Model name: model_name=MEAM_LAMMPS_KimSeolJi_2017_PtCu__MO_070797404269_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.917371600866318
cohesive_energy=5.770453791788741
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018998868641913132
Energy: 1.009663696632263
Energy: 0.018998868641913132
Energy: 1.009663696632263
Energy: 0.018998868641913132
Energy: 1.009663696632263
Energy: 1.00966369663253
Energy: 1.1972313671415376
Energy: 1.009663696632263
Energy: 1.197231367140766
Energy: 1.009663696631996
Energy: 1.1972313671410035
Energy: 0.018998868641913132
Energy: 1.009663696632263
Energy: 0.018998868641913132
Energy: 1.009663696632263
Energy: 0.018998868641913132
Energy: 1.009663696632263
Energy: 1.009663696632263
Energy: 1.1972313671418047
Energy: 1.009663696631996
Energy: 1.1972313671433477
Energy: 1.009663696632263
Energy: 1.1972313671415376
Energy: 0.018998868641913132
Energy: 1.009663696631996
Energy: 0.018998868641913132
Energy: 1.00966369663253
Energy: 0.018998868641913132
Energy: 1.00966369663253
Energy: 1.009663696631996
Energy: 1.1972313671412704
Energy: 1.009663696632263
Energy: 1.1972313671394603
Energy: 1.009663696631996
Energy: 1.1972313671418047

minimum gb energy = 0.018998868641913132 eV
minimum distance =  2.58987744796573 Angstroms
sigma value = 1


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

Energy: 1.6162413917868166
Energy: 1.7546062453937876
Energy: 1.6162413917868166
Energy: 1.7546062453937876
Energy: 1.6162413917868166
Energy: 1.7546062453937876
Energy: 1.815518701674794
Energy: 1.3873085688801559
Energy: 1.815518701674794
Energy: 1.387308568879513
Energy: 1.815518701674794
Energy: 1.387308568879513
Energy: 1.622999062630104
Energy: 1.7890628720027217
Energy: 1.622999062630747
Energy: 1.7890628720027217
Energy: 1.6229990626313897
Energy: 1.7890628720020787
Energy: 1.893426172553323
Energy: 1.5362243651242107
Energy: 1.893426172553966
Energy: 1.5362243651242107
Energy: 1.893426172553966
Energy: 1.5362243651248533
Energy: 1.6289520057012052
Energy: 1.6765364409459542
Energy: 1.6289520057012052
Energy: 1.6765364409459542
Energy: 1.6289520057012052
Energy: 1.6765364409459542
Energy: 1.6474254924076581
Energy: 1.6874239769411365
Energy: 1.6474254924063725
Energy: 1.6874239769417794
Energy: 1.647425492408944
Energy: 1.6874239769417794
Energy: 1.6338788910622652
Energy: 1.7429538241310125
Energy: 1.633878891062908
Energy: 1.7429538241316553
Energy: 1.6338788910622652
Energy: 1.7429538241310125
Energy: 1.5810211428023733
Energy: 1.7810724966883462
Energy: 1.5810211428017305
Energy: 1.7810724966877034
Energy: 1.5810211428023733
Energy: 1.7810724966883462
Energy: 1.7106414713523046
Energy: 1.7754270419389693
Energy: 1.7106414713523046
Energy: 1.7754270419389693
Energy: 1.7106414713523046
Energy: 1.7754270419396119
Energy: 1.4751050101247025
Energy: 1.7333771925580215
Energy: 1.4751050101247025
Energy: 1.7333771925580215
Energy: 1.4751050101247025
Energy: 1.7333771925573787
Energy: 1.8670383357136275
Energy: 1.4673090929737018
Energy: 1.8670383357129847
Energy: 1.4673090929737018
Energy: 1.8670383357129847
Energy: 1.467309092974345
Energy: 1.5291730294583696
Energy: 1.9603139067577715
Energy: 1.5291730294583696
Energy: 1.9603139067577715
Energy: 1.5291730294583696
Energy: 1.9603139067577715
Energy: 1.7339555050217978
Energy: 1.3764143526465646
Energy: 1.7339555050224404
Energy: 1.3764143526465646
Energy: 1.7339555050224404
Energy: 1.3764143526472075
Energy: 1.688812889647199
Energy: 1.7349627899737454
Energy: 1.688812889647199
Energy: 1.7349627899737454
Energy: 1.688812889647199
Energy: 1.7349627899737454
Energy: 1.8423703609266038
Energy: 1.514330301292159
Energy: 1.8423703609278894
Energy: 1.5143303012915161
Energy: 1.8423703609272466
Energy: 1.5143303012915161
Energy: 1.9003382697006237
Energy: 1.721193066949753
Energy: 1.9003382697006237
Energy: 1.721193066949753
Energy: 1.9003382697006237
Energy: 1.7211930669491102
Energy: 1.6682316417767586
Energy: 1.7465500682351711
Energy: 1.6682316417767586
Energy: 1.7465500682351711
Energy: 1.6682316417767586
Energy: 1.7465500682351711
Energy: 1.6392545435433228
Energy: 1.5855937360587506
Energy: 1.6392545435433228
Energy: 1.5855937360587506
Energy: 1.6392545435433228
Energy: 1.5855937360593935
Energy: 1.4357686232384876
Energy: 1.7982852927781514
Energy: 1.4357686232384876
Energy: 1.7982852927775086
Energy: 1.4357686232378448
Energy: 1.7982852927775086
Energy: 1.8037335525926994
Energy: 1.5715305764226735
Energy: 1.8037335525926994
Energy: 1.5715305764220306
Energy: 1.8037335525933422
Energy: 1.5715305764226735
Energy: 1.5251275760484688
Energy: 1.7170096997883122
Energy: 1.5251275760484688
Energy: 1.7170096997883122
Energy: 1.5251275760484688
Energy: 1.717009699788955
Energy: 1.6845131376107625
Energy: 1.6605141518736592
Energy: 1.6845131376101197
Energy: 1.660514151874302
Energy: 1.6845131376107625
Energy: 1.6605141518736592
Energy: 1.3453893682795803
Energy: 1.772483042005241
Energy: 1.3453893682795803
Energy: 1.772483042005241
Energy: 1.3453893682789373
Energy: 1.772483042005241

minimum gb energy = 1.3453893682789373 eV
minimum distance =  2.55918771089923 Angstroms
sigma value = 33


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

Energy: 1.5948332767132307
Energy: 1.9043925053585862
Energy: 1.5191794597556767
Energy: 1.9043925053597164
Energy: 1.5948332767110367
Energy: 1.9043925053585862
Energy: 2.019763983028616
Energy: 1.6798614075436695
Energy: 2.0197639830293475
Energy: 1.6798614075426057
Energy: 2.0197639830264222
Energy: 1.6798614075433371
Energy: 1.5407219772406535
Energy: 1.6428080159320466
Energy: 1.5407219772410523
Energy: 1.642808015934972
Energy: 1.5407219772391907
Energy: 1.6428080159335092
Energy: 1.928990459916419
Energy: 1.7907715300941762
Energy: 1.9289904599138925
Energy: 1.7907715300934453
Energy: 1.9289904599138925
Energy: 1.790771530093046
Energy: 1.712407183776217
Energy: 1.6621435682072105
Energy: 1.7124071837744217
Energy: 1.662143568209737
Energy: 1.7124071837747543
Energy: 1.6621435682094043
Energy: 1.9967000773934171
Energy: 1.659495670264657
Energy: 1.9967000773938157
Energy: 1.6597571598599816
Energy: 1.9967000773945474
Energy: 1.659495670264657
Energy: 1.8063766017157608
Energy: 1.8878461685589807
Energy: 1.8063766017157608
Energy: 1.7911997814272034
Energy: 1.8063766017139655
Energy: 1.8878461685611747
Energy: 1.4379949059631427
Energy: 1.9086879025129297
Energy: 1.4379949059620125
Energy: 1.908687902511068
Energy: 1.4379949059616801
Energy: 1.908687902511467
Energy: 1.7819823069201404
Energy: 1.7018373605215242
Energy: 1.781982306919808
Energy: 1.7018373605196626
Energy: 1.7819823069208716
Energy: 1.7018373605196626
Energy: 1.4331542572079279
Energy: 2.016497324444857
Energy: 1.426170747558875
Energy: 2.016497324443727
Energy: 1.433154257208659
Energy: 2.016497324444857
Energy: 1.8215949099950213
Energy: 1.4027935568441796
Energy: 1.8215949099942899
Energy: 1.4027935568441796
Energy: 1.8215949099953535
Energy: 1.402793556845642
Energy: 1.8139516064169512
Energy: 1.9967392183445534
Energy: 1.8138306307662646
Energy: 1.9967392183434896
Energy: 1.8139516064162196
Energy: 1.9967392183434896
Energy: 1.7398000209462627
Energy: 1.4958917113353027
Energy: 1.8854606149360729
Energy: 1.4958917113356354
Energy: 1.7398000209458635
Energy: 1.4958917113378294
Energy: 1.5498548543747035
Energy: 1.872474693892453
Energy: 1.708897416641147
Energy: 1.872474693892453
Energy: 1.5498548543732409
Energy: 1.872474693894647
Energy: 1.8761327701842605
Energy: 1.64161411232027
Energy: 1.876132770186122
Energy: 1.64161411232027
Energy: 1.8761327701871855
Energy: 1.641614112320669
Energy: 1.6586565688757569
Energy: 1.5545964847852294
Energy: 1.6586565688786818
Energy: 1.5545964847837668
Energy: 1.6586565688735626
Energy: 1.5545964847852294
Energy: 1.7538444376570743
Energy: 1.7263578224854244
Energy: 1.7538444376570743
Energy: 1.7263578224850922
Energy: 1.7538444376581381
Energy: 1.726357822486156
Energy: 1.8072077563600342
Energy: 1.6197582895462033
Energy: 1.8072077563607656
Energy: 1.6164348024285198
Energy: 1.8072077563596354
Energy: 1.6197582895498597
Energy: 1.9155872661941997
Energy: 1.7854728784027032
Energy: 1.9155872661934688
Energy: 1.809296460049484
Energy: 1.9155872661938012
Energy: 1.7854728784027032
Energy: 1.814096637626392
Energy: 1.5487865670539076
Energy: 1.8140966376260599
Energy: 1.5458598168770654
Energy: 1.814096637627855
Energy: 1.5487865670521124
Energy: 1.3628376514946001
Energy: 1.9179101481507956
Energy: 1.3628376514927387
Energy: 1.9179101481525904
Energy: 1.3628376514909437
Energy: 1.9179101481504628
Energy: 1.6415518359990797
Energy: 1.6904356621733228
Energy: 1.6415518360002102
Energy: 1.6904356621740542
Energy: 1.6415518360002102
Energy: 1.690435662175118
Energy: 1.3993436777495567
Energy: 2.0603660819630165
Energy: 1.4219889331186348
Energy: 2.0603660819640806
Energy: 1.3993436777495567
Energy: 2.0603660819640806
Energy: 1.8368880898424058
Energy: 1.8428259277675527
Energy: 1.8368880898420732
Energy: 1.8428259277668215
Energy: 1.836888089843137
Energy: 1.84282592776609
Energy: 1.7740500786106725
Energy: 1.9951504475642763
Energy: 1.6544058236445134
Energy: 1.9951504475636117
Energy: 1.7740500786125344
Energy: 1.9951504475610187
Energy: 1.8922703569687287
Energy: 1.7925577572429952
Energy: 1.7357006450552037
Energy: 1.7925577572433278
Energy: 1.8922703569687287
Energy: 1.7925577572425964
Energy: 1.9191380716577788
Energy: 1.7988238482888326
Energy: 1.735527154926079
Energy: 1.7988238482895642
Energy: 1.9191380716599729
Energy: 1.7988238482888326
Energy: 1.7295242711322616
Energy: 1.778371551339745
Energy: 1.7295242711318626
Energy: 1.7783715513408085
Energy: 1.7295242711311316
Energy: 1.7783715513382825
Energy: 1.8358075972325942
Energy: 1.7719231834356532
Energy: 1.835807597234057
Energy: 1.7719231834367835
Energy: 1.835807597234057
Energy: 1.771923183436052
Energy: 1.3353013468881298
Energy: 1.8948409693789248
Energy: 1.335301346887066
Energy: 1.8948409693781938
Energy: 1.3353013468860024
Energy: 1.8948409693781938
Energy: 1.8054642395556366
Energy: 1.7016211304404287
Energy: 1.805464239553044
Energy: 1.7016717957046879
Energy: 1.8054642395541742
Energy: 1.701621130442224
Energy: 1.4842598256925275
Energy: 1.8867748307582468
Energy: 1.4842598256910648
Energy: 1.742179457621135
Energy: 1.4842598256906658
Energy: 1.8867748307567844
Energy: 1.812780394961164
Energy: 1.637215597079496
Energy: 1.812780394960433
Energy: 1.5662639949540664
Energy: 1.8127803949600338
Energy: 1.637215597078033
Energy: 1.6856904987266894
Energy: 1.9116968066480338
Energy: 1.6856904987284846
Energy: 1.9116968066487652
Energy: 1.685690498728152
Energy: 1.9116968066480338
Energy: 1.6418209676238151
Energy: 1.5817050188707418
Energy: 1.6418209676223523
Energy: 1.5817050188707418
Energy: 1.6418209676223523
Energy: 1.581705018873268
Energy: 1.7899148636844349
Energy: 1.7281222109739793
Energy: 1.7899148636841027
Energy: 1.7281222109732481
Energy: 1.7899148636841027
Energy: 1.7281222109739793
Energy: 1.4492564715557248
Energy: 1.7180152272765892
Energy: 1.449679735492547
Energy: 1.7180152272769214
Energy: 1.4492564715575196
Energy: 1.7180152272765892
Energy: 1.6973719486771144
Energy: 1.8641985639529342
Energy: 1.723946394999256
Energy: 1.8641985639558591
Energy: 1.6973719486759842
Energy: 1.8641985639536653
Energy: 1.791091092767381
Energy: 1.814354332944182
Energy: 1.8870412303069914
Energy: 1.814354332942387
Energy: 1.7910910927684447
Energy: 1.8143543329416556
Energy: 1.921144911841376
Energy: 1.366938138231596
Energy: 1.9211449118409771
Energy: 1.3669381382323271
Energy: 1.921144911841376
Energy: 1.3669381382319283
Energy: 1.8140463191257548
Energy: 1.778489379113673
Energy: 1.8140463191268186
Energy: 1.778489379113341
Energy: 1.8140463191260874
Energy: 1.7784893791144047

minimum gb energy = 1.3353013468860024 eV
minimum distance =  2.57793678822868 Angstroms
sigma value = 51


