135223039153
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Energy: 0.711561837479953
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Energy: 0.6908160958812333
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Energy: 0.690816095876773
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Energy: 0.6908160958692775
Energy: 0.7415541922931831
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Energy: 0.7415541922928733
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Energy: 0.7415541922911388
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Energy: 0.718455923280277
Energy: 0.7781720342813006
Energy: 0.718455923275507
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Energy: 0.7184559232727813
Energy: 0.7225250496799445
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Energy: 0.7225250496809357
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Energy: 0.7225250496734401
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Energy: 0.6917823096006306
Energy: 0.8027008497448137
Energy: 0.6917823096023652
Energy: 0.8027008497523093
Energy: 0.6917823096019934
Energy: 0.7381809546398629
Energy: 0.7453568262944433
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Energy: 0.7453568262968594
Energy: 0.7381809546330487
Energy: 0.7453568262954965
Energy: 0.7344217658490036
Energy: 0.7676999237985618
Energy: 0.7344217658442337
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Energy: 0.7344217658537736
Energy: 0.7676999238012875
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Energy: 0.7433166633540088
Energy: 0.7114439901745859
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Energy: 0.7433166633417434
Energy: 0.8052663080361795
Energy: 0.7296236833677038
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Energy: 0.7296236833619426
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Energy: 0.7296236833608895
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Energy: 0.7263559458630721
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Energy: 0.7297386694172568
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Energy: 0.7510731899257931
Energy: 0.7282341825250644
Energy: 0.7510731899380587
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Energy: 0.7510731899360145
Energy: 0.7125256133328763
Energy: 0.755340647345475
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Energy: 0.755340647343059
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Energy: 0.7553406473447936
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Energy: 0.671587373793046
Energy: 0.7666949644167813
Energy: 0.6715873737961434
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Energy: 0.6715873737944088
Energy: 0.7329135514820784
Energy: 0.6918076600317687
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Energy: 0.7329135514827599
Energy: 0.6918076600324501
Energy: 0.7575013449483256
Energy: 0.7252410256672426
Energy: 0.7213601422895893
Energy: 0.7252410256661895
Energy: 0.7575013449353786
Energy: 0.725241025662101
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Energy: 0.6912996108983914
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Energy: 0.7084649284300698
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Energy: 0.7088064266623678
Energy: 0.7230566998658942
Energy: 0.7088118095897483
Energy: 0.7717902419307577
Energy: 0.7756998639703112
Energy: 0.771790241932802
Energy: 0.7756998639713644
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Energy: 0.7756998639709924
Energy: 0.7071211408696731
Energy: 0.7342943568736071
Energy: 0.7071211408717174
Energy: 0.7342943568579343
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Energy: 0.7292277962153384
Energy: 0.7892502455246007
Energy: 0.7292277962078428
Energy: 0.7875510580191799
Energy: 0.7292277962067897
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Energy: 0.8098934354210819
Energy: 0.7198187751980464
Energy: 0.8098934348612022
Energy: 0.7199251124887074
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Energy: 0.7250615667850467
Energy: 0.7579193118951894
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Energy: 0.7250615667802767
Energy: 0.6930516830270995
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Energy: 0.7608543151058935
Energy: 0.6930516830223297
Energy: 0.7608543151093006
Energy: 0.7937085841329169
Energy: 0.7318423537984025
Energy: 0.7937085841404125
Energy: 0.7318423537993938
Energy: 0.7937085841451824
Energy: 0.7318423537977211
Energy: 0.7136877073600506
Energy: 0.724294245791798
Energy: 0.7136733323404183
Energy: 0.7242942456558856
Energy: 0.7136877073583162
Energy: 0.7242942459620291
Energy: 0.8186096660135839
Energy: 0.7186448109489197
Energy: 0.8186096660231239
Energy: 0.7186448109468755
Energy: 0.8186096660163096
Energy: 0.7186448109475568
Energy: 0.7237994755849145
Energy: 0.7132178699147451
Energy: 0.7237994755880118
Energy: 0.7132178699154266
Energy: 0.7237994755784719
Energy: 0.713217869916108
Energy: 0.758949649604401
Energy: 0.6925254352976019
Energy: 0.7589496495904627
Energy: 0.6925254353040444
Energy: 0.7589496495955425
Energy: 0.69252543530677
Energy: 0.7238356882177559
Energy: 0.7838694501846325
Energy: 0.7238356882198002
Energy: 0.7838694501904554
Energy: 0.7238356882217823
Energy: 0.7838694501890927
Energy: 0.7984169169730649
Energy: 0.6943239625509252
Energy: 0.7984169169696578
Energy: 0.6943239625570581
Energy: 0.7984169169744278
Energy: 0.6943239625566863
Energy: 0.7823547597790214
Energy: 0.6930957141676304
Energy: 0.7823432637037583
Energy: 0.693095714173763
Energy: 0.7823547597793311
Energy: 0.6930957141665772
Energy: 0.7667865457071567
Energy: 0.7201889933615497
Energy: 0.7667865457092009
Energy: 0.7201889933604967
Energy: 0.7667865457112452
Energy: 0.7201889933536826
Energy: 0.7136699139595966
Energy: 0.7655590183341635
Energy: 0.7136699139626319
Energy: 0.7655590183528717
Energy: 0.7136699139605878
Energy: 0.7655590183545441
Energy: 0.7492842001110083
Energy: 0.727831005987237
Energy: 0.7492842001083445
Energy: 0.7278310060032815
Energy: 0.749284200104256
Energy: 0.7278310060026001
Energy: 0.7598395217312212
Energy: 0.7277537959126822
Energy: 0.7598418014135969
Energy: 0.7277537959106379
Energy: 0.7598395217387168
Energy: 0.7277537959143549

minimum gb energy = 0.671587373793046 eV
minimum distance =  2.35281863803244 Angstroms
sigma value = 81


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

Energy: 0.8251072138570104
Energy: 0.7605277041495733
Energy: 0.7766725637849687
Energy: 0.7605277041458324
Energy: 0.8251072138593486
Energy: 0.7605277041453647
Energy: 0.7620766427466935
Energy: 0.7157450403361953
Energy: 0.7620766427480964
Energy: 0.7157450403412966
Energy: 0.7620766427466935
Energy: 0.7157450403412966
Energy: 0.7584906143131259
Energy: 0.6423280336762461
Energy: 0.7583732274642967
Energy: 0.642328033679987
Energy: 0.7584906143084498
Energy: 0.6423280336790519
Energy: 0.7131055029952781
Energy: 0.7527894795410444
Energy: 0.7131055029952781
Energy: 0.7527894795401092
Energy: 0.7131055029920047
Energy: 0.7527894795396416
Energy: 0.7350994969288338
Energy: 0.6421148134673585
Energy: 0.7350994969283661
Energy: 0.6421148134622148
Energy: 0.7350994969293014
Energy: 0.6421148134617471
Energy: 0.7190933012290643
Energy: 0.6929483493980155
Energy: 0.7190933012314024
Energy: 0.6929483493928718
Energy: 0.7190933012253233
Energy: 0.6929483493933394
Energy: 0.642976401501187
Energy: 0.6920291978367817
Energy: 0.6429764015035251
Energy: 0.6920291978330407
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Energy: 0.7149577484443317
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Energy: 0.713482516302698
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Energy: 0.8279499537372562
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Energy: 0.7735564169531064
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Energy: 0.7265927047262496
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Energy: 0.7205854473142044
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Energy: 0.707816674151697
Energy: 0.6418032821896869
Energy: 0.7078166741554379
Energy: 0.6418032821910898
Energy: 0.7078166741559057
Energy: 0.764059262247
Energy: 0.7222480675313091
Energy: 0.764059262247
Energy: 0.722248067526633
Energy: 0.7640592622455972
Energy: 0.7222480675275682
Energy: 0.7410039999894431
Energy: 0.6429466896523688
Energy: 0.7410039999917813
Energy: 0.6429466896504984
Energy: 0.7410039999880402
Energy: 0.6429466896509659
Energy: 0.774865109766057
Energy: 0.6680112976073573
Energy: 0.7748651097627837
Energy: 0.6680112976087602
Energy: 0.7748651097632513
Energy: 0.6680112976101631
Energy: 0.7155281303440886
Energy: 0.6412442784885009
Energy: 0.7155281303403476
Energy: 0.6412442784880333
Energy: 0.7155281303408152
Energy: 0.6412442784875656
Energy: 0.7905266451255183
Energy: 0.6924495758883272
Energy: 0.7910770228342591
Energy: 0.6924495758859891
Energy: 0.7905266451241155
Energy: 0.6924495758859891
Energy: 0.680360474184165
Energy: 0.8140726453780527
Energy: 0.6802650649052852
Energy: 0.8140726453780527
Energy: 0.6803604741799564
Energy: 0.8140726453785202
Energy: 0.6508584085330817
Energy: 0.7372559554083382
Energy: 0.650858408532614
Energy: 0.7372559554083382
Energy: 0.6508584085377578
Energy: 0.7372559554088058
Energy: 0.7533666387319983
Energy: 0.8306632743548301
Energy: 0.7533666387338688
Energy: 0.8306632743501539
Energy: 0.7533666387375673
Energy: 0.8306632743501539
Energy: 0.6423685287437376
Energy: 0.7818473865699995
Energy: 0.6423685287399967
Energy: 0.7818473865667263
Energy: 0.6423685287385938
Energy: 0.7818473865667263
Energy: 0.736250683126492
Energy: 0.7211816852172251
Energy: 0.6851700894735462
Energy: 0.7211816852167574
Energy: 0.7362506831269596
Energy: 0.7211816852162899
Energy: 0.7353827790752067
Energy: 0.6307887112411746
Energy: 0.6842865854023484
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Energy: 0.7353827790780124
Energy: 0.6307887112481889
Energy: 0.8088582021174877
Energy: 0.7279465326080989
Energy: 0.8088582021174877
Energy: 0.7279465326127751
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Energy: 0.7279465326127751
Energy: 0.7409324274283983
Energy: 0.8304081260643419
Energy: 0.7409324274312041
Energy: 0.8304081260404933
Energy: 0.7409324274354125
Energy: 0.8304081260615362
Energy: 0.7816539586157759
Energy: 0.8605693939704748
Energy: 0.7816539586195169
Energy: 0.8605693939756187
Energy: 0.7816539586171788
Energy: 0.8605693939742157
Energy: 0.6800394632133242
Energy: 0.7122638135153436
Energy: 0.6800394632151946
Energy: 0.7122638135162788
Energy: 0.6800394632151946
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Energy: 0.7039597973932729
Energy: 0.6924625764393968
Energy: 0.7039597973942081
Energy: 0.6924625764351883
Energy: 0.7039597973914024
Energy: 0.692462576434253
Energy: 0.7180323730833024
Energy: 0.7659911803988031
Energy: 0.7180103761237328
Energy: 0.7659911803959973
Energy: 0.7180323730809641
Energy: 0.7659911803950622
Energy: 0.6423555835535106
Energy: 0.6688112170002585
Energy: 0.6423555835535106
Energy: 0.6688112170039995
Energy: 0.6423555835544459
Energy: 0.6688112170039995
Energy: 0.7525485065263094
Energy: 0.7719168180071299
Energy: 0.752548506528605
Energy: 0.7719168180001156
Energy: 0.7525485065290727
Energy: 0.7719168180005832
Energy: 0.7193235255806918
Energy: 0.7277204520425306
Energy: 0.7193235255778861
Energy: 0.7277204520415953
Energy: 0.7193235255797567
Energy: 0.7277204520415953
Energy: 0.6417758380836667
Energy: 0.7036604247087423
Energy: 0.6417758380846018
Energy: 0.7036604246900375
Energy: 0.6417758380817962
Energy: 0.7036604246680593
Energy: 0.6514496389384618
Energy: 0.6420385317077749
Energy: 0.6514496389408
Energy: 0.6420385317068397
Energy: 0.6514496389445409
Energy: 0.6420385317068397
Energy: 0.7493562705184955
Energy: 0.9007526710276115
Energy: 0.7495310752807074
Energy: 0.9007526710262086
Energy: 0.7493562705227039
Energy: 0.9007526710276115
Energy: 0.8406066407507007
Energy: 0.7530241697882076
Energy: 0.8406066407535063
Energy: 0.7530241697868049
Energy: 0.8406066407553768
Energy: 0.7530241697858695
Energy: 0.7178225562767278
Energy: 0.644069865955518
Energy: 0.7178225562804688
Energy: 0.6440698659573885
Energy: 0.7178225562748574
Energy: 0.6440698659573885
Energy: 0.7207486839241102
Energy: 0.6919339755893507
Energy: 0.7207486839269158
Energy: 0.6919339755874802
Energy: 0.7207486839264482
Energy: 0.6919339755865449

minimum gb energy = 0.6307887112411746 eV
minimum distance =  2.3989895410561 Angstroms
sigma value = 43


