Model name: model_name=MEAM_LAMMPS_MahataMukhopadhyayAsleZaeem_2022_AlNi__MO_461927113651_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.045353233814239
cohesive_energy=3.3603034700051637
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01037873838401919
Energy: 0.518103248299275
Energy: 0.010378738383796585
Energy: 0.5181032482999985
Energy: 0.010378738383546152
Energy: 0.5181032482997758
Energy: 0.5181032482995254
Energy: 0.6984577621773449
Energy: 0.518103248299275
Energy: 0.6984577621775953
Energy: 0.518103248299275
Energy: 0.6984577621773449
Energy: 0.010378738383796585
Energy: 0.5181032482997758
Energy: 0.010378738383546152
Energy: 0.5181032482995254
Energy: 0.010378738383295718
Energy: 0.5181032482995254
Energy: 0.5181032482997758
Energy: 0.6984577621778457
Energy: 0.5181032482997758
Energy: 0.6984577621775953
Energy: 0.5181032482995254
Energy: 0.6984577621770945
Energy: 0.010378738383546152
Energy: 0.5181032482995254
Energy: 0.010378738383295718
Energy: 0.5181032482995254
Energy: 0.010378738383045287
Energy: 0.518103248299275
Energy: 0.5181032482995254
Energy: 0.6984577621773449
Energy: 0.5181032482995254
Energy: 0.6984577621773449
Energy: 0.5181032482997758
Energy: 0.6984577621773449

minimum gb energy = 0.010378738383045287 eV
minimum distance =  2.58567290133458 Angstroms
sigma value = 1


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

Energy: 0.6522545212783628
Energy: 0.6466750480403117
Energy: 0.6522545212717317
Energy: 0.6466750480487513
Energy: 0.652254521257264
Energy: 0.6466750480421202
Energy: 0.7029535818448033
Energy: 0.5725016795704676
Energy: 0.7029535818454062
Energy: 0.5725016795698648
Energy: 0.7029535818442006
Energy: 0.5725016795704676
Energy: 0.6260132448039901
Energy: 0.6987933378963831
Energy: 0.6260132448051958
Energy: 0.6987933378963831
Energy: 0.626013244804593
Energy: 0.6987933378969859
Energy: 0.6777600882116502
Energy: 0.6020544539928298
Energy: 0.6777600882110473
Energy: 0.6020544539928298
Energy: 0.6777600882116502
Energy: 0.6020544539928298
Energy: 0.6038141164011142
Energy: 0.6665718416369858
Energy: 0.6038141164017169
Energy: 0.6665718416369858
Energy: 0.6038141164011142
Energy: 0.6665718416375886
Energy: 0.6698897360475409
Energy: 0.6051787636572439
Energy: 0.6698897360475409
Energy: 0.6051787636572439
Energy: 0.6698897360475409
Energy: 0.605178763656641
Energy: 0.6360082273819329
Energy: 0.6540918870407265
Energy: 0.63600822738133
Energy: 0.6540918870419321
Energy: 0.63600822738133
Energy: 0.6540918870437407
Energy: 0.6180508313782997
Energy: 0.6942783880322592
Energy: 0.6180508313782997
Energy: 0.6942783880322592
Energy: 0.6180508313782997
Energy: 0.6942783880322592
Energy: 0.6715275236827883
Energy: 0.6413242709839649
Energy: 0.6715275236821856
Energy: 0.6413242709851706
Energy: 0.6715275236827883
Energy: 0.6413242709851706
Energy: 0.5687793084372794
Energy: 0.6839654628240055
Energy: 0.5687793084378822
Energy: 0.6839654628137576
Energy: 0.5687793084378822
Energy: 0.6839654628143603
Energy: 0.7042208569091344
Energy: 0.5724195399866835
Energy: 0.7042208569091344
Energy: 0.5724195399872865
Energy: 0.7042208569091344
Energy: 0.5724195399872865
Energy: 0.5546245413150976
Energy: 0.7023386817320485
Energy: 0.5546245413144947
Energy: 0.7023386817332541
Energy: 0.5546245413132892
Energy: 0.7023386817320485
Energy: 0.6417424205417228
Energy: 0.5583102159746188
Energy: 0.6417424205435314
Energy: 0.5583102159752217
Energy: 0.6417424205471483
Energy: 0.5583102159746188
Energy: 0.5859189211001216
Energy: 0.6269674120484697
Energy: 0.5859189211013273
Energy: 0.6269674120478668
Energy: 0.5859189211007244
Energy: 0.6269674120484697
Energy: 0.700155059292932
Energy: 0.5995847673474807
Energy: 0.7001550592923291
Energy: 0.5995847673444668
Energy: 0.7001550592923291
Energy: 0.5995847673468779
Energy: 0.6938738800449329
Energy: 0.6672886566999439
Energy: 0.6938738800449329
Energy: 0.6672886566999439
Energy: 0.6938738800407132
Energy: 0.6672886566999439
Energy: 0.6522112392589728
Energy: 0.6255523358173214
Energy: 0.6522112392589728
Energy: 0.6255523358173214
Energy: 0.6522112392589728
Energy: 0.6255523358173214
Energy: 0.6544730136546514
Energy: 0.6364595396080729
Energy: 0.6544730136546514
Energy: 0.6364595396080729
Energy: 0.6544730136546514
Energy: 0.6364595396080729
Energy: 0.5863707423467178
Energy: 0.6396681146063768
Energy: 0.5863707423461151
Energy: 0.639668114605774
Energy: 0.5863707423467178
Energy: 0.6396681146063768
Energy: 0.7203361688841532
Energy: 0.604534402279497
Energy: 0.7203361688835502
Energy: 0.604534402279497
Energy: 0.7203361688835502
Energy: 0.604534402279497
Energy: 0.5725617330924232
Energy: 0.73893880284455
Energy: 0.5725617330815724
Energy: 0.7389388028451529
Energy: 0.5725617331376075
Energy: 0.73893880284455
Energy: 0.639821902539318
Energy: 0.6430960319720349
Energy: 0.6398219025471548
Energy: 0.6430960319726376
Energy: 0.639821902546552
Energy: 0.6430960319726376
Energy: 0.5356628564748058
Energy: 0.7212541297984802
Energy: 0.5356628564742031
Energy: 0.7212541297984802
Energy: 0.5356628564742031
Energy: 0.7212541297984802

minimum gb energy = 0.5356628564742031 eV
minimum distance =  2.55834287736116 Angstroms
sigma value = 33


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

Energy: 0.6690918109769262
Energy: 0.6437974627784708
Energy: 0.6690918109772691
Energy: 0.643797462777785
Energy: 0.6690918109765833
Energy: 0.6437974627784708
Energy: 0.7012305691414201
Energy: 0.6270841999691114
Energy: 0.7012305691410771
Energy: 0.6270841999687685
Energy: 0.7012305691414201
Energy: 0.6270841999687685
Energy: 0.6155555704209085
Energy: 0.666899580026335
Energy: 0.6155555704219372
Energy: 0.6668995800266778
Energy: 0.6155555704219372
Energy: 0.6668995800277064
Energy: 0.6195662284055764
Energy: 0.6625848508419172
Energy: 0.6195662284055764
Energy: 0.66258485084226
Energy: 0.6195662284052336
Energy: 0.66258485084226
Energy: 0.5947082123757569
Energy: 0.6598013738687918
Energy: 0.5947082123754139
Energy: 0.659801373868449
Energy: 0.5947082123757569
Energy: 0.6598013738687918
Energy: 0.6282986653669713
Energy: 0.6197576715403748
Energy: 0.6282986653669713
Energy: 0.6197576715355744
Energy: 0.6282986653659427
Energy: 0.6197576715348887
Energy: 0.6338972295607644
Energy: 0.6288723316512174
Energy: 0.6338972295604216
Energy: 0.628872331651529
Energy: 0.6338972295600788
Energy: 0.6288723316512174
Energy: 0.5806372981231437
Energy: 0.6911228941878527
Energy: 0.5806372981231437
Energy: 0.6911228941881955
Energy: 0.5806372981228008
Energy: 0.6911228941875098
Energy: 0.6580293479960982
Energy: 0.6046202917351274
Energy: 0.6580293479960982
Energy: 0.6046202917388992
Energy: 0.6580293479957554
Energy: 0.6046202917546406
Energy: 0.5500797616434298
Energy: 0.6660752255058556
Energy: 0.5500797616430867
Energy: 0.6660752255061985
Energy: 0.5500797616427439
Energy: 0.6660752255061985
Energy: 0.6626020101910209
Energy: 0.5556865338051757
Energy: 0.6626020101913638
Energy: 0.5556865338048328
Energy: 0.6626020101913638
Energy: 0.5556865338051757
Energy: 0.5570844540891448
Energy: 0.6335783460014826
Energy: 0.5570844540888019
Energy: 0.6335783460045685
Energy: 0.5570844540888019
Energy: 0.6335783460025113
Energy: 0.6801722810578186
Energy: 0.5924994595387609
Energy: 0.6801722810574757
Energy: 0.5924994595391038
Energy: 0.6801722810574757
Energy: 0.5924994595394467
Energy: 0.6286864395760318
Energy: 0.6308523894621024
Energy: 0.6286864395774032
Energy: 0.6308523894621024
Energy: 0.6286864395774032
Energy: 0.6308523894627881
Energy: 0.7097182089880418
Energy: 0.6440090829146509
Energy: 0.7097182089876988
Energy: 0.6440090829136222
Energy: 0.7097182089876988
Energy: 0.6440090829139651
Energy: 0.6376989507440983
Energy: 0.647868965428217
Energy: 0.6376989507440983
Energy: 0.6478689654271885
Energy: 0.6376989507444412
Energy: 0.6478689654278742
Energy: 0.6532821461770587
Energy: 0.6282410067346577
Energy: 0.6532821461770587
Energy: 0.6282410067343148
Energy: 0.6532821461770587
Energy: 0.6282410067336291
Energy: 0.6507361831630267
Energy: 0.6201131219509216
Energy: 0.6507361831626838
Energy: 0.6201131219543503
Energy: 0.6507361831623409
Energy: 0.6201131219509216
Energy: 0.5725272784281361
Energy: 0.6816559669012079
Energy: 0.5725272784281361
Energy: 0.6816559669015507
Energy: 0.5725272784281361
Energy: 0.6816559669012079
Energy: 0.630081246237151
Energy: 0.6269624775739812
Energy: 0.630081246237151
Energy: 0.6269624775739812
Energy: 0.6300812462368081
Energy: 0.6269624775739812
Energy: 0.5747756729570078
Energy: 0.6912244670937374
Energy: 0.5747756729570078
Energy: 0.6912244670930516
Energy: 0.5747756729566648
Energy: 0.6912244670937374
Energy: 0.75804901810303
Energy: 0.6141983862768705
Energy: 0.7580490181040588
Energy: 0.6141983862765276
Energy: 0.7580490181033728
Energy: 0.6141983862761847
Energy: 0.5522879874681615
Energy: 0.6355754915074268
Energy: 0.5522879874681615
Energy: 0.6355754915060552
Energy: 0.5522879874681615
Energy: 0.6355754915057124
Energy: 0.6600615712445569
Energy: 0.5944292099137536
Energy: 0.660061571243871
Energy: 0.5944292099137536
Energy: 0.6600615712442139
Energy: 0.5944292099137536
Energy: 0.6124315014091356
Energy: 0.6403004501932485
Energy: 0.6124315013916798
Energy: 0.6403004501932485
Energy: 0.6124315013999089
Energy: 0.6403004501932485
Energy: 0.6584477054404478
Energy: 0.6672705471313397
Energy: 0.658447705439762
Energy: 0.6672705471323682
Energy: 0.658447705439762
Energy: 0.6672705471320254
Energy: 0.6583027309409571
Energy: 0.662454634689846
Energy: 0.6583027309409571
Energy: 0.6624546345698993
Energy: 0.6583027309406142
Energy: 0.662454634462608
Energy: 0.6147368802862071
Energy: 0.6501557196551541
Energy: 0.6147368802865499
Energy: 0.65015571965584
Energy: 0.6147368802865499
Energy: 0.6501557196548112
Energy: 0.6327894463955185
Energy: 0.5833585987207838
Energy: 0.6327894463955185
Energy: 0.5833585987211267
Energy: 0.6327894463958613
Energy: 0.5833585987207838
Energy: 0.555923659369764
Energy: 0.6598974219342811
Energy: 0.5559236593701068
Energy: 0.6598974219339381
Energy: 0.5559236593701068
Energy: 0.6598974219325667
Energy: 0.791656239605364
Energy: 0.6071974005660113
Energy: 0.791656239605364
Energy: 0.6071974005673829
Energy: 0.7916562396057069
Energy: 0.6071974005649827
Energy: 0.5914903402740537
Energy: 0.68548200297235
Energy: 0.5914903402743965
Energy: 0.6854820029720071
Energy: 0.5914903402743965
Energy: 0.6854820029720071
Energy: 0.6301418168014433
Energy: 0.6269577537365703
Energy: 0.6301418168011005
Energy: 0.6269577537375988
Energy: 0.6301418168017863
Energy: 0.6269577537365703
Energy: 0.5854339043408796
Energy: 0.7169719902708374
Energy: 0.5854339043405368
Energy: 0.7169719902711803
Energy: 0.5854339043408796
Energy: 0.7169719902704944
Energy: 0.6589288079372174
Energy: 0.6303349945126946
Energy: 0.6589288079372174
Energy: 0.6303349946042132
Energy: 0.6589288079372174
Energy: 0.6303349944544356
Energy: 0.6617521360404729
Energy: 0.621697116808591
Energy: 0.6617521360404729
Energy: 0.6216971168079052
Energy: 0.6617521360404729
Energy: 0.6216971168075623
Energy: 0.6164077934691731
Energy: 0.6454377492274571
Energy: 0.6164077934277155
Energy: 0.6454377492278
Energy: 0.6164077930843023
Energy: 0.6454377492271143
Energy: 0.6814258849337523
Energy: 0.6210494380586289
Energy: 0.6814258849207229
Energy: 0.6210494380582859
Energy: 0.6814258849183227
Energy: 0.6210494380586289
Energy: 0.6287116841718304
Energy: 0.6305711854236076
Energy: 0.6287116841718304
Energy: 0.6305711854232647
Energy: 0.6287116841714876
Energy: 0.6305711854239504
Energy: 0.6921132232867278
Energy: 0.5765869075287237
Energy: 0.6921132232887851
Energy: 0.5765869075276949
Energy: 0.6921132232863848
Energy: 0.5765869075290665
Energy: 0.5535651699322227
Energy: 0.6310504623512371
Energy: 0.5535651699325657
Energy: 0.63105046235158
Energy: 0.5535651699322227
Energy: 0.6310504623512371

minimum gb energy = 0.5500797616427439 eV
minimum distance =  2.64950572139306 Angstroms
sigma value = 51


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

Energy: 0.6342538117249894
Energy: 0.6697472979417933
Energy: 0.6342538117249894
Energy: 0.6697472979425878
Energy: 0.6342538117249894
Energy: 0.6697472979417933
Energy: 0.6307172996589929
Energy: 0.583740672479588
Energy: 0.6307172996589929
Energy: 0.5837406724803826
Energy: 0.6307172996589929
Energy: 0.5837406724803826
Energy: 0.5945153007855671
Energy: 0.7402551160949485
Energy: 0.5945153007863616
Energy: 0.740255116095743
Energy: 0.5945153007863616
Energy: 0.740255116095743
Energy: 0.6053835701694109
Energy: 0.554136998898297
Energy: 0.6053835701694109
Energy: 0.554136998898297
Energy: 0.6053835701694109
Energy: 0.554136998898297
Energy: 0.6473297660315687
Energy: 0.6508110095268813
Energy: 0.6473297660307742
Energy: 0.6508110095268813
Energy: 0.6473297660315687
Energy: 0.6508110095268813
Energy: 0.6870396459348801
Energy: 0.6416958677462644
Energy: 0.6870396459348801
Energy: 0.6416958677462644
Energy: 0.6870396459348801
Energy: 0.6416958677454699
Energy: 0.6062729795059565
Energy: 0.6384341527997646
Energy: 0.6062729795067509
Energy: 0.6384341527997646
Energy: 0.6062729795059565
Energy: 0.6384341527997646
Energy: 0.5726817343132802
Energy: 0.6602170638322589
Energy: 0.5726817343124856
Energy: 0.66021706383067
Energy: 0.5726817343124856
Energy: 0.6602170638290812
Energy: 0.7184088543101284
Energy: 0.5534233821607129
Energy: 0.7184088543101284
Energy: 0.5534233821599184
Energy: 0.7184088543101284
Energy: 0.5534233821607129
Energy: 0.6039742130076053
Energy: 0.753314548612656
Energy: 0.6039742130076053
Energy: 0.753314548612656
Energy: 0.6039742130076053
Energy: 0.753314548612656
Energy: 0.7178568734718643
Energy: 0.5832948169482326
Energy: 0.7178568734718643
Energy: 0.5832948169490271
Energy: 0.7178568734678922
Energy: 0.5832948169482326
Energy: 0.6502264909599249
Energy: 0.6703500460159441
Energy: 0.6502264909599249
Energy: 0.6703500460159441
Energy: 0.6502264909599249
Energy: 0.6703500460135606
Energy: 0.6309575286319253
Energy: 0.5925959882607179
Energy: 0.6309575286343087
Energy: 0.5925959882607179
Energy: 0.6309575286343087
Energy: 0.5925959882607179
Energy: 0.5907080228768621
Energy: 0.6357860408333793
Energy: 0.590708022878451
Energy: 0.6357860408333793
Energy: 0.5907080228760676
Energy: 0.6357860408333793
Energy: 0.6414490971452044
Energy: 0.6060259531704365
Energy: 0.6414490971452044
Energy: 0.606025953169642
Energy: 0.6414490971452044
Energy: 0.6060259531704365
Energy: 0.6553809689881626
Energy: 0.6416955845351343
Energy: 0.655380968988957
Energy: 0.6416955845351343
Energy: 0.6553809689881626
Energy: 0.6416955845351343
Energy: 0.6600927322901896
Energy: 0.6878696408911413
Energy: 0.6600927322901896
Energy: 0.6878696409983387
Energy: 0.6600927322893952
Energy: 0.6878696410483713
Energy: 0.6056894809646193
Energy: 0.5959591691345065
Energy: 0.6056894809646193
Energy: 0.5959591691345065
Energy: 0.6056894809646193
Energy: 0.5959591691345065

minimum gb energy = 0.5534233821599184 eV
minimum distance =  2.52946844168835 Angstroms
sigma value = 19


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

Energy: 0.5586803508573869
Energy: 0.5527362085673196
Energy: 0.5586803508583295
Energy: 0.552736208567791
Energy: 0.5586803508578582
Energy: 0.5527362085673196
Energy: 0.6471869612746207
Energy: 0.6215454725911522
Energy: 0.6471869612741494
Energy: 0.6215454725911522
Energy: 0.6471869612736781
Energy: 0.6215454725916235
Energy: 0.5371912359751567
Energy: 0.5373174301912175
Energy: 0.5371912359756279
Energy: 0.5373174301949875
Energy: 0.5371912359751567
Energy: 0.5373174302204349
Energy: 0.556576754376002
Energy: 0.5389713284314879
Energy: 0.556576754376002
Energy: 0.5389713284319589
Energy: 0.5565767543764732
Energy: 0.5389713284319589
Energy: 0.5510223480400444
Energy: 0.5169794095552752
Energy: 0.5510223480400444
Energy: 0.5169794095552752
Energy: 0.5510223480400444
Energy: 0.5169794095557464
Energy: 0.5328338383829876
Energy: 0.6367103362405516
Energy: 0.5328338383829876
Energy: 0.6367103362400804
Energy: 0.5328338383829876
Energy: 0.6367103362405516
Energy: 0.6367070406771057
Energy: 0.5386189097871821
Energy: 0.6367070421552389
Energy: 0.5386189097871821
Energy: 0.6367070382701001
Energy: 0.5386189097871821
Energy: 0.5371136466322931
Energy: 0.6509638884997042
Energy: 0.5371136466327644
Energy: 0.6509638884940493
Energy: 0.5371136466322931
Energy: 0.6509638884945205
Energy: 0.5943147701175402
Energy: 0.6000626519023438
Energy: 0.5943147701180115
Energy: 0.6000626512937486
Energy: 0.5943147701180115
Energy: 0.6000626533550081
Energy: 0.5174600130429503
Energy: 0.5366799255172378
Energy: 0.5174600130420078
Energy: 0.5366799255172378
Energy: 0.5174600130415367
Energy: 0.5366799255172378
Energy: 0.6471869612746207
Energy: 0.621545472590681
Energy: 0.6471869612732069
Energy: 0.6215454725902098
Energy: 0.6471869612736781
Energy: 0.621545472590681
Energy: 0.5371912359756279
Energy: 0.5373174302176074
Energy: 0.5371912359756279
Energy: 0.5373174302180785
Energy: 0.5371912359751567
Energy: 0.5373174302496307
Energy: 0.556576754376002
Energy: 0.5387955100728188
Energy: 0.5565767543755308
Energy: 0.5387955100723475
Energy: 0.556576754376002
Energy: 0.5387955100723475
Energy: 0.5510223480395732
Energy: 0.5169794095552752
Energy: 0.5510223480395732
Energy: 0.5169794095552752
Energy: 0.5510223480395732
Energy: 0.5169794095548039
Energy: 0.5328338383825163
Energy: 0.6367103362400804
Energy: 0.5328338383825163
Energy: 0.6367103362410229
Energy: 0.5328338383829876
Energy: 0.6367103362405516
Energy: 0.6367070397943941
Energy: 0.5386189097881247
Energy: 0.6367070382936625
Energy: 0.5386189097876534
Energy: 0.6367070399809226
Energy: 0.5386189097871821
Energy: 0.5370644037437493
Energy: 0.6509638884973479
Energy: 0.5370644037437493
Energy: 0.6509638884964055
Energy: 0.537064403743278
Energy: 0.6509638884959342
Energy: 0.6106061582963875
Energy: 0.6000626431598605
Energy: 0.6106061582963875
Energy: 0.6000626437048586
Energy: 0.6106061582968588
Energy: 0.6000626480464224
Energy: 0.5586803508569157
Energy: 0.5527362085682622
Energy: 0.5586803508578582
Energy: 0.552736208567791
Energy: 0.5586803508564445
Energy: 0.5527362085682622
Energy: 0.6471869612741494
Energy: 0.6215454725911522
Energy: 0.6471869612750919
Energy: 0.6215454725911522
Energy: 0.6471869612741494
Energy: 0.6215454725911522
Energy: 0.5371912359751567
Energy: 0.5373174301469417
Energy: 0.5371912359751567
Energy: 0.5373174301935737
Energy: 0.5371912359751567
Energy: 0.5373174301158606
Energy: 0.5565767543755308
Energy: 0.5389713284314879
Energy: 0.5565767543755308
Energy: 0.5389713284314879
Energy: 0.5565767543755308
Energy: 0.5389713284314879
Energy: 0.5510223480395732
Energy: 0.5169794095548039
Energy: 0.5510223480395732
Energy: 0.5169794095557464
Energy: 0.5510223480395732
Energy: 0.5169794095552752
Energy: 0.5328338383825163
Energy: 0.636710336235368
Energy: 0.5328338383829876
Energy: 0.6367103362363103
Energy: 0.5328338383829876
Energy: 0.636710336235368
Energy: 0.6367070432518112
Energy: 0.5386189097876534
Energy: 0.636707044449659
Energy: 0.5386189097871821
Energy: 0.6367070429795585
Energy: 0.5386189097876534
Energy: 0.5371136466332357
Energy: 0.6509638884978193
Energy: 0.5371136466332357
Energy: 0.6509638884945205
Energy: 0.5371136466332357
Energy: 0.6509638885011179
Energy: 0.5943147701180115
Energy: 0.6000626576254562
Energy: 0.5943147701184828
Energy: 0.6000626543569239
Energy: 0.5943147701184828
Energy: 0.6000626588035116
Energy: 0.5174600130415367
Energy: 0.5366799255177089
Energy: 0.5174600130420078
Energy: 0.5366799255177089
Energy: 0.5174600130415367
Energy: 0.5366799255177089
Energy: 0.6471869612736781
Energy: 0.6215454725911522
Energy: 0.6471869612741494
Energy: 0.6215454725911522
Energy: 0.6471869612736781
Energy: 0.6215454725911522
Energy: 0.5371912359746854
Energy: 0.537317430159194
Energy: 0.5371912359751567
Energy: 0.5373174301959299
Energy: 0.5371912359746854
Energy: 0.5373174301615502

minimum gb energy = 0.5169794095548039 eV
minimum distance =  2.66834985186179 Angstroms
sigma value = 27