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

Energy: 1.8704557476885886
Energy: 1.6447408415545282
Energy: 1.8704557476885886
Energy: 1.644740841553681
Energy: 1.8704557476885886
Energy: 1.6447408415545282
Energy: 1.9080890485945274
Energy: 1.4810135321919788
Energy: 1.9080890485953748
Energy: 1.4810135321919788
Energy: 1.9080890485945274
Energy: 1.4810135321919788
Energy: 1.4094921532838187
Energy: 1.9506153245352118
Energy: 1.4094921532829716
Energy: 1.9506153245343643
Energy: 1.4094921532821245
Energy: 1.9506153245343643
Energy: 1.640979206012331
Energy: 1.4791145848165712
Energy: 1.640979206012331
Energy: 1.4791145848174185
Energy: 1.640979206012331
Energy: 1.4791145848165712
Energy: 1.766207339554921
Energy: 1.7175311262544193
Energy: 1.766207339554921
Energy: 1.7175311262544193
Energy: 1.7662073395540736
Energy: 1.7175311262552662
Energy: 1.8777758563438334
Energy: 1.7493999532157425
Energy: 1.8777758563438334
Energy: 1.7493999532157425
Energy: 1.8777758563438334
Energy: 1.7493999532157425
Energy: 1.6051293166101066
Energy: 1.6365006072549346
Energy: 1.6051293166101066
Energy: 1.6365006072549346
Energy: 1.6051293166101066
Energy: 1.6365006072540873
Energy: 1.7203462768627842
Energy: 1.8898478361387558
Energy: 1.7203462768627842
Energy: 1.8898478361379083
Energy: 1.7203462768627842
Energy: 1.8898478361387558
Energy: 1.8810634437040503
Energy: 1.414958989247917
Energy: 1.8810634437040503
Energy: 1.414958989247917
Energy: 1.8810634437040503
Energy: 1.414958989247917
Energy: 1.60623180223117
Energy: 1.8759326096800792
Energy: 1.6062318022294755
Energy: 1.8759326096800792
Energy: 1.606231802230323
Energy: 1.8759326096800792
Energy: 1.9001594844693195
Energy: 1.3260763094191916
Energy: 1.9001594844684722
Energy: 1.3260763094191916
Energy: 1.9001594844693195
Energy: 1.3260763094200387
Energy: 1.6756240846908337
Energy: 1.7715683227959689
Energy: 1.6756240846908337
Energy: 1.7715683227959689
Energy: 1.6756240846908337
Energy: 1.7715683227951602
Energy: 1.8196417629477748
Energy: 1.479450583472245
Energy: 1.8196417629477748
Energy: 1.479450583472245
Energy: 1.8196417629477748
Energy: 1.479450583472245
Energy: 1.6646729512725498
Energy: 1.617672536056055
Energy: 1.6646729512708551
Energy: 1.6176725360577493
Energy: 1.6646729512725498
Energy: 1.6176725360585966
Energy: 1.5630668718446974
Energy: 1.6979633765810482
Energy: 1.5630668718446974
Energy: 1.6979633765810482
Energy: 1.56306687184385
Energy: 1.697963376580201
Energy: 1.7522585196951967
Energy: 1.7497050347795338
Energy: 1.7522585196951967
Energy: 1.7497050347795338
Energy: 1.7522585196951967
Energy: 1.7497050347795338
Energy: 1.7329798418507274
Energy: 1.8445222716868739
Energy: 1.7329798418507274
Energy: 1.8445222716868739
Energy: 1.7329798418507274
Energy: 1.8445222716860268
Energy: 1.6064135168819138
Energy: 1.572564682338184
Energy: 1.6064135168827607
Energy: 1.572564682338184
Energy: 1.6064135168819138
Energy: 1.572564682338184

minimum gb energy = 1.3260763094191916 eV
minimum distance =  2.49346281907882 Angstroms
sigma value = 19


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

Energy: 1.5293426414796865
Energy: 1.5797467058675787
Energy: 1.5293426414796865
Energy: 1.5797467058675787
Energy: 1.5293426414796865
Energy: 1.5797467058675787
Energy: 1.7695241522842684
Energy: 1.8407585741374126
Energy: 1.7695241522842684
Energy: 1.8407585741369101
Energy: 1.769524152283766
Energy: 1.8407585741369101
Energy: 1.2386600189474228
Energy: 1.6591542665951626
Energy: 1.2386600189474228
Energy: 1.6591542665956651
Energy: 1.2386600189474228
Energy: 1.6591542665956651
Energy: 1.832810522686075
Energy: 1.1874759508495427
Energy: 1.832810522685572
Energy: 1.1874759508495427
Energy: 1.8328105226850695
Energy: 1.1874759508495427
Energy: 1.3347942272863902
Energy: 1.387999405886742
Energy: 1.3347942272863902
Energy: 1.3879994058862395
Energy: 1.3347942272863902
Energy: 1.3879994058872445
Energy: 1.3348244575795027
Energy: 1.3880175005602509
Energy: 1.3348244575800052
Energy: 1.388017500561256
Energy: 1.3348244575795027
Energy: 1.388017500561256
Energy: 1.832855940590651
Energy: 1.1875154423916507
Energy: 1.8328559405911535
Energy: 1.1875154423916507
Energy: 1.8328559405911535
Energy: 1.1875154423921532
Energy: 1.2381998453511263
Energy: 1.6592962001761626
Energy: 1.2381998453511263
Energy: 1.6592962001751577
Energy: 1.2381998453521312
Energy: 1.6592962001751577
Energy: 1.7696842128434394
Energy: 1.8407783626694376
Energy: 1.7696842128429369
Energy: 1.8407783626694376
Energy: 1.7696842128434394
Energy: 1.8407783626694376
Energy: 1.529342641479184
Energy: 1.5797467058675787
Energy: 1.5293426414796865
Energy: 1.5797467058675787
Energy: 1.5293426414796865
Energy: 1.5797467058675787
Energy: 1.7695241522842684
Energy: 1.8407585741374126
Energy: 1.7695241522842684
Energy: 1.8407585741374126
Energy: 1.7695241522842684
Energy: 1.8407585741369101
Energy: 1.2386600189474228
Energy: 1.6591542665951626
Energy: 1.2386600189469203
Energy: 1.6591542665956651
Energy: 1.2386600189474228
Energy: 1.6591542665956651
Energy: 1.832810522685572
Energy: 1.1874759508490405
Energy: 1.832810522685572
Energy: 1.1874759508490405
Energy: 1.832810522685572
Energy: 1.1874759508495427
Energy: 1.3347942272863902
Energy: 1.3879994058862395
Energy: 1.3347942272858877
Energy: 1.387999405887747
Energy: 1.3347942272863902
Energy: 1.387999405885737
Energy: 1.3348244575795027
Energy: 1.388017500561256
Energy: 1.3348244575800052
Energy: 1.3880175005617585
Energy: 1.3348244575795027
Energy: 1.3880175005617585
Energy: 1.8328559405911535
Energy: 1.1875154423921532
Energy: 1.8328559405911535
Energy: 1.1875154423916507
Energy: 1.832855940590651
Energy: 1.1875154423916507
Energy: 1.2381998453516287
Energy: 1.6592962001761626
Energy: 1.2381998453516287
Energy: 1.6592962001756602
Energy: 1.2381998453511263
Energy: 1.6592962001756602
Energy: 1.7696842128429369
Energy: 1.8407783626694376
Energy: 1.7696842128429369
Energy: 1.8407783626694376
Energy: 1.7696842128434394
Energy: 1.8407783626694376
Energy: 1.529342641479184
Energy: 1.5797467058680812
Energy: 1.5293426414796865
Energy: 1.5797467058675787
Energy: 1.5293426414796865
Energy: 1.5797467058680812
Energy: 1.7695241522842684
Energy: 1.8407585741369101
Energy: 1.7695241522842684
Energy: 1.8407585741374126
Energy: 1.769524152283766
Energy: 1.8407585741374126
Energy: 1.2386600189474228
Energy: 1.6591542665951626
Energy: 1.2386600189474228
Energy: 1.6591542665951626
Energy: 1.2386600189469203
Energy: 1.659154266596168
Energy: 1.832810522685572
Energy: 1.1874759508495427
Energy: 1.832810522685572
Energy: 1.1874759508490405
Energy: 1.832810522685572
Energy: 1.1874759508495427
Energy: 1.3347942272863902
Energy: 1.3879994058862395
Energy: 1.334794227286893
Energy: 1.3879994058852343
Energy: 1.3347942272858877
Energy: 1.3879994058852343
Energy: 1.3348244575795027
Energy: 1.3880175005597484
Energy: 1.3348244575805077
Energy: 1.3880175005607533
Energy: 1.3348244575805077
Energy: 1.3880175005607533
Energy: 1.8328559405911535
Energy: 1.1875154423916507
Energy: 1.832855940591656
Energy: 1.1875154423916507
Energy: 1.8328559405911535
Energy: 1.1875154423916507
Energy: 1.2381998453521312
Energy: 1.6592962001756602
Energy: 1.2381998453511263
Energy: 1.6592962001756602
Energy: 1.2381998453521312
Energy: 1.6592962001761626
Energy: 1.7696842128434394
Energy: 1.8407783626694376
Energy: 1.7696842128429369
Energy: 1.8407783626694376
Energy: 1.7696842128429369
Energy: 1.8407783626689354
Energy: 1.5293426414796865
Energy: 1.579746705868584
Energy: 1.529342641479184
Energy: 1.5797467058680812
Energy: 1.529342641479184
Energy: 1.5797467058680812
Energy: 1.769524152283766
Energy: 1.8407585741369101
Energy: 1.769524152283766
Energy: 1.8407585741369101
Energy: 1.769524152283766
Energy: 1.8407585741374126
Energy: 1.2386600189474228
Energy: 1.6591542665951626
Energy: 1.2386600189474228
Energy: 1.6591542665951626
Energy: 1.2386600189474228
Energy: 1.6591542665956651

minimum gb energy = 1.1874759508490405 eV
minimum distance =  2.51353606874207 Angstroms
sigma value = 27


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

Energy: 1.295729759676503
Energy: 1.2741452280580643
Energy: 1.295729759676503
Energy: 1.2741452280580643
Energy: 1.295729759676503
Energy: 1.274145228059295
Energy: 2.1622958127718155
Energy: 1.4531647503469678
Energy: 2.1622958127705845
Energy: 1.4531647503469678
Energy: 2.162295812773046
Energy: 1.4531647503481988
Energy: 1.2390185493883468
Energy: 2.226173899895415
Energy: 1.2390185493883468
Energy: 2.2261738998966463
Energy: 1.239018549389578
Energy: 2.226173899895415
Energy: 1.8925701708053853
Energy: 1.2684780019219652
Energy: 1.8925701708053853
Energy: 1.2684780019219652
Energy: 1.8925701708053853
Energy: 1.2684780019219652
Energy: 1.8914925661068667
Energy: 1.1941993081019977
Energy: 1.8914925661068667
Energy: 1.194199308100767
Energy: 1.8914925661080977
Energy: 1.1941993081019977
Energy: 1.3897635206677283
Energy: 1.649414488290967
Energy: 1.3897635206677283
Energy: 1.649414488290967
Energy: 1.3897635206689596
Energy: 1.649414488290967
Energy: 1.6988306884958646
Energy: 1.4520812710039182
Energy: 1.6988306884958646
Energy: 1.4520812710039182
Energy: 1.6988306884958646
Energy: 1.4520812710039182
Energy: 1.294026928622166
Energy: 1.2763374738315436
Energy: 1.294026928622166
Energy: 1.2763374738315436
Energy: 1.2940269286209352
Energy: 1.2763374738315436
Energy: 2.158518985415605
Energy: 1.4329254527179667
Energy: 2.158518985415605
Energy: 1.4329254527179667
Energy: 2.158518985415605
Energy: 1.4329254527179667
Energy: 1.5856945552986137
Energy: 1.5492692097190184
Energy: 1.5856945552986137
Energy: 1.5492692097190184
Energy: 1.5856945552986137
Energy: 1.5492692097202494
Energy: 1.2581690048488574
Energy: 1.266880859643188
Energy: 1.2581690048500882
Energy: 1.266880859643188
Energy: 1.2581690048500882
Energy: 1.266880859643188
Energy: 1.7903212199602108
Energy: 1.8045929257078392
Energy: 1.7903212199614416
Energy: 1.8045929257078392
Energy: 1.7903212199614416
Energy: 1.8045929257078392

minimum gb energy = 1.194199308100767 eV
minimum distance =  2.59223032437923 Angstroms
sigma value = 9


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

Energy: 1.0531226073948974
Energy: 1.3591073616845861
Energy: 1.0531226073948974
Energy: 1.3591073616845861
Energy: 1.0531226073948974
Energy: 1.3591073616845861
Energy: 1.774931746563905
Energy: 1.3950421019060275
Energy: 1.774931746563905
Energy: 1.3950421019060275
Energy: 1.774931746563905
Energy: 1.3950421019060275
Energy: 1.1134469712619228
Energy: 1.9745297801957025
Energy: 1.1134469712653814
Energy: 1.9745297801922432
Energy: 1.1134469712619228
Energy: 1.9745297801957025
Energy: 1.0617589247880546
Energy: 1.0370194539922029
Energy: 1.0617589247880546
Energy: 1.0370194539922029
Energy: 1.0617589247880546
Energy: 1.0370194539922029
Energy: 1.3635975677659333
Energy: 1.297140513537402
Energy: 1.3635975677659333
Energy: 1.297140513537402
Energy: 1.3635975677659333
Energy: 1.297140513537402
Energy: 1.4420958571449438
Energy: 1.8935268402971304
Energy: 1.4420958571414852
Energy: 1.8935268402971304
Energy: 1.4420958571380265
Energy: 1.8935268402971304
Energy: 1.1648214246154118
Energy: 1.6404472381634576
Energy: 1.1648214246154118
Energy: 1.6404472381600614
Energy: 1.1648214246188704
Energy: 1.6404472381634576
Energy: 1.0242759827940504
Energy: 1.3889147838166376
Energy: 1.0242759827940504
Energy: 1.3889147838166376
Energy: 1.0242759827940504
Energy: 1.3889147838166376
Energy: 1.9735042068126485
Energy: 1.2516151020940223
Energy: 1.9735042068161073
Energy: 1.2516151020940223
Energy: 1.9735042068126485
Energy: 1.2516151020940223
Energy: 1.3328975527706777
Energy: 1.806561737904401
Energy: 1.3328975527706777
Energy: 1.806561737904401
Energy: 1.3328975527672187
Energy: 1.806561737904401
Energy: 1.0625330982263503
Energy: 1.0436213821167073
Energy: 1.0625330982263503
Energy: 1.0436213821167073
Energy: 1.0625330982263503
Energy: 1.0436213821167073
Energy: 1.163941523915778
Energy: 1.180085694455862
Energy: 1.163941523915778
Energy: 1.180085694455862
Energy: 1.163941523915778
Energy: 1.180085694455862
Energy: 1.5777096689620698
Energy: 1.127846799610119
Energy: 1.5777096689620698
Energy: 1.127846799610119
Energy: 1.5777096689620698
Energy: 1.127846799610119
Energy: 1.0526589285431682
Energy: 1.359486690017589
Energy: 1.0526589285500856
Energy: 1.3594866900141305
Energy: 1.0526589285466268
Energy: 1.3594866900141305
Energy: 1.0477079208747715
Energy: 1.4053285408597929
Energy: 1.0477079208713125
Energy: 1.4053285408597929
Energy: 1.0477079208713125
Energy: 1.4053285408597929
Energy: 1.8154449488549056
Energy: 1.0329930733450035
Energy: 1.8154449488549056
Energy: 1.0329930733450035
Energy: 1.8154449488549056
Energy: 1.0329930733415449
Energy: 1.4886905873963254
Energy: 1.615073872233138
Energy: 1.4886905873928666
Energy: 1.615073872233138
Energy: 1.4886905873963254
Energy: 1.615073872233138
Energy: 1.062931783266415
Energy: 1.3508930350760193
Energy: 1.0629317832629561
Energy: 1.3508930350760193
Energy: 1.062931783266415
Energy: 1.3508930350760193
Energy: 0.9864431820647167
Energy: 1.4716777986701768
Energy: 0.9864431820612579
Energy: 1.4716777986701768
Energy: 0.9864431820647167
Energy: 1.4716777986701768
Energy: 2.4126872497058636
Energy: 1.3217206121105836
Energy: 2.4126872497024046
Energy: 1.3285141463555208
Energy: 2.4126872497058636
Energy: 1.3285141463555208
Energy: 0.9840081324892379
Energy: 1.4716659052635053
Energy: 0.9840081324892379
Energy: 1.4716659052635053
Energy: 0.9840081324892379
Energy: 1.4716659052635053
Energy: 1.0621362651281026
Energy: 1.3509144514853455
Energy: 1.0621362651281026
Energy: 1.3509144514853455
Energy: 1.0621362651281026
Energy: 1.3509144514853455
Energy: 1.4886234107059237
Energy: 1.6122903826010735
Energy: 1.4886234107059237
Energy: 1.612290382597615
Energy: 1.4886234107059237
Energy: 1.6122903826010735
Energy: 1.8154757775292178
Energy: 1.000095350029332
Energy: 1.8154757775292178
Energy: 1.000095349642142
Energy: 1.8154757775292178
Energy: 1.000095350077754
Energy: 1.047931536496006
Energy: 1.405330624226529
Energy: 1.047931536496006
Energy: 1.405330624226529
Energy: 1.047931536496006
Energy: 1.405330624226529
Energy: 1.0534253258494968
Energy: 1.3598933220132396
Energy: 1.0534253258460382
Energy: 1.3598933220132396
Energy: 1.0534253258494968
Energy: 1.3598933220132396
Energy: 1.5775986393478738
Energy: 1.1275718582677072
Energy: 1.5775986393478738
Energy: 1.1275718582642482
Energy: 1.5775986393478738
Energy: 1.1275718582677072
Energy: 1.1636723309959842
Energy: 1.0099289787935395
Energy: 1.1636723309959842
Energy: 1.0099289787935395
Energy: 1.1636723309959842
Energy: 1.0099289787935395
Energy: 1.0632409981708342
Energy: 1.043707976481909
Energy: 1.0632409981708342
Energy: 1.043707976481909
Energy: 1.0632409981708342
Energy: 1.043707976481909
Energy: 1.332482005150395
Energy: 2.2719080112813077
Energy: 1.3324820051469362
Energy: 2.2719080112813077
Energy: 1.332482005150395
Energy: 2.2719080112813077
Energy: 1.9154884837817403
Energy: 1.2492700804386772
Energy: 1.9154884837817403
Energy: 1.2492700804386772
Energy: 1.9154884837851989
Energy: 1.2492700804352184
Energy: 1.02431589537218
Energy: 1.3889595211783559
Energy: 1.02431589537218
Energy: 1.3889595211783559
Energy: 1.02431589537218
Energy: 1.3889595211783559
Energy: 1.1652224194376277
Energy: 1.6403815676846938
Energy: 1.165222419434169
Energy: 1.6403815676846938
Energy: 1.1652224194376277
Energy: 1.6403815676846938
Energy: 1.4417675912120642
Energy: 2.2368838466671623
Energy: 1.4417675912120642
Energy: 2.2368838466671623
Energy: 1.4417675912155228
Energy: 2.2368838466671623
Energy: 1.3636478923791606
Energy: 1.2969380814346358
Energy: 1.3636478923791606
Energy: 1.2969380814346358
Energy: 1.3636478923791606
Energy: 1.2969380814346358
Energy: 1.0616531514676948
Energy: 1.0371542187831027
Energy: 1.0616531514676948
Energy: 1.0371542187831027
Energy: 1.0616531514676948
Energy: 1.0371542187831027
Energy: 1.113333118495763
Energy: 1.9744139122664057
Energy: 1.113333118495763
Energy: 1.9744139122664057
Energy: 1.113333118495763
Energy: 1.9744139122664057
Energy: 1.7750305448475514
Energy: 1.40429961222881
Energy: 1.7750305448475514
Energy: 1.40429961222881
Energy: 1.7750305448475514
Energy: 1.40429961222881
Energy: 1.0531226073948974
Energy: 1.3591073616811273
Energy: 1.0531226073948974
Energy: 1.3591073616845861
Energy: 1.0531226073948974
Energy: 1.3591073616845861
Energy: 1.774931746570822
Energy: 1.4505048520637527
Energy: 1.7749317465673635
Energy: 1.4505048520637527
Energy: 1.7749317465673635
Energy: 1.4505048520637527
Energy: 1.1134469712619228
Energy: 1.9745297801922432
Energy: 1.1134469712619228
Energy: 1.9745297801957025
Energy: 1.1134469712619228
Energy: 1.9745297801922432
Energy: 1.0617589247880546
Energy: 1.0370194539956614
Energy: 1.0617589247880546
Energy: 1.0370194539956614
Energy: 1.0617589247880546
Energy: 1.0370194539956614
Energy: 1.363597567769392
Energy: 1.297140513537402
Energy: 1.363597567769392
Energy: 1.297140513537402
Energy: 1.363597567769392
Energy: 1.297140513537402