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

Energy: 0.8684819249729389
Energy: 0.6601933146886358
Energy: 0.8684819249735133
Energy: 0.6601933146880614
Energy: 0.868481924974662
Energy: 0.6601933146886358
Energy: 0.7479305963214299
Energy: 0.6653515731052608
Energy: 0.7479305963220042
Energy: 0.6653515731035377
Energy: 0.7479305963225785
Energy: 0.6653515731046865
Energy: 0.7793915059156231
Energy: 0.8195811040221039
Energy: 0.7793915059156231
Energy: 0.8195811040266991
Energy: 0.7793915059156231
Energy: 0.8195811040399101
Energy: 0.6947808320539808
Energy: 0.714352685293156
Energy: 0.6947808320551296
Energy: 0.7143526852937303
Energy: 0.6947808320539808
Energy: 0.714352685293156
Energy: 0.68744997380825
Energy: 0.7413249457004844
Energy: 0.68744997380825
Energy: 0.7413249457010588
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Energy: 0.7413249457045051
Energy: 0.7042711043768536
Energy: 0.721515636870568
Energy: 0.7042711043762793
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Energy: 0.7042711043762793
Energy: 0.7215156368699936
Energy: 0.7838374494060082
Energy: 0.7876550108540086
Energy: 0.7838374494060082
Energy: 0.7876550108540086
Energy: 0.7838374494048594
Energy: 0.7876550108522854
Energy: 0.7017843271548698
Energy: 0.742204198614871
Energy: 0.7017843271548698
Energy: 0.742204198614871
Energy: 0.7017843271554443
Energy: 0.7422041986137222
Energy: 0.773044256290145
Energy: 0.6733526653970121
Energy: 0.7730439170472085
Energy: 0.6733526653975865
Energy: 0.7730423921077089
Energy: 0.6733526653964378
Energy: 0.7032355548102438
Energy: 0.7246697784000121
Energy: 0.7032355548096695
Energy: 0.7246697784005866
Energy: 0.7032355548085206
Energy: 0.7246697783994378
Energy: 0.7856894115085677
Energy: 0.7367785668582492
Energy: 0.7856894115085677
Energy: 0.7367785668553772
Energy: 0.7856894115085677
Energy: 0.7367785668548029
Energy: 0.7017230440088188
Energy: 0.7120454880950162
Energy: 0.7017230440076702
Energy: 0.7120454880955905
Energy: 0.7017230440076702
Energy: 0.712045488096165
Energy: 0.6955749439735652
Energy: 0.7221673121042014
Energy: 0.6966092885826689
Energy: 0.722167312103627
Energy: 0.6970364713587386
Energy: 0.7221673121042014
Energy: 0.6386220065576639
Energy: 0.8178193064931114
Energy: 0.6386220065570896
Energy: 0.8178193064936858
Energy: 0.6386220065582383
Energy: 0.8178193064931114
Energy: 0.6870901623174891
Energy: 0.7361125559778835
Energy: 0.6870901623163402
Energy: 0.7361125559773092
Energy: 0.6870901623174891
Energy: 0.7361125559773092
Energy: 0.7328106098244546
Energy: 0.7133141043443454
Energy: 0.7328106098238802
Energy: 0.7133141043408991
Energy: 0.7328106098250289
Energy: 0.7133141043294113
Energy: 0.7601948463633588
Energy: 0.6626652739172139
Energy: 0.7601948463662307
Energy: 0.6626652739183626
Energy: 0.7601948463673794
Energy: 0.6626652739166395
Energy: 0.7891741164357458
Energy: 0.7135852285546648
Energy: 0.7891741164357458
Energy: 0.7135852285546648
Energy: 0.7891741164351713
Energy: 0.7135852285546648
Energy: 0.788105719452709
Energy: 0.7026962694372656
Energy: 0.7881057194521348
Energy: 0.7026962694366913
Energy: 0.7881057194532834
Energy: 0.7026962694361168
Energy: 0.765389271716785
Energy: 0.6634272595551848
Energy: 0.7653892717185081
Energy: 0.6634272595546103
Energy: 0.7653892717202313
Energy: 0.6634272595551848
Energy: 0.7325725035932689
Energy: 0.7382420126417923
Energy: 0.7325725035903969
Energy: 0.7382420126429411
Energy: 0.7325725035921201
Energy: 0.7382420126423667
Energy: 0.775665867909535
Energy: 0.7294892874584818
Energy: 0.7756658679101093
Energy: 0.7294892874579074
Energy: 0.775665867909535
Energy: 0.7294892874573331
Energy: 0.6385312824789305
Energy: 0.7640765133417766
Energy: 0.6385312824783561
Energy: 0.7640765133417766
Energy: 0.6385312824783561
Energy: 0.7640765133412022
Energy: 0.7821226040299453
Energy: 0.7224826044283196
Energy: 0.782122604031094
Energy: 0.7224826044283196
Energy: 0.7821226040328172
Energy: 0.722482604428894
Energy: 0.7026842652917547
Energy: 0.7012220761417349
Energy: 0.7026842652911802
Energy: 0.7012220761411606
Energy: 0.7026842652917547
Energy: 0.7012220761411606
Energy: 0.7596462162682892
Energy: 0.7271591302523178
Energy: 0.7596462162700123
Energy: 0.7271591302523178
Energy: 0.7596462162774795
Energy: 0.7271591302528922
Energy: 0.7227737483891141
Energy: 0.664143879002258
Energy: 0.7227737483896886
Energy: 0.6641438790085763
Energy: 0.7227737483885398
Energy: 0.6641438790057044
Energy: 0.7687151686739296
Energy: 0.6718037697886718
Energy: 0.7687151686733553
Energy: 0.6718037697880975
Energy: 0.7687151686762272
Energy: 0.6718037697875231
Energy: 0.7038961985712348
Energy: 0.7419161036282583
Energy: 0.7038961985603475
Energy: 0.7419161036265352
Energy: 0.7038961985695116
Energy: 0.741916103627684
Energy: 0.7421916394828233
Energy: 0.7604546054855089
Energy: 0.7421916394811001
Energy: 0.7604546054860833
Energy: 0.7421916394816744
Energy: 0.7604546054878065
Energy: 0.7052590661139595
Energy: 0.7217131714975595
Energy: 0.7052590661145339
Energy: 0.7217131714992826
Energy: 0.705259066112837
Energy: 0.7217131714975595

minimum gb energy = 0.6385312824783561 eV
minimum distance =  2.36544600196473 Angstroms
sigma value = 57


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

Energy: 0.7297873042448397
Energy: 0.6285685247498477
Energy: 0.729787304244096
Energy: 0.6285685247498477
Energy: 0.7297873042426086
Energy: 0.6285685247505916
Energy: 0.7119271369119056
Energy: 0.6446582389224975
Energy: 0.7119271369133929
Energy: 0.6446582389210102
Energy: 0.7119271369119056
Energy: 0.6446582389195227
Energy: 0.7275118943848645
Energy: 0.8027180514502901
Energy: 0.727511894386352
Energy: 0.8027180514502901
Energy: 0.7275118943885831
Energy: 0.8027180514510338
Energy: 0.7301463039031059
Energy: 0.7504832671759311
Energy: 0.7301463039031059
Energy: 0.7504832671766747
Energy: 0.7301463039023621
Energy: 0.7504832671744437
Energy: 0.6631397418432393
Energy: 0.7482387353535751
Energy: 0.663139741843983
Energy: 0.7482387353565499
Energy: 0.6631397418432393
Energy: 0.7482387353558062
Energy: 0.698433614236063
Energy: 0.7175320190051542
Energy: 0.6984336142308909
Energy: 0.7175320190051542
Energy: 0.6984336142338656
Energy: 0.7175320190051542
Energy: 0.7225529439934202
Energy: 0.7972446620263971
Energy: 0.7225529439941639
Energy: 0.7972446620256535
Energy: 0.7225529439934202
Energy: 0.7972446620263971
Energy: 0.7298837989336535
Energy: 0.6460367273631513
Energy: 0.7298837989336535
Energy: 0.6460367273624076
Energy: 0.7298837989336535
Energy: 0.6460367273624076
Energy: 0.6771472285510062
Energy: 0.6359823066310598
Energy: 0.6771472285502625
Energy: 0.6359823066310598
Energy: 0.6771472285510062
Energy: 0.6359823066318037
Energy: 0.5980164161993189
Energy: 0.7176453076885423
Energy: 0.5980164161978315
Energy: 0.7176453076900298
Energy: 0.5980164162015501
Energy: 0.7176453076922608
Energy: 0.7225706684820938
Energy: 0.715036245122275
Energy: 0.7225706684835812
Energy: 0.7150362451230187
Energy: 0.7225706684820938
Energy: 0.715036245122275
Energy: 0.6660042513163745
Energy: 0.7484858507526089
Energy: 0.6660042513156308
Energy: 0.7484858507421971
Energy: 0.6660042513156308
Energy: 0.7484858507317851
Energy: 0.6838074000750954
Energy: 0.6370592710929548
Energy: 0.6838074000698895
Energy: 0.637059271092211
Energy: 0.6838074000795578
Energy: 0.637059271092211
Energy: 0.7337447725507371
Energy: 0.6372222634796347
Energy: 0.7337447725529682
Energy: 0.6372222634796347
Energy: 0.7337447725499934
Energy: 0.6372222634803784
Energy: 0.6628824394291063
Energy: 0.6379470613019699
Energy: 0.6628824394320474
Energy: 0.637947061301226
Energy: 0.6628824394298499
Energy: 0.6379470613004823
Energy: 0.6658891198731658
Energy: 0.629623537309953
Energy: 0.665889119872422
Energy: 0.6296235373106968
Energy: 0.665889119872422
Energy: 0.6296235373106968
Energy: 0.601231978047898
Energy: 0.7091260508187178
Energy: 0.6012319780456669
Energy: 0.7091260508194616
Energy: 0.6012319780426921
Energy: 0.7091260508202052
Energy: 0.7209111989179264
Energy: 0.719662339374456
Energy: 0.7209111989186701
Energy: 0.7196623393751997
Energy: 0.720911198916439
Energy: 0.7196623393751997
Energy: 0.6016333123498259
Energy: 0.7091268290532152
Energy: 0.6016333124174696
Energy: 0.7091268290547026
Energy: 0.6016333124144948
Energy: 0.7091268290539589
Energy: 0.6659966457009592
Energy: 0.6295739126724398
Energy: 0.6659966457009592
Energy: 0.6295739126731835
Energy: 0.6659966457002154
Energy: 0.6295739126724398
Energy: 0.6629566615915673
Energy: 0.6378811906412524
Energy: 0.6629566606891102
Energy: 0.6378811906419961
Energy: 0.6629566756525714
Energy: 0.6378811906419961
Energy: 0.7317798632347445
Energy: 0.6420433808365928
Energy: 0.7317798632369756
Energy: 0.6420433808313869
Energy: 0.7317798632444127
Energy: 0.6420433808321305
Energy: 0.6843941957212131
Energy: 0.6372356113166721
Energy: 0.6843941957212131
Energy: 0.6372356113166721
Energy: 0.6843941957204693
Energy: 0.6372356113174157
Energy: 0.6659752252132419
Energy: 0.7486719318295407
Energy: 0.6659752252124983
Energy: 0.7486719318265658
Energy: 0.6659752252132419
Energy: 0.7486719318094606

minimum gb energy = 0.5980164161978315 eV
minimum distance =  2.40056528143501 Angstroms
sigma value = 17