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

Energy: 0.5960635798177181
Energy: 0.5127209490948111
Energy: 0.5960635798165638
Energy: 0.5127209490948111
Energy: 0.5960635798177181
Energy: 0.5127209490948111
Energy: 0.76149504831958
Energy: 0.5235406792804717
Energy: 0.76149504831958
Energy: 0.5235406792804717
Energy: 0.76149504831958
Energy: 0.5235406792804717
Energy: 0.5288685049733877
Energy: 0.6274210223663842
Energy: 0.5288685049733877
Energy: 0.6274210223629213
Energy: 0.5288685049733877
Energy: 0.627421022361767
Energy: 0.6220580227298302
Energy: 0.5062744674644128
Energy: 0.6220580227298302
Energy: 0.5062744674655671
Energy: 0.6220580227298302
Energy: 0.5062744674655671
Energy: 0.6225877878517112
Energy: 0.5116539369584593
Energy: 0.6225877878517112
Energy: 0.511653936957305
Energy: 0.6225877878517112
Energy: 0.5116539369584593
Energy: 0.5995377380218783
Energy: 0.7148819140870353
Energy: 0.5995377380218783
Energy: 0.7148819140870353
Energy: 0.5995377380218783
Energy: 0.7148819140870353
Energy: 0.5646956745958305
Energy: 0.5633369473074581
Energy: 0.5646956745935219
Energy: 0.5633369473109211
Energy: 0.5646956745889046
Energy: 0.5633369473109211
Energy: 0.5969954467438442
Energy: 0.5120919466967568
Energy: 0.5969954467438442
Energy: 0.5120919466967568
Energy: 0.5969954467426898
Energy: 0.5120919466967568
Energy: 0.660502907761749
Energy: 0.5287359526591645
Energy: 0.6605029077756007
Energy: 0.5287359526591645
Energy: 0.6605029077306086
Energy: 0.5287359526591645
Energy: 0.558921553970424
Energy: 0.6209353958212908
Energy: 0.5589215539692697
Energy: 0.6209353958212908
Energy: 0.558921553970424
Energy: 0.6209353958212908
Energy: 0.5647883440174088
Energy: 0.58381943298617
Energy: 0.5647883440208454
Energy: 0.58381943298617
Energy: 0.5647883440196912
Energy: 0.58381943298617
Energy: 0.605225299475619
Energy: 0.5710451364269484
Energy: 0.605225299475619
Energy: 0.5710451364269484
Energy: 0.6052252994767733
Energy: 0.5710451364281027

minimum gb energy = 0.5062744674644128 eV
minimum distance =  2.51760477096927 Angstroms
sigma value = 9


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

Energy: 0.5327334511283829
Energy: 0.49622777769566745
Energy: 0.5327334511283829
Energy: 0.4962277776959918
Energy: 0.5327334511287073
Energy: 0.4962277776950188
Energy: 0.637529783268329
Energy: 0.5030732887344096
Energy: 0.6375297833470833
Energy: 0.5030732887334367
Energy: 0.6375297832686533
Energy: 0.5030732887327879
Energy: 0.5061818685704395
Energy: 0.6464081850244154
Energy: 0.5061818685681692
Energy: 0.646408185024091
Energy: 0.5061818685847103
Energy: 0.6464081850234424
Energy: 0.5207346085991801
Energy: 0.5069854989951894
Energy: 0.5207346085991801
Energy: 0.5069854989964868
Energy: 0.5207346085991801
Energy: 0.5069854989955137
Energy: 0.508761627415316
Energy: 0.4878996651327268
Energy: 0.5087616274156403
Energy: 0.48789966518686123
Energy: 0.508761627415316
Energy: 0.4878996652027537
Energy: 0.5246974431147226
Energy: 0.5187457039385647
Energy: 0.524697443118939
Energy: 0.5274895697866959
Energy: 0.5246974431176417
Energy: 0.5274895697863715
Energy: 0.5777725308912074
Energy: 0.521751703884193
Energy: 0.5777725309083971
Energy: 0.5217517038845173
Energy: 0.5777725309145595
Energy: 0.5217517038845173
Energy: 0.5037339696783184
Energy: 0.5236362041756452
Energy: 0.5037339696786427
Energy: 0.5236362041753208
Energy: 0.5037339696776698
Energy: 0.5236362041756452
Energy: 0.627692414141348
Energy: 0.4938090282726104
Energy: 0.627692414142321
Energy: 0.4938090282726104
Energy: 0.6276924141419967
Energy: 0.49380902827196177
Energy: 0.5202205735791133
Energy: 0.6385886288941385
Energy: 0.5202205735810593
Energy: 0.6385886288895979
Energy: 0.5202205735813836
Energy: 0.6385886289012739
Energy: 0.5236645411727417
Energy: 0.5158657683901834
Energy: 0.5236645411717686
Energy: 0.5158657683898591
Energy: 0.5236645411714443
Energy: 0.5158657683898591
Energy: 0.4864797595308074
Energy: 0.5302823840579673
Energy: 0.4864797595308074
Energy: 0.5302823840521294
Energy: 0.486479759530483
Energy: 0.5302823840388315
Energy: 0.6278006088277435
Energy: 0.5273227894422585
Energy: 0.6278006088270949
Energy: 0.5273227894419342
Energy: 0.6278006088274192
Energy: 0.5273227894419342
Energy: 0.6199354596957751
Energy: 0.6190972179099687
Energy: 0.6199354596960994
Energy: 0.6190972179099687
Energy: 0.6199354596944777
Energy: 0.6190972179099687
Energy: 0.47139810578739344
Energy: 0.5091264449618781
Energy: 0.4713981057838552
Energy: 0.5091264449612294
Energy: 0.4713981057864499
Energy: 0.5091264449615538
Energy: 0.6129000066418431
Energy: 0.5400518285829486
Energy: 0.6129000066392779
Energy: 0.5400518285780838
Energy: 0.6129000066392779
Energy: 0.5400518285926788
Energy: 0.6042488350398341
Energy: 0.6092430917401377
Energy: 0.6042488350398341
Energy: 0.6092430917407864
Energy: 0.6042488350395097
Energy: 0.609243091739489
Energy: 0.5166539029709886
Energy: 0.48568644477915446
Energy: 0.5166539029706642
Energy: 0.4856864447785058
Energy: 0.5166539029706642
Energy: 0.48568644477947875
Energy: 0.483317797211104
Energy: 0.5875843649266961
Energy: 0.483317797211104
Energy: 0.5875843649266961
Energy: 0.483317797211104
Energy: 0.5875843649266961
Energy: 0.5905366722690559
Energy: 0.5597623150183423
Energy: 0.5905366722690559
Energy: 0.5597623150180179
Energy: 0.5905366722687316
Energy: 0.5597623150183423
Energy: 0.5049396096581826
Energy: 0.5876715059116991
Energy: 0.5049396096578583
Energy: 0.5876715059113748
Energy: 0.504939609658507
Energy: 0.5876715059123478
Energy: 0.51752999298821
Energy: 0.4865509535044834
Energy: 0.5175299929914534
Energy: 0.48655095350415906
Energy: 0.5175299929904803
Energy: 0.48655095350415906
Energy: 0.6011281640703191
Energy: 0.6079417124476815
Energy: 0.6011281640706434
Energy: 0.6079417124570872
Energy: 0.6011281640703191
Energy: 0.6079417124603306
Energy: 0.6148954803070651
Energy: 0.5247016762886942
Energy: 0.6148954803064164
Energy: 0.5247016762685855
Energy: 0.6148954803067407
Energy: 0.5247016762368302
Energy: 0.49289462125413397
Energy: 0.5089013953963618
Energy: 0.49289462125251227
Energy: 0.5089013953966862
Energy: 0.49289462125380956
Energy: 0.5089013953963618
Energy: 0.61541021114735
Energy: 0.5333075258404352
Energy: 0.61541021114735
Energy: 0.5333075258404352
Energy: 0.6154102111483228
Energy: 0.5333075258404352
Energy: 0.6022932699939358
Energy: 0.5875835586811357
Energy: 0.6022932698448007
Energy: 0.58758355868146
Energy: 0.602293269987449
Energy: 0.5875835586811357
Energy: 0.48660335293790496
Energy: 0.5020060716336631
Energy: 0.48660335293790496
Energy: 0.5020060716271763
Energy: 0.4866033529382293
Energy: 0.502006071627825
Energy: 0.5197501002267312
Energy: 0.5153528866239285
Energy: 0.5197501002251095
Energy: 0.5153528866242528
Energy: 0.5197501002247852
Energy: 0.5153528866239285
Energy: 0.5220466627461035
Energy: 0.6376905735493875
Energy: 0.5220466627486982
Energy: 0.6376905735497119
Energy: 0.5220466627457792
Energy: 0.6376905735477658
Energy: 0.6371497060615926
Energy: 0.49056756994731165
Energy: 0.6371497060609439
Energy: 0.49056756993790596
Energy: 0.6371497060612682
Energy: 0.49056756993887896
Energy: 0.5047580271312743
Energy: 0.5236053701458006
Energy: 0.5047580271306256
Energy: 0.5236053701454761
Energy: 0.5047580271303013
Energy: 0.5236053701458006
Energy: 0.49687476241712103
Energy: 0.5211455565125087
Energy: 0.49687476241906703
Energy: 0.5211455565209415
Energy: 0.4968747624148507
Energy: 0.5211455565193198
Energy: 0.5253849965464413
Energy: 0.516435628677924
Energy: 0.5253849965483873
Energy: 0.5164356286831134
Energy: 0.5253849965470899
Energy: 0.516435628677924
Energy: 0.5087416603539215
Energy: 0.4889361310464302
Energy: 0.508741660354246
Energy: 0.4889361310438355
Energy: 0.5087416603539215
Energy: 0.4889361310467545
Energy: 0.5169771671234463
Energy: 0.5163239123461456
Energy: 0.5169771671234463
Energy: 0.5163239123461456
Energy: 0.516977167123122
Energy: 0.5163239123458212
Energy: 0.5061651485265787
Energy: 0.6495920029985273
Energy: 0.506165148524957
Energy: 0.6495920030030383
Energy: 0.5061651485265787
Energy: 0.6495920030007976
Energy: 0.6727256905741764
Energy: 0.509253267981041
Energy: 0.6727256905774198
Energy: 0.5092532679803924
Energy: 0.6727256905761224
Energy: 0.5092532679800681
Energy: 0.5327334511283829
Energy: 0.4962277776950188
Energy: 0.5327334511283829
Energy: 0.4962277776950188
Energy: 0.5327334511287073
Energy: 0.4962277776946945
Energy: 0.6375297825158717
Energy: 0.5030732887308419
Energy: 0.6375297824782489
Energy: 0.5030732887305176
Energy: 0.6375297825116554
Energy: 0.5030732887305176
Energy: 0.5061818686067355
Energy: 0.6464081850250641
Energy: 0.506181868635277
Energy: 0.646408185024091
Energy: 0.5061818686031678
Energy: 0.6464081850237668
Energy: 0.5207346085998287
Energy: 0.5069854989893514
Energy: 0.5207346085998287
Energy: 0.5069854989858131
Energy: 0.520734608600153
Energy: 0.5069854989890271
Energy: 0.5087616274156403
Energy: 0.48789966580510286
Energy: 0.5087616274156403
Energy: 0.48789966579634575
Energy: 0.5087616274159648
Energy: 0.48789966578337235

minimum gb energy = 0.4713981057838552 eV
minimum distance =  2.61870221786049 Angstroms
sigma value = 57


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

Energy: 0.32637230720408317
Energy: 0.3181254502230389
Energy: 0.2822738801130662
Energy: 0.3181254502230389
Energy: 0.32637230720408317
Energy: 0.31812545022451555
Energy: 0.6180017488164069
Energy: 0.313967343832056
Energy: 0.618001749306439
Energy: 0.313967343832056
Energy: 0.6180017492702622
Energy: 0.3139673438313177
Energy: 0.33333850379392166
Energy: 0.581935208285242
Energy: 0.3333385037946599
Energy: 0.5819352082845036
Energy: 0.33333850379392166
Energy: 0.5819352082859803
Energy: 0.3197317351800329
Energy: 0.2823656019728613
Energy: 0.3197317351792946
Energy: 0.2823656019728613
Energy: 0.3197317351800329
Energy: 0.282365601972123
Energy: 0.3354664685112285
Energy: 0.3689485937231447
Energy: 0.3354664685119668
Energy: 0.3689485937231447
Energy: 0.3354664685112285
Energy: 0.3689485937231447
Energy: 0.2825335830296813
Energy: 0.33671171092631924
Energy: 0.2825335830296813
Energy: 0.33671171092631924
Energy: 0.282533583028943
Energy: 0.3367117109270576
Energy: 0.2825650680324045
Energy: 0.3041290769040439
Energy: 0.2825650680331428
Energy: 0.3041290769040439
Energy: 0.2825650680324045
Energy: 0.30412907690478214
Energy: 0.37057504373386496
Energy: 0.3344681011997217
Energy: 0.3705750437346033
Energy: 0.33446810119898346
Energy: 0.37057504373386496
Energy: 0.33446810119898346
Energy: 0.32041586756318297
Energy: 0.28235958135515427
Energy: 0.32041586756170637
Energy: 0.28235958135515427
Energy: 0.32041586756318297
Energy: 0.28235958135515427
Energy: 0.30062436375004187
Energy: 0.6269562461507571
Energy: 0.30062436374856527
Energy: 0.6269562461514955
Energy: 0.30062436375004187
Energy: 0.6269562461514955
Energy: 0.33558265192160674
Energy: 0.31401574844914704
Energy: 0.33558265192160674
Energy: 0.31401574844914704
Energy: 0.33558265192160674
Energy: 0.31401574844914704
Energy: 0.32637230720408317
Energy: 0.31812545022451555
Energy: 0.2822738801108513
Energy: 0.31812545022451555
Energy: 0.32637230720408317
Energy: 0.31812545022525385
Energy: 0.6180017506702198
Energy: 0.313967343832056
Energy: 0.6180017501337082
Energy: 0.313967343832056
Energy: 0.6180017503942287
Energy: 0.3139673438313177
Energy: 0.33333850379392166
Energy: 0.5819352082859803
Energy: 0.33333850379392166
Energy: 0.5819352082859803
Energy: 0.33333850379392166
Energy: 0.5819352082859803
Energy: 0.3197317351792946
Energy: 0.28236560197359967
Energy: 0.3197317351785563
Energy: 0.2823656019728613
Energy: 0.3197317351792946
Energy: 0.282365601972123
Energy: 0.3354664685119668
Energy: 0.368948593723883
Energy: 0.3354664685112285
Energy: 0.3689485937231447
Energy: 0.3354664685112285
Energy: 0.368948593723883
Energy: 0.2825335830296813
Energy: 0.33671171092631924
Energy: 0.2825335830296813
Energy: 0.33671171092631924
Energy: 0.2825335830296813
Energy: 0.33671171092779584
Energy: 0.2825650680316662
Energy: 0.3041290769040439
Energy: 0.2825650680324045
Energy: 0.3041290769040439
Energy: 0.2825650680316662
Energy: 0.30412907690478214
Energy: 0.37057504373386496
Energy: 0.33446810119898346
Energy: 0.37057504373386496
Energy: 0.33446810119898346
Energy: 0.37057504373386496
Energy: 0.33446810119898346

minimum gb energy = 0.2822738801108513 eV
minimum distance =  2.74333129760268 Angstroms
sigma value = 11


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

Energy: 0.4859390250371293
Energy: 0.487773276730924
Energy: 0.4859390250414559
Energy: 0.4877732767271382
Energy: 0.4859390250414559
Energy: 0.4877732767260566
Energy: 0.5799452880623933
Energy: 0.46744771524630335
Energy: 0.5799452880645567
Energy: 0.46744771524576256
Energy: 0.5799452880634751
Energy: 0.46744771524576256
Energy: 0.5404135454499779
Energy: 0.6803376314726993
Energy: 0.5404135454504695
Energy: 0.680337631470536
Energy: 0.540413545449437
Energy: 0.6803376314840565
Energy: 0.5660907949016065
Energy: 0.530576118740382
Energy: 0.5660907949005249
Energy: 0.530576118740382
Energy: 0.5660907949005249
Energy: 0.530576118740382
Energy: 0.4760339579408968
Energy: 0.449332282770046
Energy: 0.4760339579403561
Energy: 0.44933228277112763
Energy: 0.4760339579408968
Energy: 0.4493322827705868
Energy: 0.5239198187110001
Energy: 0.5141155170494203
Energy: 0.5239198186028848
Energy: 0.5141155170515835
Energy: 0.5239198175044263
Energy: 0.514115517050502
Energy: 0.45126867768927564
Energy: 0.5742874530521617
Energy: 0.45126867768981654
Energy: 0.5742874530445902
Energy: 0.4512686776903573
Energy: 0.5742874530527025
Energy: 0.5237083103241821
Energy: 0.44286956562428215
Energy: 0.5237083103231003
Energy: 0.442869565624823
Energy: 0.5237083103241821
Energy: 0.44286956562428215
Energy: 0.4755518972847929
Energy: 0.43916935148563213
Energy: 0.4755518972847929
Energy: 0.4391693514829279
Energy: 0.4755518972847929
Energy: 0.4391693514829279
Energy: 0.4603909740782291
Energy: 0.6219196710267835
Energy: 0.4603909742311834
Energy: 0.6219196710262426
Energy: 0.46039097412036406
Energy: 0.6219196710257018
Energy: 0.6436917683733225
Energy: 0.5590769450564494
Energy: 0.6436917683733225
Energy: 0.5590769450564494
Energy: 0.6436917683733225
Energy: 0.5590769450559085
Energy: 0.46810493776209844
Energy: 0.44961913390627606
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Energy: 0.490557460331316
Energy: 0.4781700546364137
Energy: 0.4905574603323977
Energy: 0.47817005463695456
Energy: 0.490557460331316
Energy: 0.478170054635873
Energy: 0.4945186371907201
Energy: 0.6723653573180277
Energy: 0.4945186371907201
Energy: 0.6723653570336537
Energy: 0.49451863719126093
Energy: 0.6723653571801673
Energy: 0.6059490675102001
Energy: 0.46902387393991546
Energy: 0.605949067510741
Energy: 0.46902387394099715
Energy: 0.6059490675096592
Energy: 0.46902387393991546
Energy: 0.48674032375649506
Energy: 0.48173599191387323
Energy: 0.4867403237532501
Energy: 0.48173599191387323
Energy: 0.4867403237570358
Energy: 0.4817359919144141
Energy: 0.4689968185400222
Energy: 0.4676508953270528
Energy: 0.46899681854488967
Energy: 0.4676508953270528
Energy: 0.4689968185400222
Energy: 0.46765089532651194
Energy: 0.5602335198193907
Energy: 0.6700640519789881
Energy: 0.5602335198193907
Energy: 0.6700640519563228
Energy: 0.5602335198193907
Energy: 0.6700640518254931
Energy: 0.6004459963283912
Energy: 0.5312053463028541
Energy: 0.6004459963267688
Energy: 0.5312053463001499
Energy: 0.6004459963208197
Energy: 0.5312053462877603
Energy: 0.47712837012130005
Energy: 0.44867917711122207
Energy: 0.4771283701218409
Energy: 0.4486791771117629
Energy: 0.4771283701218409
Energy: 0.44867917711122207
Energy: 0.4461796189768957
Energy: 0.5009547749919537
Energy: 0.44617961897797737
Energy: 0.5009547749919537
Energy: 0.4461796189920387
Energy: 0.5009547749919537
Energy: 0.5603917863977741
Energy: 0.5672539650364865
Energy: 0.5603917863988557
Energy: 0.5672539650364865
Energy: 0.5603917863983149
Energy: 0.5672539650375681
Energy: 0.5245700917321383
Energy: 0.5146299248126684
Energy: 0.5245700917310567
Energy: 0.514629924819699
Energy: 0.5245700917332199
Energy: 0.5146299248126684
Energy: 0.4775178405079932
Energy: 0.45501261565593376
Energy: 0.4775178405069115
Energy: 0.45501261565755624
Energy: 0.4775178405069115
Energy: 0.4550126156548522
Energy: 0.4483516562831841
Energy: 0.5771535952272511
Energy: 0.4483516563172067
Energy: 0.5771535952272511
Energy: 0.4483516566404708
Energy: 0.5771535952267103
Energy: 0.6949577209209707
Energy: 0.5604227768305304
Energy: 0.6949577209209707
Energy: 0.5604227768299895
Energy: 0.69495772092043
Energy: 0.5604227768305304

minimum gb energy = 0.4391693514829279 eV
minimum distance =  2.61503782092508 Angstroms
sigma value = 41