minimum gb energy = 0.9840081324892379 eV
minimum distance =  2.57355340352699 Angstroms
sigma value = 57


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

Energy: 0.41887163180592224
Energy: 0.4298735709891467
Energy: 0.41887163180592224
Energy: 0.42987357098835927
Energy: 0.41887163180592224
Energy: 0.42987357098835927
Energy: 1.3613889923002744
Energy: 1.3749304457447562
Energy: 1.3613889923002744
Energy: 1.3749304457455436
Energy: 1.3613889923002744
Energy: 1.3749304457447562
Energy: 0.4783460814070357
Energy: 1.3074319246290782
Energy: 0.47834608140624835
Energy: 1.3074319246290782
Energy: 0.47834608140624835
Energy: 1.3074319246298658
Energy: 0.43209900902844905
Energy: 0.4186431615415407
Energy: 0.43209900902844905
Energy: 0.4186431615415407
Energy: 0.43209900902766163
Energy: 0.418643161542328
Energy: 0.5439291911655154
Energy: 0.5455682776422089
Energy: 0.5439291911655154
Energy: 0.5455682776422089
Energy: 0.5439291911655154
Energy: 0.5455682776414216
Energy: 0.4188930793710094
Energy: 1.6026840004881608
Energy: 0.4188930793710094
Energy: 1.6026840004881608
Energy: 0.4188930793710094
Energy: 1.6026840004881608
Energy: 0.4188831953718934
Energy: 1.6024912647524643
Energy: 0.41888319537110597
Energy: 1.6024912647532517
Energy: 0.41888319537110597
Energy: 1.6024912647532517
Energy: 0.5409242104582217
Energy: 0.5452512928061167
Energy: 0.540924210459009
Energy: 0.5452512928061167
Energy: 0.5409242104582217
Energy: 0.5452512928069041
Energy: 0.4320828735657446
Energy: 0.4186379081693461
Energy: 0.4320828735649572
Energy: 0.4186379081693461
Energy: 0.4320828735649572
Energy: 0.4186379081693461
Energy: 0.4782913524907917
Energy: 1.307514425229811
Energy: 0.4782913524907917
Energy: 1.3075144252305984
Energy: 0.4782913524907917
Energy: 1.307514425229811
Energy: 1.361406216407797
Energy: 1.3749086490479696
Energy: 1.361406216407797
Energy: 1.3749086490463949
Energy: 1.361406216407797
Energy: 1.3749086490471822
Energy: 0.4188716318067095
Energy: 0.42987357098835927
Energy: 0.4188716318067095
Energy: 0.42987357098835927
Energy: 0.4188716318067095
Energy: 0.42987357098835927
Energy: 1.3613889923002744
Energy: 1.3749304457439686
Energy: 1.3613889923002744
Energy: 1.3749304457431817
Energy: 1.3613889923002744
Energy: 1.3749304457439686
Energy: 0.47834608140624835
Energy: 1.3074319246275035
Energy: 0.47834608140624835
Energy: 1.3074319246275035
Energy: 0.4783460814070357
Energy: 1.3074319246282908
Energy: 0.43209900902844905
Energy: 0.4186431615415407
Energy: 0.43209900902844905
Energy: 0.4186431615415407
Energy: 0.43209900902844905
Energy: 0.4186431615415407
Energy: 0.5439291911663028
Energy: 0.5455682776414216
Energy: 0.5439291911655154
Energy: 0.5455682776414216
Energy: 0.5439291911663028
Energy: 0.5455682776414216
Energy: 0.4188930793710094
Energy: 1.6026840004881608
Energy: 0.4188930793710094
Energy: 1.6026840004881608
Energy: 0.4188930793710094
Energy: 1.6026840004881608
Energy: 0.41888319537110597
Energy: 1.6024912647532517
Energy: 0.41888319537110597
Energy: 1.6024912647532517
Energy: 0.4188831953718934
Energy: 1.6024912647532517
Energy: 0.5409242104597964
Energy: 0.5452512928061167
Energy: 0.5409242104597964
Energy: 0.5452512928061167
Energy: 0.5409242104597964
Energy: 0.5452512928061167

minimum gb energy = 0.4186379081693461 eV
minimum distance =  2.65471748726968 Angstroms
sigma value = 11


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

Energy: 0.9304000149322775
Energy: 1.1466550829513154
Energy: 0.9304000149288172
Energy: 1.1466550829507385
Energy: 0.9304000149322775
Energy: 1.1466550829518922
Energy: 1.1996441378965685
Energy: 1.0756239806050312
Energy: 1.1996441378942615
Energy: 1.0756239806050312
Energy: 1.199644137908103
Energy: 1.0756239806050312
Energy: 1.2716573269181237
Energy: 2.501880571777512
Energy: 1.2716573269181237
Energy: 2.5018805717780888
Energy: 1.2716573269181237
Energy: 2.501880571777512
Energy: 1.4664244876001629
Energy: 0.8955906648177407
Energy: 1.4664244876001629
Energy: 0.8955906648177407
Energy: 1.4664244876001629
Energy: 0.8955906648188943
Energy: 1.1329065162434615
Energy: 0.8998007450452484
Energy: 1.1329065162434615
Energy: 0.8998007450464018
Energy: 1.1329065162434615
Energy: 0.8998007450458251
Energy: 1.0421422444910986
Energy: 1.3723783883621032
Energy: 1.0421422444899453
Energy: 1.3723783883615268
Energy: 1.0421422444859079
Energy: 1.3723783883621032
Energy: 1.2693604220841754
Energy: 2.066601436355291
Energy: 1.2693604220841754
Energy: 2.066601436354714
Energy: 1.269360422085329
Energy: 2.066601436355868
Energy: 1.1779361530847738
Energy: 0.8687326875200232
Energy: 1.1779361530841972
Energy: 0.8687326875194465
Energy: 1.1779361530847738
Energy: 0.8687326875200232
Energy: 1.1752878736165375
Energy: 0.8665730168286092
Energy: 1.1752878736188443
Energy: 0.8665730168286092
Energy: 1.1752878736159607
Energy: 0.866573016829186
Energy: 0.866831577263983
Energy: 2.0187554395088756
Energy: 0.8668315772605225
Energy: 2.0187554395088756
Energy: 0.866831577263983
Energy: 2.0187554395088756
Energy: 1.637052058435568
Energy: 1.5922044177980876
Energy: 1.6370520584349915
Energy: 1.5922044177980876
Energy: 1.637052058435568
Energy: 1.592204417797511
Energy: 1.1348437776576774
Energy: 0.903871982545187
Energy: 1.1348437776565239
Energy: 0.903871982545187
Energy: 1.1348437776559472
Energy: 0.9038719825457636
Energy: 1.174181857525888
Energy: 0.892175493016315
Energy: 1.174181857525888
Energy: 0.8921754930145849
Energy: 1.1741818575253111
Energy: 0.8921754930157384
Energy: 1.354346918153326
Energy: 2.27242473939161
Energy: 1.354346918153903
Energy: 2.272424739392187
Energy: 1.354346918153903
Energy: 2.272424739392187
Energy: 1.3923147373495552
Energy: 1.1109597867712147
Energy: 1.392314737343788
Energy: 1.110959786770638
Energy: 1.3923147373449414
Energy: 1.1109597867712147
Energy: 0.9698298370701574
Energy: 1.1508711789689705
Energy: 0.9698298370695805
Energy: 1.1508711789683939
Energy: 0.9698298370695805
Energy: 1.1508711789672403
Energy: 1.0317473396786851
Energy: 1.0660626528759602
Energy: 1.0317473396798387
Energy: 1.0660626528759602
Energy: 1.0317473396786851
Energy: 1.0660626528753834
Energy: 1.5445899193474568
Energy: 2.315370575052093
Energy: 1.5445899193474568
Energy: 2.315370575052093
Energy: 1.5445899193474568
Energy: 2.315370575052093
Energy: 1.7028809029691543
Energy: 0.8893823690481085
Energy: 1.7028809029691543
Energy: 0.8893823690486852
Energy: 1.7028809029691543
Energy: 0.889382369046955
Energy: 1.134623870880159
Energy: 1.0326455288800098
Energy: 1.134623870880159
Energy: 1.0326455288805865
Energy: 1.1346238708813126
Energy: 1.032645528879433
Energy: 0.8707301769205671
Energy: 1.3709973691340522
Energy: 0.8707301769199904
Energy: 1.3709973691340522
Energy: 0.8707301769199904
Energy: 1.3709973691340522
Energy: 1.4274351952652942
Energy: 2.1174094481848513
Energy: 1.4274351952664477
Energy: 2.1174094481848513
Energy: 1.4274351952664477
Energy: 2.1174094481836985
Energy: 1.383548793896885
Energy: 1.0247214414290775
Energy: 1.383548793896885
Energy: 1.0247214414285009
Energy: 1.383548793896885
Energy: 1.0247214414285009
Energy: 1.1756360890659316
Energy: 1.0008895259581767
Energy: 1.1756360890659316
Energy: 1.0008895259564465
Energy: 1.175636089066508
Energy: 1.0008895259581767
Energy: 0.8705170308913414
Energy: 2.0412620135909667
Energy: 0.870517030891918
Energy: 2.0412620135909667
Energy: 0.8705170308913414
Energy: 2.0412620135909667
Energy: 2.3949211778350183
Energy: 1.4581084723836009
Energy: 2.3949211778344415
Energy: 1.4581084723836009
Energy: 2.3949211778350183
Energy: 1.4581084723836009

minimum gb energy = 0.8665730168286092 eV
minimum distance =  2.56261083221241 Angstroms
sigma value = 41