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

Energy: 0.674322627359702
Energy: 0.6585343237604473
Energy: 0.6743226273618056
Energy: 0.6585343237604473
Energy: 0.674322627359702
Energy: 0.6585343237604473
Energy: 0.6292618285884494
Energy: 0.644304958747435
Energy: 0.6292618286063054
Energy: 0.6443049587484868
Energy: 0.6292618285915808
Energy: 0.6443049587484868
Energy: 0.6735132373546946
Energy: 0.7603762440267294
Energy: 0.6735132373525912
Energy: 0.7603762440267294
Energy: 0.6735132373515633
Energy: 0.7603762440267294
Energy: 0.5764154152649736
Energy: 0.7469170729989933
Energy: 0.5764154152639218
Energy: 0.7469170730000451
Energy: 0.5764154152649736
Energy: 0.7469170729989933
Energy: 0.6617288531260745
Energy: 0.718894502048046
Energy: 0.6617288531260745
Energy: 0.7188945020501494
Energy: 0.661728853128178
Energy: 0.7188945020501494
Energy: 0.6771945216956198
Energy: 0.7294963775717805
Energy: 0.677194521694568
Energy: 0.7294963775728324
Energy: 0.6771945216956198
Energy: 0.7294963775728324
Energy: 0.7285767355263905
Energy: 0.639766306626055
Energy: 0.7285767355263905
Energy: 0.639766306626055
Energy: 0.7285767355263905
Energy: 0.639766306626055
Energy: 0.5765631548757012
Energy: 0.6969099389326051
Energy: 0.5765631548757012
Energy: 0.6969099389315534
Energy: 0.5765631548757012
Energy: 0.6969099389315534
Energy: 0.7129015236625328
Energy: 0.6502166731004868
Energy: 0.7129015236625328
Energy: 0.650216673099435
Energy: 0.7129015236625328
Energy: 0.6502166731004868
Energy: 0.683705510444014
Energy: 0.6384164872368736
Energy: 0.683705510444014
Energy: 0.6384164872368736
Energy: 0.6837055104450658
Energy: 0.6384164872368736
Energy: 0.6735069635016596
Energy: 0.6127687188466273
Energy: 0.6735069635037632
Energy: 0.6127687188476791
Energy: 0.6735069635027114
Energy: 0.6127687188466273
Energy: 0.6514068342540518
Energy: 0.6527338558492428
Energy: 0.6514068342540518
Energy: 0.6527338558492428
Energy: 0.6514068342540518
Energy: 0.6527338558492428
Energy: 0.6008582700080676
Energy: 0.730710714553554
Energy: 0.6008582700070159
Energy: 0.730710714553554
Energy: 0.6008582700080676
Energy: 0.7307107145525022
Energy: 0.6836501027352091
Energy: 0.7217522201733156
Energy: 0.6836501027362608
Energy: 0.7217522201733156
Energy: 0.6836501027362608
Energy: 0.7217522201733156
Energy: 0.6810773767844511
Energy: 0.5970755199355842
Energy: 0.6810773767865547
Energy: 0.5970755199355842
Energy: 0.6810773767865547
Energy: 0.5970755199355842
Energy: 0.6808053606005702
Energy: 0.7286848670059133
Energy: 0.6808053606026737
Energy: 0.7286848670059133
Energy: 0.680805360601622
Energy: 0.7286848670059133
Energy: 0.6820775145516778
Energy: 0.7186507412687377
Energy: 0.6820775145527295
Energy: 0.7186507412687377
Energy: 0.6820775145516778
Energy: 0.7186507412697896

minimum gb energy = 0.5764154152639218 eV
minimum distance =  2.3352539876003 Angstroms
sigma value = 17


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

Energy: 0.6734570000717011
Energy: 0.6015370076843362
Energy: 0.6734570000717011
Energy: 0.6015370076843362
Energy: 0.6734570000712949
Energy: 0.6015370076839299
Energy: 0.6190602035724536
Energy: 0.5818040045213166
Energy: 0.6190602035724536
Energy: 0.581804004522535
Energy: 0.6190602035752967
Energy: 0.581804004522535
Energy: 0.6299011335986611
Energy: 0.6389231525281295
Energy: 0.6299011336019104
Energy: 0.6389231525285356
Energy: 0.6299011336015041
Energy: 0.6389231525281295
Energy: 0.5654661391550543
Energy: 0.6444777715774315
Energy: 0.5654661391501804
Energy: 0.6444777715778377
Energy: 0.5654661391526173
Energy: 0.6444777715782438
Energy: 0.6116511863711409
Energy: 0.5823559694289859
Energy: 0.6116511863691101
Energy: 0.5823559694289859
Energy: 0.6116511863707348
Energy: 0.5823559694281737
Energy: 0.6448098781439843
Energy: 0.6174241054079155
Energy: 0.6448098781443905
Energy: 0.6174241054083216
Energy: 0.6448098781439843
Energy: 0.6174241054115708
Energy: 0.6165134844386265
Energy: 0.6144325042657598
Energy: 0.6165134844378143
Energy: 0.6144325042681967
Energy: 0.6165134844386265
Energy: 0.6144325042677905
Energy: 0.6239881871897522
Energy: 0.6805029972058834
Energy: 0.6239881871877215
Energy: 0.6805029972083203
Energy: 0.6239881871832539
Energy: 0.6805029972054772
Energy: 0.6305477092700875
Energy: 0.6472417257068015
Energy: 0.6305477092676506
Energy: 0.6472417257068015
Energy: 0.6305477092700875
Energy: 0.6472417257076137
Energy: 0.6114413018339907
Energy: 0.5519383276484224
Energy: 0.6114413018392707
Energy: 0.5519383276484224
Energy: 0.611441301834803
Energy: 0.5519383276480163
Energy: 0.5643743974818084
Energy: 0.6549106828334403
Energy: 0.5643743974822145
Energy: 0.6549106828334403
Energy: 0.5643743974805899
Energy: 0.6549106828362834
Energy: 0.6803441864798387
Energy: 0.5999640080439398
Energy: 0.6803441864810572
Energy: 0.5999640080455643
Energy: 0.680344186483088
Energy: 0.5999640080471889
Energy: 0.6283349466532883
Energy: 0.6017320292491447
Energy: 0.6283349466520699
Energy: 0.6017320292503632
Energy: 0.6283349466520699
Energy: 0.6017320292515816
Energy: 0.617279183515042
Energy: 0.6059081152263257
Energy: 0.6172791835154482
Energy: 0.6059081152255134
Energy: 0.6172791835162604
Energy: 0.6059081152263257
Energy: 0.639595621891949
Energy: 0.6004345946917903
Energy: 0.6395956218935736
Energy: 0.6004345946926025
Energy: 0.6395956218935736
Energy: 0.6004345946917903
Energy: 0.5644262157250626
Energy: 0.6974929173343168
Energy: 0.5644262157218135
Energy: 0.6975912762014995
Energy: 0.5644262157234381
Energy: 0.6679664678617218
Energy: 0.6260036997229164
Energy: 0.6358632443395453
Energy: 0.6260036997290087
Energy: 0.6358632443403576
Energy: 0.6260036997253533
Energy: 0.6358632443399515
Energy: 0.6495461941515397
Energy: 0.636360887197616
Energy: 0.6495461941511336
Energy: 0.6363608871935544
Energy: 0.6495461941519458
Energy: 0.6363608871939607
Energy: 0.6239764664713072
Energy: 0.6338632334921946
Energy: 0.6239764664713072
Energy: 0.6338632334897577
Energy: 0.6239764664700888
Energy: 0.6338632334901639
Energy: 0.6252896794521456
Energy: 0.5574251729881092
Energy: 0.6252896794521456
Energy: 0.633071761356645
Energy: 0.6252896794533641
Energy: 0.6320006092470897
Energy: 0.6240302403353813
Energy: 0.6379751456923544
Energy: 0.6240302403361936
Energy: 0.6379751456923544
Energy: 0.6240302403357875
Energy: 0.6379751456911359
Energy: 0.6495001796748808
Energy: 0.6353409254542752
Energy: 0.6495001796740686
Energy: 0.6353409254554937
Energy: 0.6495001796781301
Energy: 0.6353409254554937
Energy: 0.6262940338531745
Energy: 0.6357415309811095
Energy: 0.6262940338531745
Energy: 0.6357415309811095
Energy: 0.6262940338519561
Energy: 0.6357415309815158
Energy: 0.5641101320078686
Energy: 0.7065937962052125
Energy: 0.5641101320046193
Energy: 0.6933376985997759
Energy: 0.564110132003807
Energy: 0.7065937961991202
Energy: 0.639669326402803
Energy: 0.6002848767528123
Energy: 0.6396693264036154
Energy: 0.6002848767503753
Energy: 0.6396693264032093
Energy: 0.6002848767568738
Energy: 0.6170055014758578
Energy: 0.6054500207262729
Energy: 0.6170055014766701
Energy: 0.6054500207254606
Energy: 0.6170055014770762
Energy: 0.6054500207242421
Energy: 0.6284300103291998
Energy: 0.6012708050803768
Energy: 0.6284300103279813
Energy: 0.6012708050791583
Energy: 0.6284300103287936
Energy: 0.6012708050787522
Energy: 0.6798820113409605
Energy: 0.599961575175322
Energy: 0.6798820113377113
Energy: 0.5999615751765405
Energy: 0.6798820113409605
Energy: 0.5999615751769466
Energy: 0.564513471255761
Energy: 0.6533466651116665
Energy: 0.5645134712508872
Energy: 0.6533466651319743
Energy: 0.5645134712541364
Energy: 0.6533466651571558
Energy: 0.6116053707912943
Energy: 0.5519853054473146
Energy: 0.6116053707908881
Energy: 0.6014362033583328
Energy: 0.6116053707884512
Energy: 0.6596449260561319
Energy: 0.6304373921357966
Energy: 0.6476203033492286
Energy: 0.630437392137015
Energy: 0.6476203033496347
Energy: 0.6304373921382335
Energy: 0.6476203033484162
Energy: 0.6239556578455815
Energy: 0.6799106870705732
Energy: 0.6239556578411138
Energy: 0.6799106870705732
Energy: 0.6239556578463938
Energy: 0.6799106870681363
Energy: 0.616292421324365
Energy: 0.6138723435654091
Energy: 0.6162924213239589
Energy: 0.6138723435706521
Energy: 0.6162924213223343
Energy: 0.6138723435674398
Energy: 0.6450494539626521
Energy: 0.5903971527278145
Energy: 0.6450494539614338
Energy: 0.5903971527278145
Energy: 0.645049453962246
Energy: 0.5903971527278145
Energy: 0.6118862772265222
Energy: 0.5821786261212748
Energy: 0.6118862772261161
Energy: 0.5821786261204625
Energy: 0.6118862772273346
Energy: 0.5821786261249301
Energy: 0.5655399382393286
Energy: 0.6430263905766477
Energy: 0.5655399382385162
Energy: 0.64302639057218
Energy: 0.565539938240547
Energy: 0.6430263905738046
Energy: 0.6299029960320038
Energy: 0.638866247176179
Energy: 0.62990299603241
Energy: 0.6388662471765851
Energy: 0.6299029960295669
Energy: 0.6388662471769911
Energy: 0.6189410289340138
Energy: 0.5816938276165976
Energy: 0.6189410289372631
Energy: 0.5816938276182222
Energy: 0.6189410289348262
Energy: 0.5816938276170037
Energy: 0.673457000074101
Energy: 0.6015370076888038
Energy: 0.6734570000749134
Energy: 0.6015370076875853
Energy: 0.6734570000733257
Energy: 0.6015370076867731
Energy: 0.6190602035740782
Energy: 0.605102654894491
Energy: 0.6190602035757029
Energy: 0.6051026548948972
Energy: 0.6190602035748906
Energy: 0.6051026548936788
Energy: 0.6299011336027226
Energy: 0.6389231525240678
Energy: 0.6299011336019104
Energy: 0.6389231525240678
Energy: 0.6299011336019104
Energy: 0.6389231525244741
Energy: 0.5654661391526173
Energy: 0.6358616973477116
Energy: 0.5654661391497743
Energy: 0.63586169734893
Energy: 0.5654661391513989
Energy: 0.6358616973481177
Energy: 0.6116511863723594
Energy: 0.5823559694293922
Energy: 0.6116511863695162
Energy: 0.5823559694293922
Energy: 0.6116511863654548
Energy: 0.5823559694277675

minimum gb energy = 0.5519383276480163 eV
minimum distance =  2.37631976374901 Angstroms
sigma value = 57