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

Energy: 0.5308989877061564
Energy: 0.48314351472941974
Energy: 0.5308989877061564
Energy: 0.4831435147289934
Energy: 0.5308989877061564
Energy: 0.48314351472771466
Energy: 0.6065539420972884
Energy: 0.5101004488612951
Energy: 0.606553942093452
Energy: 0.5101004488617213
Energy: 0.6065539420921733
Energy: 0.5101004488612951
Energy: 0.6163725957136644
Energy: 0.7145552978643553
Energy: 0.6163725957136644
Energy: 0.7145552978639289
Energy: 0.6163725957136644
Energy: 0.7145552978630765
Energy: 0.5412075493302575
Energy: 0.4649081567381121
Energy: 0.5412075493306837
Energy: 0.4649081567070145
Energy: 0.5412075493311099
Energy: 0.46490815675857255
Energy: 0.4525746618470424
Energy: 0.49062072834922615
Energy: 0.4525746618466161
Energy: 0.49062072834922615
Energy: 0.45257466184746864
Energy: 0.49062072834922615
Energy: 0.5856860445741757
Energy: 0.5722072539972543
Energy: 0.5856860444714859
Energy: 0.5722072539972543
Energy: 0.5856860446278457
Energy: 0.5722072539972543
Energy: 0.6017085936794937
Energy: 0.6214030976866387
Energy: 0.6017085936799199
Energy: 0.6214030978387359
Energy: 0.6017085936794937
Energy: 0.6214030963696512
Energy: 0.4590761019359921
Energy: 0.4685461252154633
Energy: 0.4590761019355658
Energy: 0.46854612727082956
Energy: 0.4590761019359921
Energy: 0.46854612615879543
Energy: 0.47216660640204305
Energy: 0.48452956927936475
Energy: 0.47216660640246927
Energy: 0.48452956927552837
Energy: 0.47216660640204305
Energy: 0.4845295692746759
Energy: 0.6070101696145076
Energy: 0.5881973742029546
Energy: 0.6070101701496574
Energy: 0.5881973742029546
Energy: 0.607010168277079
Energy: 0.5881973742029546
Energy: 0.5812526581278621
Energy: 0.6319461767476441
Energy: 0.5812526582680434
Energy: 0.6319461767476441
Energy: 0.5812526576459754
Energy: 0.6319461767476441
Energy: 0.5190778705508091
Energy: 0.4890083651279093
Energy: 0.5190778705508091
Energy: 0.4890083651279093
Energy: 0.519077870550383
Energy: 0.4890083651283355
Energy: 0.4846316059852942
Energy: 0.47152999039911236
Energy: 0.48463160598444166
Energy: 0.4715299903986861
Energy: 0.48463160598444166
Energy: 0.4715299903982598
Energy: 0.4741007153559758
Energy: 0.6627071010321732
Energy: 0.47410071535043447
Energy: 0.6627071010321732
Energy: 0.4741007153517133
Energy: 0.662707101031747
Energy: 0.592340972300216
Energy: 0.5788533208935872
Energy: 0.5923409723049049
Energy: 0.5788533208940134
Energy: 0.5923409723049049
Energy: 0.5788533208940134
Energy: 0.4572954607591665
Energy: 0.5203800743053545
Energy: 0.4572954607604453
Energy: 0.5203800743053545
Energy: 0.4572954607578878
Energy: 0.5203800743053545
Energy: 0.49592616042708715
Energy: 0.4636737505595363
Energy: 0.49592616042751336
Energy: 0.4636737505582575
Energy: 0.49592616042708715
Energy: 0.4636737505522898
Energy: 0.5229082849373824
Energy: 0.6729039280306581
Energy: 0.5229082849369563
Energy: 0.6729039280310843
Energy: 0.5229082849373824
Energy: 0.6729039280298056
Energy: 0.6200292895151939
Energy: 0.5095580500060958
Energy: 0.6200292895147677
Energy: 0.5095580500060958
Energy: 0.6200292895160464
Energy: 0.5095580500056696
Energy: 0.5325940666246805
Energy: 0.5362209629354715
Energy: 0.5325940666246805
Energy: 0.5362209629354715
Energy: 0.5325940666246805
Energy: 0.5788950863075534
Energy: 0.4841175574998411
Energy: 0.5357103550454116
Energy: 0.48411755749941476
Energy: 0.5357103550454116
Energy: 0.4841175574998411
Energy: 0.5357103550454116
Energy: 0.6212527240560135
Energy: 0.7292664246766069
Energy: 0.6212527240564397
Energy: 0.7292664246770332
Energy: 0.6212527240560135
Energy: 0.7292664246766069
Energy: 0.5248500427591525
Energy: 0.48973740568191587
Energy: 0.5248500427587456
Energy: 0.48973740568276836
Energy: 0.5248500427587456
Energy: 0.48973740568276836
Energy: 0.450795694578009
Energy: 0.5254531318609792
Energy: 0.45079569457715646
Energy: 0.5254531318609792
Energy: 0.4507956945801403
Energy: 0.5254531318609792
Energy: 0.4635154958461081
Energy: 0.5254990767089618
Energy: 0.46351549584653445
Energy: 0.5254990767089618
Energy: 0.4635154958456819
Energy: 0.5254990767089618
Energy: 0.477042188517812
Energy: 0.5107716136723051
Energy: 0.4770421885182383
Energy: 0.5107716159010816
Energy: 0.4770421885148282
Energy: 0.5107716152099983
Energy: 0.4594642276109158
Energy: 0.48592685378175987
Energy: 0.4594642276109158
Energy: 0.4859268537809073
Energy: 0.4594642276109158
Energy: 0.48592685378175987
Energy: 0.4791825136788805
Energy: 0.5387109905502124
Energy: 0.4791825136788805
Energy: 0.5387109905497861
Energy: 0.4791825136788805
Energy: 0.5466711743437046
Energy: 0.5314567935732841
Energy: 0.515126059279357
Energy: 0.5314567934923335
Energy: 0.515126059279357
Energy: 0.5314567935758419
Energy: 0.515126059279357
Energy: 0.712120157982496
Energy: 0.47365995330073674
Energy: 0.7121201579807909
Energy: 0.4736599534609329
Energy: 0.7121201579863128
Energy: 0.4736599546049366
Energy: 0.5285607015988694
Energy: 0.49101237282611315
Energy: 0.5285607015988694
Energy: 0.4910123728256869
Energy: 0.5285607015984432
Energy: 0.49101237282611315
Energy: 0.49276638814836116
Energy: 0.46398889404838695
Energy: 0.49276638814836116
Energy: 0.46398889404838695
Energy: 0.4927663881487874
Energy: 0.4639888940458294
Energy: 0.4622907344285814
Energy: 0.5130062200492791
Energy: 0.46229073442772883
Energy: 0.5130062200497053
Energy: 0.4622907344285814
Energy: 0.5130062200492791

minimum gb energy = 0.45079569457715646 eV
minimum distance =  2.63072953242211 Angstroms
sigma value = 33


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

Energy: 0.5192333873880755
Energy: 0.47532827293733027
Energy: 0.5141904133043813
Energy: 0.47532827293703117
Energy: 0.5192333873877765
Energy: 0.4753282729379286
Energy: 0.6863312921812509
Energy: 0.4689581525346115
Energy: 0.68633129218155
Energy: 0.4689581525346115
Energy: 0.6863312921830458
Energy: 0.46895815253491063
Energy: 0.6689007192097376
Energy: 0.7693475900922793
Energy: 0.668900719210635
Energy: 0.7693475900928776
Energy: 0.6689007192091393
Energy: 0.7693475900922793
Energy: 0.6009039053948394
Energy: 0.4955192945503108
Energy: 0.600903905393942
Energy: 0.4955192945562939
Energy: 0.6009039053942411
Energy: 0.49551929454432775
Energy: 0.474142111148826
Energy: 0.6251709118380996
Energy: 0.4741141897286977
Energy: 0.6251709118366038
Energy: 0.4741421111485269
Energy: 0.6251709118366038
Energy: 0.5834431828359865
Energy: 0.5989727581286071
Energy: 0.5834431828356873
Energy: 0.5989727581286071
Energy: 0.5834431828359865
Energy: 0.5989727581292053
Energy: 0.5179933239974778
Energy: 0.673129830749337
Energy: 0.5179933239968795
Energy: 0.6731240025837449
Energy: 0.5179933239974778
Energy: 0.6731138770947509
Energy: 0.5400985190254123
Energy: 0.5804664185244968
Energy: 0.5400985190221217
Energy: 0.5804664185244968
Energy: 0.5400985190257115
Energy: 0.5804664185218044
Energy: 0.6378722312495817
Energy: 0.5366564462626322
Energy: 0.6377661359427467
Energy: 0.5366564462629314
Energy: 0.6378722312495817
Energy: 0.5366564462641279
Energy: 0.6674018714287392
Energy: 0.4809640524083249
Energy: 0.6674018714251494
Energy: 0.48096405240802576
Energy: 0.6674018714203629
Energy: 0.4809640524083249
Energy: 0.6891394180842898
Energy: 0.5201877993954863
Energy: 0.6891394180842898
Energy: 0.5201877993984777
Energy: 0.6891394180842898
Energy: 0.5201877993942896
Energy: 0.6109718807414993
Energy: 0.5160257904397835
Energy: 0.6109718807423968
Energy: 0.516025790438587
Energy: 0.6109718807412002
Energy: 0.516025790438587
Energy: 0.5271554415456531
Energy: 0.61860741177859
Energy: 0.5271554415468498
Energy: 0.6186074117791883
Energy: 0.5271554415462515
Energy: 0.6186074117809832
Energy: 0.5629992067105238
Energy: 0.538115003900683
Energy: 0.5629992067087289
Energy: 0.5381150038997855
Energy: 0.562999206710823
Energy: 0.5381150039009822
Energy: 0.560430016174307
Energy: 0.505187399743834
Energy: 0.5604300161722128
Energy: 0.505187399743834
Energy: 0.5604300161737086
Energy: 0.5051873997453297
Energy: 0.5133686420099481
Energy: 0.5831793624898771
Energy: 0.5133686420171006
Energy: 0.5831793624901764
Energy: 0.5133686420027684
Energy: 0.5831793624883814
Energy: 0.5985070306784817
Energy: 0.473204095696754
Energy: 0.5985070306772851
Energy: 0.4732040956964548
Energy: 0.5985070306781825
Energy: 0.47320409569585653
Energy: 0.5025222528389219
Energy: 0.5401511603173068
Energy: 0.5022698241641957
Energy: 0.5401511603173068
Energy: 0.5025222528245625
Energy: 0.5401511603164093
Energy: 0.7822125351520385
Energy: 0.6646586182945401
Energy: 0.782212535152936
Energy: 0.6646586182948392
Energy: 0.7822125351517394
Energy: 0.6646586182933706
Energy: 0.5367108168938313
Energy: 0.5207806401028708
Energy: 0.5367108168941304
Energy: 0.5207806401016744
Energy: 0.5367108168917372
Energy: 0.5207806401010759
Energy: 0.4919805414204312
Energy: 0.4987798831429662
Energy: 0.49198054337901537
Energy: 0.4987798831761449
Energy: 0.4919805435025113
Energy: 0.4987798829755218
Energy: 0.46959586999480424
Energy: 0.71392319976302
Energy: 0.4695894752932474
Energy: 0.7139231997627209
Energy: 0.46959586999480424
Energy: 0.7139231997615242
Energy: 0.7281699213508136
Energy: 0.5468802679446041
Energy: 0.7281699213514119
Energy: 0.5468802679446041
Energy: 0.7281699213508136
Energy: 0.5468802679431355
Energy: 0.4815851037507986
Energy: 0.6074884487679464
Energy: 0.48158510375259356
Energy: 0.6074884487679464
Energy: 0.4815851037516961
Energy: 0.6074884487655532
Energy: 0.6181047989966156
Energy: 0.48986891301529234
Energy: 0.6181047989980842
Energy: 0.4898689130131983
Energy: 0.6181047989966156
Energy: 0.48986891301529234
Energy: 0.49361059331275714
Energy: 0.5831223441397965
Energy: 0.49361016806787217
Energy: 0.5831223441403948
Energy: 0.49361027779196404
Energy: 0.5831223441365058
Energy: 0.6067221018240668
Energy: 0.5203146598914702
Energy: 0.6067221018147931
Energy: 0.5203146598917693
Energy: 0.6067221018195795
Energy: 0.5203146598929659
Energy: 0.6236118207168655
Energy: 0.4832568097740388
Energy: 0.5216203320450084
Energy: 0.48325680978301333
Energy: 0.6236118207174638
Energy: 0.4832568098170896
Energy: 0.5328800621341843
Energy: 0.6181767975408288
Energy: 0.5328800621338852
Energy: 0.6181767975411279
Energy: 0.5328800621341843
Energy: 0.6181767975408288
Energy: 0.4825314536800026
Energy: 0.7811606829096578
Energy: 0.4825314536785068
Energy: 0.7811606829096578
Energy: 0.48253145368030176
Energy: 0.7811606829078629
Energy: 0.5314601442886354
Energy: 0.5051307716611114
Energy: 0.5314601442880372
Energy: 0.5051307717768294
Energy: 0.5314601442886354
Energy: 0.5051307715803672
Energy: 0.5000872198232017
Energy: 0.6120305866619289
Energy: 0.4743518457456782
Energy: 0.6120305866619289
Energy: 0.5000872196701168
Energy: 0.6120305866625273
Energy: 0.6166973762260091
Energy: 0.5275859802882042
Energy: 0.6166973762260091
Energy: 0.5275859802885036
Energy: 0.6166973762257099
Energy: 0.527585980291495
Energy: 0.6849603211807099
Energy: 0.5604954947844624
Energy: 0.6849603211798124
Energy: 0.5604954947820693
Energy: 0.6849603211801115
Energy: 0.5604954947829667
Energy: 0.6677441400739457
Energy: 0.5605554975855775
Energy: 0.6677441400766381
Energy: 0.5605554975852783
Energy: 0.6677441400742448
Energy: 0.5605554975855775
Energy: 0.5841028165396921
Energy: 0.5288166675962859
Energy: 0.58409835187393
Energy: 0.5288166675505426
Energy: 0.5841028165393928
Energy: 0.5288166675711842
Energy: 0.47990412879366845
Energy: 0.596609096550033
Energy: 0.4799041287951642
Energy: 0.5966090965497338
Energy: 0.4799041287930701
Energy: 0.5966090965488363
Energy: 0.536450214708668
Energy: 0.5105370099175603
Energy: 0.5364502147062749
Energy: 0.5105370098132102
Energy: 0.5364502147080698
Energy: 0.5105370098359459
Energy: 0.495931851826275
Energy: 0.7737591350589114
Energy: 0.49593230385713344
Energy: 0.7737591350592105
Energy: 0.495931851826275
Energy: 0.7737591350598089
Energy: 0.5247906506562414
Energy: 0.5661633860429889
Energy: 0.5247906506580363
Energy: 0.5661633860447838
Energy: 0.5247906506568398
Energy: 0.5661633860447838
Energy: 0.504474567403212
Energy: 0.4834167722667612
Energy: 0.5044745673592637
Energy: 0.48341677226586377
Energy: 0.5044745673891518
Energy: 0.48341677226556456
Energy: 0.6994766978879313
Energy: 0.5059323968032298
Energy: 0.6994766990897119
Energy: 0.5059323968029306
Energy: 0.6994767007178676
Energy: 0.505932396801734
Energy: 0.5852912735643653
Energy: 0.5725672834907413
Energy: 0.5852912735488094
Energy: 0.5725672834904421
Energy: 0.5852912735640662
Energy: 0.5725672834910405
Energy: 0.6063335937632536
Energy: 0.47977103481476413
Energy: 0.6063335937629544
Energy: 0.47977103481476413
Energy: 0.6063335937632536
Energy: 0.4797710348162599
Energy: 0.49040560288163554
Energy: 0.6081416495561373
Energy: 0.4901650813888395
Energy: 0.608141649555838
Energy: 0.49040560288133633
Energy: 0.608141649557633
Energy: 0.7538285834395521
Energy: 0.5599011410384828
Energy: 0.7538285834398512
Energy: 0.5599011410396795
Energy: 0.7538285834392527
Energy: 0.5599011410366879
Energy: 0.46973737055811166
Energy: 0.6661106675375309
Energy: 0.4697373705587099
Energy: 0.6661106675393258
Energy: 0.46973737055811166
Energy: 0.6661106675381291

minimum gb energy = 0.4689581525346115 eV
minimum distance =  2.63184696531566 Angstroms
sigma value = 67


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

Energy: 0.4451357444438297
Energy: 0.43731797825212804
Energy: 0.44513574444423865
Energy: 0.4373179782515373
Energy: 0.4451357444436252
Energy: 0.4373179782513328
Energy: 0.4167686193397209
Energy: 0.4058109519916454
Energy: 0.41676861933910747
Energy: 0.4058109519918499
Energy: 0.4167686193395164
Energy: 0.4058109519918499
Energy: 0.4059141227506633
Energy: 0.8313153371027282
Energy: 0.7873019574934907
Energy: 0.8313153371027282
Energy: 0.5491013103987402
Energy: 0.8313153371025238
Energy: 0.41677303424841333
Energy: 0.4057887786716792
Energy: 0.41677303424820883
Energy: 0.4057887786716792
Energy: 0.4167730342486177
Energy: 0.4057887786714975
Energy: 0.44513574444403414
Energy: 0.43731797825174173
Energy: 0.445135744443239
Energy: 0.4373179782519236
Energy: 0.44513574444442044
Energy: 0.43731797825174173
Energy: 0.4167686193395164
Energy: 0.4058109519914637
Energy: 0.41676861933910747
Energy: 0.4058109519916454
Energy: 0.4167686193397209
Energy: 0.4058109519916454
Energy: 0.6383981470016706
Energy: 0.8313153371025238
Energy: 0.6383981471917439
Energy: 0.8313153371025238
Energy: 0.5075300252189894
Energy: 0.8313153371025238

minimum gb energy = 0.4057887786714975 eV
minimum distance =  2.675676894208 Angstroms
sigma value = 3