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

Energy: 1.1708498948827653
Energy: 1.0092995119639707
Energy: 1.170849894881402
Energy: 1.0092995119635162
Energy: 1.170849894881402
Energy: 1.0092995119635162
Energy: 1.262783213210517
Energy: 1.310869475885729
Energy: 1.262783213211426
Energy: 1.310869475885729
Energy: 1.262783213211426
Energy: 1.310869475885729
Energy: 1.5112081168014504
Energy: 2.548570222400973
Energy: 1.5112081168009956
Energy: 2.548570222400973
Energy: 1.5112081168009956
Energy: 2.548570222400973
Energy: 1.8284514774439287
Energy: 0.9969792408446183
Energy: 1.8284514774434741
Energy: 0.9969792408441637
Energy: 1.8284514774439287
Energy: 0.9969792408441637
Energy: 0.9746637585195804
Energy: 1.0440501539655729
Energy: 0.9746637585195804
Energy: 1.0440501539655729
Energy: 0.9746637585195804
Energy: 1.0440501539660274
Energy: 1.6550230437861289
Energy: 1.5203494498361156
Energy: 1.6550230437856743
Energy: 1.5203494498365702
Energy: 1.6550230437870381
Energy: 1.5203494498365702
Energy: 1.230185177699896
Energy: 2.2576047098383754
Energy: 1.2301851777012598
Energy: 2.257604709838829
Energy: 1.2301851777008053
Energy: 2.257604709838829
Energy: 1.3910516884479485
Energy: 0.9970060168412233
Energy: 1.391051688448403
Energy: 0.9970060168412233
Energy: 1.3910516884479485
Energy: 0.9970060168412233
Energy: 1.0179184713374423
Energy: 1.038069167892045
Energy: 1.0179184713369878
Energy: 1.038069167892045
Energy: 1.0179184713369878
Energy: 1.038069167892045
Energy: 1.6368497488098246
Energy: 1.7375535735469003
Energy: 1.636849748810279
Energy: 1.7375535735469003
Energy: 1.636849748810279
Energy: 1.7375535735469003
Energy: 1.6432936040697073
Energy: 1.7835285952537236
Energy: 1.6432936040710708
Energy: 1.7835285952537236
Energy: 1.6432936040624342
Energy: 1.7835285952537236
Energy: 1.2417136997963805
Energy: 1.1330602160031924
Energy: 1.2417136997968352
Energy: 1.1330602160031924
Energy: 1.2417136997968352
Energy: 1.1330602160041015
Energy: 1.0266832131436487
Energy: 0.9973209224813974
Energy: 1.0266832131427397
Energy: 0.9973209224813974
Energy: 1.0266832131436487
Energy: 0.9973209224813974
Energy: 0.9668483617178284
Energy: 2.0426524308283707
Energy: 0.9668483617178284
Energy: 2.0426524308283707
Energy: 0.9668483617178284
Energy: 2.0426524308283707
Energy: 1.66441337127839
Energy: 1.6826397560084425
Energy: 1.66441337127839
Energy: 1.6826397560084425
Energy: 1.6644133712779352
Energy: 1.6826397560084425
Energy: 0.9765306938436371
Energy: 1.1639811317929314
Energy: 0.9765306938431825
Energy: 1.1639811317947495
Energy: 0.9765306938436371
Energy: 1.1639811317933861
Energy: 1.0280845954317528
Energy: 0.9971553157064389
Energy: 1.0280845954317528
Energy: 0.9971553157059844
Energy: 1.0280845954317528
Energy: 0.9971553157068934
Energy: 1.3140919175993993
Energy: 1.915188988070023
Energy: 1.3140919176003083
Energy: 1.9151889880713866
Energy: 1.3140919176003083
Energy: 1.915188988070023
Energy: 1.2668267125185277
Energy: 1.3185993019601916
Energy: 1.266826712518073
Energy: 1.3185993019606461
Energy: 1.266826712517164
Energy: 1.3185993019601916
Energy: 1.0505104276318207
Energy: 1.2980317691035075
Energy: 1.050510427631366
Energy: 1.2980317691035075
Energy: 1.0505104276322752
Energy: 1.2980317691035075
Energy: 1.0148940682455079
Energy: 1.3073863284663536
Energy: 1.0148940682455079
Energy: 1.3073863284663536
Energy: 1.0148940682459626
Energy: 1.3073863284658993
Energy: 1.5302627776651638
Energy: 1.9766054278169198
Energy: 1.5302627776651638
Energy: 1.9766054278141927
Energy: 1.5302627776660316
Energy: 1.9766054278155563
Energy: 1.784400233910543
Energy: 0.9963642701597454
Energy: 1.784400233910543
Energy: 0.9963642701597454
Energy: 1.784400233910543
Energy: 0.9963642701601999
Energy: 0.9769271604710502
Energy: 1.3877502266661406
Energy: 0.9769271604715046
Energy: 1.3877502266661406
Energy: 0.9769271604715046
Energy: 1.387750226665686
Energy: 0.9750842910503744
Energy: 1.521163916300152
Energy: 0.9750842910490108
Energy: 1.5211639163006068
Energy: 0.9750842910494653
Energy: 1.521163916300152
Energy: 1.55123497114919
Energy: 0.9978874906923255
Energy: 1.55123497114919
Energy: 0.9978874906927803
Energy: 1.5512349711500988
Energy: 0.9978874906955076
Energy: 0.9126280471082503
Energy: 0.9965057453438245
Energy: 0.912628047107341
Energy: 0.9965057453442789
Energy: 0.9126280471077957
Energy: 0.9965057453442789
Energy: 1.0153016065399558
Energy: 1.2807469936696123
Energy: 1.0153016065399558
Energy: 1.2807469936696123
Energy: 1.0153016065399558
Energy: 1.2807469936696123
Energy: 1.0513963374751711
Energy: 1.5414980782347778
Energy: 1.051396337474262
Energy: 1.5414980782329595
Energy: 1.0513963374751711
Energy: 1.5414980782352325
Energy: 1.7900646993966811
Energy: 1.0501717360338574
Energy: 1.7900646993962264
Energy: 1.0501717360338574
Energy: 1.7900646993966811
Energy: 1.050171736033403
Energy: 1.260790134350073
Energy: 1.3608900459953457
Energy: 1.260790134350073
Energy: 1.3608900459953457
Energy: 1.2607901343505274
Energy: 1.3608900459944366
Energy: 1.0277924849925466
Energy: 0.9983807205390204
Energy: 1.0277924849925466
Energy: 0.9983807205390204
Energy: 1.0277924849930011
Energy: 0.9983807205390204
Energy: 0.9648017971464524
Energy: 1.2311978594113795
Energy: 0.9648017971473616
Energy: 1.2311978594113795
Energy: 0.9648017971469071
Energy: 1.2311978594118342

minimum gb energy = 0.912628047107341 eV
minimum distance =  2.57547127630727 Angstroms
sigma value = 33


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

Energy: 1.1909808736282343
Energy: 1.1435380872874725
Energy: 1.1416810376923896
Energy: 1.1435380872906624
Energy: 1.1909808736250442
Energy: 1.1435380872906624
Energy: 1.7132166399664939
Energy: 1.0313138131229562
Energy: 1.7132166399633038
Energy: 1.0313138131229562
Energy: 1.7132166399664939
Energy: 1.0313138131229562
Energy: 1.690092670800053
Energy: 2.465716033069707
Energy: 1.690092670800053
Energy: 2.465716033069707
Energy: 1.690092670800053
Energy: 2.465716033069707
Energy: 1.8029880523196997
Energy: 1.1385277603822823
Energy: 1.80298805232289
Energy: 1.1385277603822823
Energy: 1.8029880523260804
Energy: 1.1385277603822823
Energy: 1.1397819312977842
Energy: 1.6119966961807333
Energy: 1.1397819781951588
Energy: 1.6119966961807333
Energy: 1.1397819312977842
Energy: 1.6119966961807333
Energy: 1.619519411358707
Energy: 1.3865292609474433
Energy: 1.619519411358707
Energy: 1.3865292609474433
Energy: 1.6195194113555167
Energy: 1.3865292609474433
Energy: 1.5235760800138671
Energy: 1.7663941084422983
Energy: 1.5235760800138671
Energy: 1.7663941084422983
Energy: 1.5235760800138671
Energy: 1.7663941084391082
Energy: 1.5917350431899107
Energy: 1.5597054566481503
Energy: 1.5917350431867203
Energy: 1.55970545664496
Energy: 1.5917350431867203
Energy: 1.5597054566481503
Energy: 1.5840940822105474
Energy: 1.196725216968918
Energy: 1.5854266105275914
Energy: 1.1967252169721083
Energy: 1.5840940822105474
Energy: 1.196725216968918
Energy: 1.5056187451168137
Energy: 1.3222292258677635
Energy: 1.5056187446416487
Energy: 1.3222292258677635
Energy: 1.5056187445619518
Energy: 1.3222292258677635
Energy: 2.1853596505924684
Energy: 2.0503503860552867
Energy: 2.1853596505956583
Energy: 2.050350386058477
Energy: 2.1853596505956583
Energy: 2.050350386058477
Energy: 1.936147239737736
Energy: 1.1385604408384205
Energy: 1.936147239737736
Energy: 1.1385604408352301
Energy: 1.936147239737736
Energy: 1.1385604408352301
Energy: 1.1517263196111247
Energy: 1.5921857234225194
Energy: 1.1517263196111247
Energy: 1.5921857234225194
Energy: 1.1517263196079346
Energy: 1.5921857234225194
Energy: 1.5448643974040865
Energy: 1.5916094747028364
Energy: 1.5448643974040865
Energy: 1.591609474699646
Energy: 1.5448643974040865
Energy: 1.591609474699646
Energy: 1.5654127727643918
Energy: 1.3806767328809584
Energy: 1.5654127727612015
Energy: 1.3806767328809584
Energy: 1.5654127727643918
Energy: 1.3806767328777683
Energy: 1.4099297609192323
Energy: 1.374996237160638
Energy: 1.4099297609224224
Energy: 1.374996237160638
Energy: 1.4099297609224224
Energy: 1.374996237160638
Energy: 1.5821107760826758
Energy: 1.1413446237980558
Energy: 1.582110776079486
Energy: 1.141344623801246
Energy: 1.582110776079486
Energy: 1.141344623801246
Energy: 1.121534735878299
Energy: 1.847797930075449
Energy: 1.1214197897195022
Energy: 1.847797930075449
Energy: 1.121534735878299
Energy: 1.847797930075449
Energy: 1.8431726406678373
Energy: 1.6893510885222691
Energy: 1.8431726406678373
Energy: 1.6893510885222691
Energy: 1.8431726406678373
Energy: 1.6893510885222691
Energy: 1.6115075554199347
Energy: 1.1630368155359991
Energy: 1.6115075554199347
Energy: 1.1630368155359991
Energy: 1.6115075554167444
Energy: 1.1630368155359991
Energy: 1.1446618613881232
Energy: 1.1380741618333519
Energy: 1.1446618613881232
Energy: 1.1380741618365422
Energy: 1.1446618613881232
Energy: 1.1380741618365422
Energy: 1.0468832597976798
Energy: 1.550694054727539
Energy: 1.0469593141389215
Energy: 1.5506940547243488
Energy: 1.0468832597976798
Energy: 1.550694054727539
Energy: 1.6240902517323659
Energy: 1.5043434471636503
Energy: 1.624090251735556
Energy: 1.5043434471668407
Energy: 1.6240902517323659
Energy: 1.5043434471668407
Energy: 1.1415566673608326
Energy: 1.8390364154057648
Energy: 1.1415566673608326
Energy: 1.8390364154057648
Energy: 1.1415566673608326
Energy: 1.8390364154057648
Energy: 1.6114077015272628
Energy: 1.1418287580583966
Energy: 1.6114077015272628
Energy: 1.1418287580583966
Energy: 1.6114077015272628
Energy: 1.1418287580583966
Energy: 1.612935346432201
Energy: 1.620960614964219
Energy: 1.612935346432201
Energy: 1.6209606149674092
Energy: 1.6129353464290108
Energy: 1.620960614964219
Energy: 2.017163518698957
Energy: 1.5172639468434936
Energy: 2.017163518698957
Energy: 1.5172639468434936
Energy: 2.017163518695767
Energy: 1.5172639468434936
Energy: 1.1900257316637959
Energy: 1.1486032231176184
Energy: 1.1410771781519131
Energy: 1.1486032231144283
Energy: 1.1900257316637959
Energy: 1.1486032231144283
Energy: 1.1973066980658862
Energy: 1.6835674090431247
Energy: 1.1973066980658862
Energy: 1.6835674090399346
Energy: 1.1973066980658862
Energy: 1.6835674090399346
Energy: 1.3443670473770288
Energy: 1.672478349571953
Energy: 1.3443670473738387
Energy: 1.672478349571953
Energy: 1.3443670473738387
Energy: 1.6724783495751434
Energy: 1.8006052140876105
Energy: 1.1385947041469329
Energy: 1.8006052140908007
Energy: 1.1385947041469329
Energy: 1.8006052140939908
Energy: 1.1385947041469329
Energy: 1.1414066121082689
Energy: 1.7342102290584678
Energy: 1.141403142863773
Energy: 1.734210229061658
Energy: 1.1414066121082689
Energy: 1.734210229061658
Energy: 1.639711405741341
Energy: 1.155827441041512
Energy: 1.639711405741341
Energy: 1.1558274410383216
Energy: 1.639711405741341
Energy: 1.155827441041512
Energy: 1.878791642478476
Energy: 1.5465632949838843
Energy: 1.8787916424816662
Energy: 1.5465632949838843
Energy: 1.878791642478476
Energy: 1.5465632949870747
Energy: 1.833062727321781
Energy: 1.5622633832568316
Energy: 1.8330627273249716
Energy: 1.562263383260022
Energy: 1.8330627273249716
Energy: 1.562263383260022
Energy: 1.644117260551201
Energy: 1.2044677309567946
Energy: 1.6441195433787053
Energy: 1.2044677309567946
Energy: 1.644117260544821
Energy: 1.2044677309567946
Energy: 1.1414499204320232
Energy: 1.6667136635721902
Energy: 1.1414499204320232
Energy: 1.6667136635721902
Energy: 1.1414499204320232
Energy: 1.6667136635721902
Energy: 1.8493010095389468
Energy: 1.131346932219991
Energy: 1.849301009542137
Energy: 1.131346932219991
Energy: 1.849301009542137
Energy: 1.1313469322168008
Energy: 1.3948777135480974
Energy: 1.4293825581080093
Energy: 1.3948798568984195
Energy: 1.4293825581080093
Energy: 1.3948777135480974
Energy: 1.4293825581080093
Energy: 1.1576313126497073
Energy: 1.653213695692827
Energy: 1.1576313126528972
Energy: 1.653213695692827
Energy: 1.1576313126497073
Energy: 1.653213695692827
Energy: 1.1408525675264511
Energy: 1.1480082500494944
Energy: 1.1408525675296413
Energy: 1.148008250046304
Energy: 1.1408525675296413
Energy: 1.148008250046304
Energy: 2.0569148883351374
Energy: 1.3836680018793666
Energy: 2.0569148883351374
Energy: 1.3836680018793666
Energy: 2.0569148883383277
Energy: 1.3836680018793666
Energy: 1.6752902923716106
Energy: 1.6228922471985074
Energy: 1.6752902923716106
Energy: 1.6228922471985074
Energy: 1.6752902923716106
Energy: 1.6228922471985074
Energy: 1.5633595615045044
Energy: 1.141951657930353
Energy: 1.5633595615045044
Energy: 1.141951657930353
Energy: 1.5633595615076947
Energy: 1.141951657930353
Energy: 1.141691354473244
Energy: 1.8891818606283686
Energy: 1.1416895777527767
Energy: 1.8891818606283686
Energy: 1.141691354473244
Energy: 1.8891818606283686
Energy: 1.623314332698964
Energy: 1.4757475011480143
Energy: 1.623314332698964
Energy: 1.475747501144824
Energy: 1.623314332698964
Energy: 1.475747501144824
Energy: 1.0403544532831794
Energy: 1.4830368192493137
Energy: 1.0403544532799893
Energy: 1.4830368192493137
Energy: 1.0403544532767992
Energy: 1.4830368192493137

minimum gb energy = 1.0313138131229562 eV
minimum distance =  2.52855444106502 Angstroms
sigma value = 67


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

Energy: 1.244755674099465
Energy: 0.9985487753505448
Energy: 1.244755674099465
Energy: 0.9985487753505448
Energy: 1.244755674099465
Energy: 0.9985487753505448
Energy: 1.2335376739134327
Energy: 1.0413981767241207
Energy: 1.2335376739134327
Energy: 1.0413981767241207
Energy: 1.233537673915565
Energy: 1.0413981767241207
Energy: 1.9285454066189496
Energy: 1.5324521933877826
Energy: 1.9285454066189496
Energy: 1.5324521933877826
Energy: 1.4589602315004455
Energy: 1.5324521933877826
Energy: 1.2335551032147793
Energy: 1.0414284381750276
Energy: 1.2335551032147793
Energy: 1.0414284381750276
Energy: 1.2335551032147793
Energy: 1.0414284381750276
Energy: 1.244755674101597
Energy: 0.9985487753505448
Energy: 1.244755674101597
Energy: 0.9985487753505448
Energy: 1.244755674101597
Energy: 0.9985487753505448
Energy: 1.233537673915565
Energy: 1.0413981767241207
Energy: 1.233537673915565
Energy: 1.0413981767241207
Energy: 1.233537673915565
Energy: 1.0413981767241207
Energy: 1.4589602315025776
Energy: 1.5324521933856505
Energy: 1.4589602315004455
Energy: 1.5324521933877826
Energy: 1.4589602315025776
Energy: 1.5324521933877826

minimum gb energy = 0.9985487753505448 eV
minimum distance =  2.50219477145775 Angstroms
sigma value = 3


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

Energy: 1.7123414844292355
Energy: 1.3839192581081805
Energy: 1.7123414844292355
Energy: 1.3839192581081805
Energy: 1.7123414844292355
Energy: 1.383919258111082
Energy: 1.6495647749622626
Energy: 1.5217322433240512
Energy: 1.6495647749622626
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Energy: 1.493083479775488
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Energy: 1.7950144966167474
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Energy: 1.9302909745802723
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Energy: 1.72668087286533
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Energy: 1.9952368640557625
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Energy: 1.9952368640557625
Energy: 1.561672485494465
Energy: 1.699946379441567
Energy: 1.5616724854973665
Energy: 1.699946379441567
Energy: 1.5616724854973665
Energy: 1.699946379441567
Energy: 1.636353094354097
Energy: 1.4677273554673078
Energy: 1.6363530943569982
Energy: 1.4677273554673078
Energy: 1.6363530943569982
Energy: 1.467727355470209
Energy: 2.0466957852752943
Energy: 1.3397761374205588
Energy: 2.0466957852752943
Energy: 1.3397761374205588
Energy: 2.0466957852752943
Energy: 1.3397761374205588
Energy: 1.4309915885084996
Energy: 2.012756161141377
Energy: 1.4309915885084996
Energy: 2.012756161141377
Energy: 1.4309915885084996
Energy: 2.012756161141377
Energy: 1.540451857202975
Energy: 1.5049069495413872
Energy: 1.5404518572058765
Energy: 1.5049069495413872
Energy: 1.540451857202975
Energy: 1.5049069495413872
Energy: 1.779337623431863
Energy: 1.598500302477945
Energy: 1.779337623431863
Energy: 1.598500302477945
Energy: 1.779337623431863
Energy: 1.598500302477945
Energy: 2.0261771671045263
Energy: 1.4876983779413027
Energy: 2.0261771671045263
Energy: 1.4876983779413027
Energy: 2.0261771671045263
Energy: 1.4876983779413027
Energy: 1.378243868621484
Energy: 1.8826909467933604
Energy: 1.378243868621484
Energy: 1.8826909467933604
Energy: 1.378243868621484
Energy: 1.8826909467933604
Energy: 1.3782848629543267
Energy: 1.4760258202376262
Energy: 1.3782848629543267
Energy: 1.4760258202405279
Energy: 1.3782848629543267
Energy: 1.4760258202405279
Energy: 1.6832129806954523
Energy: 1.5536262259325873
Energy: 1.6832129806954523
Energy: 1.5536262259325873
Energy: 1.6832129806954523
Energy: 1.5536262259325873
Energy: 1.9422975648754326
Energy: 1.9124876860444242
Energy: 1.9422975648754326
Energy: 1.9124876860444242
Energy: 1.9422975648783338
Energy: 1.9124876860444242
Energy: 1.3994510405814184
Energy: 1.908076770039011
Energy: 1.39945104058432
Energy: 1.9080767700419126
Energy: 1.39945104058432
Energy: 1.9080767700419126

minimum gb energy = 1.2180797769387874 eV
minimum distance =  2.46864913632072 Angstroms
sigma value = 81