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

Energy: 0.5742340126857753
Energy: 0.5579992172224288
Energy: 0.5742340126904045
Energy: 0.5579992172224288
Energy: 0.5742340126877593
Energy: 0.5579992172224288
Energy: 0.5608366800887334
Energy: 0.5507471497736942
Energy: 0.5608366800834429
Energy: 0.550747149773033
Energy: 0.5608366800642649
Energy: 0.5507471497743556
Energy: 0.6322445965249531
Energy: 0.593955945330006
Energy: 0.6322445965262758
Energy: 0.593955945330006
Energy: 0.6322445965256145
Energy: 0.5939559453306672
Energy: 0.5345688097644736
Energy: 0.6118914867527085
Energy: 0.5345688097618284
Energy: 0.6118914867540314
Energy: 0.5345688097624898
Energy: 0.61189148675337
Energy: 0.559500731502312
Energy: 0.5406684130182586
Energy: 0.559500731504296
Energy: 0.5406684130189201
Energy: 0.5595007315016507
Energy: 0.5406684130182586
Energy: 0.609918441809474
Energy: 0.5503850990277994
Energy: 0.6099184418088127
Energy: 0.5503850990277994
Energy: 0.6099184418081514
Energy: 0.5503850990277994
Energy: 0.5284315812785094
Energy: 0.5902331365818053
Energy: 0.5284315812804934
Energy: 0.5902331365837892
Energy: 0.5284315812791707
Energy: 0.5902331365831279
Energy: 0.7169868608869805
Energy: 0.57626092556739
Energy: 0.7169868608863192
Energy: 0.5762609255660673
Energy: 0.7169868608869805
Energy: 0.5762609255660673
Energy: 0.5560704795262016
Energy: 0.5511967034480285
Energy: 0.5560704795255402
Energy: 0.5511967034526578
Energy: 0.5560704795262016
Energy: 0.5511967034526578
Energy: 0.5635881853147997
Energy: 0.5676142709625235
Energy: 0.5635881853134772
Energy: 0.5676142709631848
Energy: 0.5635881853147997
Energy: 0.5676142709625235
Energy: 0.5229797255426588
Energy: 0.6380645320231576
Energy: 0.5229797255439815
Energy: 0.6380645320251415
Energy: 0.5229797255433202
Energy: 0.6380645320264641
Energy: 0.5802597248908576
Energy: 0.5283076364863375
Energy: 0.5802597248901963
Energy: 0.5283076364869989
Energy: 0.5802597248895349
Energy: 0.5283076364863375
Energy: 0.5621812223241194
Energy: 0.5974754945273127
Energy: 0.5621812223247806
Energy: 0.5974754945266515
Energy: 0.562181222323458
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Energy: 0.5322168228027265
Energy: 0.6560047553852973
Energy: 0.5322168228033878
Energy: 0.656004755388604
Energy: 0.5322168228027265
Energy: 0.6560047553912491
Energy: 0.624848723684417
Energy: 0.5609988302644262
Energy: 0.6248487236850784
Energy: 0.560998830263765
Energy: 0.6248487236870623
Energy: 0.5609988302631035
Energy: 0.5614176829097921
Energy: 0.5575880111965722
Energy: 0.5614176829091309
Energy: 0.5575880111965722
Energy: 0.5614176829104535
Energy: 0.557588011195911
Energy: 0.5806100662141446
Energy: 0.6335131951173777
Energy: 0.580610066210838
Energy: 0.633513195118039
Energy: 0.580610066210838
Energy: 0.633513195118039
Energy: 0.5939874083896614
Energy: 0.6115038928373929
Energy: 0.5939874083923067
Energy: 0.611503892841962
Energy: 0.5939874083923067
Energy: 0.6115038928439459
Energy: 0.5410752001640402
Energy: 0.663586879335454
Energy: 0.5410752001686694
Energy: 0.663586879335454
Energy: 0.5410752001640402
Energy: 0.663586879335454
Energy: 0.5347454918722773
Energy: 0.6069976935304761
Energy: 0.5347454918749225
Energy: 0.6069976935311373
Energy: 0.5347454918749225
Energy: 0.6069976935311373
Energy: 0.5944155628169093
Energy: 0.589196208036392
Energy: 0.5944155628149254
Energy: 0.5891962080370534
Energy: 0.5944155628194945
Energy: 0.5891962080357308
Energy: 0.5223164921370869
Energy: 0.6673559664010801
Energy: 0.5223164921364255
Energy: 0.6673559664004187
Energy: 0.5223164921351028
Energy: 0.6673559663984349
Energy: 0.5789711180821253
Energy: 0.5805711800283497
Energy: 0.5789711180808026
Energy: 0.5805711800276885
Energy: 0.5789711180821253
Energy: 0.5805711800270271
Energy: 0.5828708210969219
Energy: 0.6662901149952745
Energy: 0.5828708210982446
Energy: 0.6662901149959357
Energy: 0.5828708210969219
Energy: 0.6662901149972583
Energy: 0.5737522094646499
Energy: 0.7120104477994761
Energy: 0.573752209462666
Energy: 0.7120104478007989
Energy: 0.573752209462666
Energy: 0.7120104478001376
Energy: 0.5609500267880237
Energy: 0.5796810453741121
Energy: 0.5609500267893465
Energy: 0.5796810453741121
Energy: 0.5609500267860399
Energy: 0.579681045376096
Energy: 0.531112924366406
Energy: 0.6636341636896633
Energy: 0.5311129243670673
Energy: 0.6636341636903246
Energy: 0.5311129243650834
Energy: 0.6636341636903246

minimum gb energy = 0.5223164921351028 eV
minimum distance =  2.32966260805916 Angstroms
sigma value = 43


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

Energy: 0.5368063152938419
Energy: 0.5025924843236824
Energy: 0.5368063152943238
Energy: 0.5025924843241643
Energy: 0.5368063152938419
Energy: 0.5025924843246461
Energy: 0.5501356550309107
Energy: 0.5104511140812085
Energy: 0.5501356550304287
Energy: 0.5104511140812085
Energy: 0.550135655029947
Energy: 0.5104511140812085
Energy: 0.5418565923974686
Energy: 0.5134343381266174
Energy: 0.5418565923965049
Energy: 0.5134343381256539
Energy: 0.5418565923965049
Energy: 0.5134343381270994
Energy: 0.5115573439949674
Energy: 0.5266846825320707
Energy: 0.5115573439935219
Energy: 0.5266846825330344
Energy: 0.5115573439944856
Energy: 0.5266846825325524
Energy: 0.5490427541438141
Energy: 0.4858278335005124
Energy: 0.5490427541438141
Energy: 0.4858278335005124
Energy: 0.5490427541438141
Energy: 0.48582783350003067
Energy: 0.5174270621031041
Energy: 0.49401142920115904
Energy: 0.517427062103586
Energy: 0.4940114292006772
Energy: 0.5174270621026223
Energy: 0.4940114292006772
Energy: 0.4695981359103486
Energy: 0.512159960388479
Energy: 0.46959813591083044
Energy: 0.5121599603899245
Energy: 0.46959813591372146
Energy: 0.5121599603889607
Energy: 0.5494727874565807
Energy: 0.4765628997821746
Energy: 0.5494727874599536
Energy: 0.476562899781211
Energy: 0.549472787456099
Energy: 0.47656289978072913
Energy: 0.4961613430299741
Energy: 0.48706991537803407
Energy: 0.4961613430309378
Energy: 0.4870699153775521
Energy: 0.4961613430309378
Energy: 0.4870699153775521
Energy: 0.5523198733510253
Energy: 0.48717121942570635
Energy: 0.5523198733500616
Energy: 0.48717121942618824
Energy: 0.5523198733515071
Energy: 0.48717121942522457
Energy: 0.5960478716651463
Energy: 0.5340948611396482
Energy: 0.596047871663219
Energy: 0.5340948611396482
Energy: 0.5960478716637009
Energy: 0.5340948611396482
Energy: 0.4705168780385057
Energy: 0.48830251512552075
Energy: 0.47051687803609654
Energy: 0.48830251512455713
Energy: 0.4705168780394694
Energy: 0.4883025151264844
Energy: 0.5515423896497907
Energy: 0.4684116461196415
Energy: 0.5515423896502725
Energy: 0.4684116461196415
Energy: 0.5515423896473816
Energy: 0.4684116461196415
Energy: 0.5946038969337343
Energy: 0.5898009079141882
Energy: 0.5946038969332524
Energy: 0.5898009079141882
Energy: 0.5946038969327707
Energy: 0.5898009079151519
Energy: 0.48731679264828
Energy: 0.4894941557699498
Energy: 0.4873167926473163
Energy: 0.4894941557699498
Energy: 0.4873167926477982
Energy: 0.489494155769468
Energy: 0.5175707451245043
Energy: 0.5137972446638773
Energy: 0.5175707451240225
Energy: 0.5137972446648411
Energy: 0.5175707451254679
Energy: 0.5137972446629137
Energy: 0.5012273415390379
Energy: 0.5878633342778807
Energy: 0.5012273415375924
Energy: 0.5878633342783626
Energy: 0.5012273415409653
Energy: 0.5878633342778807
Energy: 0.5039044889002409
Energy: 0.48926400107899337
Energy: 0.503904488899759
Energy: 0.48926400107947515
Energy: 0.5039044889007227
Energy: 0.48926400107947515
Energy: 0.49527939838258994
Energy: 0.5410424276690008
Energy: 0.49527939838066254
Energy: 0.541042427668519
Energy: 0.4952793983830717
Energy: 0.5410424276694827
Energy: 0.5160796668741691
Energy: 0.5353689741301366
Energy: 0.5160796668751328
Energy: 0.5353689741301366
Energy: 0.5160796668741691
Energy: 0.5353689741306186
Energy: 0.5428577630689874
Energy: 0.4995473747700728
Energy: 0.5428577630685055
Energy: 0.4995473747720001
Energy: 0.5428577630689874
Energy: 0.4995473747710365
Energy: 0.5111508817138243
Energy: 0.5451413064055954
Energy: 0.5111508817138243
Energy: 0.5451413064055954
Energy: 0.5111508817157516
Energy: 0.5451413064060773
Energy: 0.5269487670993654
Energy: 0.5442794681511528
Energy: 0.5269487671027383
Energy: 0.5442794681516345
Energy: 0.5269487670988836
Energy: 0.5442794681511528
Energy: 0.5202238865470901
Energy: 0.4976728492162428
Energy: 0.5202238865475719
Energy: 0.49767284921527916
Energy: 0.5202238865446808
Energy: 0.49767284921527916
Energy: 0.47013362479144943
Energy: 0.5338840575623361
Energy: 0.470133624792895
Energy: 0.5338840575628179
Energy: 0.4701336247919313
Energy: 0.5338840575642634
Energy: 0.481500008220774
Energy: 0.5250751192687877
Energy: 0.4815000082193284
Energy: 0.5250751192692696
Energy: 0.48150000822029215
Energy: 0.5250751192692696
Energy: 0.5189216230567998
Energy: 0.4809157876716559
Energy: 0.5189216230572816
Energy: 0.4809157876716559
Energy: 0.5330467024248362
Energy: 0.48091578767213766
Energy: 0.46357032864963493
Energy: 0.5306128137739765
Energy: 0.46357032864963493
Energy: 0.5306128137739765
Energy: 0.4635703286515623
Energy: 0.5306128137744583
Energy: 0.48130651328903273
Energy: 0.4945066703311377
Energy: 0.4813065132885509
Energy: 0.4945066703306558
Energy: 0.48130651328903273
Energy: 0.494506670330174
Energy: 0.48317459811088276
Energy: 0.5306995925185838
Energy: 0.48317459811088276
Energy: 0.530699592520511
Energy: 0.48317459811040103
Energy: 0.530699592520511
Energy: 0.457366500513767
Energy: 0.5314818936142396
Energy: 0.4573665005152126
Energy: 0.5314818936137579
Energy: 0.4573665005128034
Energy: 0.5314818936137579
Energy: 0.4817048905229044
Energy: 0.47704055073532625
Energy: 0.48170489052483173
Energy: 0.4770405507358081
Energy: 0.4817048905243499
Energy: 0.47704055073484436
Energy: 0.4676701980548985
Energy: 0.5332928912792841
Energy: 0.4676701980529713
Energy: 0.5332928912812114
Energy: 0.4676701980544168
Energy: 0.5332928912812114
Energy: 0.5533109586847487
Energy: 0.6428431420676782
Energy: 0.5533109586871579
Energy: 0.6428431420671963
Energy: 0.5533109586857123
Energy: 0.6428431420671963
Energy: 0.482537150383371
Energy: 0.46322193298021996
Energy: 0.4825371503824074
Energy: 0.46322193298070186
Energy: 0.4825371503828892
Energy: 0.46322193298070186
Energy: 0.4320958090930965
Energy: 0.5319246848123729
Energy: 0.43209580909261464
Energy: 0.5319246848128546
Energy: 0.43209580909213285
Energy: 0.5319246848143002

minimum gb energy = 0.43209580909213285 eV
minimum distance =  2.32300047322898 Angstroms
sigma value = 81


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

Energy: 0.02113325072033536
Energy: 0.05061193362282463
Energy: 0.02113325072033536
Energy: 0.05061193362459501
Energy: 0.02113325072033536
Energy: 0.05061193362459501
Energy: 0.39630795674389224
Energy: 0.0225117156759826
Energy: 0.39630795674389224
Energy: 0.022511715677752987
Energy: 0.39630795674566266
Energy: 0.0225117156759826
Energy: 0.39627535092175875
Energy: 0.0224628089512905
Energy: 0.39627535092175875
Energy: 0.02246280894952012
Energy: 0.39627535092175875
Energy: 0.02246280894952012
Energy: 0.02113325072033536
Energy: 0.050611933621054254
Energy: 0.02113325072033536
Energy: 0.05061193362282463
Energy: 0.02113325072033536
Energy: 0.050611933621054254
Energy: 0.39630795674389224
Energy: 0.022511715670691573
Energy: 0.39630795674389224
Energy: 0.022511715670691573
Energy: 0.39630795674389224
Energy: 0.022511715670691573
Energy: 0.39627535092175875
Energy: 0.0224628089512905
Energy: 0.39627535092175875
Energy: 0.0224628089512905
Energy: 0.39627535092175875
Energy: 0.0224628089512905
Energy: 0.02113325072033536
Energy: 0.05061193362282463
Energy: 0.02113325072033536
Energy: 0.05061193362282463
Energy: 0.02113325072033536
Energy: 0.050611933621054254
Energy: 0.39630795674389224
Energy: 0.022511715668921194
Energy: 0.39630795674389224
Energy: 0.022511715667150815
Energy: 0.39630795674389224
Energy: 0.022511715667150815
Energy: 0.39627535092175875
Energy: 0.022462808954831263
Energy: 0.39627535092175875
Energy: 0.022462808954831263
Energy: 0.39627535092175875
Energy: 0.02246280895306088
Energy: 0.02113325072033536
Energy: 0.05061193362282463
Energy: 0.02113325072033536
Energy: 0.050611933621054254
Energy: 0.02113325072033536
Energy: 0.050611933621054254

minimum gb energy = 0.02113325072033536 eV
minimum distance =  2.53184781678156 Angstroms
sigma value = 3