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

Energy: 0.6644747340568953
Energy: 0.5400621786148763
Energy: 0.6644747340563512
Energy: 0.540062178615173
Energy: 0.6644747340561039
Energy: 0.5400621786064665
Energy: 0.6185028733769975
Energy: 0.5499600936050961
Energy: 0.6185028733767501
Energy: 0.5499600936050961
Energy: 0.6185028733769975
Energy: 0.5499600936050961
Energy: 0.5118149947950091
Energy: 0.6846684898741872
Energy: 0.511814994795306
Energy: 0.6846684898761164
Energy: 0.5118149947947619
Energy: 0.6846684898744839
Energy: 0.6019712306956497
Energy: 0.5462979514486841
Energy: 0.6019712306420758
Energy: 0.5462979514495251
Energy: 0.6019712307668841
Energy: 0.5462979514492282
Energy: 0.5632674960300631
Energy: 0.5739341433534868
Energy: 0.5632674960697861
Energy: 0.5739341433556634
Energy: 0.5632674960267982
Energy: 0.5739341433556634
Energy: 0.5856876842735358
Energy: 0.6089020890884923
Energy: 0.5856876843763307
Energy: 0.6089020890879481
Energy: 0.5856876842724476
Energy: 0.6089020890868597
Energy: 0.6103789149690411
Energy: 0.6968808120308573
Energy: 0.6103789149687937
Energy: 0.6968808120311046
Energy: 0.6103789149684969
Energy: 0.6968808120308573
Energy: 0.6167629178222837
Energy: 0.5545016178815907
Energy: 0.6167629178217395
Energy: 0.5545016178810466
Energy: 0.6167629178222837
Energy: 0.5545016178815907
Energy: 0.498406703150798
Energy: 0.565754566016867
Energy: 0.49840670311597246
Energy: 0.5657545660157787
Energy: 0.49840670311216334
Energy: 0.5657545660179553
Energy: 0.5263825078074416
Energy: 0.6113667010846942
Energy: 0.5263825077995762
Energy: 0.6113667010602073
Energy: 0.5263825078128832
Energy: 0.6113667010800442
Energy: 0.680868462765314
Energy: 0.7187204771238626
Energy: 0.6808684627658581
Energy: 0.7187204771230712
Energy: 0.6808684627645224
Energy: 0.7187204771251982
Energy: 0.5935501548458794
Energy: 0.5325628760340414
Energy: 0.5935501548458794
Energy: 0.5325628760348329
Energy: 0.5935501548461762
Energy: 0.5325628760342886
Energy: 0.5020766325131545
Energy: 0.5608170289202936
Energy: 0.5020766325251257
Energy: 0.5608170289148521
Energy: 0.5020766325039039
Energy: 0.5608170289170287
Energy: 0.5522526040611979
Energy: 0.5892281987553817
Energy: 0.552252604062583
Energy: 0.5892281987548375
Energy: 0.5522526040614947
Energy: 0.5892281987559257
Energy: 0.7264264352412017
Energy: 0.6548469065184843
Energy: 0.7264264352466432
Energy: 0.6548469065366885
Energy: 0.7264264352412017
Energy: 0.6548469065402008
Energy: 0.615799084509924
Energy: 0.5489165650053519
Energy: 0.6157990845077473
Energy: 0.5600182706444724
Energy: 0.6157990845112596
Energy: 0.5600182706441755
Energy: 0.5907262666612159
Energy: 0.5681393167147215
Energy: 0.5907262666615126
Energy: 0.5681393167152656
Energy: 0.5907262666604243
Energy: 0.5681393167150183
Energy: 0.5715396543975111
Energy: 0.6176884189493921
Energy: 0.5715396543977584
Energy: 0.6176884189472155
Energy: 0.5715396543980552
Energy: 0.617688418948848
Energy: 0.7035572535713235
Energy: 0.6000630024729666
Energy: 0.7035572535694437
Energy: 0.6000630024740549
Energy: 0.7035572535640021
Energy: 0.6000630024729666
Energy: 0.5972471849705591
Energy: 0.5821002489823729
Energy: 0.5972471849711032
Energy: 0.5821002489821255
Energy: 0.5972471849702622
Energy: 0.5821002489823729
Energy: 0.5498396771039118
Energy: 0.6309868128924893
Energy: 0.5498396771044559
Energy: 0.6309868128878887
Energy: 0.5498396771071767
Energy: 0.6309868128941216
Energy: 0.5521441419159607
Energy: 0.6455382954386079
Energy: 0.5521441418281546
Energy: 0.6455382954389047
Energy: 0.5521441419146251
Energy: 0.6455382954386079
Energy: 0.6706447265797792
Energy: 0.5447804082319493
Energy: 0.6706447265806202
Energy: 0.5447804082319493
Energy: 0.6706447265797792
Energy: 0.5447804082319493
Energy: 0.5687311768860454
Energy: 0.5756072184645118
Energy: 0.5687311768847096
Energy: 0.5756072184647592
Energy: 0.5687311768863421
Energy: 0.5756072184647592
Energy: 0.5689700497721794
Energy: 0.6308306516457992
Energy: 0.568970049771388
Energy: 0.630830651645255
Energy: 0.5689700497710911
Energy: 0.6308306516455519
Energy: 0.555275794007952
Energy: 0.6233605322540828
Energy: 0.5552757940139377
Energy: 0.6233605322546268
Energy: 0.5552757939984047
Energy: 0.6233605322543795
Energy: 0.6714107920579845
Energy: 0.5541742135598441
Energy: 0.6714107920596168
Energy: 0.5541742135595473
Energy: 0.6714107920590728
Energy: 0.5541742135600914
Energy: 0.5702808256132771
Energy: 0.5497598926819611
Energy: 0.5702808256132771
Energy: 0.5497598926814169
Energy: 0.5702808256146128
Energy: 0.5497598926789931
Energy: 0.5691380830839774
Energy: 0.5647278415467342
Energy: 0.56913808307908
Energy: 0.56472784154619
Energy: 0.5691380830839774
Energy: 0.56472784154619
Energy: 0.6391690386474592
Energy: 0.5953163359094061
Energy: 0.6391690386319757
Energy: 0.5953163359776722
Energy: 0.6391690386393465
Energy: 0.595316335908862
Energy: 0.7494784961694717
Energy: 0.5886339568908511
Energy: 0.7494784961559174
Energy: 0.588633956876159
Energy: 0.7494784961496349
Energy: 0.5886339568922362
Energy: 0.5648063793917558
Energy: 0.5706028245348755
Energy: 0.5648063793922999
Energy: 0.5706028245357166
Energy: 0.5648063793920032
Energy: 0.5706028245348755
Energy: 0.5657115565309945
Energy: 0.5641746237612265
Energy: 0.5657115565306976
Energy: 0.5641746237617706
Energy: 0.5657115565306976
Energy: 0.5641746237617706
Energy: 0.6129784504624312
Energy: 0.5532142605690127
Energy: 0.6129784504597104
Energy: 0.55321426056926
Energy: 0.6129784504545658
Energy: 0.55321426056926
Energy: 0.580971086118566
Energy: 0.6131367079789973
Energy: 0.5809710847756528
Energy: 0.6131367079741
Energy: 0.5809710870643978
Energy: 0.613136707982559
Energy: 0.5838029346741779
Energy: 0.6329270264131046
Energy: 0.5838029346741779
Energy: 0.6329270264131046
Energy: 0.5838029346739305
Energy: 0.6329270264128573
Energy: 0.530160092038791
Energy: 0.5582694837776401
Energy: 0.5301600920358229
Energy: 0.5582694837792725
Energy: 0.5301600920377026
Energy: 0.5582694837751667
Energy: 0.6416842468099608
Energy: 0.5198142298831246
Energy: 0.6416842468094166
Energy: 0.519814229885054
Energy: 0.6416842468083284
Energy: 0.5198142298834215
Energy: 0.5493077765785335
Energy: 0.6278958418967284
Energy: 0.5493077765799186
Energy: 0.6278958418958875
Energy: 0.5493077765774452
Energy: 0.6278958418964316
Energy: 0.6101137424886435
Energy: 0.6330407044614619
Energy: 0.6101137424889403
Energy: 0.6330407044609179
Energy: 0.6101137424873079
Energy: 0.6330407044617588
Energy: 0.5890681909212083
Energy: 0.5894539249743604
Energy: 0.5890681909206642
Energy: 0.5894539249752013
Energy: 0.5890681909209116
Energy: 0.5894539249730247
Energy: 0.6803383553614826
Energy: 0.5319674345702029
Energy: 0.6803383553785985
Energy: 0.531967434570747
Energy: 0.680338355348423
Energy: 0.5319674345702029
Energy: 0.5459184693374537
Energy: 0.6297296270578135
Energy: 0.5459184693257298
Energy: 0.6297296270583578
Energy: 0.5459184693431426
Energy: 0.6297296270572694
Energy: 0.5983929774884122
Energy: 0.5695447272745475
Energy: 0.5983929774884122
Energy: 0.5695447272750918
Energy: 0.5983929774884122
Energy: 0.5695447272748444
Energy: 0.6316506333147591
Energy: 0.583286995099535
Energy: 0.6316506333147591
Energy: 0.5832869950992382
Energy: 0.6316506333147591
Energy: 0.5832869951006233
Energy: 0.6452468953087107
Energy: 0.5341086663246728
Energy: 0.645246895678535
Energy: 0.5341086663241286
Energy: 0.6452468950565713
Energy: 0.5341086663233372
Energy: 0.5192454980781347
Energy: 0.6032122130676446
Energy: 0.5192454980778378
Energy: 0.6032122130706622
Energy: 0.5192454980781347
Energy: 0.6032122130695738
Energy: 0.5710892183721449
Energy: 0.5544417852620088
Energy: 0.5710892183740742
Energy: 0.5544417852622562
Energy: 0.5710892184001438
Energy: 0.5544417852617121
Energy: 0.5772903794069506
Energy: 0.5620359764249847
Energy: 0.5772903794061096
Energy: 0.562035976412766
Energy: 0.5772903794069506
Energy: 0.5620359764252816
Energy: 0.5815654134563731
Energy: 0.614230701262978
Energy: 0.581565413459638
Energy: 0.6142307011990652
Energy: 0.5815654134898135
Energy: 0.61423070109815
Energy: 0.5547577711223194
Energy: 0.6321343112274977
Energy: 0.5547577712359973
Energy: 0.6321343112277947
Energy: 0.5547577713233086
Energy: 0.6321343112274977

minimum gb energy = 0.49840670311216334 eV
minimum distance =  2.48763614223622 Angstroms
sigma value = 81


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

Energy: 0.6071845215408841
Energy: 0.5440278249225551
Energy: 0.5900571036967385
Energy: 0.5440278249203144
Energy: 0.6071845215405107
Energy: 0.5440278249233019
Energy: 0.5354174386131428
Energy: 0.6040680411084138
Energy: 0.5354174386075415
Energy: 0.6040680411087873
Energy: 0.5354174386172504
Energy: 0.6040680411084138
Energy: 0.5495612653161225
Energy: 0.6318714491441229
Energy: 0.5314529710242988
Energy: 0.6318714491437494
Energy: 0.5495612653161225
Energy: 0.6318714491441229
Energy: 0.530281367212054
Energy: 0.5321528751195179
Energy: 0.5302813672128008
Energy: 0.5321528750728745
Energy: 0.5302813672124274
Energy: 0.5321528751087227
Energy: 0.640345115551168
Energy: 0.5658310405793238
Energy: 0.6403451155507948
Energy: 0.5658310405793238
Energy: 0.640345115551168
Energy: 0.5658310405774567
Energy: 0.5247342044858839
Energy: 0.5435340194570255
Energy: 0.5247342044851371
Energy: 0.5435340194570255
Energy: 0.5247342044855106
Energy: 0.543534019457399
Energy: 0.5978994694891069
Energy: 0.6746018902143756
Energy: 0.5978994694887335
Energy: 0.6746018902132555
Energy: 0.5978994694891069
Energy: 0.6746018902125084
Energy: 0.6238673674500618
Energy: 0.6779328658345641
Energy: 0.6289649523768104
Energy: 0.6779328658341908
Energy: 0.6238673674504351
Energy: 0.6779328658356844
Energy: 0.5481177779966285
Energy: 0.5262480828839868
Energy: 0.548117777997002
Energy: 0.5262480828847337
Energy: 0.5481177779962552
Energy: 0.5262480828839868
Energy: 0.5365574568273943
Energy: 0.6462134159773008
Energy: 0.5365574568273943
Energy: 0.6462134151423348
Energy: 0.5365574568277677
Energy: 0.6462134160063936
Energy: 0.6201855605639907
Energy: 0.7234832359367812
Energy: 0.6201855605636172
Energy: 0.7234832359367812
Energy: 0.6201855605647375
Energy: 0.7234832359360344
Energy: 0.5145595459749566
Energy: 0.5376144804171539
Energy: 0.5146879807825173
Energy: 0.5376144804167805
Energy: 0.5145595459745832
Energy: 0.5376144804171539
Energy: 0.6293659654996547
Energy: 0.6041826990865913
Energy: 0.6293659654992814
Energy: 0.6041826990865913
Energy: 0.6293659654992814
Energy: 0.6041826990865913
Energy: 0.5992857839654554
Energy: 0.5177842271908141
Energy: 0.5992857839665757
Energy: 0.5177842271908141
Energy: 0.5992857839654554
Energy: 0.5177842271900672
Energy: 0.6425525233574615
Energy: 0.5737701975436471
Energy: 0.6425525237673064
Energy: 0.5737701975440205
Energy: 0.6425525116399297
Energy: 0.5737701975455142
Energy: 0.6241653017529949
Energy: 0.5548487358262565
Energy: 0.6241653017529949
Energy: 0.5548487358288704
Energy: 0.6241653017526214
Energy: 0.5548487358258831
Energy: 0.5505010748692151
Energy: 0.5353259357404628
Energy: 0.5540905956753021
Energy: 0.5353259357188045
Energy: 0.5505010748695883
Energy: 0.535325935712083
Energy: 0.5734011067009536
Energy: 0.5956039091641118
Energy: 0.5717371246282711
Energy: 0.595603909162618
Energy: 0.5734011067009536
Energy: 0.5956039091629914
Energy: 0.6151733102043742
Energy: 0.5476179786394334
Energy: 0.6151733101998931
Energy: 0.5476179786398068
Energy: 0.6151733102032539
Energy: 0.5476179786386867
Energy: 0.5466336141467201
Energy: 0.5406708613287502
Energy: 0.5466336141459733
Energy: 0.5406708613287502
Energy: 0.5466336141467201
Energy: 0.5406708613298703
Energy: 0.611102044963182
Energy: 0.5272233458283685
Energy: 0.6111020449624353
Energy: 0.5272230498590577
Energy: 0.611102044963182
Energy: 0.5272231475880789
Energy: 0.5777797190639267
Energy: 0.5810111719300537
Energy: 0.5921866092464461
Energy: 0.5810111719296802
Energy: 0.5777797190654204
Energy: 0.5810111719300537
Energy: 0.7214855495042626
Energy: 0.5940427137285379
Energy: 0.7116697704866736
Energy: 0.594042713727791
Energy: 0.7214855495046361
Energy: 0.5940427137281645
Energy: 0.630834469513555
Energy: 0.6295221297602944
Energy: 0.6308344695139285
Energy: 0.6295221297602944
Energy: 0.630834469513555
Energy: 0.6295221297617882
Energy: 0.5270748914901116
Energy: 0.5484939859807503
Energy: 0.5270748914908584
Energy: 0.5484939852741727
Energy: 0.5270748914901116
Energy: 0.5484939852603561
Energy: 0.7218822948087676
Energy: 0.6259632364148469
Energy: 0.7218822948091411
Energy: 0.6259632364141
Energy: 0.7218822948087676
Energy: 0.6259632364137266
Energy: 0.5691446563488534
Energy: 0.5453227279590857
Energy: 0.569144656650814
Energy: 0.5453227279602059
Energy: 0.5691446566500672
Energy: 0.5453227279609527
Energy: 0.531155898765344
Energy: 0.5409437994637758
Energy: 0.5311558987649705
Energy: 0.5409437993346066
Energy: 0.5311558987649705
Energy: 0.5409437993383408
Energy: 0.5654201183636999
Energy: 0.536585332693321
Energy: 0.5909066073023522
Energy: 0.5365853326944412
Energy: 0.5654201184379763
Energy: 0.536585332693321
Energy: 0.5764674335905918
Energy: 0.5527201324378036
Energy: 0.5764674335920854
Energy: 0.5527201324378036
Energy: 0.5764674335905918
Energy: 0.5527201324378036
Energy: 0.5229182203724025
Energy: 0.6381449287927358
Energy: 0.5229182212958351
Energy: 0.638144928787508
Energy: 0.5229182199715197
Energy: 0.6381449287901219
Energy: 0.5826163856497607
Energy: 0.6291376435486877
Energy: 0.5826163856497607
Energy: 0.6291376435486877
Energy: 0.5826163856497607
Energy: 0.6291376435494346
Energy: 0.5153621398040635
Energy: 0.518990050728024
Energy: 0.5149789191402891
Energy: 0.5189900499509039
Energy: 0.515362139804437
Energy: 0.5189900521672848
Energy: 0.6622940258369046
Energy: 0.5720397155973255
Energy: 0.6570877647407385
Energy: 0.5720397155973255
Energy: 0.6622940258365312
Energy: 0.5720397155984457
Energy: 0.5472869807824401
Energy: 0.6550844692534369
Energy: 0.547565412303372
Energy: 0.6550844692538103
Energy: 0.5472869807820667
Energy: 0.6550844692534369
Energy: 0.5264250176173451
Energy: 0.55320938520699
Energy: 0.5264250176162248
Energy: 0.55320938520699
Energy: 0.5264250176165982
Energy: 0.5532093852077369
Energy: 0.5835086819393857
Energy: 0.6191441463242898
Energy: 0.5835086819401325
Energy: 0.6191441463246633
Energy: 0.5835086819390123
Energy: 0.6191441463246633
Energy: 0.7383273513468601
Energy: 0.6480580397551589
Energy: 0.7383273513479806
Energy: 0.6480580397551589
Energy: 0.7383273513468601
Energy: 0.6480580397551589

minimum gb energy = 0.5145595459745832 eV
minimum distance =  2.4624870860456 Angstroms
sigma value = 43


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

Energy: 0.6194572780002311
Energy: 0.4998787976318399
Energy: 0.6194572779993137
Energy: 0.4998787976318399
Energy: 0.6194572780011484
Energy: 0.4998787976336746
Energy: 0.5847915430972839
Energy: 0.5276928119155954
Energy: 0.5847915430977425
Energy: 0.5276928119160541
Energy: 0.5847915430982012
Energy: 0.5276928119155954
Energy: 0.5589510733477429
Energy: 0.6556731200649292
Energy: 0.5430134592941012
Energy: 0.6556731200649292
Energy: 0.5589510733482015
Energy: 0.6556731200644705
Energy: 0.575453970725668
Energy: 0.5567591832880281
Energy: 0.5754539707293373
Energy: 0.5567591832884868
Energy: 0.5754539707288786
Energy: 0.5567591832880281
Energy: 0.5904790693932831
Energy: 0.5782496212034889
Energy: 0.5904790693928244
Energy: 0.5782496212034889
Energy: 0.5904790693928244
Energy: 0.5782496212034889
Energy: 0.5331180690773417
Energy: 0.5719721401828478
Energy: 0.5331180690768832
Energy: 0.5719721401833064
Energy: 0.5331180690773417
Energy: 0.5719721401819304
Energy: 0.6187442797124988
Energy: 0.6543269004459092
Energy: 0.6187442797138748
Energy: 0.6543269004459092
Energy: 0.6187442797124988
Energy: 0.6543269004459092
Energy: 0.5449646896779692
Energy: 0.5181260060872745
Energy: 0.5449646896788866
Energy: 0.5181260060868159
Energy: 0.5449646896788866
Energy: 0.5181260060872745
Energy: 0.5933459422136118
Energy: 0.5257762079621042
Energy: 0.5933459422136118
Energy: 0.525776136665522
Energy: 0.5933459422131531
Energy: 0.5257762678064312
Energy: 0.5300090893293313
Energy: 0.6290246608780532
Energy: 0.5300090893293313
Energy: 0.6290246608936483
Energy: 0.5300090893293313
Energy: 0.6290246608986938
Energy: 0.6404920027670594
Energy: 0.6024695178904803
Energy: 0.6404920027597206
Energy: 0.6024695178904803
Energy: 0.6404920027666007
Energy: 0.6024695178904803
Energy: 0.5724761818590235
Energy: 0.5605393916350121
Energy: 0.5724761818590235
Energy: 0.5605393916331983
Energy: 0.5724761818585647
Energy: 0.5605393916350121
Energy: 0.5686828351042021
Energy: 0.5850496516012337
Energy: 0.5686828351037434
Energy: 0.5850496516039857
Energy: 0.5686828351042021
Energy: 0.5850496516053618
Energy: 0.5108642789951029
Energy: 0.6330335281223257
Energy: 0.5108642789946443
Energy: 0.6330335282470239
Energy: 0.5108642789951029
Energy: 0.633033528107648
Energy: 0.5594483074389117
Energy: 0.5468350487461382
Energy: 0.5594483074338663
Energy: 0.5468350487461382
Energy: 0.5594483074554034
Energy: 0.5468350487461382
Energy: 0.5698738615012323
Energy: 0.5890000815451072
Energy: 0.5698738615012323
Energy: 0.5890000815455659
Energy: 0.5698738615016911
Energy: 0.5890000815455659
Energy: 0.5703403542905676
Energy: 0.5422673857056909
Energy: 0.5703403542901089
Energy: 0.542267385709819
Energy: 0.5703403542910263
Energy: 0.542267385707067
Energy: 0.6141272067905751
Energy: 0.5502907407525721
Energy: 0.6141268762376422
Energy: 0.5502907407122293
Energy: 0.6141271385735636
Energy: 0.5502907407232166
Energy: 0.6363124975327143
Energy: 0.5384091500714944
Energy: 0.6363124975166813
Energy: 0.5384091500710356
Energy: 0.6363124975180574
Energy: 0.5384091500696597
Energy: 0.5832841962859845
Energy: 0.5543982464910506
Energy: 0.5832841962859845
Energy: 0.5543982464919679
Energy: 0.5832841962859845
Energy: 0.5543982464905919
Energy: 0.5605202955518759
Energy: 0.5577355996607194
Energy: 0.5605202955518759
Energy: 0.557735599655674
Energy: 0.5605202955518759
Energy: 0.5577355996506285
Energy: 0.5584327101735467
Energy: 0.5299488147219705
Energy: 0.5584327095843943
Energy: 0.5299488147219705
Energy: 0.5584327087678622
Energy: 0.5299488147224293
Energy: 0.4685914702039476
Energy: 0.5474888054282554
Energy: 0.4685914702039476
Energy: 0.547489441620555
Energy: 0.4685914702034889
Energy: 0.5474883374354166
Energy: 0.5366963147289633
Energy: 0.5868169055785724
Energy: 0.5366963147271286
Energy: 0.5868169055781137
Energy: 0.5366963147285047
Energy: 0.5868169055781137
Energy: 0.5498999937165793
Energy: 0.5457252489555903
Energy: 0.5498999937152033
Energy: 0.545725248956049
Energy: 0.5498999937463726
Energy: 0.5457252489555903
Energy: 0.583404416046768
Energy: 0.5638437537670649
Energy: 0.5834044160687846
Energy: 0.5638437537670649
Energy: 0.5834044160311729
Energy: 0.5638437537670649
Energy: 0.5339690240227113
Energy: 0.5359352626816235
Energy: 0.5339690240231699
Energy: 0.5359352626802475
Energy: 0.5339690240227113
Energy: 0.5359352626816235
Energy: 0.5897929944346779
Energy: 0.5290925285212167
Energy: 0.5897929944351364
Energy: 0.5290919421715818
Energy: 0.5897929944337604
Energy: 0.5290918827206348
Energy: 0.5376365766620645
Energy: 0.5353621236489423
Energy: 0.537636576661606
Energy: 0.5353621236489423
Energy: 0.5376365766611473
Energy: 0.5353621236489423
Energy: 0.5959393073017885
Energy: 0.6358458667881681
Energy: 0.595939307305458
Energy: 0.6358458667904615
Energy: 0.5959393073059166
Energy: 0.6358458667913788
Energy: 0.5305961041265939
Energy: 0.5747148420995399
Energy: 0.5305961041270526
Energy: 0.5747148420995399
Energy: 0.5305961041270526
Energy: 0.5747148420995399

minimum gb energy = 0.4685914702034889 eV
minimum distance =  2.50235588699973 Angstroms
sigma value = 57