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

Energy: 1.6444679448060242
Energy: 1.4700798919847762
Energy: 1.6444679448064223
Energy: 1.4700798919847762
Energy: 1.6444679448064223
Energy: 1.4700798919843778
Energy: 1.4024389529332688
Energy: 1.611858289921586
Energy: 1.4024389529332688
Energy: 1.6118582899211882
Energy: 1.4024389529332688
Energy: 1.611858289921586
Energy: 1.3224703948225187
Energy: 1.7517285306544248
Energy: 1.3224703948225187
Energy: 1.751728530654823
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Energy: 1.4820550192209416
Energy: 1.539188387753219
Energy: 1.4820550192217377
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Energy: 1.4820550192213398
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Energy: 1.6418020936951556
Energy: 1.4084122511111776
Energy: 1.6418020936955537
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Energy: 1.641802093695952
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Energy: 1.4611908920170775
Energy: 1.7686373985735282
Energy: 1.461190892017874
Energy: 1.76863739857313
Energy: 1.461190892017476
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Energy: 1.8003310963442734
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Energy: 1.8003310963438752
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Energy: 1.4723283624803225
Energy: 1.5134488287411114
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Energy: 1.4723283624799242
Energy: 1.5134488287411114
Energy: 1.4003373105305679
Energy: 1.6143977750023994
Energy: 1.400337310530966
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Energy: 1.6143977750027978
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Energy: 1.689539635408912
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Energy: 1.9315993613479323
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Energy: 1.9315993613483304
Energy: 1.4575905295125735
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Energy: 1.629823623829499
Energy: 1.403090229420594
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Energy: 1.403090229420594
Energy: 1.6298236238291008
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Energy: 1.4985089800235283
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Energy: 1.4985089800243245
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Energy: 1.75142513866835
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Energy: 1.3785972471520644
Energy: 1.5369136277722897
Energy: 1.5434202435322362
Energy: 1.5369136277726878
Energy: 1.5434202435318383
Energy: 1.5369136277722897
Energy: 1.5434202435318383
Energy: 1.677691548983575
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Energy: 1.615197623286317
Energy: 1.779557095552641
Energy: 1.7891706089467383
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Energy: 1.7891706089463397
Energy: 1.779557095553039
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Energy: 1.9082882430773604
Energy: 1.5922155184519815
Energy: 1.9082882430773604
Energy: 1.5922155184523799
Energy: 1.9082882430781571
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Energy: 1.637349153537631
Energy: 1.634786020359971
Energy: 1.637349153537631
Energy: 1.634786020359971
Energy: 1.5800664603572538
Energy: 1.4973589431422307
Energy: 1.5800664603572538
Energy: 1.4973589431422307
Energy: 1.5800664603572538
Energy: 1.4973589431422307
Energy: 1.9224858730823176
Energy: 1.6107812759210982
Energy: 1.9224858730831138
Energy: 1.6107812759214963
Energy: 1.9224858730823176
Energy: 1.6107812759214963
Energy: 1.5509834140200829
Energy: 1.501313431945379
Energy: 1.5509834140200829
Energy: 1.5013134319441845
Energy: 1.5509834140200829
Energy: 1.5013134319449808
Energy: 1.4970439836754494
Energy: 1.601665860697121
Energy: 1.4970439836758478
Energy: 1.6016658606967225
Energy: 1.4970439836758478
Energy: 1.6016658606967225
Energy: 1.6117462789126629
Energy: 1.4061403149133584
Energy: 1.611746278912265
Energy: 1.4061403149129605
Energy: 1.6117462789118666
Energy: 1.4061403149129605
Energy: 1.751712898281874
Energy: 1.3535390641588119
Energy: 1.751712898281476
Energy: 1.35353906415921
Energy: 1.751712898281476
Energy: 1.3535390641588119
Energy: 1.7529672037685098
Energy: 1.9282790749328742
Energy: 1.7529672037685098
Energy: 1.928279074932476
Energy: 1.752967203768908
Energy: 1.9282790749328742
Energy: 1.4542460031264013
Energy: 1.63470102587801
Energy: 1.4542460031267994
Energy: 1.63470102587801
Energy: 1.4542460031267994
Energy: 1.6347010258776116
Energy: 1.4730883581134109
Energy: 1.511780104340028
Energy: 1.473088358113809
Energy: 1.511780104340028
Energy: 1.4730883581134109
Energy: 1.5117801043404264
Energy: 1.7183896612489113
Energy: 1.338517412351269
Energy: 1.718389661248513
Energy: 1.338517412350871
Energy: 1.718389661248513
Energy: 1.338517412350871
Energy: 1.366651240122429
Energy: 1.991085821749829
Energy: 1.366651240122429
Energy: 1.991085821749829
Energy: 1.3666512401220305
Energy: 1.991085821749829
Energy: 1.5824165825614305
Energy: 1.560466130590838
Energy: 1.5824165825618284
Energy: 1.560466130590838
Energy: 1.5824165825614305
Energy: 1.56046613059044
Energy: 1.61133354003512
Energy: 1.634922382164534
Energy: 1.6113335400343238
Energy: 1.634922382164534
Energy: 1.61133354003512
Energy: 1.634922382164534
Energy: 1.7947219494161568
Energy: 1.7573285869869513
Energy: 1.7947219494157587
Energy: 1.7573285869869513
Energy: 1.7947219494161568
Energy: 1.7573285869869513

minimum gb energy = 1.3224703948225187 eV
minimum distance =  2.5408026191339 Angstroms
sigma value = 43


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

Energy: 1.967434600135267
Energy: 1.336640209693156
Energy: 1.9674346001357563
Energy: 1.336640209693156
Energy: 1.9674346001357563
Energy: 1.336640209693156
Energy: 1.6696980519714562
Energy: 1.6436624124533588
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Energy: 1.6436624124528696
Energy: 1.6696980519714562
Energy: 1.6436624124528696
Energy: 1.3116711369802911
Energy: 1.8620359485062645
Energy: 1.311671136979802
Energy: 1.8620359485057754
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Energy: 1.7110223166043808
Energy: 1.5346121093342193
Energy: 1.7110223166048697
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Energy: 1.7110223166048697
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Energy: 1.4761469282241557
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Energy: 1.7453870845881043
Energy: 1.4761469282246447
Energy: 1.4961770944825163
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Energy: 1.6864914451422188
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Energy: 1.7244760002625885
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Energy: 1.6778528830304575
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Energy: 1.6778528830294792
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Energy: 1.3739096014832068
Energy: 1.7182144060086002
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Energy: 1.7182144060090894
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Energy: 1.5413422228712392
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Energy: 1.5413422228722176
Energy: 1.6877246110479067
Energy: 1.5389053807372888
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Energy: 1.6877246110479067
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Energy: 1.5909787902116468
Energy: 1.7121264817302302
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Energy: 1.5909787902116468
Energy: 1.7121264817302302
Energy: 1.5215431281265754
Energy: 1.9242224899680944
Energy: 1.5215431281260865
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Energy: 1.5215431281260865
Energy: 1.9242224899685838
Energy: 1.837714158480225
Energy: 1.3897645043034192
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Energy: 1.3897645043034192
Energy: 1.837714158480225
Energy: 1.38976450430293
Energy: 1.5831592510366217
Energy: 1.4778543841543972
Energy: 1.5831592510366217
Energy: 1.4778543841543972
Energy: 1.5831592510366217
Energy: 1.4778543841548861
Energy: 1.611495316446519
Energy: 1.5334946089928165
Energy: 1.611495316446519
Energy: 1.533494608993306
Energy: 1.611495316446519
Energy: 1.5334946089918382
Energy: 1.8807789858904844
Energy: 1.6951541666935688
Energy: 1.8807789858904844
Energy: 1.695154166694058
Energy: 1.8807789858904844
Energy: 1.6951541666935688
Energy: 1.883157894008149
Energy: 1.63220022816353
Energy: 1.8831578940086384
Energy: 1.63220022816353
Energy: 1.883157894008149
Energy: 1.63220022816353
Energy: 1.5413291622879242
Energy: 1.6275572922481059
Energy: 1.5413291622879242
Energy: 1.6275572922481059
Energy: 1.5413291622879242
Energy: 1.6275572922481059
Energy: 1.6257211142587087
Energy: 1.458846989267201
Energy: 1.6257211142587087
Energy: 1.4588469892667115
Energy: 1.625721114259198
Energy: 1.458846989267201
Energy: 1.7930435786566001
Energy: 1.272876634451242
Energy: 1.7930435786561112
Energy: 1.272876634450753
Energy: 1.7930435786575785
Energy: 1.272876634450753
Energy: 1.5017175351304992
Energy: 1.667705839173315
Energy: 1.5017175351304992
Energy: 1.667705839173315
Energy: 1.5017175351300103
Energy: 1.6677058391728259
Energy: 1.450761301776538
Energy: 1.6869013418757053
Energy: 1.450761301776538
Energy: 1.6869013418752163
Energy: 1.450761301777027
Energy: 1.6869013418766836
Energy: 1.6590195389457074
Energy: 1.4966423311545705
Energy: 1.6590195389457074
Energy: 1.4966423311545705
Energy: 1.6590195389457074
Energy: 1.496642331154081
Energy: 1.8485552936745668
Energy: 1.3725965897305408
Energy: 1.8485552936745668
Energy: 1.3725965897305408
Energy: 1.848555293675056
Energy: 1.3725965897305408
Energy: 1.3778050939774384
Energy: 1.6993179066942528
Energy: 1.3778050939779276
Energy: 1.6993179066947417
Energy: 1.3778050939779276
Energy: 1.6993179066942528
Energy: 1.5789201055735267
Energy: 1.533284559222244
Energy: 1.5789201055735267
Energy: 1.533284559222244
Energy: 1.5789201055745046
Energy: 1.533284559222244
Energy: 1.7540148345749924
Energy: 1.4692764676372754
Energy: 1.7540148345749924
Energy: 1.4692764676367864
Energy: 1.7540148345749924
Energy: 1.4692764676367864
Energy: 1.645580546448465
Energy: 1.7795435113982498
Energy: 1.645580546448465
Energy: 1.7795435113982498
Energy: 1.645580546448465
Energy: 1.7795435113982498
Energy: 1.5199677996175192
Energy: 1.7800874933257205
Energy: 1.5199677996175192
Energy: 1.7800874933257205
Energy: 1.5199677996175192
Energy: 1.7800874933257205

minimum gb energy = 1.272876634450753 eV
minimum distance =  2.47678176031225 Angstroms
sigma value = 57


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

Energy: 1.83996805011485
Energy: 1.3219753188032428
Energy: 1.83996805011485
Energy: 1.3219753188032428
Energy: 1.83996805011485
Energy: 1.3219753188032428
Energy: 1.42619940667021
Energy: 1.504624623738726
Energy: 1.42619940667021
Energy: 1.504624623739359
Energy: 1.42619940667021
Energy: 1.504624623738726
Energy: 1.3262732535862816
Energy: 1.628146233183022
Energy: 1.326273253585648
Energy: 1.6281462331823888
Energy: 1.326273253585648
Energy: 1.6281462331823888
Energy: 1.8189486784712046
Energy: 1.604657302582592
Energy: 1.818948678468671
Energy: 1.604657302582592
Energy: 1.818948678470571
Energy: 1.604657302582592
Energy: 1.778630238642313
Energy: 1.561190928509858
Energy: 1.778630238642313
Energy: 1.561190928509858
Energy: 1.778630238642313
Energy: 1.561190928509858
Energy: 1.327286031660081
Energy: 1.6259526033151386
Energy: 1.327286031660081
Energy: 1.6259526033151386
Energy: 1.327286031660081
Energy: 1.6259526033151386
Energy: 1.6710821731818284
Energy: 1.597724439382283
Energy: 1.6710821731811953
Energy: 1.597724439382283
Energy: 1.6710821731818284
Energy: 1.597724439382283
Energy: 1.7104036764058972
Energy: 1.5587430104115478
Energy: 1.7104036764052637
Energy: 1.5587430104115478
Energy: 1.7104036764058972
Energy: 1.5587430104115478
Energy: 1.5049757309579168
Energy: 1.5102865960678442
Energy: 1.5049757309623502
Energy: 1.5102865960678442
Energy: 1.50497573095665
Energy: 1.5102865960684773
Energy: 1.311290748941628
Energy: 1.4070708108455316
Energy: 1.311290748941628
Energy: 1.4070708108455316
Energy: 1.3112907489409946
Energy: 1.4070708108455316
Energy: 1.6656051256873583
Energy: 1.6048112472682068
Energy: 1.6656051256873583
Energy: 1.6048112472682068
Energy: 1.665605125687992
Energy: 1.6048112472675733
Energy: 1.488810423184041
Energy: 1.6390535696563209
Energy: 1.4888104231834078
Energy: 1.6390535696563209
Energy: 1.488810423184041
Energy: 1.6390535696569544
Energy: 1.3913893407052915
Energy: 1.6692608960145867
Energy: 1.3913893407052915
Energy: 1.6692608960145867
Energy: 1.3913893407052915
Energy: 1.6692608960145867
Energy: 1.5933066414627333
Energy: 1.408105106869839
Energy: 1.5933066414627333
Energy: 1.4081051068704722
Energy: 1.5933066414633663
Energy: 1.408105106869839
Energy: 1.808862380396493
Energy: 1.6027201284047097
Energy: 1.808862380396493
Energy: 1.6027201284047097
Energy: 1.808862380396493
Energy: 1.6027201284047097
Energy: 1.5896592575860748
Energy: 1.8067619722558286
Energy: 1.589659257584175
Energy: 1.8067619722558286
Energy: 1.5896592575867083
Energy: 1.8067619722558286
Energy: 1.4777856853516012
Energy: 1.4261866276282378
Energy: 1.4777856853516012
Energy: 1.426186627628871
Energy: 1.4777856853516012
Energy: 1.4261866276282378
Energy: 1.6103198253826538
Energy: 1.4816674998168229
Energy: 1.6103198253832873
Energy: 1.4816674998168229
Energy: 1.6103198253832873
Energy: 1.4816674998168229
Energy: 1.4777863500188821
Energy: 1.4261782968879222
Energy: 1.4777863500188821
Energy: 1.4261782968872887
Energy: 1.4777863500188821
Energy: 1.4261782968879222
Energy: 1.5895703246485382
Energy: 1.8067467071013505
Energy: 1.5895703246472717
Energy: 1.8067467071013505
Energy: 1.5895703246479047
Energy: 1.806746707101984
Energy: 1.8085831482948098
Energy: 1.6026932198956185
Energy: 1.8085831482954433
Energy: 1.6026932198949855
Energy: 1.8085831482954433
Energy: 1.6026932198949855
Energy: 1.593462893185196
Energy: 1.5513433975724746
Energy: 1.5934628931845625
Energy: 1.5513433975705744
Energy: 1.593462893185196
Energy: 1.5513433975693078
Energy: 1.3913992645039148
Energy: 1.669426726303026
Energy: 1.3913992645032816
Energy: 1.669426726303026
Energy: 1.3913992645032816
Energy: 1.6694267263023925
Energy: 1.4891873577685095
Energy: 1.6390435908906849
Energy: 1.4891873577691428
Energy: 1.639043590891318
Energy: 1.4891873577697763
Energy: 1.639043590891318

minimum gb energy = 1.3112907489409946 eV
minimum distance =  2.59245850310311 Angstroms
sigma value = 17