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

Energy: 0.4624048684387994
Energy: 0.38547902688205943
Energy: 0.4624048684387994
Energy: 0.38547902688205943
Energy: 0.46240486843826967
Energy: 0.38547902688205943
Energy: 0.3895928823121069
Energy: 0.44509741042394835
Energy: 0.3895928823115772
Energy: 0.44509741042394835
Energy: 0.3895928823110474
Energy: 0.44509741042394835
Energy: 0.45040338485172715
Energy: 0.4446145950682072
Energy: 0.4504033848506676
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Energy: 0.4504033848511973
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Energy: 0.46716299548544626
Energy: 0.4297414085142587
Energy: 0.4671629954870356
Energy: 0.42974140851372894
Energy: 0.467162995485976
Energy: 0.42974140851372894
Energy: 0.3851160748731922
Energy: 0.445486772208378
Energy: 0.3851160748970328
Energy: 0.44548677220731836
Energy: 0.3851160748726624
Energy: 0.4454867722062588
Energy: 0.45200454053314487
Energy: 0.44725931015040443
Energy: 0.45200454053314487
Energy: 0.44725931015040443
Energy: 0.45200454053314487
Energy: 0.44725931015040443
Energy: 0.4426514018288172
Energy: 0.43474961314391725
Energy: 0.4426514018282873
Energy: 0.43474961314338745
Energy: 0.44265140182775753
Energy: 0.43474961314338745
Energy: 0.3823253338078702
Energy: 0.4371396295264918
Energy: 0.3823253338073404
Energy: 0.4371396295249025
Energy: 0.3823253338078702
Energy: 0.43713962952596214
Energy: 0.46013388949350004
Energy: 0.4521228190672403
Energy: 0.4601338894929702
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Energy: 0.4601338894924404
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Energy: 0.44316013050352415
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Energy: 0.40820716755546066
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Energy: 0.38586063521212216
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Energy: 0.4215896818130877
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Energy: 0.4878264793537711
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Energy: 0.4878264793543009
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Energy: 0.455704529388427
Energy: 0.3267865383822555
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Energy: 0.4406984955718428
Energy: 0.4477456085422261
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Energy: 0.4644286704113416
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Energy: 0.4644286704102821
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Energy: 0.46026107305927366
Energy: 0.450768919022054
Energy: 0.46026107305874386
Energy: 0.4507689190231136
Energy: 0.46026107305821407
Energy: 0.45076891902258387

minimum gb energy = 0.3267865383822555 eV
minimum distance =  2.38655354514159 Angstroms
sigma value = 67


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

Energy: 0.6013560285586858
Energy: 0.561011631980676
Energy: 0.6013560285579307
Energy: 0.561011631980676
Energy: 0.6013560285594406
Energy: 0.561011631979921
Energy: 0.5565100980708853
Energy: 0.5575803888576649
Energy: 0.5565100980716402
Energy: 0.5575803888576649
Energy: 0.5565100980716402
Energy: 0.5575803888576649
Energy: 0.5840344831768396
Energy: 0.5745716589157241
Energy: 0.5840344831760845
Energy: 0.5745716589157241
Energy: 0.5840344831768396
Energy: 0.5745716589157241
Energy: 0.5844085895801259
Energy: 0.5734350031146224
Energy: 0.5844085895778612
Energy: 0.5734350031146224
Energy: 0.5844085895786161
Energy: 0.5734350031153772
Energy: 0.5082251389603609
Energy: 0.5434088335004983
Energy: 0.5082251389618708
Energy: 0.5434088334997433
Energy: 0.5082251389618708
Energy: 0.5434088335004983
Energy: 0.5851102090613542
Energy: 0.5726821081778904
Energy: 0.5851102090643737
Energy: 0.5726821081778904
Energy: 0.5851102090621092
Energy: 0.5726821081771357
Energy: 0.5463677104862203
Energy: 0.5498115780416024
Energy: 0.5463677104877301
Energy: 0.5498115780416024
Energy: 0.5463677104854654
Energy: 0.5498115780423574
Energy: 0.5439964697875681
Energy: 0.5354783673949289
Energy: 0.5439964697868133
Energy: 0.5354783673949289
Energy: 0.5439964697868133
Energy: 0.5354783673941741
Energy: 0.6009031736610535
Energy: 0.6091829117320047
Energy: 0.6009031736625632
Energy: 0.6091829117312498
Energy: 0.6009031736618085
Energy: 0.6091829117320047
Energy: 0.5661775359306218
Energy: 0.51856487599462
Energy: 0.566177535929867
Energy: 0.51856487599462
Energy: 0.566177535929867
Energy: 0.5185648759953749
Energy: 0.5876914398060911
Energy: 0.5782886613502779
Energy: 0.5876914398060911
Energy: 0.5782886613502779
Energy: 0.587691439806846
Energy: 0.5782886613502779
Energy: 0.5506427439391951
Energy: 0.5771082322447182
Energy: 0.5506427439376852
Energy: 0.5771082322447182
Energy: 0.5506427439354206
Energy: 0.577108232245473
Energy: 0.5658749869576531
Energy: 0.5511411835449551
Energy: 0.5658749869576531
Energy: 0.5511411835442002
Energy: 0.565874986958408
Energy: 0.5511411835464648
Energy: 0.5571361468320459
Energy: 0.5723850050407403
Energy: 0.5571361468320459
Energy: 0.5723850050445146
Energy: 0.557136146831291
Energy: 0.5723850050437598
Energy: 0.5537424617667027
Energy: 0.5521880136900155
Energy: 0.5537424617659479
Energy: 0.5521880136892604
Energy: 0.5537424617667027
Energy: 0.5521880136900155
Energy: 0.5823573853456228
Energy: 0.5605289298479512
Energy: 0.5823573853456228
Energy: 0.5605289298479512
Energy: 0.5823573853448679
Energy: 0.5605289298464413
Energy: 0.577686577205559
Energy: 0.5779547758805309
Energy: 0.577686577205559
Energy: 0.5779547758767565
Energy: 0.577686577205559
Energy: 0.5779547758782662
Energy: 0.5656214987892045
Energy: 0.5428941056379316
Energy: 0.5656214987892045
Energy: 0.5428941056379316
Energy: 0.5656214987884497
Energy: 0.5428941056386866
Energy: 0.574171860462544
Energy: 0.5872500722064874
Energy: 0.5741718604632988
Energy: 0.5872500722049776
Energy: 0.5741718604632988
Energy: 0.5872500722064874
Energy: 0.508442305727809
Energy: 0.5760843123327194
Energy: 0.5084423058334254
Energy: 0.5760843123342291
Energy: 0.5084423058311607
Energy: 0.5760843123334742
Energy: 0.5982756809401505
Energy: 0.5504201541250607
Energy: 0.5982756809401505
Energy: 0.5504201541258155
Energy: 0.5982756809424152
Energy: 0.5504201541250607
Energy: 0.5910012576361439
Energy: 0.6094111485434308
Energy: 0.5910012576353891
Energy: 0.6094111485426759
Energy: 0.5910012576353891
Energy: 0.6094111485441855
Energy: 0.544790612551161
Energy: 0.5753507965328778
Energy: 0.5447906125504061
Energy: 0.575350796531368
Energy: 0.5447906125504061
Energy: 0.5753507965328778

minimum gb energy = 0.5082251389603609 eV
minimum distance =  2.38738647438755 Angstroms
sigma value = 33


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

Energy: 0.677438803244141
Energy: 0.6315493632779039
Energy: 0.6774388032427044
Energy: 0.6315493632802983
Energy: 0.6774388032427044
Energy: 0.6315493632812561
Energy: 0.6308199219593114
Energy: 0.6462908335609411
Energy: 0.6308199219593114
Energy: 0.6462908335614199
Energy: 0.6308199219597903
Energy: 0.6462908335614199
Energy: 0.6626785951719806
Energy: 0.647200283147413
Energy: 0.6626785951724594
Energy: 0.647200283147413
Energy: 0.6626785951729384
Energy: 0.6472002831469341
Energy: 0.6614368521348222
Energy: 0.6510975102350701
Energy: 0.6614368521348222
Energy: 0.6510975102345912
Energy: 0.66143685213578
Energy: 0.651097510235549
Energy: 0.6382048000687597
Energy: 0.6417673239486833
Energy: 0.6382048000697175
Energy: 0.6417673239482043
Energy: 0.6382048000692386
Energy: 0.6417673239482043
Energy: 0.7001513273440756
Energy: 0.6790419090795408
Energy: 0.7001513273431178
Energy: 0.7121910097151214
Energy: 0.7001513273431178
Energy: 0.6962808507139255
Energy: 0.6304426745645024
Energy: 0.6214264343781444
Energy: 0.6304426745640236
Energy: 0.6214264343781444
Energy: 0.6304426745649814
Energy: 0.6214264343786232
Energy: 0.6675423322748618
Energy: 0.6628446487039423
Energy: 0.6675423322753407
Energy: 0.6628446487044213
Energy: 0.6675423322758196
Energy: 0.6628446487039423
Energy: 0.6449509439660126
Energy: 0.6721209094135078
Energy: 0.6449509439660126
Energy: 0.6721209094149009
Energy: 0.6449509439669704
Energy: 0.6721209094135078
Energy: 0.6732365302226792
Energy: 0.5991781741955704
Energy: 0.6732365302241158
Energy: 0.6552898126352095
Energy: 0.6732365302236369
Energy: 0.6420670171924953
Energy: 0.6699627794216078
Energy: 0.6439927159143077
Energy: 0.6699627794211289
Energy: 0.6439927159152654
Energy: 0.6699627794220867
Energy: 0.6439927159147866
Energy: 0.630588581449644
Energy: 0.63707331138703
Energy: 0.6305885814510808
Energy: 0.6370733113865511
Energy: 0.6305885814491652
Energy: 0.6370733113865511
Energy: 0.6730068144120274
Energy: 0.6333461989372263
Energy: 0.6730068144115484
Energy: 0.6333461989377053
Energy: 0.6730068144125062
Energy: 0.6333461989377053
Energy: 0.6339752507992885
Energy: 0.6500813478244625
Energy: 0.6339752507992885
Energy: 0.6500813478244625
Energy: 0.6339752507988096
Energy: 0.6500813478244625
Energy: 0.6390381829099685
Energy: 0.6415303262877433
Energy: 0.6390381829109263
Energy: 0.6415303262882223
Energy: 0.6390381829094895
Energy: 0.6415303262877433
Energy: 0.660874525384136
Energy: 0.6650050202810077
Energy: 0.6608745253831784
Energy: 0.6650050202814866
Energy: 0.660874525384136
Energy: 0.6650050202810077
Energy: 0.6395578460010084
Energy: 0.6478310405685641
Energy: 0.639557845998135
Energy: 0.6478310405680853
Energy: 0.6395578459995717
Energy: 0.6478310405685641
Energy: 0.681087320898656
Energy: 0.6905610365984547
Energy: 0.6810873208981771
Energy: 0.6905610365989336
Energy: 0.6810873208991349
Energy: 0.6905610365989336
Energy: 0.6210082549782703
Energy: 0.6717246944889576
Energy: 0.6210082549773124
Energy: 0.6717246944889576
Energy: 0.6210082549763546
Energy: 0.6717246944884786
Energy: 0.6410590961402919
Energy: 0.6484457890855306
Energy: 0.6410590961393342
Energy: 0.6484457890855306
Energy: 0.6410590961398132
Energy: 0.6484457890860095
Energy: 0.6586423002036923
Energy: 0.6665423609257332
Energy: 0.6586423002032133
Energy: 0.6665423609252543
Energy: 0.6586423002032133
Energy: 0.6665423609252543
Energy: 0.6404469387606466
Energy: 0.6261680742202038
Energy: 0.6404469387616044
Energy: 0.6261680742202038
Energy: 0.6404469387606466
Energy: 0.6261680742206827
Energy: 0.6584936518459485
Energy: 0.6441243790501068
Energy: 0.6584936518464275
Energy: 0.6441243790510646
Energy: 0.6584936518469063
Energy: 0.6441243790505856
Energy: 0.6718076670887516
Energy: 0.6332680274246725
Energy: 0.6718076670882727
Energy: 0.6332680274246725
Energy: 0.6718076670887516
Energy: 0.6332680274246725
Energy: 0.6283161357130083
Energy: 0.6321134670776631
Energy: 0.6283161357120505
Energy: 0.6321134670786209
Energy: 0.6283161357158815
Energy: 0.6321134670790998
Energy: 0.6576734427045602
Energy: 0.6573423467008539
Energy: 0.6576734427059968
Energy: 0.6573423467008539
Energy: 0.6576734427059968
Energy: 0.6573423467013328
Energy: 0.6295798706053215
Energy: 0.6270952753248359
Energy: 0.6295798706058005
Energy: 0.6270952753248359
Energy: 0.629579870603406
Energy: 0.6270952753248359
Energy: 0.6600210391383811
Energy: 0.7053982994272143
Energy: 0.6600210391369443
Energy: 0.7053982994272143
Energy: 0.6600210391374233
Energy: 0.7053982994267355
Energy: 0.6357641889044651
Energy: 0.6435168803211428
Energy: 0.6357641889039861
Energy: 0.6435168803221006
Energy: 0.6357641889035072
Energy: 0.6435168803216217
Energy: 0.6217670180500217
Energy: 0.6186536971633361
Energy: 0.6217670180509794
Energy: 0.6186536971623782
Energy: 0.6217670180505006
Energy: 0.6186536971628571
Energy: 0.7009996239037584
Energy: 0.6919238109166492
Energy: 0.7009996239032794
Energy: 0.6919238109166492
Energy: 0.7009996239037584
Energy: 0.6919238109166492
Energy: 0.6474509650509962
Energy: 0.6481863033199511
Energy: 0.6474509650500385
Energy: 0.6481863033199511
Energy: 0.6474509650519541
Energy: 0.6481863033204299
Energy: 0.6606446650699063
Energy: 0.6636286791727398
Energy: 0.6606446650694273
Energy: 0.6636286791703453
Energy: 0.6606446650708641
Energy: 0.6636286791732188
Energy: 0.6488914683086733
Energy: 0.6432974085404819
Energy: 0.6488914683081943
Energy: 0.6432974085404819
Energy: 0.6488914683077154
Energy: 0.6432974085395241
Energy: 0.6325700213882552
Energy: 0.6477361331215308
Energy: 0.6325700213877763
Energy: 0.6477361331210518
Energy: 0.6325700213872975
Energy: 0.6477361331210518
Energy: 0.6658495079661741
Energy: 0.6336012299437479
Energy: 0.6658495079647374
Energy: 0.6336012299442269
Energy: 0.6658495079633008
Energy: 0.6336012299442269
Energy: 0.6315444420584437
Energy: 0.6393696071200986
Energy: 0.6315444420589226
Energy: 0.639369607118183
Energy: 0.6315444420594014
Energy: 0.639369607118183