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

Energy: 0.5869781505594758
Energy: 0.4642939010345209
Energy: 0.586978150536314
Energy: 0.4642939010345209
Energy: 0.5869781505464101
Energy: 0.4642939010345209
Energy: 0.4986106160381551
Energy: 0.5190124835132605
Energy: 0.49861061603043455
Energy: 0.5190124835132605
Energy: 0.4986106160298406
Energy: 0.5190124835120726
Energy: 0.534263984757552
Energy: 0.6600525655167044
Energy: 0.534263984757552
Energy: 0.6600525655178923
Energy: 0.534263984757552
Energy: 0.6600525655178923
Energy: 0.6182675662537699
Energy: 0.6025202406870445
Energy: 0.618267566254364
Energy: 0.6025202406876384
Energy: 0.618267566254364
Energy: 0.6025202406870445
Energy: 0.6332948862425342
Energy: 0.5683107994923996
Energy: 0.6332948862419403
Energy: 0.5683107994923996
Energy: 0.6332948862425342
Energy: 0.5683107994929935
Energy: 0.5333727891329767
Energy: 0.5596550395055899
Energy: 0.5333727891329767
Energy: 0.559655039925282
Energy: 0.5333727891329767
Energy: 0.559655039668829
Energy: 0.5215841885154145
Energy: 0.58918810222232
Energy: 0.5215841885124451
Energy: 0.5891881022217262
Energy: 0.5215841885094755
Energy: 0.58918810222232
Energy: 0.5734468526482218
Energy: 0.5104193304517899
Energy: 0.5734468526482218
Energy: 0.510419330452384
Energy: 0.5734468526488158
Energy: 0.510419330452384
Energy: 0.5881267588720617
Energy: 0.5212726980705977
Energy: 0.5881267588720617
Energy: 0.5212726980700039
Energy: 0.5881267588720617
Energy: 0.52127269806941
Energy: 0.4462323053178026
Energy: 0.5417341299971677
Energy: 0.4462323053172088
Energy: 0.5417341299971677
Energy: 0.4462323053172088
Energy: 0.5417341299971677
Energy: 0.5208581283679624
Energy: 0.6057986125968472
Energy: 0.5208581283691502
Energy: 0.6057986125962532
Energy: 0.5208581283691502
Energy: 0.6057986125962532
Energy: 0.5959944754237229
Energy: 0.5611842130041728
Energy: 0.5959944754237229
Energy: 0.5611842130041728
Energy: 0.5959944754225349
Energy: 0.5611842130041728
Energy: 0.5029028315162746
Energy: 0.5198207020189526
Energy: 0.5029028315162746
Energy: 0.5198207020189526
Energy: 0.5029028315162746
Energy: 0.5198207020189526
Energy: 0.5655467754059563
Energy: 0.5130362995918409
Energy: 0.5655467754059563
Energy: 0.5130362995876837
Energy: 0.5655467754059563
Energy: 0.5130362995882776
Energy: 0.5161358352561612
Energy: 0.5092463783637922
Energy: 0.5161358352555675
Energy: 0.5092463783637922
Energy: 0.5161358352561612
Energy: 0.5092463783637922
Energy: 0.6063672582971052
Energy: 0.5749819978485113
Energy: 0.6063672582971052
Energy: 0.5749819978491052
Energy: 0.6063672582959173
Energy: 0.5749819978491052
Energy: 0.4434582135951782
Energy: 0.5029412944545947
Energy: 0.4434582135951782
Energy: 0.5029412944593458
Energy: 0.4434582135951782
Energy: 0.5029412944593458
Energy: 0.5189515130237095
Energy: 0.5798378367886758
Energy: 0.5189515130237095
Energy: 0.5798378367863002
Energy: 0.5189515130237095
Energy: 0.597301436202067
Energy: 0.4433858138900201
Energy: 0.49718552065124333
Energy: 0.44338581389061393
Energy: 0.49718552243332154
Energy: 0.44338581389061393
Energy: 0.49718552079847433
Energy: 0.5869385817193778
Energy: 0.5746876381335209
Energy: 0.5869385817152206
Energy: 0.5746876381329269
Energy: 0.586938581718784
Energy: 0.5746876381329269
Energy: 0.5160254858100136
Energy: 0.5094039200971809
Energy: 0.5160254858106076
Energy: 0.5094039200965871
Energy: 0.5160254858100136
Energy: 0.5094039200965871
Energy: 0.5655786137205623
Energy: 0.6288427231060674
Energy: 0.565578613721156
Energy: 0.6288427230971589
Energy: 0.565578613721156
Energy: 0.6288427231001285
Energy: 0.5028542222605703
Energy: 0.5197683926514659
Energy: 0.5028542222605703
Energy: 0.5197683926520597
Energy: 0.5028542222611642
Energy: 0.5197683926520597
Energy: 0.6026276422951617
Energy: 0.5613174642080767
Energy: 0.6026276422945678
Energy: 0.5613174642080767
Energy: 0.6026276422951617
Energy: 0.5613174642080767

minimum gb energy = 0.4433858138900201 eV
minimum distance =  2.56498919932544 Angstroms
sigma value = 17


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

Energy: 0.5903276739159379
Energy: 0.4582757373656136
Energy: 0.5903276739159379
Energy: 0.4582757373656136
Energy: 0.5903276739150981
Energy: 0.4582757373656136
Energy: 0.4992373887217772
Energy: 0.5529711269489487
Energy: 0.4992373887217772
Energy: 0.5529711269489487
Energy: 0.4992373887217772
Energy: 0.5529711269481086
Energy: 0.4869109912825421
Energy: 0.5708986081454845
Energy: 0.4869109912825421
Energy: 0.5708986081387655
Energy: 0.4869109912825421
Energy: 0.5708986081471643
Energy: 0.5565239824669104
Energy: 0.5672263536919504
Energy: 0.5565239824669104
Energy: 0.5672263536911105
Energy: 0.5565239824669104
Energy: 0.5672263536911105
Energy: 0.5521569713010777
Energy: 0.5603289026863896
Energy: 0.5521569713010777
Energy: 0.5603289026855688
Energy: 0.5521569713010777
Energy: 0.5603289026863896
Energy: 0.547157732023464
Energy: 0.4939117731511226
Energy: 0.547157732023464
Energy: 0.4939117731511226
Energy: 0.547157732023464
Energy: 0.4939117731519625
Energy: 0.6160269647814306
Energy: 0.5124389624885503
Energy: 0.6160269647814306
Energy: 0.5124389624877105
Energy: 0.6160269647797507
Energy: 0.5124389624885503
Energy: 0.5565989705486387
Energy: 0.5474627432398957
Energy: 0.5565989705486387
Energy: 0.5474627432398957
Energy: 0.5565989705486387
Energy: 0.5474627432398957
Energy: 0.47626480483462597
Energy: 0.5110938254985988
Energy: 0.47626480483462597
Energy: 0.5110938254994388
Energy: 0.47626480483462597
Energy: 0.5110938254994388
Energy: 0.5487819811492352
Energy: 0.5479131375718437
Energy: 0.5487819811500749
Energy: 0.5479131375718437
Energy: 0.5487819811500749
Energy: 0.5479131375718437
Energy: 0.6297149170111845
Energy: 0.49614398391233955
Energy: 0.6297149170103448
Energy: 0.49614398391233955
Energy: 0.6297149170111845
Energy: 0.49614398391233955
Energy: 0.5409682317358172
Energy: 0.5639864170901399
Energy: 0.5409682317358172
Energy: 0.5639864170909797
Energy: 0.5409682317358172
Energy: 0.5639864170901399
Energy: 0.5012453263004291
Energy: 0.5874809414913902
Energy: 0.5012453263054683
Energy: 0.5874809414913902
Energy: 0.5012453263138671
Energy: 0.5874809414913902
Energy: 0.45950095061913404
Energy: 0.49888300094896676
Energy: 0.45950095061913404
Energy: 0.49888300094896676
Energy: 0.4595009506182942
Energy: 0.49888300094896676
Energy: 0.5731777007549971
Energy: 0.5498832832141252
Energy: 0.5731777007558371
Energy: 0.5498832832141252
Energy: 0.5731777007549971
Energy: 0.5498832832141252
Energy: 0.5718327371285058
Energy: 0.599568348145298
Energy: 0.5718327371285058
Energy: 0.5995683481402587
Energy: 0.5718327371285058
Energy: 0.599568348146138
Energy: 0.5756994375628205
Energy: 0.49982568502928887
Energy: 0.5756994375628205
Energy: 0.49982568502928887
Energy: 0.5756994375628205
Energy: 0.49982568502928887

minimum gb energy = 0.4582757373656136 eV
minimum distance =  2.62281195499507 Angstroms
sigma value = 17


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

Energy: 0.5756641572405916
Energy: 0.4353776003166564
Energy: 0.5650987246974065
Energy: 0.4353776003156835
Energy: 0.5756641572396186
Energy: 0.43537760031600775
Energy: 0.5149923814925169
Energy: 0.5577945878961572
Energy: 0.5126225730951323
Energy: 0.5577945878961572
Energy: 0.5149923814925169
Energy: 0.5577945878964815
Energy: 0.48368153930062163
Energy: 0.5621258916938617
Energy: 0.4928899290480981
Energy: 0.562125891695159
Energy: 0.483681539302892
Energy: 0.562125891695159
Energy: 0.5382040800325053
Energy: 0.43866816015549587
Energy: 0.5380295937051349
Energy: 0.43866816015225246
Energy: 0.5382040800344513
Energy: 0.43866816015192817
Energy: 0.5609718782852791
Energy: 0.49027441714629716
Energy: 0.5609718782849547
Energy: 0.4902744171488919
Energy: 0.5609718782849547
Energy: 0.4902744171433782
Energy: 0.4711884462148714
Energy: 0.4733846171141898
Energy: 0.4720128321677099
Energy: 0.47338461757162015
Energy: 0.4711884462194121
Energy: 0.4733846105321348
Energy: 0.5861918336048619
Energy: 0.5068515476578861
Energy: 0.5861918336042132
Energy: 0.5068515476588591
Energy: 0.5861918336042132
Energy: 0.5068515476595078
Energy: 0.5423429363099928
Energy: 0.5161552976259814
Energy: 0.5423429363096683
Energy: 0.5161552976269546
Energy: 0.5423429363096683
Energy: 0.5161552976269546
Energy: 0.48899806590690925
Energy: 0.5476659816853431
Energy: 0.48899806590690925
Energy: 0.5476659731221614
Energy: 0.48899806590788225
Energy: 0.5476659754436923
Energy: 0.4958986034918361
Energy: 0.46429078882763497
Energy: 0.4958986034859981
Energy: 0.46429078882763497
Energy: 0.4958986034856738
Energy: 0.46429078882763497
Energy: 0.5424696217129802
Energy: 0.5048383348881941
Energy: 0.5424696217129802
Energy: 0.5048383348888427
Energy: 0.5424696217123315
Energy: 0.5048383348888427
Energy: 0.46691083784450865
Energy: 0.5510057432568909
Energy: 0.46691083784450865
Energy: 0.5510057432562422
Energy: 0.46691083784580606
Energy: 0.5510057432568909
Energy: 0.5466805237076274
Energy: 0.5084321948122396
Energy: 0.5466805237076274
Energy: 0.5084321947973202
Energy: 0.5466805237086004
Energy: 0.5084321947973202
Energy: 0.5711319651987559
Energy: 0.47749527722724533
Energy: 0.5711319651984315
Energy: 0.4774952772265967
Energy: 0.5711319652010262
Energy: 0.4774952772265967
Energy: 0.5292452882577882
Energy: 0.5473649168772439
Energy: 0.5279686758515455
Energy: 0.5473649168762709
Energy: 0.5292452882574639
Energy: 0.5473649168769196
Energy: 0.4786457384156183
Energy: 0.5160946607436749
Energy: 0.481990153223671
Energy: 0.5160946607427018
Energy: 0.478645738415294
Energy: 0.5160946607420532
Energy: 0.5900502653421046
Energy: 0.47087157154640624
Energy: 0.5900502653440506
Energy: 0.47087157154575754
Energy: 0.5900502653430777
Energy: 0.47087157154575754
Energy: 0.5527083068671099
Energy: 0.5232121883232373
Energy: 0.5527083068242976
Energy: 0.523212188324859
Energy: 0.5527083068765156
Energy: 0.523212188324859
Energy: 0.515113814898956
Energy: 0.5641951954507142
Energy: 0.5151138149287654
Energy: 0.5641951954516872
Energy: 0.5151138148996046
Energy: 0.5641951954516872
Energy: 0.4962414782971763
Energy: 0.4470757413062824
Energy: 0.49624147829750065
Energy: 0.4470757413079041
Energy: 0.496241478296852
Energy: 0.44707574130693106
Energy: 0.5348806749613778
Energy: 0.5506689932144191
Energy: 0.5348806749613778
Energy: 0.550668993215392
Energy: 0.5348806749604047
Energy: 0.550668993215392
Energy: 0.5197712483799073
Energy: 0.5232363567570241
Energy: 0.519771248382502
Energy: 0.5232363567583214
Energy: 0.5197712483818533
Energy: 0.5232363567583214
Energy: 0.48214078498810836
Energy: 0.452753133950932
Energy: 0.4821408861152669
Energy: 0.4527531339525537
Energy: 0.48214069787667496
Energy: 0.4527531339525537
Energy: 0.49057395930614045
Energy: 0.5559482734207584
Energy: 0.49057395930549175
Energy: 0.5559482734214071
Energy: 0.49057395930581615
Energy: 0.5559482734214071
Energy: 0.526143325468726
Energy: 0.5454941310731146
Energy: 0.5261433254671043
Energy: 0.545494131075385
Energy: 0.526143325467753
Energy: 0.5454941310757093
Energy: 0.5619710438155042
Energy: 0.4760859493203723
Energy: 0.5547091186086924
Energy: 0.47608594932102094
Energy: 0.5619710438158285
Energy: 0.47608594932102094
Energy: 0.5527367171079883
Energy: 0.5059711481494827
Energy: 0.5367789067590142
Energy: 0.5059711481485097
Energy: 0.5527367171089614
Energy: 0.505971148151753
Energy: 0.48429725711100463
Energy: 0.5486377692589095
Energy: 0.4902715389279349
Energy: 0.5486377692728264
Energy: 0.4842972571113289
Energy: 0.5486377692718829
Energy: 0.5389825805066443
Energy: 0.5208450131215485
Energy: 0.5391071039642901
Energy: 0.5208450131218729
Energy: 0.5389825805053471
Energy: 0.5208450131218729
Energy: 0.4888988088308412
Energy: 0.4640137840786915
Energy: 0.48889880882697867
Energy: 0.4640137840806374
Energy: 0.48889880883343595
Energy: 0.4640137840806374
Energy: 0.5097146187356085
Energy: 0.6003918602079025
Energy: 0.5097146187356085
Energy: 0.6003918602082268
Energy: 0.5097146187346355
Energy: 0.6003918602059565
Energy: 0.5229833887329824
Energy: 0.5330060909974481
Energy: 0.5229833887342797
Energy: 0.5330060909958264
Energy: 0.5229833887346041
Energy: 0.5330060909958264
Energy: 0.5781060853271975
Energy: 0.4910276069441592
Energy: 0.5781060853271975
Energy: 0.49102760694448355
Energy: 0.5781060853271975
Energy: 0.49102760694480785
Energy: 0.4614852539434135
Energy: 0.5277201176000965
Energy: 0.4614852539450352
Energy: 0.5277201176007451
Energy: 0.4614852539456838
Energy: 0.5277201176010694
Energy: 0.547880600847521
Energy: 0.4907411921569622
Energy: 0.5478806008488183
Energy: 0.49074119215858386
Energy: 0.5478806008491427
Energy: 0.49074119215598916
Energy: 0.5382010892017212
Energy: 0.506529568388987
Energy: 0.5382010892013968
Energy: 0.5065295683902844
Energy: 0.538201089200748
Energy: 0.506529568388987
Energy: 0.46492880674919884
Energy: 0.5361432583789955
Energy: 0.4649288067482258
Energy: 0.5361432583796442
Energy: 0.4649288067466042
Energy: 0.5361432583786713
Energy: 0.525777828239471
Energy: 0.5517364926257449
Energy: 0.5257778282397952
Energy: 0.5517364926263936
Energy: 0.5257778282401196
Energy: 0.5517364926263936
Energy: 0.5650987246964335
Energy: 0.4353776003166564
Energy: 0.5650987246974065
Energy: 0.4353776003156835
Energy: 0.5650987246970822
Energy: 0.43537760031600775
Energy: 0.5126225730941593
Energy: 0.5641608298496555
Energy: 0.5126225730944836
Energy: 0.564160829819522
Energy: 0.5126225730938349
Energy: 0.5641608297627633
Energy: 0.4881898483129638
Energy: 0.5458600425650555
Energy: 0.48863107462837585
Energy: 0.5458600425686232
Energy: 0.4881898483119908
Energy: 0.5458600425686232
Energy: 0.5366099096631325
Energy: 0.45196081217548006
Energy: 0.5366152214825093
Energy: 0.45196081217320966
Energy: 0.5366099096621596
Energy: 0.45196081217742606
Energy: 0.5609718782852791
Energy: 0.5206077284489632
Energy: 0.5609718782849547
Energy: 0.5206077284473415
Energy: 0.5609718782846304
Energy: 0.5206077284492876

minimum gb energy = 0.4353776003156835 eV
minimum distance =  2.5419613680339 Angstroms
sigma value = 57


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

Energy: 0.5384356939242217
Energy: 0.39659991548665857
Energy: 0.5384356939236937
Energy: 0.3965999154850743
Energy: 0.5384356939236937
Energy: 0.3965999154861305
Energy: 0.445098937047659
Energy: 0.4740900438128738
Energy: 0.4450989370466028
Energy: 0.47409004382660425
Energy: 0.445098937047659
Energy: 0.4740900438118176
Energy: 0.4392106403196458
Energy: 0.49851924431671313
Energy: 0.4392106403201739
Energy: 0.49851924431618505
Energy: 0.4392106403207019
Energy: 0.49851924431671313
Energy: 0.509093324950233
Energy: 0.4473891175680497
Energy: 0.5090933249507611
Energy: 0.4473891175680497
Energy: 0.5090933249507611
Energy: 0.4473891175680497
Energy: 0.4977115326014826
Energy: 0.47233207002895705
Energy: 0.4977115326009545
Energy: 0.47233207004532796
Energy: 0.4977115326014826
Energy: 0.47233207002631655
Energy: 0.4240648823426556
Energy: 0.4784194193515707
Energy: 0.4240648823426556
Energy: 0.47841941935315496
Energy: 0.4240648823426556
Energy: 0.4784194193462897
Energy: 0.4934382757025976
Energy: 0.4639217980225697
Energy: 0.49343827570312565
Energy: 0.46392179802098543
Energy: 0.4934382757025976
Energy: 0.46392179802204164
Energy: 0.4832582164068518
Energy: 0.4917612419554698
Energy: 0.4832582164068518
Energy: 0.4917612419559979
Energy: 0.4832582164073798
Energy: 0.4917612419544136
Energy: 0.44514963148247993
Energy: 0.44866502515884704
Energy: 0.445149631483008
Energy: 0.4486650251340746
Energy: 0.445149631483008
Energy: 0.4486650251150632
Energy: 0.48173119902484646
Energy: 0.4542805448458395
Energy: 0.4817311990222059
Energy: 0.45428054484531144
Energy: 0.48173119902379025
Energy: 0.4542805448458395
Energy: 0.49377363362829735
Energy: 0.5191906387118179
Energy: 0.4937736336267131
Energy: 0.519190638712346
Energy: 0.4937736336277692
Energy: 0.5191906387118179
Energy: 0.41411297168117484
Energy: 0.5184407029938137
Energy: 0.41411297168117484
Energy: 0.5184407029980385
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Energy: 0.5184407029938137
Energy: 0.4750515653117583
Energy: 0.442010184131508
Energy: 0.4750515653128145
Energy: 0.44201018413097987
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Energy: 0.5331509238624839
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Energy: 0.4789841552659667
Energy: 0.5331509238619558
Energy: 0.47898415526755106
Energy: 0.42980813965109854
Energy: 0.5198395226551642
Energy: 0.42980813965109854
Energy: 0.5198395226546362
Energy: 0.4298081396516267
Energy: 0.5198395226546362
Energy: 0.49533316468801275
Energy: 0.49437323162549013
Energy: 0.4953331646890689
Energy: 0.49437323162760255
Energy: 0.4953331646890689
Energy: 0.49437323162549013
Energy: 0.5127338883166147
Energy: 0.46838604438541886
Energy: 0.5127338883208394
Energy: 0.4683860443885874
Energy: 0.5127338883192551
Energy: 0.46838604438911546
Energy: 0.47705323433101543
Energy: 0.5182529856454164
Energy: 0.47705323433207164
Energy: 0.5182529856448883
Energy: 0.4770532343315435
Energy: 0.5182529856454164
Energy: 0.4671209183341436
Energy: 0.5248549204649436
Energy: 0.4671209183341436
Energy: 0.5248549204644155
Energy: 0.4671209183341436
Energy: 0.5248549204644155
Energy: 0.4646112397012958
Energy: 0.42394876394578235
Energy: 0.4646112396843968
Energy: 0.42394876394578235
Energy: 0.4646112396796439
Energy: 0.42394876394578235
Energy: 0.4824773260550286
Energy: 0.497844922286364
Energy: 0.48247732605555665
Energy: 0.4978449222858359
Energy: 0.48247732605555665
Energy: 0.4978449222858359
Energy: 0.4487400662472229
Energy: 0.5143277181396766
Energy: 0.44874006624669477
Energy: 0.5143277181391486
Energy: 0.44874006624669477
Energy: 0.5143277181386204
Energy: 0.4021460445128598
Energy: 0.41322894419468015
Energy: 0.40214604441679447
Energy: 0.41322894419468015
Energy: 0.4021460444663874
Energy: 0.41322894419468015
Energy: 0.469125571796569
Energy: 0.535419797819585
Energy: 0.46912557179920944
Energy: 0.5354197978201131
Energy: 0.4691255717976252
Energy: 0.5354197978201131
Energy: 0.48423787047749217
Energy: 0.48790984250428476
Energy: 0.48423787047749217
Energy: 0.48790984250322855
Energy: 0.48423787047590794
Energy: 0.48790984250481284
Energy: 0.5023760290886311
Energy: 0.4131472684358797
Energy: 0.5023760290891592
Energy: 0.4131472684358797
Energy: 0.5023760290886311
Energy: 0.4131472684358797
Energy: 0.428322892294235
Energy: 0.5776441261296683
Energy: 0.42832289229317877
Energy: 0.5776441261296683
Energy: 0.42832289229845977
Energy: 0.5776441261291402

minimum gb energy = 0.3965999154850743 eV
minimum distance =  2.55230158279539 Angstroms
sigma value = 43