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

Energy: 1.7474291781738296
Energy: 1.4200893628612035
Energy: 1.7474291781738296
Energy: 1.4200893628612035
Energy: 1.7474291781738296
Energy: 1.4200893628612035
Energy: 1.3284124591213402
Energy: 1.5253995271288794
Energy: 1.3284124591222362
Energy: 1.525399527129775
Energy: 1.3284124591222362
Energy: 1.5253995271288794
Energy: 1.2221701114729335
Energy: 1.4049539157475428
Energy: 1.2221701114729335
Energy: 1.404953915746647
Energy: 1.2221701114729335
Energy: 1.4049539157457513
Energy: 1.5002838683721869
Energy: 1.5911501919844253
Energy: 1.5002838683721869
Energy: 1.5911501919844253
Energy: 1.5002838683721869
Energy: 1.5911501919844253
Energy: 1.5104988732745048
Energy: 1.5011182468950441
Energy: 1.5104988732745048
Energy: 1.5011182468950441
Energy: 1.5104988732745048
Energy: 1.5011182468950441
Energy: 1.3923727408508033
Energy: 1.4594047068492708
Energy: 1.3923727408508033
Energy: 1.4594047068484157
Energy: 1.3923727408508033
Energy: 1.4594047068484157
Energy: 1.52063946325243
Energy: 1.28312748021186
Energy: 1.52063946325243
Energy: 1.28312748021186
Energy: 1.52063946325243
Energy: 1.28312748021186
Energy: 1.5000871261690156
Energy: 1.5916223134893883
Energy: 1.5000871261690156
Energy: 1.5916223134893883
Energy: 1.5000871261690156
Energy: 1.5916223134893883
Energy: 1.2828649255984015
Energy: 1.4960171238476228
Energy: 1.2828649255984015
Energy: 1.4960171238476228
Energy: 1.2828649255984015
Energy: 1.4960171238476228
Energy: 1.4933654764454536
Energy: 1.2942462764828775
Energy: 1.4933654764454536
Energy: 1.2942462764837734
Energy: 1.4933654764454536
Energy: 1.2942462764828775
Energy: 1.6369446283006615
Energy: 1.2932760507972396
Energy: 1.6369446283006615
Energy: 1.2932760507972396
Energy: 1.6369446282997657
Energy: 1.2932760507972396
Energy: 1.3683353014641333
Energy: 1.5072495481252899
Energy: 1.3683353014641333
Energy: 1.5072495481243942
Energy: 1.3683353014641333
Energy: 1.5072495481243942
Energy: 1.3856016904439048
Energy: 1.4016352899425568
Energy: 1.3856016904439048
Energy: 1.4016352899425568
Energy: 1.3856016904439048
Energy: 1.4016352899425568
Energy: 1.4272659318452419
Energy: 1.1613189802399908
Energy: 1.427265931844346
Energy: 1.1613189802399908
Energy: 1.4272659318452419
Energy: 1.1613189802399908
Energy: 1.514661925823233
Energy: 1.522529183532308
Energy: 1.514661925823233
Energy: 1.522529183532308
Energy: 1.514661925823233
Energy: 1.522529183532308
Energy: 1.5209271649649545
Energy: 1.6839758544561032
Energy: 1.5209271649649545
Energy: 1.6839758544561032
Energy: 1.5209271649649545
Energy: 1.6839758544561032
Energy: 1.349903579066311
Energy: 1.1604482616839433
Energy: 1.349903579066311
Energy: 1.1604482616839433
Energy: 1.349903579066311
Energy: 1.1604482616839433

minimum gb energy = 1.1604482616839433 eV
minimum distance =  2.57709565143516 Angstroms
sigma value = 17


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

Energy: 1.6031746811358265
Energy: 1.12413996259555
Energy: 1.6031746811392857
Energy: 1.12413996259555
Energy: 1.6031746811358265
Energy: 1.1241399625920914
Energy: 1.2445573942532908
Energy: 1.3722358168858582
Energy: 1.2445573942532908
Energy: 1.3722358168823994
Energy: 1.2445573942532908
Energy: 1.3722358168823994
Energy: 1.069390537609094
Energy: 1.2388112112136311
Energy: 1.069390537609094
Energy: 1.2388112112136311
Energy: 1.069390537609094
Energy: 1.2388112112136311
Energy: 1.393135732850301
Energy: 1.0964505146753145
Energy: 1.393135732850301
Energy: 1.0964505146753145
Energy: 1.393135732850301
Energy: 1.0964505146753145
Energy: 1.598372641442185
Energy: 1.344607204329621
Energy: 1.598372641442185
Energy: 1.344607204329621
Energy: 1.598372641442185
Energy: 1.3446072043261625
Energy: 1.0335409557315127
Energy: 1.2868303148277833
Energy: 1.0335409557315127
Energy: 1.2868303148277833
Energy: 1.0335409557315127
Energy: 1.2868303148277833
Energy: 1.2784703135359565
Energy: 1.2698703394231894
Energy: 1.2784703135359565
Energy: 1.2698703394231894
Energy: 1.2784703135359565
Energy: 1.2698703394231894
Energy: 1.4591705899650809
Energy: 1.3448885222711744
Energy: 1.4591705899650809
Energy: 1.3448885222711744
Energy: 1.4591705899650809
Energy: 1.3448885222711744
Energy: 1.2142085226750188
Energy: 1.3086131289580594
Energy: 1.2142085226750188
Energy: 1.3086131289580594
Energy: 1.2142085226750188
Energy: 1.3086131289580594
Energy: 1.2870009518447376
Energy: 1.0633856202654624
Energy: 1.287000951841279
Energy: 1.0633856202654624
Energy: 1.287000951841279
Energy: 1.0633856202654624
Energy: 1.380671306087636
Energy: 1.3744896475360637
Energy: 1.380671306087636
Energy: 1.3744896475360637
Energy: 1.380671306087636
Energy: 1.3744896475360637
Energy: 1.1760695537490884
Energy: 1.409163973606467
Energy: 1.1760695537490884
Energy: 1.409163973606467
Energy: 1.1760695537490884
Energy: 1.409163973606467
Energy: 1.3384911216468451
Energy: 1.3372532502680652
Energy: 1.338491121650304
Energy: 1.3372532502680652
Energy: 1.338491121650304
Energy: 1.3372532502680652
Energy: 1.5199772948752197
Energy: 1.1771137976997634
Energy: 1.5199772948752197
Energy: 1.1771137976997634
Energy: 1.5199772948752197
Energy: 1.1771137976997634
Energy: 1.3124414702889686
Energy: 1.4909466001627738
Energy: 1.3124414702889686
Energy: 1.4909466001627738
Energy: 1.3124414702889686
Energy: 1.4909466001627738
Energy: 1.2023323195046696
Energy: 1.2435972827663166
Energy: 1.2023323195046696
Energy: 1.2435972827663166
Energy: 1.2023323195046696
Energy: 1.2435972827663166
Energy: 1.3696207451633415
Energy: 1.0222336521470528
Energy: 1.3696207451633415
Energy: 1.0222336521470528
Energy: 1.3696207451633415
Energy: 1.0222336521470528
Energy: 1.4230696200727975
Energy: 1.400697546742136
Energy: 1.4230696200727975
Energy: 1.400697546742136
Energy: 1.4230696200727975
Energy: 1.400697546742136
Energy: 1.2743086771303935
Energy: 1.55806498489891
Energy: 1.274308677126935
Energy: 1.55806498489891
Energy: 1.2743086771303935
Energy: 1.55806498489891
Energy: 1.2639529026812246
Energy: 1.030011698660099
Energy: 1.2639529026812246
Energy: 0.9933879079806128
Energy: 1.2639529026812246
Energy: 0.9933879079806128
Energy: 1.2753534366185635
Energy: 1.5578358768536567
Energy: 1.2753534366220223
Energy: 1.5578358768536567
Energy: 1.2753534366220223
Energy: 1.5578358768536567
Energy: 1.4233821135355726
Energy: 1.400677449140097
Energy: 1.4233821135321139
Energy: 1.400677449140097
Energy: 1.4233821135321139
Energy: 1.400677449140097
Energy: 1.3694272656737931
Energy: 1.02225620942845
Energy: 1.3694272656737931
Energy: 1.02225620942845
Energy: 1.3694272656737931
Energy: 1.02225620942845
Energy: 1.2021357517167728
Energy: 1.271991287122177
Energy: 1.2021357517202313
Energy: 1.271991287122177
Energy: 1.2021357517167728
Energy: 1.2719912871256358
Energy: 1.312777397792548
Energy: 1.490965744642777
Energy: 1.3127773977891521
Energy: 1.490965744642777
Energy: 1.3127773977891521
Energy: 1.490965744642777
Energy: 1.5202014102242003
Energy: 1.1770829033144665
Energy: 1.5202014102242003
Energy: 1.1770829033144665
Energy: 1.5202014102242003
Energy: 1.1770829033144665
Energy: 1.3385298509225976
Energy: 1.3370633885295402
Energy: 1.3385298509191388
Energy: 1.3370633885295402
Energy: 1.3385298509225976
Energy: 1.3370633885295402
Energy: 1.1758029055972277
Energy: 1.4093100057502974
Energy: 1.1758029055972277
Energy: 1.4093100057502974
Energy: 1.1758029055972277
Energy: 1.4093100057502974
Energy: 1.3806262939512342
Energy: 1.3741991373317541
Energy: 1.3806262939512342
Energy: 1.3741991373317541
Energy: 1.3806262939512342
Energy: 1.3741991373317541
Energy: 1.2869028568901264
Energy: 1.0983258984725308
Energy: 1.2869028568901264
Energy: 1.0983258984725308
Energy: 1.2869028568901264
Energy: 1.0983258984725308
Energy: 1.2137640582285876
Energy: 1.3084069929266342
Energy: 1.2137640582285876
Energy: 1.3084069929266342
Energy: 1.2137640582285876
Energy: 1.3084069929266342
Energy: 1.459205269142925
Energy: 1.3450494768671266
Energy: 1.4592052691463837
Energy: 1.3450494768671266
Energy: 1.459205269142925
Energy: 1.3450494768671266
Energy: 1.278508248869494
Energy: 1.2700560826734346
Energy: 1.278508248872953
Energy: 1.2700560826734346
Energy: 1.278508248869494
Energy: 1.2700560826734346
Energy: 1.0337356829863227
Energy: 1.2607066518470647
Energy: 1.0337356829863227
Energy: 1.2607066518470647
Energy: 1.0337356829863227
Energy: 1.2607066518470647
Energy: 1.5980680043701756
Energy: 1.254548355051642
Energy: 1.5980680043701756
Energy: 1.254548355051642
Energy: 1.5980680043701756
Energy: 1.254548355051642
Energy: 1.3930686059124093
Energy: 1.0618805379770506
Energy: 1.3930686059124093
Energy: 1.0618805379770506
Energy: 1.3930686059124093
Energy: 1.0618805379770506
Energy: 1.069467359382643
Energy: 1.2389949320475848
Energy: 1.069467359382643
Energy: 1.2389949320475848
Energy: 1.069467359382643
Energy: 1.2389949320475848
Energy: 1.2447875804433244
Energy: 1.439045546893684
Energy: 1.2447875804433244
Energy: 1.4390455468971428
Energy: 1.2447875804433244
Energy: 1.439045546893684
Energy: 1.6031746811358265
Energy: 1.12413996259555
Energy: 1.6031746811358265
Energy: 1.12413996259555
Energy: 1.6031746811358265
Energy: 1.12413996259555
Energy: 1.2445573942532908
Energy: 1.3415557501447446
Energy: 1.2445573942532908
Energy: 1.3415557501447446
Energy: 1.2445573942532908
Energy: 1.3415557501447446
Energy: 1.069390537609094
Energy: 1.2388112112136311
Energy: 1.069390537609094
Energy: 1.2388112112136311
Energy: 1.069390537609094
Energy: 1.2388112112136311
Energy: 1.393135732850301
Energy: 1.0741468473607974
Energy: 1.393135732850301
Energy: 1.0741468473607974
Energy: 1.393135732850301
Energy: 1.0741468473607974
Energy: 1.598372641442185
Energy: 1.344607204329621
Energy: 1.598372641442185
Energy: 1.344607204329621
Energy: 1.598372641442185
Energy: 1.34460720433308

minimum gb energy = 0.9933879079806128 eV
minimum distance =  2.51108144475429 Angstroms
sigma value = 57


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

Energy: 1.5032096014880174
Energy: 1.216743052322611
Energy: 1.5032096014874543
Energy: 1.216743052322611
Energy: 1.5032096014880174
Energy: 1.2167430523231744
Energy: 1.1060004927119824
Energy: 1.339414055291625
Energy: 1.1060004927114193
Energy: 1.339414055291625
Energy: 1.1060004927119824
Energy: 1.339414055291625
Energy: 1.0387793905659106
Energy: 1.1273137802084228
Energy: 1.0387793905659106
Energy: 1.1273137802089859
Energy: 1.0387793905664737
Energy: 1.1273137802089859
Energy: 1.3847913798717888
Energy: 1.093953228274576
Energy: 1.384791379872352
Energy: 1.093953228274576
Energy: 1.3847913798729152
Energy: 1.093953228274576
Energy: 1.4268035719581988
Energy: 1.3123265494944505
Energy: 1.426803571958762
Energy: 1.3123265494944505
Energy: 1.4268035719581988
Energy: 1.3123265494938874
Energy: 0.9686354663326412
Energy: 1.1682724354536917
Energy: 0.9686354663326412
Energy: 1.1682724354536917
Energy: 0.9686354663326412
Energy: 1.168272435454818
Energy: 1.2408844557767567
Energy: 1.2038851350647806
Energy: 1.2408844557761936
Energy: 1.203885135065344
Energy: 1.2408844557767567
Energy: 1.203885135065344
Energy: 1.3550119165238186
Energy: 1.299609151621075
Energy: 1.3550119165238186
Energy: 1.299609151621638
Energy: 1.3550119165238186
Energy: 1.299609151621075
Energy: 1.061707129134321
Energy: 1.21053272244913
Energy: 1.061707129134884
Energy: 1.2105327224496931
Energy: 1.061707129134884
Energy: 1.21053272244913
Energy: 1.179188504042328
Energy: 1.2416836465848624
Energy: 1.179188504042891
Energy: 1.2416836465842993
Energy: 1.1791885040434544
Energy: 1.2416836465842993
Energy: 1.2407284231716267
Energy: 1.322196225186078
Energy: 1.24072842317219
Energy: 1.3221962251855148
Energy: 1.24072842317219
Energy: 1.3221962251855148
Energy: 0.9553256349918375
Energy: 1.2821527760296805
Energy: 0.9553256349924006
Energy: 1.2821527760291174
Energy: 0.9553256349912743
Energy: 1.2821527760291174
Energy: 1.1825168033068298
Energy: 1.0379746348411945
Energy: 1.1825168033068298
Energy: 1.0379746348406826
Energy: 1.1825168033073932
Energy: 1.0379746348411945
Energy: 1.319151396692696
Energy: 1.1858122651074896
Energy: 1.3191513966921329
Energy: 1.1858122651091791
Energy: 1.3191513966921329
Energy: 1.185812265108616
Energy: 1.0157266028218657
Energy: 1.4040833707307374
Energy: 1.0157266028213026
Energy: 1.4040833707318638
Energy: 1.0157266028218657
Energy: 1.4040833707313005
Energy: 1.1898705988298535
Energy: 1.0992184908143958
Energy: 1.1898705988298535
Energy: 1.0992184908143958
Energy: 1.1898705988304168
Energy: 1.0992184908143958
Energy: 1.441452035495121
Energy: 1.0832081131733524
Energy: 1.441452035495121
Energy: 1.0832081131733524
Energy: 1.441452035495121
Energy: 1.0832081131733524
Energy: 1.1906306470068315
Energy: 1.4106051356247646
Energy: 1.1906306470068315
Energy: 1.4106051356242013
Energy: 1.1906306470073948
Energy: 1.4106051356247646
Energy: 1.0449182691558432
Energy: 1.2348650383124773
Energy: 1.0449182691552799
Energy: 1.2348650383119142
Energy: 1.0449182691558432
Energy: 1.2348650383119142
Energy: 1.3054246397840457
Energy: 0.9807045820782092
Energy: 1.3054246397829194
Energy: 0.9807045820782092
Energy: 1.3054246397823563
Energy: 0.9807045820776462
Energy: 1.2668337351249328
Energy: 1.3168457597969472
Energy: 1.266833735125496
Energy: 1.3168457597969472
Energy: 1.266833735125496
Energy: 1.3168457597969472
Energy: 1.1112995376139103
Energy: 1.4164843781759842
Energy: 1.1112995376144734
Energy: 1.4164843781759842
Energy: 1.1112995376139103
Energy: 1.4164843781765475
Energy: 1.1704737259763784
Energy: 0.9296330857215445
Energy: 1.1704737259758153
Energy: 0.9296330857221077
Energy: 1.1704737259758153
Energy: 0.9296330857215445
Energy: 1.3152958084762076
Energy: 1.176634572553847
Energy: 1.3152958084767707
Energy: 1.1766345725566631
Energy: 1.3152958084762076
Energy: 1.176634572553284
Energy: 1.1668825969691312
Energy: 1.272497801566536
Energy: 1.1668825969691312
Energy: 1.272497801566536
Energy: 1.166882596968568
Energy: 1.2724978015659727
Energy: 1.1737776070212371
Energy: 0.9296730670985959
Energy: 1.1737776070212371
Energy: 0.9296730670985959
Energy: 1.1737776070218005
Energy: 0.9296730670980327
Energy: 1.0077069380248853
Energy: 1.2459245487916641
Energy: 1.0077069380260117
Energy: 1.2459245487916641
Energy: 1.0077069380248853
Energy: 1.2459245487916641

minimum gb energy = 0.9296330857215445 eV
minimum distance =  2.52133796668354 Angstroms
sigma value = 43