minimum gb energy = 0.5991781741955704 eV
minimum distance =  2.36269186442726 Angstroms
sigma value = 41


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

Energy: 0.7902243538306888
Energy: 0.7746975911098388
Energy: 0.7902243538306888
Energy: 0.774697591112454
Energy: 0.7902243538306888
Energy: 0.7746975911111464
Energy: 0.750110444821629
Energy: 0.7630381977747833
Energy: 0.7501104448203216
Energy: 0.7630381977747833
Energy: 0.7501104448203216
Energy: 0.7630381977747833
Energy: 0.8457919759204706
Energy: 0.7592592791447089
Energy: 0.8730066841777313
Energy: 0.7592592791434014
Energy: 0.825842867346077
Energy: 0.7592592791434014
Energy: 0.7836892995551548
Energy: 0.8068044864513729
Energy: 0.7836892995577698
Energy: 0.8068044864526805
Energy: 0.7836892995564623
Energy: 0.8068044864526805
Energy: 0.746120440567406
Energy: 0.7832671369587644
Energy: 0.7461204405687135
Energy: 0.7832671369587644
Energy: 0.746120440567406
Energy: 0.783267136957457
Energy: 0.8415229920530619
Energy: 0.8191778677318704
Energy: 0.8415229920517544
Energy: 0.8191778677318704
Energy: 0.8415229920504469
Energy: 0.8191778677318704
Energy: 0.7830565893022414
Energy: 0.7318220745877348
Energy: 0.7830565893022414
Energy: 0.7318220745877348
Energy: 0.7830565893022414
Energy: 0.7318220745864273
Energy: 0.7944138057675989
Energy: 0.7632807836969906
Energy: 0.7944138057675989
Energy: 0.7632807836956831
Energy: 0.7944138057689064
Energy: 0.7632807836969906
Energy: 0.7005704599954117
Energy: 0.7510714152319238
Energy: 0.7005704599967191
Energy: 0.7510714152319238
Energy: 0.7005704599954117
Energy: 0.7510714152319238
Energy: 0.7839222694268
Energy: 0.7647465105654505
Energy: 0.7839222694268
Energy: 0.764746510564143
Energy: 0.7839222694268
Energy: 0.7647465105654505
Energy: 0.748307033893149
Energy: 0.7597685161642946
Energy: 0.7483070338944565
Energy: 0.7597685161642946
Energy: 0.748307033893149
Energy: 0.7597685161642946
Energy: 0.7845973728223423
Energy: 0.7623429475451512
Energy: 0.7845973728223423
Energy: 0.7623429475451512
Energy: 0.7845973728223423
Energy: 0.7623429475451512
Energy: 0.7102377254230875
Energy: 0.7996325011745361
Energy: 0.71023772542178
Energy: 0.7996325011745361
Energy: 0.7102377254204725
Energy: 0.7996325011745361
Energy: 0.7509459274866201
Energy: 0.7633294782346187
Energy: 0.7509459274879277
Energy: 0.7633294782346187
Energy: 0.7509459274866201
Energy: 0.7633294782346187

minimum gb energy = 0.7005704599954117 eV
minimum distance =  2.34867733645956 Angstroms
sigma value = 11


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

Energy: 0.9568724091224982
Energy: 0.8856439836329
Energy: 0.9568724091230726
Energy: 0.8856439836351974
Energy: 0.9568724091224982
Energy: 0.8856439836317511
Energy: 0.8381458438113004
Energy: 0.8676415214771239
Energy: 0.8381458438113004
Energy: 0.8676415214771239
Energy: 0.8381458438124492
Energy: 0.8676415214776984
Energy: 0.9061741424606039
Energy: 0.8792095358943182
Energy: 0.9061741424600296
Energy: 0.8792095358943182
Energy: 0.9316155121932276
Energy: 0.8792095358943182
Energy: 0.8788815614709863
Energy: 0.8409719474253001
Energy: 0.8788815614709863
Energy: 0.8409719474253001
Energy: 0.8788815614715605
Energy: 0.8409719474258746
Energy: 0.8899199726758174
Energy: 0.8475481505833752
Energy: 0.8899199726746687
Energy: 0.8475481505828008
Energy: 0.8899199726746687
Energy: 0.8475481505828008
Energy: 0.858796222497319
Energy: 0.9019922131177958
Energy: 0.8587962224984679
Energy: 0.9019922131183702
Energy: 0.858796222497319
Energy: 0.9019922131183702
Energy: 0.8754116360696859
Energy: 0.8644092759893766
Energy: 0.8754116360696859
Energy: 0.8644092759888022
Energy: 0.8754116360708347
Energy: 0.864409275989951
Energy: 0.8727886267885593
Energy: 0.8897189202614326
Energy: 0.8727886267897081
Energy: 0.8897189202608583
Energy: 0.8727886267885593
Energy: 0.8897189202614326
Energy: 0.8874465655517467
Energy: 0.8679957040451776
Energy: 0.8874465655523213
Energy: 0.8679957040457519
Energy: 0.8874465655523213
Energy: 0.8679957040457519
Energy: 0.8662180245762284
Energy: 0.886428039593664
Energy: 0.8662180245739309
Energy: 0.886428039593664
Energy: 0.8662180245745054
Energy: 0.886428039593664
Energy: 0.8700032530895881
Energy: 0.8715370820941705
Energy: 0.8700032530890137
Energy: 0.8715370820941705
Energy: 0.8700032530895881
Energy: 0.8715370820941705
Energy: 0.8721173854531478
Energy: 0.8780256639864117
Energy: 0.8721173854531478
Energy: 0.8780256639858375
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Energy: 0.8780256639864117
Energy: 0.8818865915689024
Energy: 0.8630642155051836
Energy: 0.8818865915700512
Energy: 0.8630642155051836
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Energy: 0.8630642155057581
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Energy: 0.8814334534467418
Energy: 0.873053368504666
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Energy: 0.8730533685052404
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Energy: 0.8752140926665203
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Energy: 0.8752140926676689
Energy: 0.8758882774631542
Energy: 0.8644367764000501
Energy: 0.8758882774637287
Energy: 0.8644367764000501
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Energy: 0.8510565560389494
Energy: 0.8699230391609075
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Energy: 0.8510565560395238
Energy: 0.8699230391603331
Energy: 0.9056057650778269
Energy: 0.9054867861332974
Energy: 0.9056057650772527
Energy: 0.9054867861321487
Energy: 0.9056057650789758
Energy: 0.9054867861327232
Energy: 0.8618864047546462
Energy: 0.8238160319961064
Energy: 0.861886404755795
Energy: 0.8238160319961064
Energy: 0.8618864047540719
Energy: 0.823816031995532
Energy: 0.86827525988504
Energy: 0.869181280551921
Energy: 0.8682752598833168
Energy: 0.8691812805524953
Energy: 0.8682752598838911
Energy: 0.869181280551921
Energy: 0.8520684804109047
Energy: 0.860386157341471
Energy: 0.8520684804114791
Energy: 0.860386157341471
Energy: 0.8520684804120533
Energy: 0.8603861573408967
Energy: 0.9029134710860706
Energy: 0.9029914106116631
Energy: 0.9029134710849218
Energy: 0.9029914106116631
Energy: 0.9029134710854962
Energy: 0.9029914106122375
Energy: 0.8751677472572901
Energy: 0.8795181766580457
Energy: 0.8751677472561412
Energy: 0.8795181766580457
Energy: 0.8751677472578643
Energy: 0.8795181766580457
Energy: 0.9073693946751865
Energy: 0.8793375713922705
Energy: 0.9073693946751865
Energy: 0.8793375713916962
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Energy: 0.879337571392845
Energy: 0.8739321095837843
Energy: 0.8775888521128383
Energy: 0.8739321095837843
Energy: 0.8775888521122639
Energy: 0.8739321095837843
Energy: 0.8775888521122639
Energy: 0.8566905930567748
Energy: 0.8692491774149592
Energy: 0.8566905930567748
Energy: 0.8692491774161081
Energy: 0.8566905930573492
Energy: 0.8692491774161081
Energy: 0.8471457760156105
Energy: 0.9111438736113737
Energy: 0.8471457760161849
Energy: 0.9111438736107993
Energy: 0.8471457760161849
Energy: 0.9111438736113737
Energy: 0.8894630439246088
Energy: 0.8666625270703255
Energy: 0.8894630439240343
Energy: 0.8666625270697511
Energy: 0.8894630439246088
Energy: 0.8666625270714744
Energy: 0.8814789444168158
Energy: 0.8824251019746682
Energy: 0.8814789444168158
Energy: 0.8824251019746682
Energy: 0.8814789444162414
Energy: 0.8824251019740939
Energy: 0.8680532033542105
Energy: 0.8322358681171026
Energy: 0.8680532033536361
Energy: 0.8322358681171026
Energy: 0.868053203354785
Energy: 0.8322358681171026
Energy: 0.8701729367881305
Energy: 0.9099583373221088
Energy: 0.8701729367881305
Energy: 0.9099583373221088
Energy: 0.870172936787556
Energy: 0.9099583373221088

minimum gb energy = 0.823816031995532 eV
minimum distance =  2.32186331633904 Angstroms
sigma value = 57