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

Energy: 0.49538528106955043
Energy: 0.37727724205362106
Energy: 0.49538528106955043
Energy: 0.37727724205439056
Energy: 0.49538528106955043
Energy: 0.3772772420540058
Energy: 0.40919929840093705
Energy: 0.4347751915774283
Energy: 0.4091992984001675
Energy: 0.43477519157704353
Energy: 0.4091992984013218
Energy: 0.43477519157704353
Energy: 0.37772772392813736
Energy: 0.407474795338017
Energy: 0.37772772392813736
Energy: 0.40747480403387026
Energy: 0.37772772392813736
Energy: 0.4074747973479624
Energy: 0.45848803454502424
Energy: 0.39379429432180924
Energy: 0.4584880345392527
Energy: 0.39379429432180924
Energy: 0.4584880345477177
Energy: 0.39379429432142443
Energy: 0.4284775374507637
Energy: 0.42640386561463417
Energy: 0.4284775374392205
Energy: 0.4264038654738425
Energy: 0.4284775374426835
Energy: 0.42640386562344895
Energy: 0.3694617257344226
Energy: 0.41466751105432803
Energy: 0.3694617257344226
Energy: 0.41466750906558003
Energy: 0.3694617257340379
Energy: 0.41466751115010136
Energy: 0.44719093945891597
Energy: 0.40567509519080047
Energy: 0.4471909394623789
Energy: 0.40567509519080047
Energy: 0.4471909394643027
Energy: 0.40567509519233946
Energy: 0.47694283654115444
Energy: 0.44342458967936627
Energy: 0.47694283654115444
Energy: 0.4434245896855227
Energy: 0.4769428365407697
Energy: 0.443424589688216
Energy: 0.35824510872124493
Energy: 0.4149403503808092
Energy: 0.3582451087208602
Energy: 0.4149403503827331
Energy: 0.35824510872124493
Energy: 0.414940350381194
Energy: 0.47471495055128926
Energy: 0.39793470123525787
Energy: 0.47471495055013485
Energy: 0.3979347012356427
Energy: 0.47471495054859586
Energy: 0.3979347012360274
Energy: 0.42470598650827407
Energy: 0.4459092935651218
Energy: 0.42470598650827407
Energy: 0.44590929356589143
Energy: 0.4247059865078893
Energy: 0.44590929356589143
Energy: 0.3784677004240451
Energy: 0.41324259218234816
Energy: 0.3784677004244299
Energy: 0.41324259218042425
Energy: 0.37846770042366035
Energy: 0.4132425921815786
Energy: 0.46257620198659416
Energy: 0.3834042042206856
Energy: 0.46257620197659016
Energy: 0.3834042042206856
Energy: 0.46257620187508014
Energy: 0.3834042042206856
Energy: 0.4367637526764039
Energy: 0.4344389094796148
Energy: 0.43676375267563433
Energy: 0.4344389094799996
Energy: 0.4367637526752496
Energy: 0.43443890948076913
Energy: 0.38383272392386464
Energy: 0.4712550040679949
Energy: 0.38383272392424944
Energy: 0.47125500408300103
Energy: 0.38383272392463424
Energy: 0.47125500406568627
Energy: 0.41959915650133506
Energy: 0.3669221592184383
Energy: 0.41959915650133506
Energy: 0.36692215921882304
Energy: 0.41959915650133506
Energy: 0.36692215921882304
Energy: 0.468788203277278
Energy: 0.4354482208209557
Energy: 0.4687882032795867
Energy: 0.4354482208205709
Energy: 0.4687882032668891
Energy: 0.4354482208205709
Energy: 0.36667519669097676
Energy: 0.45647141174639044
Energy: 0.36667519669290055
Energy: 0.4564714117456209
Energy: 0.36667519669136156
Energy: 0.4564714117456209
Energy: 0.420464202580886
Energy: 0.3831864486513415
Energy: 0.420464202580886
Energy: 0.3831864486505719
Energy: 0.420464202582425
Energy: 0.3831864486594217
Energy: 0.47359094788800277
Energy: 0.43051297829626517
Energy: 0.47359094788800277
Energy: 0.4305129782978042
Energy: 0.47359094788800277
Energy: 0.4305129782970347
Energy: 0.3832206336452345
Energy: 0.47177681947736394
Energy: 0.3832206336452345
Energy: 0.4717768194792879
Energy: 0.38322063364561926
Energy: 0.4717768194819813
Energy: 0.44723225535840105
Energy: 0.39385798568149133
Energy: 0.44723225536840516
Energy: 0.3938579856657156
Energy: 0.447232255356862
Energy: 0.39385798570146446
Energy: 0.4391229297516018
Energy: 0.38653253579873365
Energy: 0.43912292812894715
Energy: 0.38653253579911845
Energy: 0.4391229288654712
Energy: 0.38653253579796415
Energy: 0.4451648414211789
Energy: 0.46893721198206045
Energy: 0.4451648414207941
Energy: 0.4689372119785975
Energy: 0.4451648414211789
Energy: 0.46893721197821275
Energy: 0.419434153429199
Energy: 0.4410366178447809
Energy: 0.4194341534476681
Energy: 0.4410366178236534
Energy: 0.41943415341922996
Energy: 0.4410366178201905
Energy: 0.441066217806424
Energy: 0.3724657972933514
Energy: 0.44106621782489314
Energy: 0.37246579728873397
Energy: 0.4410662179429483
Energy: 0.3724657972902731
Energy: 0.3655144984196914
Energy: 0.44967902528243325
Energy: 0.37267996772876294
Energy: 0.44967902005414767
Energy: 0.37267908207052114
Energy: 0.4496790206906659
Energy: 0.3952923380614335
Energy: 0.4569018552721504
Energy: 0.39529233806220304
Energy: 0.4569018552721504
Energy: 0.3952923380618183
Energy: 0.4569018552717656
Energy: 0.4323237119596187
Energy: 0.35756637912330536
Energy: 0.4323237119603883
Energy: 0.35756637912330536
Energy: 0.4323237119596187
Energy: 0.35756637912330536
Energy: 0.405445726682673
Energy: 0.44265885301566416
Energy: 0.405445726682673
Energy: 0.44265885301566416
Energy: 0.405445726682673
Energy: 0.44265885301604896
Energy: 0.406852682363293
Energy: 0.4660107601766553
Energy: 0.40685268236290817
Energy: 0.4660107601766553
Energy: 0.40685268236367783
Energy: 0.4660107601762706
Energy: 0.41086687459960164
Energy: 0.35057419235288645
Energy: 0.4108668745672808
Energy: 0.35057419235288645
Energy: 0.41086687462842464
Energy: 0.35057419235288645
Energy: 0.3926352277635137
Energy: 0.47006459584504545
Energy: 0.3926352277715939
Energy: 0.4700645958343068
Energy: 0.3926352277642832
Energy: 0.47006459583507637
Energy: 0.450612334413232
Energy: 0.43028647097441297
Energy: 0.4506123345232069
Energy: 0.43028647097441297
Energy: 0.4506123343451273
Energy: 0.4302864709747978
Energy: 0.42261293967581454
Energy: 0.37306704352638387
Energy: 0.4226129396738907
Energy: 0.37306704352522957
Energy: 0.42261293967658403
Energy: 0.37306704352522957
Energy: 0.36259305492709226
Energy: 0.46399514619717896
Energy: 0.36259305492709226
Energy: 0.4639951461979485
Energy: 0.36259305492786176
Energy: 0.4639951461998723

minimum gb energy = 0.35057419235288645 eV
minimum distance =  2.56981208094226 Angstroms
sigma value = 81


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

Energy: 0.15912137060681633
Energy: 0.17875793246911592
Energy: 0.08316339406407437
Energy: 0.1787579324692605
Energy: 0.1591213706069609
Energy: 0.17875793246897131
Energy: 0.3285211215910548
Energy: 0.08416457674473346
Energy: 0.32852112159147256
Energy: 0.08416457672932688
Energy: 0.3285211215910548
Energy: 0.08416457677143394
Energy: 0.3441889257296659
Energy: 0.0834368629445061
Energy: 0.3441889257296659
Energy: 0.0834368629445061
Energy: 0.3441889257296659
Energy: 0.0834368629440884
Energy: 0.08316339406407437
Energy: 0.1787579324692605
Energy: 0.08316339406407437
Energy: 0.1787579324692605
Energy: 0.08316339406407437
Energy: 0.17875793246884283
Energy: 0.3285211215910548
Energy: 0.08416457702438158
Energy: 0.3285211215913279
Energy: 0.08416457708416045
Energy: 0.3285211215910548
Energy: 0.08416457705731538
Energy: 0.3441889257296659
Energy: 0.0834368629440884
Energy: 0.34418892572924825
Energy: 0.08343686294394383
Energy: 0.3441889257298106
Energy: 0.08343686294394383
Energy: 0.15912137060654322
Energy: 0.1787579324696782
Energy: 0.08316339406421897
Energy: 0.17875793246954966
Energy: 0.15912137060667175
Energy: 0.1787579324692605
Energy: 0.32852112159091024
Energy: 0.08416457771412782
Energy: 0.32852112159091024
Energy: 0.08416457765944163
Energy: 0.32852112159091024
Energy: 0.08416457768119401
Energy: 0.34418892572924825
Energy: 0.08343686294436152
Energy: 0.3441889257288145
Energy: 0.0834368629445061
Energy: 0.34418892572937676
Energy: 0.08343686294394383
Energy: 0.08316339406407437
Energy: 0.17875793246911592
Energy: 0.08316339406407437
Energy: 0.1787579324692605
Energy: 0.08316339406421897
Energy: 0.17875793246911592

minimum gb energy = 0.08316339406407437 eV
minimum distance =  2.78836626240064 Angstroms
sigma value = 3


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

Energy: 0.4398933688811385
Energy: 0.39825137983411485
Energy: 0.43989336883588964
Energy: 0.39825137983411485
Energy: 0.4398933692778021
Energy: 0.39825137983411485
Energy: 0.3874932973413937
Energy: 0.43650173284763566
Energy: 0.3874932973413937
Energy: 0.4365017328480587
Energy: 0.3874932973422399
Energy: 0.43650173284763566
Energy: 0.4438462246002862
Energy: 0.41353936654019496
Energy: 0.42592252804602543
Energy: 0.41353936654019496
Energy: 0.4259225282769237
Energy: 0.4135393665397719
Energy: 0.4163565721567567
Energy: 0.3924035716283096
Energy: 0.41635657215633365
Energy: 0.3924035716270404
Energy: 0.41635657215633365
Energy: 0.3924035716261944
Energy: 0.3969924774453919
Energy: 0.4408956558545459
Energy: 0.3969924774441227
Energy: 0.44089565586089186
Energy: 0.39699247744369964
Energy: 0.4408956558558151
Energy: 0.43164163933362004
Energy: 0.42837743542644363
Energy: 0.4316416393344662
Energy: 0.42837743542602064
Energy: 0.43164163933404315
Energy: 0.4283774354251745
Energy: 0.4365231068686401
Energy: 0.4292679265961722
Energy: 0.43652310686779394
Energy: 0.4292679265961722
Energy: 0.43652310686567863
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Energy: 0.3951089664670726
Energy: 0.4654464719788737
Energy: 0.3951089664674956
Energy: 0.4654464719792968
Energy: 0.3951089664670726
Energy: 0.46544647197802763
Energy: 0.4364544886228688
Energy: 0.4297447958704771
Energy: 0.4364544886228688
Energy: 0.42974479586963105
Energy: 0.4364544886228688
Energy: 0.42974479587005404
Energy: 0.4338765992858947
Energy: 0.3856256342973914
Energy: 0.43387659927702954
Energy: 0.3856256342969682
Energy: 0.4338765992837795
Energy: 0.3856256343045835
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Energy: 0.44076994782699574
Energy: 0.4131029942736099
Energy: 0.4407699478248805
Energy: 0.41310299426895625
Energy: 0.44076994782741885
Energy: 0.4340561845231654
Energy: 0.44216617330917435
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Energy: 0.43405618452274236
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Energy: 0.44333462591470524
Energy: 0.39621754049338054
Energy: 0.4433346259595311
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Energy: 0.4035068719982124
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Energy: 0.40350687199736623
Energy: 0.4043186246283364
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Energy: 0.4043186246397592
Energy: 0.42571480253939287
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Energy: 0.4257148025389698
Energy: 0.44017862355588655
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Energy: 0.3932387098585555
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Energy: 0.43241537162077914
Energy: 0.4248667101613979
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Energy: 0.40110119623804963
Energy: 0.43123896639611664
Energy: 0.4011011962376265
Energy: 0.4312389663948475
Energy: 0.40110119623847273
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Energy: 0.4317598180568946
Energy: 0.4467134068700329
Energy: 0.431760495850156
Energy: 0.4467134068700329
Energy: 0.43176022587581625
Energy: 0.4275707731057977
Energy: 0.40740052517011405
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Energy: 0.43333970392538324
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Energy: 0.47612307105262236
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Energy: 0.4112911025332577
Energy: 0.42504551502599464
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Energy: 0.41730710817285493
Energy: 0.4254104644890708
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Energy: 0.43698053277850823
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Energy: 0.43698053274679743
Energy: 0.37445917864867595
Energy: 0.43698053286012173
Energy: 0.4366729128665863
Energy: 0.3911513072985334
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Energy: 0.39115130729514896
Energy: 0.4366729128640479
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Energy: 0.41703546727532453
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Energy: 0.35882135831146106
Energy: 0.4243393971732217
Energy: 0.35882135831188405
Energy: 0.42433939717279856
Energy: 0.35882135831146106
Energy: 0.4243393971706833
Energy: 0.44500519017426104
Energy: 0.41104372838636344
Energy: 0.4450051902343172
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Energy: 0.44500519019456825
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Energy: 0.4040741055530007
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Energy: 0.38101708840917053
Energy: 0.43922521804892334
Energy: 0.38101708840917053
Energy: 0.43922521804850023
Energy: 0.38101708840917053
Energy: 0.43922521804850023
Energy: 0.4011712889225757
Energy: 0.40084512481868156
Energy: 0.4011712889225757
Energy: 0.40084512481698925
Energy: 0.4011712889225757
Energy: 0.4008451248115086

minimum gb energy = 0.35882135831146106 eV
minimum distance =  2.63375965623397 Angstroms
sigma value = 67


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

Energy: 0.5226239868446898
Energy: 0.5027984524657125
Energy: 0.5226239868115345
Energy: 0.5027984524657125
Energy: 0.5226239868115345
Energy: 0.5027984524657125
Energy: 0.4710270123470493
Energy: 0.5043872144925602
Energy: 0.47102701235187194
Energy: 0.5043872144919574
Energy: 0.4710270123530775
Energy: 0.5043872144937659
Energy: 0.48799628350157476
Energy: 0.47382804198900924
Energy: 0.48799628351242563
Energy: 0.4738280419896121
Energy: 0.487996283500972
Energy: 0.47382804198840645
Energy: 0.48114819221448774
Energy: 0.4453338741860116
Energy: 0.48114819215664417
Energy: 0.44533387418661446
Energy: 0.4811481923404228
Energy: 0.44533387418661446
Energy: 0.47200861942336003
Energy: 0.4976158983000327
Energy: 0.47200861942336003
Energy: 0.4976158983187203
Energy: 0.47200861942336003
Energy: 0.49761589829400454
Energy: 0.4855176739907075
Energy: 0.5064155901235554
Energy: 0.4855176739828708
Energy: 0.5064155901235554
Energy: 0.4855176739810624
Energy: 0.5064155901235554
Energy: 0.4798020382349605
Energy: 0.46810540151985514
Energy: 0.47980203826630724
Energy: 0.46810540151985514
Energy: 0.4798020381578266
Energy: 0.46810540151985514
Energy: 0.5112355381470071
Energy: 0.4968707847422968
Energy: 0.5112355381488156
Energy: 0.4968707847435025
Energy: 0.5112355381482128
Energy: 0.4968707847428996
Energy: 0.48075963307149266
Energy: 0.5245071527873633
Energy: 0.4807596330696842
Energy: 0.5245071527873633
Energy: 0.4807596330690814
Energy: 0.5245071527879661
Energy: 0.4716776106685823
Energy: 0.4808068604688112
Energy: 0.4716776106691851
Energy: 0.4808068604682084
Energy: 0.4716776106697879
Energy: 0.4808068604676056
Energy: 0.4866113038539674
Energy: 0.4732356011880257
Energy: 0.4866113038533646
Energy: 0.4732356011940539
Energy: 0.4866113038527617
Energy: 0.4732356011886285
Energy: 0.4693629151993294
Energy: 0.5024571890213633
Energy: 0.4693629151987265
Energy: 0.5024571890201577
Energy: 0.4693629151987265
Energy: 0.5024571890291999
Energy: 0.46906914403526256
Energy: 0.4647892169080803
Energy: 0.46906914403526256
Energy: 0.4647892169074775
Energy: 0.4690691440340569
Energy: 0.4647892169080803
Energy: 0.4705127015166028
Energy: 0.49252743886088
Energy: 0.4705127015166028
Energy: 0.4925274388614828
Energy: 0.47051270151720564
Energy: 0.4925274388614828
Energy: 0.457303047705431
Energy: 0.48028854546564376
Energy: 0.4573030476283245
Energy: 0.48028854461845927
Energy: 0.45730304769099067
Energy: 0.4802885451119515
Energy: 0.4872050763410948
Energy: 0.5157821743892628
Energy: 0.48720507634049187
Energy: 0.5157821743892628
Energy: 0.48720507634049187
Energy: 0.5157821743898656
Energy: 0.44496323362400353
Energy: 0.5273725407524348
Energy: 0.44496323362400353
Energy: 0.5273725407512292
Energy: 0.44496323362400353
Energy: 0.5273725407506263
Energy: 0.4648121884545289
Energy: 0.44434625410957296
Energy: 0.4648121126507219
Energy: 0.4443462541083673
Energy: 0.46481205715002455
Energy: 0.44434625410957296
Energy: 0.46770140296227414
Energy: 0.5100303308931156
Energy: 0.46770140296167134
Energy: 0.5100303308931156
Energy: 0.46770140296167134
Energy: 0.5100303308931156
Energy: 0.48345883899977266
Energy: 0.48205836330409657
Energy: 0.48345883899977266
Energy: 0.48205836330228813
Energy: 0.48345883899977266
Energy: 0.4820583633034938
Energy: 0.5017696709308133
Energy: 0.441489777647669
Energy: 0.5017696709561317
Energy: 0.4414897776470662
Energy: 0.5017696709302105
Energy: 0.44148977764824443
Energy: 0.4959636617199929
Energy: 0.5264243232733129
Energy: 0.49596366183146035
Energy: 0.5264243232733129
Energy: 0.4959636618332688
Energy: 0.5264243232733129
Energy: 0.4543451450363452
Energy: 0.5409688839734782
Energy: 0.4543451450363452
Energy: 0.5409688839728752
Energy: 0.48006558237545666
Energy: 0.5409688839734782

minimum gb energy = 0.4414897776470662 eV
minimum distance =  2.64129474463916 Angstroms
sigma value = 33