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

Energy: 1.3800905557469427
Energy: 1.0773419511736317
Energy: 1.380090555746122
Energy: 1.0773419511732214
Energy: 1.3800905557469427
Energy: 1.0773419511732214
Energy: 0.9543832473234586
Energy: 1.2478799254961324
Energy: 0.9543832473242793
Energy: 1.2478799254961324
Energy: 0.954383247322638
Energy: 1.2478799254961324
Energy: 0.8980878889141157
Energy: 1.2629326881866005
Energy: 0.8980878889137054
Energy: 1.262932688187421
Energy: 0.898087888913295
Energy: 1.2629326881870109
Energy: 1.2751341948010384
Energy: 0.9249654479153645
Energy: 1.275134194800628
Energy: 0.9249654479153645
Energy: 1.275134194800628
Energy: 0.9249654479157748
Energy: 1.1783898820418361
Energy: 1.193428794770497
Energy: 1.1783898820414256
Energy: 1.193428794770497
Energy: 1.1783898820414256
Energy: 1.193428794770497
Energy: 0.8371592992485858
Energy: 1.014639658013673
Energy: 0.8371592992485858
Energy: 1.014639658007108
Energy: 0.8371592992485858
Energy: 1.0146396580091595
Energy: 1.183832142636674
Energy: 1.0007725832622403
Energy: 1.1838321426362635
Energy: 1.0007725832626506
Energy: 1.1838321426370841
Energy: 1.0007725832626506
Energy: 1.188016846164315
Energy: 1.122409743692555
Energy: 1.1880168461647254
Energy: 1.122409743692555
Energy: 1.1880168461647254
Energy: 1.1224097436921447
Energy: 0.7984166689160455
Energy: 1.0707625667801497
Energy: 0.7984166689164558
Energy: 1.070762566779329
Energy: 0.7984166689164558
Energy: 1.0707625667797394
Energy: 1.18617652683463
Energy: 0.9074894056422744
Energy: 1.1861765268342197
Energy: 0.9074894056422744
Energy: 1.1861765268350406
Energy: 0.9074894056418641
Energy: 1.170929755802136
Energy: 1.1755096611324545
Energy: 1.1709297558017255
Energy: 1.1755096611328646
Energy: 1.170929755802136
Energy: 1.1755096611324545
Energy: 0.9455503277951666
Energy: 1.2515944991374022
Energy: 0.9455503277951666
Energy: 1.251594499136992
Energy: 0.9455503277955769
Energy: 1.251594499136992
Energy: 1.0119376841621304
Energy: 0.9476029734428193
Energy: 1.01193768416172
Energy: 0.9476029734428193
Energy: 1.0119376841625407
Energy: 0.9476029734424092
Energy: 1.0779590975986797
Energy: 1.1762568678269802
Energy: 1.0779590975986797
Energy: 1.1762568678269802
Energy: 1.0779590975982694
Energy: 1.1762568678269802
Energy: 0.9059313299999342
Energy: 1.2441962446111914
Energy: 0.9059313299999342
Energy: 1.2441962446107813
Energy: 0.9059313299999342
Energy: 1.2441962446111914
Energy: 1.0623695601310805
Energy: 0.8470691869005744
Energy: 1.0623695601286185
Energy: 0.8470691869005744
Energy: 1.0623695601298497
Energy: 0.8470691869005744
Energy: 1.146268073270242
Energy: 1.2272799248361923
Energy: 1.146268073270242
Energy: 1.2272799248366026
Energy: 1.146268073270242
Energy: 1.2272799248361923
Energy: 0.8172807736804435
Energy: 1.2000574605613121
Energy: 0.8172807736804435
Energy: 1.2000574605613121
Energy: 0.8172807736812642
Energy: 1.2000574605617225
Energy: 1.0341753877294504
Energy: 0.9050137733436816
Energy: 1.0341753877298605
Energy: 0.9050137733440918
Energy: 1.0341753877298605
Energy: 0.9050137733436816
Energy: 1.26843749337169
Energy: 1.1702524859427292
Energy: 1.2684374933712799
Energy: 1.17025248594355
Energy: 1.2684374933712799
Energy: 1.1702524859427292
Energy: 0.8761117017230741
Energy: 1.3379008658096008
Energy: 0.8761117017226637
Energy: 1.3379008658091902
Energy: 0.8761117017230741
Energy: 1.3379008658096008
Energy: 1.0693258868574846
Energy: 0.9507134299156204
Energy: 1.069325886856664
Energy: 0.9507134299156204
Energy: 1.0693258868574846
Energy: 0.95071342991521
Energy: 1.3458410474798987
Energy: 0.9272640884480057
Energy: 1.345841047479078
Energy: 0.9272640884480057
Energy: 1.3458410474807194
Energy: 0.9272640884480057
Energy: 1.057303128679445
Energy: 1.3436080981917053
Energy: 1.0573031286790349
Energy: 1.3436080981917053
Energy: 1.0573031286790349
Energy: 1.3436080981917053
Energy: 0.9555988158600581
Energy: 1.0165742360952175
Energy: 0.9555988158580064
Energy: 1.0165742360952175
Energy: 0.9555988158592374
Energy: 1.0165742360952175
Energy: 1.1705611943273626
Energy: 0.8596478896663833
Energy: 1.1705611943273626
Energy: 0.8596478896667936
Energy: 1.170561194326952
Energy: 0.8596478896663833
Energy: 1.0597671744326131
Energy: 1.2471173267309676
Energy: 1.0552272816522974
Energy: 1.2471173267309676
Energy: 1.0597671744330233
Energy: 1.2471173267309676
Energy: 1.1059521897379192
Energy: 1.2081131951510629
Energy: 1.1059521897379192
Energy: 1.2081131951510629
Energy: 1.105952189737509
Energy: 1.2081131951510629
Energy: 1.0891138738061532
Energy: 0.7950559447064667
Energy: 1.0891138738057429
Energy: 0.7950559447064667
Energy: 1.0891138738061532
Energy: 0.7950559447060563
Energy: 0.9635895880709335
Energy: 1.1713869211685888
Energy: 0.9635895880709335
Energy: 1.1713869211685888
Energy: 0.9635895880709335
Energy: 1.1713869211681787
Energy: 1.1205814526205322
Energy: 1.2088703506928722
Energy: 1.1205814526197115
Energy: 1.2088703506924618
Energy: 1.1205814526201219
Energy: 1.2088703506928722
Energy: 1.0594487065151759
Energy: 0.7684564508082795
Energy: 1.0594487065147657
Energy: 0.7684564508082795
Energy: 1.0594487065159965
Energy: 0.7684564508078692
Energy: 0.9464061789770825
Energy: 1.2125469439701577
Energy: 0.9464061789770825
Energy: 1.2125469439701577
Energy: 0.9464061789774928
Energy: 1.2125469439705683
Energy: 1.1323898067518454
Energy: 1.258637318854628
Energy: 1.1323898067518454
Energy: 1.258637318854628
Energy: 1.1323898067518454
Energy: 1.258637318854628
Energy: 1.102399056672419
Energy: 0.8620600931112117
Energy: 1.1023990566720085
Energy: 0.8620600931112117
Energy: 1.1023990566720085
Energy: 0.8620600931108013
Energy: 0.8446198881779371
Energy: 0.9884991430769591
Energy: 0.8446198881771164
Energy: 0.9884991430765487
Energy: 0.8446198881783473
Energy: 0.9884991430757281

minimum gb energy = 0.7684564508078692 eV
minimum distance =  2.51571508146325 Angstroms
sigma value = 81


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

Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033042074940369
Energy: 0.05059173471420808
Energy: 0.6033042074940369
Energy: 0.05059173471420808
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033441658851718
Energy: 0.050562213414650184
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.6033042074940369
Energy: 0.05059173471571571
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295
Energy: 0.04912709214099474
Energy: 0.09354206240358295

minimum gb energy = 0.04912709214099474 eV
minimum distance =  2.74487389419639 Angstroms
sigma value = 3


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

Energy: 1.3849057149560828
Energy: 0.845320309620614
Energy: 1.3849057149560828
Energy: 0.845320309620614
Energy: 1.3849057149560828
Energy: 0.845320309621065
Energy: 0.9561690805462594
Energy: 1.0370268610139182
Energy: 0.9561690805462594
Energy: 1.0370268610134667
Energy: 0.9561690805462594
Energy: 1.0370268610130156
Energy: 1.0414324404264372
Energy: 1.3208705744167177
Energy: 1.02825253488754
Energy: 1.3208705744167177
Energy: 1.02825253488754
Energy: 1.3208705744167177
Energy: 1.285175910211022
Energy: 0.8497718314614565
Energy: 1.2851759102114733
Energy: 0.8497718314619077
Energy: 1.2851759102114733
Energy: 0.8497718314614565
Energy: 0.9003094159177377
Energy: 1.1235412837394265
Energy: 0.9003094159177377
Energy: 1.1235412837389755
Energy: 0.9003094159177377
Energy: 1.1235412837389755
Energy: 1.0176572912327722
Energy: 1.1822419550872445
Energy: 1.0176572912323212
Energy: 1.1822419550863421
Energy: 1.0176572912323212
Energy: 1.1822419550867933
Energy: 1.1412609472676245
Energy: 0.9505128214411783
Energy: 1.1412609472676245
Energy: 0.9505128214416295
Energy: 1.1412609472676245
Energy: 0.9505128214411783
Energy: 0.9011317779305058
Energy: 1.0653807843985126
Energy: 0.9011317779300546
Energy: 1.0653807843989636
Energy: 0.9011317779305058
Energy: 1.0653807843980616
Energy: 1.1451353514851264
Energy: 1.0876133750747847
Energy: 1.1451353514846752
Energy: 1.0876133750765895
Energy: 1.1451353514846752
Energy: 1.0876133750756871
Energy: 1.2303177986602503
Energy: 0.9444592036299562
Energy: 1.2303177986602503
Energy: 0.9444592036299562
Energy: 1.2303177986607012
Energy: 0.9444592036299562
Energy: 0.9783271473843734
Energy: 1.3630716837663632
Energy: 0.9783271473843734
Energy: 1.3630716837663632
Energy: 0.9783271473839225
Energy: 1.363071683765912
Energy: 1.17526009747549
Energy: 1.1155761231298
Energy: 1.1752600974732346
Energy: 1.1155761231298
Energy: 1.1752600974750391
Energy: 1.1155761231302512
Energy: 1.100850474722973
Energy: 0.8618261913520419
Energy: 1.1008504747220706
Energy: 0.8618261913515907
Energy: 1.1008504747220706
Energy: 0.8618261913515907
Energy: 0.8805736265651541
Energy: 1.1350148292640747
Energy: 0.880573626564703
Energy: 1.1350148292640747
Energy: 0.880573626564703
Energy: 1.1350148292640747
Energy: 1.0055297045173144
Energy: 1.1333007003702051
Energy: 1.0055297045177654
Energy: 1.1333007003706563
Energy: 1.0055297045177654
Energy: 1.1333007003702051
Energy: 1.267019438191512
Energy: 0.9038337421838306
Energy: 1.267019438191512
Energy: 0.9038337421838306
Energy: 1.2670194381919635
Energy: 0.9038337421838306
Energy: 0.9507556464107106
Energy: 1.237700975095861
Energy: 0.9507556464111617
Energy: 1.237700975095861
Energy: 0.9507556464107106
Energy: 1.237700975095861
Energy: 0.9586653924996865
Energy: 1.0474198995101498
Energy: 0.9586653924987841
Energy: 1.0474198995101498
Energy: 0.9586653924996865
Energy: 1.047419899510601
Energy: 1.3079459602210413
Energy: 0.9690063349909198
Energy: 1.3079459602210413
Energy: 0.9690063349909198
Energy: 1.3079459602214927
Energy: 0.9690063349909198
Energy: 0.9128875931493408
Energy: 1.3275441298569983
Energy: 0.9128875931493408
Energy: 1.3275441298569983
Energy: 0.9128875931493408
Energy: 1.3275441298574495
Energy: 1.0219628235567189
Energy: 0.9910793102092846
Energy: 1.0219628235562677
Energy: 0.9910793102092846
Energy: 1.0219628235562677
Energy: 0.9910793102092846
Energy: 1.355257531826924
Energy: 0.9677033005081129
Energy: 1.3552575318237658
Energy: 0.9677033005081129
Energy: 1.3552575318219613
Energy: 0.9677033005081129
Energy: 0.8997817884165011
Energy: 1.3295134371355843
Energy: 0.8997817884165011
Energy: 1.3295134371360355
Energy: 0.8997817884160499
Energy: 1.3295134371360355
Energy: 1.0723561968264137
Energy: 0.9182566085200381
Energy: 1.0723561968255113
Energy: 0.918256608519587
Energy: 1.0723561968264137
Energy: 0.918256608519587
Energy: 1.2353760270000507
Energy: 0.9975288132972829
Energy: 1.2353760270018552
Energy: 0.9975288132972829
Energy: 1.2353760269991483
Energy: 0.9975288132963807
Energy: 0.8411101013802748
Energy: 1.1726499938470818
Energy: 0.841110101380726
Energy: 1.1726499938470818
Energy: 0.8411101013802748
Energy: 1.1726499938475325
Energy: 1.2465433477615
Energy: 0.948556385309867
Energy: 1.2465433477605976
Energy: 0.948556385309867
Energy: 1.2465433477615
Energy: 0.9485563853094158
Energy: 1.1436943552902323
Energy: 0.9836726114200866
Energy: 1.1436943552902323
Energy: 0.9836726114205376
Energy: 1.1436943552902323
Energy: 0.9836726114200866
Energy: 0.8056554551279155
Energy: 1.2528563779413004
Energy: 0.8056554551279155
Energy: 1.2528563779413004
Energy: 0.8056554551274643
Energy: 1.2528563779413004
Energy: 1.2307647849317505
Energy: 1.0446516389088774
Energy: 1.2307647849322016
Energy: 1.0446516389093283
Energy: 1.2307647849322016
Energy: 1.0446516389088774
Energy: 1.1900197266879726
Energy: 0.9411895928613467
Energy: 1.1900197266879726
Energy: 0.9411895928617978
Energy: 1.1900197266879726
Energy: 0.9411895928613467
Energy: 0.934155289884698
Energy: 1.323265348703182
Energy: 0.9341552898842468
Energy: 1.323265348700024
Energy: 0.934155289884698
Energy: 1.32326534870228
Energy: 1.0988068327723848
Energy: 0.9779033253795796
Energy: 1.0988068327714824
Energy: 0.9779033253800309
Energy: 1.0988068327719336
Energy: 0.9779033253800309

minimum gb energy = 0.8056554551274643 eV
minimum distance =  2.58206984615897 Angstroms
sigma value = 67