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

Energy: 0.8575900006146053
Energy: 0.8519794557987727
Energy: 0.8575900006156274
Energy: 0.8519794557977507
Energy: 0.8575900006156274
Energy: 0.8519794557987727
Energy: 0.8568331055070612
Energy: 0.9576643127246103
Energy: 0.8568331055070612
Energy: 0.9576643127246103
Energy: 0.8568331055070612
Energy: 0.9576643127235883
Energy: 0.8992227919087027
Energy: 0.8823196842383888
Energy: 0.8992227919097248
Energy: 0.8823196842383888
Energy: 0.8992227919127912
Energy: 0.8823196842373666
Energy: 0.8625520199357849
Energy: 0.90392356471991
Energy: 0.8625520199357849
Energy: 0.9039235647209322
Energy: 0.8625520199357849
Energy: 0.9039235647209322
Energy: 0.8994671553658011
Energy: 0.8823338285879799
Energy: 0.8994671553647791
Energy: 0.8823338285879799
Energy: 0.8994671553647791
Energy: 0.8823338285879799
Energy: 0.8567282052443845
Energy: 0.8452919998770784
Energy: 0.8567282052464288
Energy: 0.8452919998781006
Energy: 0.8567282052423403
Energy: 0.8452919998770784
Energy: 0.8575900006156274
Energy: 0.8519794557946843
Energy: 0.8575900006166494
Energy: 0.8519794557946843
Energy: 0.8575900006156274
Energy: 0.8519794557957064
Energy: 0.8568331055070612
Energy: 0.9576643127246103
Energy: 0.8568331055060391
Energy: 0.9576643127246103
Energy: 0.8568331055060391
Energy: 0.9576643127246103
Energy: 0.8992227919117691
Energy: 0.8823196842373666
Energy: 0.8992227919097248
Energy: 0.8823196842373666
Energy: 0.8992227919127912
Energy: 0.8823196842373666
Energy: 0.8625520199347628
Energy: 0.9039235647209322
Energy: 0.8625520199347628
Energy: 0.9039235647209322
Energy: 0.8625520199347628
Energy: 0.9039235647209322
Energy: 0.8994671553688676
Energy: 0.8823338285900243
Energy: 0.8994671553678453
Energy: 0.8823338285900243
Energy: 0.8994671553698896
Energy: 0.8823338285900243
Energy: 0.8567282052464288
Energy: 0.9095979914841443
Energy: 0.8567282052402959
Energy: 0.9095979914831223
Energy: 0.8567282052423403
Energy: 0.9095979914851664
Energy: 0.8575900006156274
Energy: 0.8519794557987727
Energy: 0.8575900006166494
Energy: 0.8519794557987727
Energy: 0.8575900006146053
Energy: 0.8519794557987727
Energy: 0.8568331055070612
Energy: 0.957664312722566
Energy: 0.8568331055070612
Energy: 0.957664312722566
Energy: 0.8568331055080834
Energy: 0.957664312721544
Energy: 0.8992227919117691
Energy: 0.8823196842373666
Energy: 0.8992227919107469
Energy: 0.8823196842373666
Energy: 0.8992227919127912
Energy: 0.8823196842373666
Energy: 0.8625520199357849
Energy: 0.9039235647209322
Energy: 0.8625520199347628
Energy: 0.90392356471991
Energy: 0.8625520199347628
Energy: 0.90392356471991
Energy: 0.8994671553637569
Energy: 0.8823338285879799
Energy: 0.8994671553647791
Energy: 0.8823338285879799
Energy: 0.8994671553658011
Energy: 0.8823338285879799

minimum gb energy = 0.8452919998770784 eV
minimum distance =  2.33827362633158 Angstroms
sigma value = 9


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

Energy: 0.9430972873217875
Energy: 0.8815014803944957
Energy: 0.9430972873201185
Energy: 0.8815014803944957
Energy: 0.9430972873217875
Energy: 0.8815014803953302
Energy: 0.9111582624685861
Energy: 0.878949139317416
Energy: 0.9111582624685861
Energy: 0.8789491393165814
Energy: 0.9111582624685861
Energy: 0.8789491393165814
Energy: 0.9020724513195132
Energy: 0.8789217213245176
Energy: 0.9020724513195132
Energy: 0.8789217213236828
Energy: 0.9020724513195132
Energy: 0.8789217213253521
Energy: 0.8884650617997547
Energy: 0.9533019969328941
Energy: 0.8884650617989202
Energy: 0.9533019969328941
Energy: 0.8884650618014238
Energy: 0.9533019969320596
Energy: 0.9143148947253574
Energy: 0.9077257030481002
Energy: 0.9143148947261921
Energy: 0.907725703048935
Energy: 0.9143148947261921
Energy: 0.907725703048935
Energy: 0.9140840064054514
Energy: 0.9034610909178187
Energy: 0.914084006404617
Energy: 0.9034610909178187
Energy: 0.9140840064054514
Energy: 0.9034610909169841
Energy: 0.9018064426764204
Energy: 0.914789040244986
Energy: 0.901806442677255
Energy: 0.914789040244986
Energy: 0.9018064426764204
Energy: 0.914789040244986
Energy: 0.8958359674880751
Energy: 0.9348342566821894
Energy: 0.8958359674889097
Energy: 0.9348342566813549
Energy: 0.8958359674872406
Energy: 0.9348342566813549
Energy: 0.9679902697921519
Energy: 0.9200159022975201
Energy: 0.9679902697921519
Energy: 0.9200159022975201
Energy: 0.967990269793821
Energy: 0.9200159022983545
Energy: 0.902815685995883
Energy: 0.8974533171668173
Energy: 0.902815685995883
Energy: 0.8974533171659829
Energy: 0.9028156859967175
Energy: 0.8974533171659829
Energy: 0.8937175511277872
Energy: 0.9100283934228609
Energy: 0.8937175511286217
Energy: 0.9100283934236953
Energy: 0.8937175511294562
Energy: 0.9100283934245299
Energy: 0.9490368011169068
Energy: 0.9182421498980953
Energy: 0.9490368011152376
Energy: 0.9182421498980953
Energy: 0.9490368011144031
Energy: 0.9182421498989299
Energy: 0.8923912407394052
Energy: 0.9314989836653861
Energy: 0.8923912407360671
Energy: 0.9314989836662205
Energy: 0.8923912407377361
Energy: 0.9314989836662205
Energy: 0.897382218402772
Energy: 0.8980577709344933
Energy: 0.8973822184036064
Energy: 0.8980577709336589
Energy: 0.897382218402772
Energy: 0.8980577709344933
Energy: 0.9189437833859345
Energy: 0.9079600158496599
Energy: 0.9189437833876039
Energy: 0.9079600158479907
Energy: 0.9189437833876039
Energy: 0.9079600158463217
Energy: 0.8953544481918813
Energy: 0.9086884452157352
Energy: 0.8953544481910466
Energy: 0.9086884452157352
Energy: 0.895354448190212
Energy: 0.9086884452157352
Energy: 0.9238156233625104
Energy: 0.908126289430076
Energy: 0.923815623363345
Energy: 0.908126289430076
Energy: 0.923815623363345
Energy: 0.9081262894309106
Energy: 0.9956848024655373
Energy: 0.9035110694834961
Energy: 0.9956848024655373
Energy: 0.9035110694826616
Energy: 0.9956848024655373
Energy: 0.9035110694826616
Energy: 0.8931158445176031
Energy: 0.9019009191694316
Energy: 0.8931158445167683
Energy: 0.9019009191677625
Energy: 0.8931158445176031
Energy: 0.901900919168597
Energy: 0.9015480174673614
Energy: 0.880715252874605
Energy: 0.9015480174690305
Energy: 0.8807152528737704
Energy: 0.9015480174665269
Energy: 0.880715252874605
Energy: 0.9529470695757377
Energy: 0.9174109244633335
Energy: 0.9529470695757377
Energy: 0.9174109244624988
Energy: 0.9529470695749033
Energy: 0.9174109244633335

minimum gb energy = 0.8789217213236828 eV
minimum distance =  2.32148318198529 Angstroms
sigma value = 27


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

Energy: 0.8917251470296477
Energy: 0.8334720606022911
Energy: 0.8917251470289441
Energy: 0.8334720606022911
Energy: 0.8917251470310548
Energy: 0.8334720606022911
Energy: 0.8464221879566608
Energy: 0.87319121887343
Energy: 0.846422187957364
Energy: 0.8731912188762438
Energy: 0.8464221879580676
Energy: 0.87319121887343
Energy: 0.8765891826033593
Energy: 0.851136062823337
Energy: 0.876589182604766
Energy: 0.8511360628240404
Energy: 0.876589182604766
Energy: 0.8511360628247439
Energy: 0.8757867710322318
Energy: 0.87808444252015
Energy: 0.8757867710329352
Energy: 0.87808444252015
Energy: 0.8757867710329352
Energy: 0.8780844425180397
Energy: 0.8743305982280399
Energy: 0.8320747206332758
Energy: 0.8743305982280399
Energy: 0.8320747206332758
Energy: 0.8743305982273364
Energy: 0.8320747206332758
Energy: 0.8356206915554132
Energy: 0.8966186174335358
Energy: 0.8356206915568203
Energy: 0.8966186174328323
Energy: 0.8356206915568203
Energy: 0.8966186174328323
Energy: 0.8913743228889988
Energy: 0.8337318797387123
Energy: 0.8913743228875919
Energy: 0.8337318797394159
Energy: 0.8913743228882952
Energy: 0.8337318797394159
Energy: 0.9140255654662758
Energy: 0.912998022124625
Energy: 0.9140255654648686
Energy: 0.9129980221253285
Energy: 0.9140255654641651
Energy: 0.9129980221239214
Energy: 0.8349708688588895
Energy: 0.8965796918571325
Energy: 0.8349708688595928
Energy: 0.8965796918571325
Energy: 0.8349708688588895
Energy: 0.896579691857836
Energy: 0.875703900719353
Energy: 0.8334800918550711
Energy: 0.875703900723574
Energy: 0.8334800918543677
Energy: 0.87570390072076
Energy: 0.8334800918550711
Energy: 0.8760292332735805
Energy: 0.8334919426159747
Energy: 0.8760292332735805
Energy: 0.8334919426159747
Energy: 0.8760292332721735
Energy: 0.8334919426159747
Energy: 0.8349450320481492
Energy: 0.896570016631577
Energy: 0.8349450320495562
Energy: 0.896570016631577
Energy: 0.8349450320488526
Energy: 0.896570016631577
Energy: 0.9144012481224215
Energy: 0.91309350090201
Energy: 0.9144012481245319
Energy: 0.913093500900603
Energy: 0.914401248121718
Energy: 0.91309350090201
Energy: 0.891386326878242
Energy: 0.833730591180556
Energy: 0.891386326878242
Energy: 0.8337305911798526
Energy: 0.8913863268789455
Energy: 0.8337305911812596
Energy: 0.835622250716481
Energy: 0.8964839792207601
Energy: 0.8356222507171844
Energy: 0.8964839792214636
Energy: 0.8356222507157773
Energy: 0.8964839792207601
Energy: 0.8744261920307626
Energy: 0.8320327117587204
Energy: 0.8744261920293555
Energy: 0.8320327117587204
Energy: 0.8744261920307626
Energy: 0.8320327117587204
Energy: 0.875635955495285
Energy: 0.8780506446318619
Energy: 0.8756359554959886
Energy: 0.8780506446318619
Energy: 0.8756359554959886
Energy: 0.8780506446311583
Energy: 0.8767253852889122
Energy: 0.8514867622736864
Energy: 0.8767253852910226
Energy: 0.8514867622736864
Energy: 0.8767253852882086
Energy: 0.851486762272983
Energy: 0.8464181292181086
Energy: 0.8734434079344632
Energy: 0.8464181292159979
Energy: 0.8734434079337597
Energy: 0.8464181292188118
Energy: 0.8734434079330562
Energy: 0.8917251470296477
Energy: 0.8334720606022911
Energy: 0.8917251470289441
Energy: 0.8334720606022911
Energy: 0.8917251470296477
Energy: 0.8334720606022911
Energy: 0.846422187957364
Energy: 0.8731912188706481
Energy: 0.846422187957364
Energy: 0.8731912188741335
Energy: 0.8464221879587711
Energy: 0.8731912188727264
Energy: 0.8765891826033593
Energy: 0.8511360628240404
Energy: 0.8765891825998416
Energy: 0.8511360628254474
Energy: 0.8765891826033593
Energy: 0.8511360628254474
Energy: 0.8757867710329352
Energy: 0.8780844425215572
Energy: 0.8757867710329352
Energy: 0.87808444252015
Energy: 0.8757867710329352
Energy: 0.8780844425215572
Energy: 0.8743305982273364
Energy: 0.8320747206325724
Energy: 0.8743305982273364
Energy: 0.8320747206346829
Energy: 0.8743305982280399
Energy: 0.8320747206325724
Energy: 0.8356206915568203
Energy: 0.8966186174328323
Energy: 0.8356206915554132
Energy: 0.8966186174328323
Energy: 0.8356206915568203
Energy: 0.8966186174335358

minimum gb energy = 0.8320327117587204 eV
minimum distance =  2.3412673039193 Angstroms
sigma value = 19