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

Energy: 0.563300565797828
Energy: 0.4741351476265686
Energy: 0.5633005657894494
Energy: 0.4741351476261862
Energy: 0.5633005658005049
Energy: 0.4741351476261862
Energy: 0.49452020585377965
Energy: 0.5091683492186355
Energy: 0.49452020585798623
Energy: 0.509168349230873
Energy: 0.4945202058541621
Energy: 0.5091683491953428
Energy: 0.5425153606017556
Energy: 0.5158312585715892
Energy: 0.5425153606017556
Energy: 0.5158312585715892
Energy: 0.542515360602138
Energy: 0.5158312585715892
Energy: 0.5707843933404307
Energy: 0.4743723198911391
Energy: 0.5707843933404307
Energy: 0.4743723198907567
Energy: 0.5707843933404307
Energy: 0.4743723198911391
Energy: 0.48737660474659045
Energy: 0.5620057513282556
Energy: 0.4873766047446784
Energy: 0.5620057513278731
Energy: 0.48737660474582567
Energy: 0.5620057513278731
Energy: 0.5674444040935505
Energy: 0.5400667484179769
Energy: 0.5674444040935505
Energy: 0.54166992795012
Energy: 0.5674444040939328
Energy: 0.5416699278969637
Energy: 0.5542584833100856
Energy: 0.522860745682678
Energy: 0.5542584833100856
Energy: 0.522860745682678
Energy: 0.5542584833097033
Energy: 0.5228607456822956
Energy: 0.5342009621113696
Energy: 0.538011249759062
Energy: 0.5342009621113696
Energy: 0.5380112497567674
Energy: 0.5342009621113696
Energy: 0.5380112497598268
Energy: 0.5084062647046323
Energy: 0.5730262398175783
Energy: 0.5084062647046323
Energy: 0.5730262398175783
Energy: 0.5084062647046323
Energy: 0.5730262398179606
Energy: 0.5996141751354745
Energy: 0.517457945610313
Energy: 0.5996141751282086
Energy: 0.5303349289185694
Energy: 0.599614175128591
Energy: 0.5169593949052765
Energy: 0.5113395760833241
Energy: 0.5580794370149871
Energy: 0.5113395760833241
Energy: 0.5580794370157519
Energy: 0.5113395760833241
Energy: 0.5580794370149871
Energy: 0.48945176692054865
Energy: 0.48780793605307743
Energy: 0.48945176692284315
Energy: 0.4878079362644508
Energy: 0.489451766934281
Energy: 0.4878079360076044
Energy: 0.5782320540496311
Energy: 0.4916554410509146
Energy: 0.5782320540496311
Energy: 0.4916554410509146
Energy: 0.5782320540500135
Energy: 0.4916554410505322
Energy: 0.5235406134159132
Energy: 0.5666919122968714
Energy: 0.5235406134159132
Energy: 0.5666919122972538
Energy: 0.5235406134162955
Energy: 0.566691912296489
Energy: 0.5681312886449477
Energy: 0.49840752405582006
Energy: 0.5681312886453301
Energy: 0.49840752405582006
Energy: 0.5681312886453301
Energy: 0.49840752405543765
Energy: 0.5365374625421895
Energy: 0.5215053724720919
Energy: 0.5365374625421895
Energy: 0.5215053724720919
Energy: 0.536537462542572
Energy: 0.5215053724720919
Energy: 0.5342893615143347
Energy: 0.5138982193081084
Energy: 0.5342893615143347
Energy: 0.5138982193081084
Energy: 0.5342893615143347
Energy: 0.5138982193081084
Energy: 0.5751790793798125
Energy: 0.531942309991474
Energy: 0.5751790793790477
Energy: 0.531942309991474
Energy: 0.5751790793798125
Energy: 0.531942309991474
Energy: 0.5270804590486586
Energy: 0.5325073650723657
Energy: 0.5270804590494234
Energy: 0.5325073650746602
Energy: 0.5270804590494234
Energy: 0.5325073650750427
Energy: 0.5229221071983469
Energy: 0.5139548156000626
Energy: 0.5229221071983469
Energy: 0.5139548155992978
Energy: 0.5229221071983469
Energy: 0.5139548155996801
Energy: 0.5524966054448572
Energy: 0.5175158874205982
Energy: 0.5524966054448572
Energy: 0.5175158874225102
Energy: 0.552496605445622
Energy: 0.5175158874244224
Energy: 0.5561923798035255
Energy: 0.47741701348597737
Energy: 0.5561923798233765
Energy: 0.47741701348597737
Energy: 0.5561923797974068
Energy: 0.477417013485595
Energy: 0.47567664980111923
Energy: 0.5357770982676707
Energy: 0.47567664980150165
Energy: 0.5357770982680531
Energy: 0.47567664980111923
Energy: 0.5357770982676707
Energy: 0.559152807209932
Energy: 0.49680988137326276
Energy: 0.5591528072110792
Energy: 0.49680988137326276
Energy: 0.5591528072110792
Energy: 0.49680988137441007
Energy: 0.5121247402495425
Energy: 0.5508548486832615
Energy: 0.5121247402495425
Energy: 0.5508548486832615
Energy: 0.5121247402495425
Energy: 0.5508548486832615
Energy: 0.4906675461349296
Energy: 0.5466005635950304
Energy: 0.490667546135312
Energy: 0.5466005635950304
Energy: 0.49066754613454716
Energy: 0.5466005635950304
Energy: 0.5164604706660452
Energy: 0.5011257956620131
Energy: 0.5164604706656628
Energy: 0.5011257956616306
Energy: 0.5164604706656628
Energy: 0.5011257956608658
Energy: 0.5568933429422591
Energy: 0.5770531040310128
Energy: 0.5568933429422591
Energy: 0.5418617870805953
Energy: 0.5568933429422591
Energy: 0.5416856927213907
Energy: 0.523764119661152
Energy: 0.5239604619062764
Energy: 0.5237641196607695
Energy: 0.5239604619051291
Energy: 0.5237641196607695
Energy: 0.523960461905894
Energy: 0.5152767151689432
Energy: 0.5308686194266266
Energy: 0.5152767143302985
Energy: 0.5308686194273915
Energy: 0.5152767146410661
Energy: 0.530868619427009
Energy: 0.5716863036186021
Energy: 0.5353921548398578
Energy: 0.5716863036186021
Energy: 0.5353921548452116
Energy: 0.5716863036186021
Energy: 0.5353921548482362
Energy: 0.5393094949752512
Energy: 0.5253398249030409
Energy: 0.5393094949752512
Energy: 0.5253398249034232
Energy: 0.5393094949767807
Energy: 0.5253398249041881
Energy: 0.5343444642293709
Energy: 0.5219032444200455
Energy: 0.5343444642293709
Energy: 0.5219032444200455
Energy: 0.5343444642297533
Energy: 0.5219032444200455
Energy: 0.5008418294398216
Energy: 0.5100932408422298
Energy: 0.5008418295457169
Energy: 0.5100932408422298
Energy: 0.5008418294516767
Energy: 0.5100932408422298
Energy: 0.5234596742691502
Energy: 0.5121245558563625
Energy: 0.5234596742691502
Energy: 0.5121245558563625
Energy: 0.5234596742695327
Energy: 0.51212455585598
Energy: 0.5493727761346344
Energy: 0.49165338454531265
Energy: 0.549372776134252
Energy: 0.4916533845456951
Energy: 0.5493727761346344
Energy: 0.4916533845456951
Energy: 0.4941181976168187
Energy: 0.49899107401659204
Energy: 0.49411819764320564
Energy: 0.4989910740185042
Energy: 0.49411819761796594
Energy: 0.49899107401659204

minimum gb energy = 0.4741351476261862 eV
minimum distance =  2.63157504841417 Angstroms
sigma value = 41


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

Energy: 0.5984160711345349
Energy: 0.5303684744378645
Energy: 0.5984160711345349
Energy: 0.5303684744378645
Energy: 0.5984160711345349
Energy: 0.5303684744368203
Energy: 0.5461686619183839
Energy: 0.5624929480952818
Energy: 0.5461686619173397
Energy: 0.5624929480952818
Energy: 0.5461686619183839
Energy: 0.5624929481192966
Energy: 0.631173156715012
Energy: 0.5672744491514303
Energy: 0.6056170671573256
Energy: 0.5672744491535187
Energy: 0.605617064638982
Energy: 0.5672744491503863
Energy: 0.5813400668719063
Energy: 0.5849503151638275
Energy: 0.5813400668719063
Energy: 0.5849503151638275
Energy: 0.5813400668729505
Energy: 0.5849503151638275
Energy: 0.5959842660860286
Energy: 0.5618294404825963
Energy: 0.5959842660860286
Energy: 0.5618294404825963
Energy: 0.5959842660849847
Energy: 0.5618294404825963
Energy: 0.6351777397297272
Energy: 0.5823211169216631
Energy: 0.6351777397297272
Energy: 0.5823211169279279
Energy: 0.6351777397297272
Energy: 0.5823211169247955
Energy: 0.6917047765239133
Energy: 0.5787836411067911
Energy: 0.6917047765249572
Energy: 0.5787836411067911
Energy: 0.6917047765249572
Energy: 0.5787836411067911
Energy: 0.6042157223380162
Energy: 0.5665157780192778
Energy: 0.6042157223380162
Energy: 0.5665157780182336
Energy: 0.6042157223369721
Energy: 0.5665157780182336
Energy: 0.5482437577401807
Energy: 0.5314114084391369
Energy: 0.5482437577401807
Energy: 0.5314114084380928
Energy: 0.5482437577401807
Energy: 0.5314114084391369
Energy: 0.604185840192601
Energy: 0.542848370945999
Energy: 0.604185840192601
Energy: 0.542848370945999
Energy: 0.604185840193645
Energy: 0.542848370945999
Energy: 0.5467675566182212
Energy: 0.5776509433957437
Energy: 0.5467675566150889
Energy: 0.5776509433957437
Energy: 0.5467675566150889
Energy: 0.5776509433957437
Energy: 0.6187635046131221
Energy: 0.5578524299566564
Energy: 0.6187635046131221
Energy: 0.5578524299577006
Energy: 0.618763504612078
Energy: 0.5578524299566564
Energy: 0.5834412851983753
Energy: 0.5734484587316117
Energy: 0.5834412851983753
Energy: 0.5734484587316117
Energy: 0.5834412851973312
Energy: 0.5734484587316117
Energy: 0.5811544986380603
Energy: 0.5636220529541253
Energy: 0.5811544986380603
Energy: 0.5636220529541253
Energy: 0.5811544986380603
Energy: 0.5636220529541253

minimum gb energy = 0.5303684744368203 eV
minimum distance =  2.5215278817385 Angstroms
sigma value = 11


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

Energy: 0.5959151663374916
Energy: 0.6296757400326356
Energy: 0.5959151663379503
Energy: 0.6296757400326356
Energy: 0.5959151663379503
Energy: 0.6296757400326356
Energy: 0.5939190056804103
Energy: 0.6043117910120168
Energy: 0.5939190056804103
Energy: 0.6043117910120168
Energy: 0.5939190056804103
Energy: 0.6043117910120168
Energy: 0.6138276657328847
Energy: 0.5855632459193609
Energy: 0.6138276657342607
Energy: 0.5855632459189022
Energy: 0.6133225460493603
Energy: 0.5855632459193609
Energy: 0.5965202707563533
Energy: 0.5539521918673906
Energy: 0.5965202707563533
Energy: 0.5539521918673906
Energy: 0.5965202707558946
Energy: 0.5539521918673906
Energy: 0.593679908354989
Energy: 0.5797223632636235
Energy: 0.593679908354989
Energy: 0.5797223632631647
Energy: 0.593679908354989
Energy: 0.5797223632636235
Energy: 0.5851323321137945
Energy: 0.621419139288404
Energy: 0.5851323321128771
Energy: 0.621419139288404
Energy: 0.5851323321151705
Energy: 0.621419139288404
Energy: 0.5811116228974292
Energy: 0.5638373678748808
Energy: 0.5811116228969705
Energy: 0.5638373678748808
Energy: 0.5811116228969705
Energy: 0.5638373678748808
Energy: 0.5697089137697082
Energy: 0.5818098053861849
Energy: 0.5697089137710843
Energy: 0.5818098053866436
Energy: 0.5697089137692496
Energy: 0.5818098053866436
Energy: 0.6058994822306326
Energy: 0.5913177063966889
Energy: 0.6058994822292567
Energy: 0.5913177063962302
Energy: 0.6058994822306326
Energy: 0.5913177063962302
Energy: 0.5767338108827205
Energy: 0.5777081485424678
Energy: 0.5767338108827205
Energy: 0.5777081485429265
Energy: 0.5767338108827205
Energy: 0.5777081485429265
Energy: 0.5555283011011071
Energy: 0.6102667151900049
Energy: 0.5555283011011071
Energy: 0.6102667151900049
Energy: 0.5555283011011071
Energy: 0.6102667151900049
Energy: 0.5899055156439318
Energy: 0.5999731136549732
Energy: 0.5899055156448492
Energy: 0.5999731136526798
Energy: 0.5899055156439318
Energy: 0.5999731136554318
Energy: 0.5968373771046609
Energy: 0.6062628105007908
Energy: 0.5968373771046609
Energy: 0.6062628105007908
Energy: 0.5968373771042023
Energy: 0.6062628105003321
Energy: 0.5942958874844049
Energy: 0.5835574924326264
Energy: 0.5942958874839464
Energy: 0.5835574924326264
Energy: 0.5942958874844049
Energy: 0.5835574924330852
Energy: 0.5618661706853595
Energy: 0.5810859219886658
Energy: 0.5618661706715992
Energy: 0.5810859219882072
Energy: 0.5618661707096487
Energy: 0.5810859219882072
Energy: 0.5804778799945307
Energy: 0.6003349698272188
Energy: 0.5804778799945307
Energy: 0.6003349698272188
Energy: 0.5804778799945307
Energy: 0.6003349698272188
Energy: 0.5885629122051965
Energy: 0.5978896564592447
Energy: 0.5885629122051965
Energy: 0.5978896564578687
Energy: 0.5885629122051965
Energy: 0.5978896563767242
Energy: 0.5981738766961319
Energy: 0.6059249005929734
Energy: 0.5981738826572284
Energy: 0.6059249005888454
Energy: 0.5981738779826223
Energy: 0.6059249005925148
Energy: 0.5919318577596033
Energy: 0.5897730923812792
Energy: 0.5919318577596033
Energy: 0.5897730923812792
Energy: 0.5919318577591448
Energy: 0.5897730923812792
Energy: 0.5903345009701637
Energy: 0.5771272873186926
Energy: 0.5903345009710811
Energy: 0.5771272873186926
Energy: 0.5903345009701637
Energy: 0.5771272873186926
Energy: 0.5662253615203954
Energy: 0.6005916979664055
Energy: 0.5662253615203954
Energy: 0.6005916979668642
Energy: 0.5662253615203954
Energy: 0.6005916979673228
Energy: 0.5917415940565446
Energy: 0.6117964583692337
Energy: 0.5917415940565446
Energy: 0.6117964583701511
Energy: 0.591741594060214
Energy: 0.6117964583701511
Energy: 0.6093822489370143
Energy: 0.5830585367504892
Energy: 0.6093822489365556
Energy: 0.5830585367500305
Energy: 0.6093822489370143
Energy: 0.5830585367500305
Energy: 0.606755257702676
Energy: 0.6101476619454148
Energy: 0.6067552577012999
Energy: 0.6101476619454148
Energy: 0.6067552577095562
Energy: 0.6101476619454148
Energy: 0.5814942315742729
Energy: 0.583945822109289
Energy: 0.5814942315742729
Energy: 0.5839458221088304
Energy: 0.5814942315742729
Energy: 0.583945822109289
Energy: 0.5582351958627715
Energy: 0.6049179906587459
Energy: 0.558235195862313
Energy: 0.6049179906587459
Energy: 0.558235195862313
Energy: 0.6049179906587459
Energy: 0.5876441933219774
Energy: 0.5935118413351093
Energy: 0.5876441933206014
Energy: 0.5935118413351093
Energy: 0.58764419332106
Energy: 0.593511841335568
Energy: 0.6134548454058476
Energy: 0.5856123676453963
Energy: 0.6134548454058476
Energy: 0.5856123676188137
Energy: 0.613454845405389
Energy: 0.5856123676458549
Energy: 0.5675621188626032
Energy: 0.585026205832763
Energy: 0.5675621188626032
Energy: 0.585026205832763
Energy: 0.5675621188621445
Energy: 0.585026205832763
Energy: 0.5769682741465684
Energy: 0.5570633418097841
Energy: 0.5769682741465684
Energy: 0.5570633418093256
Energy: 0.5769682741465684
Energy: 0.5570633418097841
Energy: 0.5765631571486166
Energy: 0.6103190658102847
Energy: 0.5765631571545794
Energy: 0.610319065809826
Energy: 0.5765631571499926
Energy: 0.6103190658093673

minimum gb energy = 0.5539521918673906 eV
minimum distance =  2.50744998131388 Angstroms
sigma value = 57


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

Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5899980342169835
Energy: 0.5688949337965004
Energy: 0.5899980342169835
Energy: 0.5688949337965004
Energy: 0.5899980342169835
Energy: 0.5688949337965004
Energy: 0.5505154846139854
Energy: 0.5347037110701118
Energy: 0.550515484613169
Energy: 0.5347037110701118
Energy: 0.550515484613169
Energy: 0.5347037110701118
Energy: 0.5251360987105548
Energy: 0.5453756684461284
Energy: 0.5251360987105548
Energy: 0.5453756684461284
Energy: 0.5251360987105548
Energy: 0.5453756684461284
Energy: 0.550927038079568
Energy: 0.5347104372295106
Energy: 0.5509270380787518
Energy: 0.5347104372295106
Energy: 0.5509270380787518
Energy: 0.5347104372295106
Energy: 0.5899257561523542
Energy: 0.596278887537128
Energy: 0.5899257561523542
Energy: 0.5554055049157709
Energy: 0.5899257561523542
Energy: 0.5554055049149547
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5899980342161673
Energy: 0.5688949337956842
Energy: 0.5899980342161673
Energy: 0.5688949337956842
Energy: 0.5899980342161673
Energy: 0.5688949337965004
Energy: 0.5505154846123528
Energy: 0.5347037110701118
Energy: 0.5505154846123528
Energy: 0.5347037110701118
Energy: 0.5505154846123528
Energy: 0.5347037110701118
Energy: 0.5251360987113711
Energy: 0.5453756684453122
Energy: 0.5251360987113711
Energy: 0.5453756684461284
Energy: 0.5251360987105548
Energy: 0.5453756684453122
Energy: 0.5509270380803842
Energy: 0.5347104372295106
Energy: 0.550927038079568
Energy: 0.5347104372295106
Energy: 0.5509270380803842
Energy: 0.5347104372295106
Energy: 0.5899257561523542
Energy: 0.5689330128588965
Energy: 0.5899257561523542
Energy: 0.5689330128588965
Energy: 0.5899257561523542
Energy: 0.5689330128588965
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5274848450376829
Energy: 0.5068244478011799
Energy: 0.5899980342161673
Energy: 0.5688949337965004
Energy: 0.5899980342169835
Energy: 0.5688949337965004
Energy: 0.5899980342169835
Energy: 0.5688949337965004
Energy: 0.550515484613169
Energy: 0.5347037110701118
Energy: 0.5505154846139854
Energy: 0.5347037110701118
Energy: 0.5505154846139854
Energy: 0.5347037110701118
Energy: 0.5251360987105548
Energy: 0.5453756684461284
Energy: 0.5251360987105548
Energy: 0.5453756684461284
Energy: 0.5251360987105548
Energy: 0.5453756684461284
Energy: 0.550927038079568
Energy: 0.5347104372295106
Energy: 0.550927038079568
Energy: 0.5347104372295106
Energy: 0.550927038079568
Energy: 0.5347104372295106

minimum gb energy = 0.5068244478011799 eV
minimum distance =  2.55019948176838 Angstroms
sigma value = 9


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

Energy: 0.5762950431573042
Energy: 0.6238788174134221
Energy: 0.5762950431579706
Energy: 0.6238788174134221
Energy: 0.5762950431559714
Energy: 0.6238788174134221
Energy: 0.607240839045766
Energy: 0.5990966788496521
Energy: 0.607240839045766
Energy: 0.5990966788496521
Energy: 0.6072408390450995
Energy: 0.5990966788496521
Energy: 0.6110600311581245
Energy: 0.5909976041485009
Energy: 0.6008275725882181
Energy: 0.5909976041485009
Energy: 0.6110600311581245
Energy: 0.5909976041485009
Energy: 0.5562081751647245
Energy: 0.6224214969881741
Energy: 0.5562081751640582
Energy: 0.6224214969875076
Energy: 0.5562081751640582
Energy: 0.6224214969881741
Energy: 0.5983074134473743
Energy: 0.5599892475211
Energy: 0.5983074134480407
Energy: 0.5599892475211
Energy: 0.5983074134473743
Energy: 0.5599892475257651
Energy: 0.5627295827151201
Energy: 0.6038662441446583
Energy: 0.5627295827151201
Energy: 0.6038662441446583
Energy: 0.562729582716453
Energy: 0.6038662441446583
Energy: 0.5510701527511813
Energy: 0.5931937585076482
Energy: 0.5510701527498485
Energy: 0.5931937585076482
Energy: 0.551070152750515
Energy: 0.5931937585083147
Energy: 0.5723263167514745
Energy: 0.6139445851591555
Energy: 0.5723263167421444
Energy: 0.6139445851591555
Energy: 0.57232631674481
Energy: 0.613944585158489
Energy: 0.6645726591633406
Energy: 0.5707723455634367
Energy: 0.664572659164007
Energy: 0.5707723455621038
Energy: 0.6645726591633406
Energy: 0.5707723455647696
Energy: 0.5545706647009039
Energy: 0.5705816303417451
Energy: 0.5545706647009039
Energy: 0.5705816303424116
Energy: 0.5545706647009039
Energy: 0.5705816303410787
Energy: 0.5869452749068663
Energy: 0.6113588128656476
Energy: 0.5869452749048671
Energy: 0.6113588128643147
Energy: 0.5869452749068663
Energy: 0.6113588128649812
Energy: 0.5912259461847134
Energy: 0.5601185510745879
Energy: 0.5912259461853799
Energy: 0.5601185510739215
Energy: 0.5912259461853799
Energy: 0.5601185510739215
Energy: 0.5945671986426907
Energy: 0.6188361918053464
Energy: 0.5945671986426907
Energy: 0.6188361918060129
Energy: 0.5945671986426907
Energy: 0.6188361918060129
Energy: 0.6033265362553966
Energy: 0.5663062883783371
Energy: 0.6033265362553966
Energy: 0.56630628837967
Energy: 0.6033265362553966
Energy: 0.5663062883770043
Energy: 0.5894349730438396
Energy: 0.6115286384973811
Energy: 0.5894349730438396
Energy: 0.6115286384980476
Energy: 0.5894349730438396
Energy: 0.6115286384973811
Energy: 0.5676511947078099
Energy: 0.6152437927466822
Energy: 0.5676511947198059
Energy: 0.6152437927466822
Energy: 0.5676511946871501
Energy: 0.6152437927473486
Energy: 0.6404155734853301
Energy: 0.5624354128783274
Energy: 0.6404155734853301
Energy: 0.5624354128829622
Energy: 0.6404155734859965
Energy: 0.562435412876328
Energy: 0.6073210218527512
Energy: 0.5921384283863854
Energy: 0.6073210218520847
Energy: 0.5921384283863854
Energy: 0.6073210218520847
Energy: 0.5921384283863854
Energy: 0.5496594315956941
Energy: 0.6221443345747267
Energy: 0.5496594315956941
Energy: 0.6221443345740603
Energy: 0.5496594315956941
Energy: 0.6221443345740603
Energy: 0.5897609182702518
Energy: 0.6218344791637351
Energy: 0.5897609182702518
Energy: 0.6218344791637351
Energy: 0.5897609182695854
Energy: 0.6218344791637351
Energy: 0.5804055323622448
Energy: 0.5581718131913426
Energy: 0.5804055323622448
Energy: 0.5581718131933419
Energy: 0.5804055323622448
Energy: 0.5581718131880103

minimum gb energy = 0.5496594315956941 eV
minimum distance =  2.56464406271473 Angstroms
sigma value = 27


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

Energy: 0.6325049536278273
Energy: 0.6096579081647975
Energy: 0.6325049536278273
Energy: 0.6096579081647975
Energy: 0.6325049536278273
Energy: 0.6096579081647975
Energy: 0.5734050678184544
Energy: 0.615817342447412
Energy: 0.5734050678178927
Energy: 0.6158173424350533
Energy: 0.5734050678178927
Energy: 0.6158173424440415
Energy: 0.5964256796569788
Energy: 0.5391291568284317
Energy: 0.5964256797322297
Energy: 0.5391291568284317
Energy: 0.5964256797131298
Energy: 0.5391291568284317
Energy: 0.6607959547703571
Energy: 0.6785387916383366
Energy: 0.6607959547703571
Energy: 0.6785387916388984
Energy: 0.6607959547703571
Energy: 0.6785387916388984
Energy: 0.5994055365832054
Energy: 0.5575885351186243
Energy: 0.5994055365826436
Energy: 0.5575885351180625
Energy: 0.5994055365837672
Energy: 0.5575885351180625
Energy: 0.5548478967680381
Energy: 0.5697470315109427
Energy: 0.5548478967669146
Energy: 0.5697470090958148
Energy: 0.5548478967669146
Energy: 0.5697470152719074
Energy: 0.5626487224887772
Energy: 0.5726947664088421
Energy: 0.5626487224887772
Energy: 0.5726947664094039
Energy: 0.5626487224887772
Energy: 0.5726947664088421
Energy: 0.5639773560152738
Energy: 0.6340665696671315
Energy: 0.5639773560158354
Energy: 0.6340665696676933
Energy: 0.5639773560163972
Energy: 0.6340665696660079
Energy: 0.565812333747729
Energy: 0.5520899046704427
Energy: 0.5658123337466053
Energy: 0.552089904669881
Energy: 0.565812333747729
Energy: 0.552089904669881
Energy: 0.648482509980895
Energy: 0.5559053731352755
Energy: 0.6484825099825803
Energy: 0.5559053731358373
Energy: 0.6484825099825803
Energy: 0.5559053731358373
Energy: 0.6499299971354102
Energy: 0.6251381411044857
Energy: 0.6499299971354102
Energy: 0.6251381411044857
Energy: 0.6499299971337249
Energy: 0.6251381411044857
Energy: 0.5762550596989163
Energy: 0.5635146370672136
Energy: 0.5762550596994781
Energy: 0.5635146370672136
Energy: 0.5762550596994781
Energy: 0.5635146370672136
Energy: 0.5843273437780407
Energy: 0.6699635802487572
Energy: 0.5843273437785769
Energy: 0.6699635802481955
Energy: 0.5843273437785769
Energy: 0.6699635802504426
Energy: 0.5494084046306484
Energy: 0.5490659250608536
Energy: 0.5494084046306484
Energy: 0.5490659250608536
Energy: 0.5494084046312102
Energy: 0.5490659250608536
Energy: 0.5575304457757275
Energy: 0.7016078172234003
Energy: 0.5575304457757275
Energy: 0.7016078172234003
Energy: 0.5575304457757275
Energy: 0.7016078172234003
Energy: 0.6122670722485939
Energy: 0.5575109443063238
Energy: 0.6122670722485939
Energy: 0.5575109443063238
Energy: 0.6122670722485939
Energy: 0.5575109443063238
Energy: 0.6033214849903964
Energy: 0.6134255213480982
Energy: 0.6033214849903964
Energy: 0.6134255215710167
Energy: 0.6033214849903964
Energy: 0.6134255213576483
Energy: 0.6709434649889567
Energy: 0.5446098325891818
Energy: 0.6709434649872714
Energy: 0.5446098325886201
Energy: 0.6709434649923273
Energy: 0.5446098325886201
Energy: 0.5505660020788273
Energy: 0.6132663877920745
Energy: 0.5505660020788273
Energy: 0.6132663877920745
Energy: 0.5505660020777039
Energy: 0.6132663877926362
Energy: 0.6325049536278273
Energy: 0.6096579081647975
Energy: 0.6325049536278273
Energy: 0.6096579081653593
Energy: 0.6325049536283891
Energy: 0.6096579081647975
Energy: 0.5734050678178927
Energy: 0.6158173426546011
Energy: 0.5734050678178927
Energy: 0.6158173426495452
Energy: 0.5734050678178927
Energy: 0.6158173426579718
Energy: 0.5964256804155911
Energy: 0.5391291568278699
Energy: 0.5964256803380931
Energy: 0.5391291568278699
Energy: 0.5964256803728969
Energy: 0.5391291568278699
Energy: 0.6607959547703571
Energy: 0.6785387916377749
Energy: 0.6607959547703571
Energy: 0.6785387916388984
Energy: 0.6607959547703571
Energy: 0.6785387916388984
Energy: 0.5994055365837672
Energy: 0.5575885351191859
Energy: 0.5994055365854525
Energy: 0.5575885351186243
Energy: 0.5994055365843289
Energy: 0.5575885351191859
Energy: 0.5548478967663529
Energy: 0.569751650227743
Energy: 0.5548478967669146
Energy: 0.5697517012767858
Energy: 0.5548478967680381
Energy: 0.5697515322702222

minimum gb energy = 0.5391291568278699 eV
minimum distance =  2.59757771076528 Angstroms
sigma value = 19


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

Energy: 0.5421522989296815
Energy: 0.5995473144250396
Energy: 0.5421522989296815
Energy: 0.5995473144216452
Energy: 0.5421522989296815
Energy: 0.5995473144211603
Energy: 0.6219404413329277
Energy: 0.5733595161141918
Energy: 0.6219404413324429
Energy: 0.5733595161141918
Energy: 0.6219404413324429
Energy: 0.5733595161141918
Energy: 0.6260102109438839
Energy: 0.5448309340520889
Energy: 0.6260102109438839
Energy: 0.5448309340520889
Energy: 0.6260102109438839
Energy: 0.5448309340520889
Energy: 0.5218794272994461
Energy: 0.6013175580641277
Energy: 0.5218794272999311
Energy: 0.6013175580641277
Energy: 0.521879427300416
Energy: 0.6013175580641277
Energy: 0.5620963742428763
Energy: 0.625024029419868
Energy: 0.5620963742423913
Energy: 0.625024029419868
Energy: 0.5620963742419064
Energy: 0.625024029419868
Energy: 0.5820739919035451
Energy: 0.5260894976810074
Energy: 0.5820739919030603
Energy: 0.5260894976810074
Energy: 0.5820739919030603
Energy: 0.5260894976810074
Energy: 0.5180775174576948
Energy: 0.6634816392981506
Energy: 0.5180775174581796
Energy: 0.6634816392981506
Energy: 0.5180775174591495
Energy: 0.6634816392986355
Energy: 0.5679632670439866
Energy: 0.6361936878549286
Energy: 0.5679632670439866
Energy: 0.6361936878549286
Energy: 0.5679632670439866
Energy: 0.6361936878549286
Energy: 0.5967428202582166
Energy: 0.5163693066133905
Energy: 0.5967428202582166
Energy: 0.5163693066133905
Energy: 0.5967428202587015
Energy: 0.5163693066133905
Energy: 0.5785568279085578
Energy: 0.5993167892091963
Energy: 0.5785568279293869
Energy: 0.5993167892091963
Energy: 0.578556827928902
Energy: 0.5993167892091963
Energy: 0.5187920229348245
Energy: 0.6328492521826462
Energy: 0.5187920229353093
Energy: 0.6328492521826462
Energy: 0.5187920229348245
Energy: 0.6328492521826462
Energy: 0.6535449849029697
Energy: 0.5236921972066816
Energy: 0.6535449849029697
Energy: 0.5236921972071665
Energy: 0.6535449849029697
Energy: 0.5236921972066816
Energy: 0.6500375513913837
Energy: 0.5812421522776073
Energy: 0.6500375513913837
Energy: 0.5812421522776073
Energy: 0.6500375513918687
Energy: 0.5812421522776073
Energy: 0.5297384427860593
Energy: 0.5796979842314783
Energy: 0.5297384427860593
Energy: 0.5796979842314783
Energy: 0.5297384427865443
Energy: 0.5796979842319632
Energy: 0.6266652486730773
Energy: 0.5689371274303371
Energy: 0.6266652486730773
Energy: 0.5689371274308219
Energy: 0.6266652486730773
Energy: 0.5689371274308219
Energy: 0.6152256506689818
Energy: 0.5155026092461995
Energy: 0.6152256506578289
Energy: 0.5155026092461995
Energy: 0.6152256506748007
Energy: 0.5155026092461995
Energy: 0.5256227217755733
Energy: 0.6056927249629442
Energy: 0.5256227217760583
Energy: 0.6056927249610046
Energy: 0.5256227217760583
Energy: 0.6056927249634292
Energy: 0.602852770253929
Energy: 0.6466090074214309
Energy: 0.6028527702505567
Energy: 0.6466090074209461
Energy: 0.6028527702515265
Energy: 0.6466090074214309
Energy: 0.5945869684903569
Energy: 0.5320718849224481
Energy: 0.5945869684903569
Energy: 0.5320718849224481
Energy: 0.5945869684947209
Energy: 0.5320718849224481
Energy: 0.5302785717317127
Energy: 0.6135533150977608
Energy: 0.5302785717777571
Energy: 0.6135533150977608
Energy: 0.5302785717787268
Energy: 0.613553315096791
Energy: 0.5130466357619282
Energy: 0.6436260803886364
Energy: 0.5130466357619282
Energy: 0.6436260803886364
Energy: 0.5130466357624132
Energy: 0.6436260803891213
Energy: 0.6185669063020892
Energy: 0.5439081051443274
Energy: 0.6185669063040289
Energy: 0.5439081051452973
Energy: 0.6185669063045138
Energy: 0.5439081051448124
Energy: 0.6426412059531026
Energy: 0.6196550363520715
Energy: 0.6426412059531026
Energy: 0.6196550363540112
Energy: 0.6426412059531026
Energy: 0.6196550363520715
Energy: 0.5745186604154061
Energy: 0.6031216324775235
Energy: 0.5745186604154061
Energy: 0.6031216324755838
Energy: 0.5745186604149212
Energy: 0.6031216324770385
Energy: 0.6205779865450495
Energy: 0.525427223965521
Energy: 0.6205779865450495
Energy: 0.5254272239645511
Energy: 0.6205779865450495
Energy: 0.525427223965521
Energy: 0.6251924682317632
Energy: 0.5698477688352065
Energy: 0.625192468232248
Energy: 0.5698477688352065
Energy: 0.625192468233218
Energy: 0.5698477688352065
Energy: 0.5156362145534835
Energy: 0.5759288375719646
Energy: 0.5156362145529986
Energy: 0.5759288375724494
Energy: 0.5156362145525136
Energy: 0.5759288375709947
Energy: 0.611653994304155
Energy: 0.584958811945829
Energy: 0.6116539943056097
Energy: 0.584958811945829
Energy: 0.6116539943036701
Energy: 0.5849588119448592
Energy: 0.6200947761054445
Energy: 0.5243227806514859
Energy: 0.6200947761039897
Energy: 0.524322780651001
Energy: 0.6200947761039897
Energy: 0.5243227806519708

minimum gb energy = 0.5130466357619282 eV
minimum distance =  2.58105667116828 Angstroms
sigma value = 101


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

Energy: 0.5024720601346712
Energy: 0.5801418446208307
Energy: 0.5024720601346712
Energy: 0.5801418446204045
Energy: 0.5024720601350974
Energy: 0.5801418446204045
Energy: 0.6702623243563918
Energy: 0.5661011498423016
Energy: 0.6702623243555391
Energy: 0.5661011498423016
Energy: 0.6702623243559654
Energy: 0.5661011498423016
Energy: 0.6107964470046594
Energy: 0.49721735613180157
Energy: 0.6107964470029543
Energy: 0.49721735613009654
Energy: 0.6107964470097551
Energy: 0.4972173561343591
Energy: 0.48357914508873284
Energy: 0.6766229694840974
Energy: 0.48357914508873284
Energy: 0.6427529826832311
Energy: 0.48357914508873284
Energy: 0.6427529826802474
Energy: 0.5612987431845601
Energy: 0.6098602034855124
Energy: 0.5612987431832813
Energy: 0.6098602034893293
Energy: 0.5612987431883963
Energy: 0.6098602034897556
Energy: 0.579586786291814
Energy: 0.489815856760413
Energy: 0.5795867862913877
Energy: 0.489815856760413
Energy: 0.5795867862913877
Energy: 0.489815856760413
Energy: 0.562912475157313
Energy: 0.6411667088877853
Energy: 0.562912475157313
Energy: 0.6411667088882116
Energy: 0.562912475157313
Energy: 0.6411667088877853
Energy: 0.4874575407381454
Energy: 0.6797513212206049
Energy: 0.4874575407381454
Energy: 0.6369635630229118
Energy: 0.48745754073899794
Energy: 0.6369635630229118
Energy: 0.5772871064094072
Energy: 0.4906868041837768
Energy: 0.5772871064094072
Energy: 0.4906868041837768
Energy: 0.5772871064094072
Energy: 0.4906868041837768
Energy: 0.6279681332992314
Energy: 0.5793607003717638
Energy: 0.6279681332996577
Energy: 0.5793607003645173
Energy: 0.6279681332996577
Energy: 0.5793607003798628
Energy: 0.4818639126478895
Energy: 0.6153022987530262
Energy: 0.4818639126478895
Energy: 0.6153022987530262
Energy: 0.4818639126474633
Energy: 0.6153022987530262
Energy: 0.6796979425651991
Energy: 0.5349390523852843
Energy: 0.6796979425656254
Energy: 0.5349390523857105
Energy: 0.6796979425617891
Energy: 0.5349390523848581
Energy: 0.5935064423402618
Energy: 0.5463795973365012
Energy: 0.5935064423406881
Energy: 0.5463795973365012
Energy: 0.5935064423402618
Energy: 0.5463795973356488
Energy: 0.5068737635578099
Energy: 0.5934049165840611
Energy: 0.5068737635569572
Energy: 0.5934049165495534
Energy: 0.5068737635578099
Energy: 0.5934049166458495
Energy: 0.6231526560722109
Energy: 0.5362156043633282
Energy: 0.6231526560713583
Energy: 0.5362156043854743
Energy: 0.6231526560717846
Energy: 0.5362156043381788
Energy: 0.6126819274443414
Energy: 0.499322494741141
Energy: 0.6126819274443414
Energy: 0.499322494741141
Energy: 0.6126819274443414
Energy: 0.49932249473943596
Energy: 0.48246139363191337
Energy: 0.6389822276462017
Energy: 0.48246139363191337
Energy: 0.6389822276457754
Energy: 0.48246139363191337
Energy: 0.6389822276462017
Energy: 0.48043930485999686
Energy: 0.6144540150806839
Energy: 0.48043930485999686
Energy: 0.6144540150802577
Energy: 0.48043930486042313
Energy: 0.6144540150806839
Energy: 0.5844496761727603
Energy: 0.4902011611615196
Energy: 0.5844496761710553
Energy: 0.4902011611619459
Energy: 0.5844496761714816
Energy: 0.4902011611615196
Energy: 0.602113631594987
Energy: 0.6379460797003029
Energy: 0.6021136315945608
Energy: 0.6379460797007293
Energy: 0.602113631594987
Energy: 0.6379460797007293
Energy: 0.4878092699272848
Energy: 0.6263113377890778
Energy: 0.4878092699272848
Energy: 0.6263113377886514
Energy: 0.4878092699272848
Energy: 0.6263113377886514
Energy: 0.6809084128076304
Energy: 0.4896050846613162
Energy: 0.6809084128076304
Energy: 0.48960508466216873
Energy: 0.6809084128093352
Energy: 0.48960508466174246
Energy: 0.602048701653521
Energy: 0.5807571759537473
Energy: 0.6020487016539472
Energy: 0.5807571759537473
Energy: 0.6020487016539472
Energy: 0.5807571759537473
Energy: 0.4842930319778739
Energy: 0.5824119008637116
Energy: 0.4842930319778739
Energy: 0.5824119008632854
Energy: 0.48429303197744766
Energy: 0.5824119008632854
Energy: 0.6495845218700103
Energy: 0.5747277836473855
Energy: 0.6495845218700103
Energy: 0.5747277836473855
Energy: 0.6495845218700103
Energy: 0.5747277836473855
Energy: 0.5674973696814875
Energy: 0.5495271568873558
Energy: 0.5674973696767986
Energy: 0.549527156887782
Energy: 0.567497369675946
Energy: 0.549527156887782
Energy: 0.5140401385178541
Energy: 0.5849337465982739
Energy: 0.5140401385170016
Energy: 0.5849337465399151
Energy: 0.5140401385174278
Energy: 0.5849337465369312
Energy: 0.6216095958603998
Energy: 0.616787567993198
Energy: 0.6216095958603998
Energy: 0.6167875679927718
Energy: 0.6216095958599736
Energy: 0.616787567993198
Energy: 0.5824969985223917
Energy: 0.49819808446738434
Energy: 0.5824969985223917
Energy: 0.49819808446738434
Energy: 0.5824969985228179
Energy: 0.49819808446738434
Energy: 0.5681981431702487
Energy: 0.5939972389265765
Energy: 0.5681981431698225
Energy: 0.5939972389218876
Energy: 0.5681981431693961
Energy: 0.5939972389231664
Energy: 0.4826230401284349
Energy: 0.5840162835096785
Energy: 0.4826230401284349
Energy: 0.5840162835096785
Energy: 0.4826230401284349
Energy: 0.5840162835096785
Energy: 0.5714872988678302
Energy: 0.49089370777211994
Energy: 0.5714872988682566
Energy: 0.49089370777211994
Energy: 0.5714872988691091
Energy: 0.49089370777211994
Energy: 0.6564531217238402
Energy: 0.5679891978320984
Energy: 0.6564531217229875
Energy: 0.5679891978397711
Energy: 0.6564531217217089
Energy: 0.5679891978401973

minimum gb energy = 0.48043930485999686 eV
minimum distance =  2.59842358936374 Angstroms
sigma value = 33


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

Energy: 0.011729444582482979
Energy: 0.39981879875094345
Energy: 0.011729444582482979
Energy: 0.39981879875094345
Energy: 0.011729444582482979
Energy: 0.3998187987502548
Energy: 0.013082556372136178
Energy: 0.9368701685564097
Energy: 0.013082556372136178
Energy: 0.9368701685574327
Energy: 0.013082556371782012
Energy: 0.936870168556744
Energy: 0.3997312485614367
Energy: 0.16444003708094462
Energy: 0.399726707705833
Energy: 0.16444175299750616
Energy: 0.39968308646066947
Energy: 0.16443981585547351
Energy: 0.013082556372136178
Energy: 0.9368701685570983
Energy: 0.013082556372490343
Energy: 0.936870168556744
Energy: 0.013082556372490343
Energy: 0.9368701685570983

minimum gb energy = 0.011729444582482979 eV
minimum distance =  2.79309864085774 Angstroms
sigma value = 1