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

Energy: 0.8833581265479417
Energy: 0.8820417147018293
Energy: 0.8833581265479417
Energy: 0.8820417147018293
Energy: 0.883358126548549
Energy: 0.8820417147018293
Energy: 0.8690578681319566
Energy: 0.8582452011976796
Energy: 0.8690578681325639
Energy: 0.8582452011976796
Energy: 0.8690578681319566
Energy: 0.8582452011976796
Energy: 0.8767844496410162
Energy: 0.8404307809118902
Energy: 0.9136692759319258
Energy: 0.8404307809118902
Energy: 0.8751176455752085
Energy: 0.8404307809118902
Energy: 0.8513662931442111
Energy: 0.8605969510256543
Energy: 0.8513662931442111
Energy: 0.8605969510256543
Energy: 0.8513662931436039
Energy: 0.8605969510256543
Energy: 0.8684834178192942
Energy: 0.877026943420544
Energy: 0.8684834178192942
Energy: 0.8770269434211514
Energy: 0.8684834178199013
Energy: 0.8770269434211514
Energy: 0.8612295919464155
Energy: 0.8589695607249921
Energy: 0.8612295919464155
Energy: 0.8589695607249921
Energy: 0.8612295919464155
Energy: 0.8589695607243849
Energy: 0.8352181276567034
Energy: 0.8839990034486392
Energy: 0.8352181276573106
Energy: 0.8839990034462102
Energy: 0.8352181276567034
Energy: 0.8839990034480321
Energy: 0.858476175134514
Energy: 0.8886661584198629
Energy: 0.858476175134514
Energy: 0.8886661584204701
Energy: 0.8584761751339066
Energy: 0.8886661584198629
Energy: 0.9176908034021543
Energy: 0.8399361473845933
Energy: 0.9176908034021543
Energy: 0.8399361473845933
Energy: 0.9176908034021543
Energy: 0.8399361473852006
Energy: 0.8710642933879476
Energy: 0.8707869952118885
Energy: 0.8710642933885548
Energy: 0.8707869952118885
Energy: 0.8710642933879476
Energy: 0.8707869952118885
Energy: 0.8479603338975839
Energy: 0.8890160765174815
Energy: 0.8479603338957621
Energy: 0.8890160765168744
Energy: 0.8479603338957621
Energy: 0.8890160765162948
Energy: 0.8737380622925432
Energy: 0.8391769445408445
Energy: 0.8737380622925432
Energy: 0.8391769445408445
Energy: 0.8737380622925432
Energy: 0.8391769445408445
Energy: 0.8645702892447864
Energy: 0.8617946993880264
Energy: 0.8645702892453937
Energy: 0.8617946993849902
Energy: 0.8645702892453937
Energy: 0.8617946993862047
Energy: 0.8550701920802352
Energy: 0.8602086620451531
Energy: 0.8550701920796278
Energy: 0.860208662044546
Energy: 0.8550701920796278
Energy: 0.860208662044546
Energy: 0.8862818457894907
Energy: 0.8430501789393188
Energy: 0.8862818457888836
Energy: 0.8430501789399261
Energy: 0.8862818457894907
Energy: 0.8430501789393188
Energy: 0.876787661834446
Energy: 0.8349319215265012
Energy: 0.8767876618350533
Energy: 0.8349319215271084
Energy: 0.8767876618350533
Energy: 0.8349319215271084
Energy: 0.8503164819257998
Energy: 0.8669154189077303
Energy: 0.8503164819245853
Energy: 0.866915418907123
Energy: 0.8503164819251925
Energy: 0.8669154189077303
Energy: 0.8820929937257659
Energy: 0.8782041659428111
Energy: 0.8820929937251587
Energy: 0.8782041659428111
Energy: 0.8820929937245514
Energy: 0.8782041659422039
Energy: 0.8632279597871576
Energy: 0.8565103211716375
Energy: 0.8632279597865505
Energy: 0.856510321170423
Energy: 0.8632279597859431
Energy: 0.8565103211679941
Energy: 0.85452952576017
Energy: 0.8781278930555299
Energy: 0.85452952576017
Energy: 0.8781278930555299
Energy: 0.8545295257589556
Energy: 0.8781278930555299
Energy: 0.8399516296966751
Energy: 0.8887424595844939
Energy: 0.8399516296966751
Energy: 0.8887424595844939
Energy: 0.8399516296960678
Energy: 0.8887424595844939
Energy: 0.8965360575314656
Energy: 0.8398876271471749
Energy: 0.8965360575302511
Energy: 0.8398876271477821
Energy: 0.8965360575320729
Energy: 0.8398876271471749
Energy: 0.9178192551148627
Energy: 0.8682544579673629
Energy: 0.9178192551148627
Energy: 0.8682544579679703
Energy: 0.91781925511547
Energy: 0.8682544579679703
Energy: 0.8796894748972062
Energy: 0.8850045862183417
Energy: 0.879689474896599
Energy: 0.8850045862189488
Energy: 0.8796894748972062
Energy: 0.8850045862153054
Energy: 0.8673890076641317
Energy: 0.8391400485649789
Energy: 0.8673890076647388
Energy: 0.8391400485643716
Energy: 0.8673890076641317
Energy: 0.8391400485649789
Energy: 0.8713133848456485
Energy: 0.8530506003103641
Energy: 0.8713133848462558
Energy: 0.8530506003103641
Energy: 0.8713133848462558
Energy: 0.8530506003109714
Energy: 0.8449708034002302
Energy: 0.8664532377786951
Energy: 0.8449708034002302
Energy: 0.8664532377793023
Energy: 0.8449708034008376
Energy: 0.8664532377793023
Energy: 0.8862583771039366
Energy: 0.8591937423283448
Energy: 0.8862583771051511
Energy: 0.8591937423283448
Energy: 0.8862583771045439
Energy: 0.8591937423277375
Energy: 0.8708494315963857
Energy: 0.858926011605166
Energy: 0.8708494315976002
Energy: 0.8589260116057733
Energy: 0.8708494315963857
Energy: 0.858926011605166

minimum gb energy = 0.8349319215265012 eV
minimum distance =  2.31986311936096 Angstroms
sigma value = 101


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

Energy: 0.8293161990066535
Energy: 0.8651005823333139
Energy: 0.8293161990071873
Energy: 0.8651005823333139
Energy: 0.8293161990077212
Energy: 0.8651005823333139
Energy: 0.8677241429792966
Energy: 0.8206493871851914
Energy: 0.8677241429803642
Energy: 0.8206493871846577
Energy: 0.8677241429792966
Energy: 0.8206493871873266
Energy: 0.8417058777549301
Energy: 0.8012995109767391
Energy: 0.8417058777549301
Energy: 0.8012995109767391
Energy: 0.8417058777549301
Energy: 0.8012995109767391
Energy: 0.7871746795624766
Energy: 0.8601203798663504
Energy: 0.7871746795619428
Energy: 0.9115842962836891
Energy: 0.7871746795624766
Energy: 0.8478269731292468
Energy: 0.826581590555831
Energy: 0.82545647065847
Energy: 0.8265815905568986
Energy: 0.8254564706579363
Energy: 0.8265815905568986
Energy: 0.8254564706590038
Energy: 0.8471423574715985
Energy: 0.8009790907809631
Energy: 0.8471423574726662
Energy: 0.8009790907809631
Energy: 0.8471423574699972
Energy: 0.8009790907809631
Energy: 0.8196471721219486
Energy: 0.8504662305815508
Energy: 0.8196471721203472
Energy: 0.8504662305799494
Energy: 0.819647172120881
Energy: 0.8504662305804833
Energy: 0.7915684144024601
Energy: 0.8512842245270781
Energy: 0.7915684144029939
Energy: 0.8512842245270781
Energy: 0.7915684144024601
Energy: 0.8512842245270781
Energy: 0.8413087452160734
Energy: 0.804436915620437
Energy: 0.8413087452166073
Energy: 0.8044369156209707
Energy: 0.8413087452166073
Energy: 0.804436915620437
Energy: 0.8269333020948997
Energy: 0.8479185948255923
Energy: 0.8269333020959672
Energy: 0.8535368176360889
Energy: 0.8269333020948997
Energy: 0.8673537157434328
Energy: 0.7900027889192643
Energy: 0.9408838212088856
Energy: 0.7900027889187304
Energy: 0.9408838212094193
Energy: 0.7900027889187304
Energy: 0.9408838212088856
Energy: 0.8813548585712879
Energy: 0.8203972997373573
Energy: 0.8813548585712879
Energy: 0.820397299737891
Energy: 0.8813548585718217
Energy: 0.8203972997368233
Energy: 0.8381900512228636
Energy: 0.8008095882034748
Energy: 0.8381900512217962
Energy: 0.8008095882034748
Energy: 0.8381900512223298
Energy: 0.8008095882034748
Energy: 0.8332458136187052
Energy: 0.8537858973468498
Energy: 0.8332458136187052
Energy: 0.8833590105935878
Energy: 0.8332458136187052
Energy: 0.8654685418066543
Energy: 0.867012128050024
Energy: 0.824392770532724
Energy: 0.867012128050024
Energy: 0.824392770532724
Energy: 0.8670121280505579
Energy: 0.8243927705332577
Energy: 0.841846277206084
Energy: 0.8006770656863981
Energy: 0.8418462772066178
Energy: 0.8006770656863981
Energy: 0.8418462772066178
Energy: 0.8006770656869318
Energy: 0.7881641143519853
Energy: 0.8603266209668767
Energy: 0.788164114353053
Energy: 0.86032662096792
Energy: 0.7881641143525192
Energy: 0.8603266209673864
Energy: 0.7900430226837558
Energy: 0.8443607783727598
Energy: 0.7900430226848234
Energy: 0.8443607783738273
Energy: 0.7900430226848234
Energy: 0.8443607783722259
Energy: 0.8366210363273874
Energy: 0.8014465224359554
Energy: 0.8366210363257859
Energy: 0.8014465224359554
Energy: 0.8366210363252522
Energy: 0.801446522434888
Energy: 0.8093208896286311
Energy: 0.8450422597227732
Energy: 0.8093208896296987
Energy: 0.8450422597227732
Energy: 0.8093208896286311
Energy: 0.8450422597217057
Energy: 0.7894459661394388
Energy: 0.9389385251280474
Energy: 0.7894459661399726
Energy: 0.9389385251264462
Energy: 0.7894459661389052
Energy: 0.9389385251269798
Energy: 0.8737401823273662
Energy: 0.7978785572061123
Energy: 0.8737401823300351
Energy: 0.7978785572055785
Energy: 0.8737401823284338
Energy: 0.7978785572050449
Energy: 0.8730545181597451
Energy: 0.796988063945478
Energy: 0.8730545181613465
Energy: 0.7969880639444105
Energy: 0.8730545181602789
Energy: 0.7969880639465455
Energy: 0.7873490795907512
Energy: 0.8614016244484023
Energy: 0.7873490795896835
Energy: 0.8614016244478686
Energy: 0.7873490795891497
Energy: 0.8614016244489361
Energy: 0.8776182344385631
Energy: 0.8253127291857788
Energy: 0.8776182344390969
Energy: 0.825312729185245
Energy: 0.8776182344396307
Energy: 0.825312729185245
Energy: 0.8404172359137891
Energy: 0.8002159197423252
Energy: 0.8404172359137891
Energy: 0.8002159197417914
Energy: 0.8404172359143229
Energy: 0.8002159197423252
Energy: 0.828790828782138
Energy: 0.8547799538612615
Energy: 0.8287908287800025
Energy: 0.8547799538612615
Energy: 0.8287908287816039
Energy: 0.8547799538617953
Energy: 0.8458839287507341
Energy: 0.8530042813320465
Energy: 0.8458839287507341
Energy: 0.8530042813315128
Energy: 0.8458839287507341
Energy: 0.8530042813315128
Energy: 0.8628935965920874
Energy: 0.8094982625647261
Energy: 0.8628935965915536
Energy: 0.8094982625641923
Energy: 0.8628935965920874
Energy: 0.8094982625647261
Energy: 0.7896319649412123
Energy: 0.8540661425143458
Energy: 0.789631964939611
Energy: 0.8540661425143458
Energy: 0.7896319649390773
Energy: 0.8540661425132781
Energy: 0.7882737298668372
Energy: 0.8401049376128058
Energy: 0.7882737298668372
Energy: 0.8401049376133395
Energy: 0.7882737298668372
Energy: 0.8401049376133395
Energy: 0.8737239387645207
Energy: 0.7978443721209629
Energy: 0.8737239387661221
Energy: 0.7978443721209629
Energy: 0.8737239387645207
Energy: 0.7978443721209629
Energy: 0.873051735446566
Energy: 0.7971931578105388
Energy: 0.8730517354476335
Energy: 0.7971931578100051
Energy: 0.8730517354481674
Energy: 0.7971931578100051

minimum gb energy = 0.7871746795619428 eV
minimum distance =  2.33072967465301 Angstroms
sigma value = 33


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

Energy: 0.015485365969729221
Energy: 0.5988916883969733
Energy: 0.01548536597014809
Energy: 0.598891688398698
Energy: 0.01548536597014809
Energy: 0.5988916883982791
Energy: 0.016068846084747835
Energy: 0.2315585291162373
Energy: 0.01606884608432896
Energy: 0.23155852911406907
Energy: 0.016068846083885452
Energy: 0.23155852911882446
Energy: 0.5990225123418097
Energy: 0.2317377153392567
Energy: 0.5990223292228961
Energy: 0.23173771532104814
Energy: 0.5990223225233237
Energy: 0.2317377151957815
Energy: 0.016068846085191345
Energy: 0.2315585291153503
Energy: 0.016068846085191345
Energy: 0.23155852911840563
Energy: 0.016068846084747835
Energy: 0.2315585291166562

minimum gb energy = 0.015485365969729221 eV
minimum distance =  2.54263611289653 Angstroms
sigma value = 1