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

Energy: 1.5080038990795719
Energy: 0.9983597528405463
Energy: 1.5080038990795719
Energy: 0.9983597528405463
Energy: 1.5080038990795719
Energy: 0.9983597528418319
Energy: 1.1024492588337658
Energy: 1.216822957807619
Energy: 1.1024492588344086
Energy: 1.216822957807619
Energy: 1.1024492588337658
Energy: 1.216822957807619
Energy: 1.2434507408309934
Energy: 1.3657047566033536
Energy: 1.2434507408316362
Energy: 1.3657047566033536
Energy: 1.2434507408316362
Energy: 1.3657047566027107
Energy: 1.3815043163713323
Energy: 0.9826864765759218
Energy: 1.3815043163713323
Energy: 0.9826864765765645
Energy: 1.3815043163713323
Energy: 0.9826864765759218
Energy: 1.0675307058813188
Energy: 1.264943356230337
Energy: 1.0675307058819616
Energy: 1.2649433562296941
Energy: 1.0675307058819616
Energy: 1.264943356230337
Energy: 1.210430861852145
Energy: 1.2622128895251192
Energy: 1.210430861852788
Energy: 1.2622128895116194
Energy: 1.210430861852788
Energy: 1.2622128895296192
Energy: 1.5822476322608765
Energy: 1.0867291100679626
Energy: 1.5822476322608765
Energy: 1.0867291100686056
Energy: 1.5822476322615193
Energy: 1.0867291100679626
Energy: 1.253084832967519
Energy: 1.4729189566157062
Energy: 1.253084832967519
Energy: 1.4729189566157062
Energy: 1.2530848329681619
Energy: 1.4729189566157062
Energy: 1.1930154934074144
Energy: 1.2942523784413251
Energy: 1.1930154934067716
Energy: 1.294252378440682
Energy: 1.1930154934080572
Energy: 1.2942523784413251
Energy: 1.3210582719079256
Energy: 1.0788350425874627
Energy: 1.3210582719079256
Energy: 1.0788350425874627
Energy: 1.3210582719079256
Energy: 1.0788350425874627
Energy: 1.0957919529628206
Energy: 1.3560669611148968
Energy: 1.0957919529628206
Energy: 1.3560669611148968
Energy: 1.0957919529628206
Energy: 1.3560669611148968
Energy: 1.1113605693420125
Energy: 1.2356852542841306
Energy: 1.1113605693420125
Energy: 1.2356852542847734
Energy: 1.1113605693420125
Energy: 1.2356852542841306
Energy: 1.3258899255738241
Energy: 1.160830030985092
Energy: 1.3258899255731815
Energy: 1.160830030984449
Energy: 1.3258899255731815
Energy: 1.160830030985092
Energy: 1.061367331915564
Energy: 1.4299349160409514
Energy: 1.0613673319149213
Energy: 1.4299349160415942
Energy: 1.0613673319149213
Energy: 1.4299349160409514
Energy: 1.1592665600506051
Energy: 1.152991334977623
Energy: 1.1592665600493195
Energy: 1.152991334977623
Energy: 1.1592665600499623
Energy: 1.1529913349769803
Energy: 1.4841989808554616
Energy: 1.1379607533434504
Energy: 1.4841989808541762
Energy: 1.1379607533434504
Energy: 1.4841989808554616
Energy: 1.1379607533434504
Energy: 1.0128176897506578
Energy: 1.3602438893974598
Energy: 1.0128176897506578
Energy: 1.3602438893974598
Energy: 1.012817689750015
Energy: 1.3602438893974598
Energy: 1.3096452191810275
Energy: 1.0725404852456724
Energy: 1.3096452191810275
Energy: 1.0725404852456724
Energy: 1.3096452191816703
Energy: 1.0725404852456724
Energy: 1.3352134700895508
Energy: 1.1777307141480826
Energy: 1.3352134700882652
Energy: 1.1777307141487257
Energy: 1.335213470088908
Energy: 1.1777307141487257
Energy: 1.1490331463309975
Energy: 1.4816486040463148
Energy: 1.1490331463309975
Energy: 1.4816486040463148
Energy: 1.149033146330355
Energy: 1.4816486040469579
Energy: 1.241145504406549
Energy: 1.0406037659174943
Energy: 1.241145504406549
Energy: 1.0406037659168514
Energy: 1.2411455044052633
Energy: 1.0406037659181373
Energy: 1.2951291889400105
Energy: 1.237509400648368
Energy: 1.2951291889393677
Energy: 1.237509400648368
Energy: 1.2951291889393677
Energy: 1.237509400648368
Energy: 1.062212991463698
Energy: 1.3990059789231057
Energy: 1.062212991463698
Energy: 1.399005978922463
Energy: 1.062212991463698
Energy: 1.3990059789231057

minimum gb energy = 0.9826864765759218 eV
minimum distance =  2.48690259808313 Angstroms
sigma value = 33


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

Energy: 1.6094805704943278
Energy: 1.0696256582320907
Energy: 1.6094805704943278
Energy: 1.0696256582324983
Energy: 1.6094805704939201
Energy: 1.0696256582320907
Energy: 1.2429635013638305
Energy: 1.2829145652678093
Energy: 1.2429635013638305
Energy: 1.2829145652674017
Energy: 1.2429635013638305
Energy: 1.2829145652674017
Energy: 1.2675916148221578
Energy: 1.4207935898545563
Energy: 1.2675916148221578
Energy: 1.4207935898545563
Energy: 1.2675916148221578
Energy: 1.4207935898545563
Energy: 1.4735376051664968
Energy: 1.075239238629713
Energy: 1.4735376051664968
Energy: 1.075239238629713
Energy: 1.4735376051669042
Energy: 1.075239238629713
Energy: 1.2259778372398573
Energy: 1.4507352136068976
Energy: 1.2259778372398573
Energy: 1.4507352136073055
Energy: 1.2259778372394496
Energy: 1.4507352136073055
Energy: 1.4018867567189879
Energy: 1.3235597269712929
Energy: 1.4018867567189879
Energy: 1.3347059161111554
Energy: 1.4018867567193958
Energy: 1.3347059161115629
Energy: 1.5107490600259068
Energy: 1.3673073591061473
Energy: 1.5107490600263151
Energy: 1.3673073591061473
Energy: 1.5107490600254991
Energy: 1.3673073591065552
Energy: 1.1971569050543147
Energy: 1.461743476235381
Energy: 1.1971569050534991
Energy: 1.461743476234973
Energy: 1.1971569050543147
Energy: 1.4617434762345654
Energy: 1.176130245246702
Energy: 1.2649729956609579
Energy: 1.176130245246702
Energy: 1.26497299566055
Energy: 1.1761302452471099
Energy: 1.2649729956609579
Energy: 1.7101890382072298
Energy: 1.2013940522395576
Energy: 1.7101890382092688
Energy: 1.2013940522395576
Energy: 1.7101890382076377
Energy: 1.2013940522395576
Energy: 1.1633599846744227
Energy: 1.4212389381054837
Energy: 1.1633599846744227
Energy: 1.4212389381058914
Energy: 1.163359984674015
Energy: 1.4212389381058914
Energy: 1.24215654344346
Energy: 1.2525657406060369
Energy: 1.2421565434450912
Energy: 1.252565740605221
Energy: 1.242156543443868
Energy: 1.2525657406060369
Energy: 1.6051842624235722
Energy: 1.2607816560740324
Energy: 1.6051842624227566
Energy: 1.2607816560736245
Energy: 1.6051842624235722
Energy: 1.2607816560740324
Energy: 1.2076689485210632
Energy: 1.4233160547465848
Energy: 1.2076689485198395
Energy: 1.4233160547461772
Energy: 1.2076689485202474
Energy: 1.4233160547465848
Energy: 1.3754672715449325
Energy: 1.2328222993521663
Energy: 1.3754672715445246
Energy: 1.2328222993525741
Energy: 1.375467271544117
Energy: 1.2328222993529818
Energy: 1.4737456903000945
Energy: 1.2149758381724713
Energy: 1.4737456903005022
Energy: 1.2149758381728792
Energy: 1.4737456903000945
Energy: 1.2149758381728792
Energy: 1.2819397860120232
Energy: 1.601920167503613
Energy: 1.2819397860116155
Energy: 1.6019201675044286
Energy: 1.2819397860112076
Energy: 1.601920167503205
Energy: 1.3886111002043195
Energy: 1.297971624829584
Energy: 1.3886111002039117
Energy: 1.297971624829584
Energy: 1.3886111002051351
Energy: 1.2979716248291762
Energy: 1.6797732226912507
Energy: 1.349698394084209
Energy: 1.6797732226916586
Energy: 1.349698394084209
Energy: 1.6797732226920665
Energy: 1.349698394084209
Energy: 1.2413590241907104
Energy: 1.5738131958800357
Energy: 1.2413590241903025
Energy: 1.5738131958800357
Energy: 1.2413590241907104
Energy: 1.57381319587922
Energy: 1.3543731543902549
Energy: 1.3030434768262726
Energy: 1.3543731543894393
Energy: 1.3030434768262726
Energy: 1.3543731543894393
Energy: 1.3030434768262726
Energy: 1.4462842430968934
Energy: 1.0871546981065854
Energy: 1.4462842430973013
Energy: 1.0871546981065854
Energy: 1.4462842430968934
Energy: 1.0871546981065854
Energy: 1.106736143570522
Energy: 1.421031699184754
Energy: 1.1067361435709298
Energy: 1.4210316991843461
Energy: 1.1067361435709298
Energy: 1.4210316991851615
Energy: 1.6050949081169632
Energy: 1.219120555229329
Energy: 1.6050949081161474
Energy: 1.219120555228921
Energy: 1.6050949081165553
Energy: 1.219120555228921
Energy: 1.1642996121155509
Energy: 1.2199324366512057
Energy: 1.1642996121155509
Energy: 1.2199324366507978
Energy: 1.1642996121155509
Energy: 1.2199324366507978
Energy: 1.1086662614231033
Energy: 1.5587791383984433
Energy: 1.1086662614231033
Energy: 1.5587791383984433
Energy: 1.1086662614226952
Energy: 1.5587791383988512
Energy: 1.3850180778307097
Energy: 1.0842479636381974
Energy: 1.3850180778307097
Energy: 1.0842479636377897
Energy: 1.3850180778307097
Energy: 1.0842479636381974
Energy: 1.351164222520157
Energy: 1.4271995721088895
Energy: 1.351164222520157
Energy: 1.4271995721084816
Energy: 1.3511642225197495
Energy: 1.4271995721088895
Energy: 1.2438763119904006
Energy: 1.574265658834034
Energy: 1.2438763119891771
Energy: 1.574265658834442
Energy: 1.2438763119899927
Energy: 1.574265658834034
Energy: 1.5223986934329778
Energy: 1.3232390750438492
Energy: 1.5223986934333855
Energy: 1.3232390750438492
Energy: 1.5223986934325702
Energy: 1.3232390750434417
Energy: 1.3930289007266143
Energy: 1.3849678509764716
Energy: 1.3930289007257988
Energy: 1.3849678509764716
Energy: 1.3930289007266143
Energy: 1.3849678509764716
Energy: 1.2240360396722914
Energy: 1.4514927290804929
Energy: 1.2240360396714758
Energy: 1.4514927290804929
Energy: 1.2240360396722914
Energy: 1.4514927290809005
Energy: 1.4694771927254306
Energy: 1.2204637117161439
Energy: 1.4694771927254306
Energy: 1.2204637117157362
Energy: 1.4694771927254306
Energy: 1.2204637117157362
Energy: 1.3132805227275821
Energy: 1.2460801399176442
Energy: 1.313280522727174
Energy: 1.2460801399176442
Energy: 1.3132805227279898
Energy: 1.2460801399176442
Energy: 1.2191652139627074
Energy: 1.5503717954986982
Energy: 1.2191652139635232
Energy: 1.55037179549829
Energy: 1.2191652139631153
Energy: 1.55037179549829
Energy: 1.612009699765303
Energy: 1.1207459468288274
Energy: 1.612009699765711
Energy: 1.1207459468288274
Energy: 1.612009699765303
Energy: 1.1207459468288274
Energy: 1.2435720508704322
Energy: 1.2349507240428883
Energy: 1.24357205087084
Energy: 1.2349507240424806
Energy: 1.2435720508704322
Energy: 1.2349507240424806

minimum gb energy = 1.0696256582320907 eV
minimum distance =  2.54051606127379 Angstroms
sigma value = 41


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

Energy: 1.7356389229252476
Energy: 1.2149130621036803
Energy: 1.7356389229252476
Energy: 1.2149130621047939
Energy: 1.735638922924134
Energy: 1.2149130621036803
Energy: 1.3818891512458482
Energy: 1.3752096199394976
Energy: 1.3818891512458482
Energy: 1.3752096199406112
Energy: 1.3818891512458482
Energy: 1.3752096199394976
Energy: 1.6388007152330522
Energy: 1.5095717243717095
Energy: 1.5534567615343065
Energy: 1.509571724370596
Energy: 1.553456761533193
Energy: 1.5095717243717095
Energy: 1.8529018705715627
Energy: 1.4269497243114648
Energy: 1.8529018705704496
Energy: 1.4269497243114648
Energy: 1.8529018705715627
Energy: 1.4269497243114648
Energy: 1.5520073240214072
Energy: 1.7749522813136338
Energy: 1.5520073240202938
Energy: 1.7749522813136338
Energy: 1.5520073240214072
Energy: 1.7749522813136338
Energy: 1.6224470178773325
Energy: 1.4355334594951674
Energy: 1.6224470178773325
Energy: 1.4355334594951674
Energy: 1.622447017876219
Energy: 1.4355334594951674
Energy: 1.7760622606956116
Energy: 1.2775916334240043
Energy: 1.7760622606956116
Energy: 1.2775916334240043
Energy: 1.7760622606956116
Energy: 1.2775916334240043
Energy: 1.347552751281242
Energy: 1.5071106787930573
Energy: 1.347552751281242
Energy: 1.5071106787930573
Energy: 1.347552751281242
Energy: 1.5071106787930573
Energy: 1.3850595337048097
Energy: 1.4279263834059335
Energy: 1.3850595337059233
Energy: 1.4279263834070468
Energy: 1.3850595337048097
Energy: 1.4279263834070468
Energy: 1.6847512312532933
Energy: 1.2494405986708448
Energy: 1.6847512312532933
Energy: 1.2494405986708448
Energy: 1.6847512312532933
Energy: 1.2494405986719581
Energy: 1.364033642834993
Energy: 1.5775273412305073
Energy: 1.3640336428338797
Energy: 1.5775273412305073
Energy: 1.364033642834993
Energy: 1.5775273412305073
Energy: 1.4635769224295205
Energy: 1.3473846547676966
Energy: 1.4635769224295205
Energy: 1.3473846547676966
Energy: 1.4635769224295205
Energy: 1.34738465476881
Energy: 1.65003478110207
Energy: 1.3992187328540502
Energy: 1.65003478110207
Energy: 1.3992187328551635
Energy: 1.65003478110207
Energy: 1.3992187328540502
Energy: 1.575060508938226
Energy: 1.7716120892356888
Energy: 1.575060508940453
Energy: 1.7716120892368024
Energy: 1.5750605089415666
Energy: 1.7716120892368024

minimum gb energy = 1.2149130621036803 eV
minimum distance =  2.51895321409119 Angstroms
sigma value = 11


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

Energy: 1.8739522739281913
Energy: 1.5351139494914277
Energy: 1.8739522739281913
Energy: 1.5351139494914277
Energy: 1.8739522739281913
Energy: 1.5351139494909383
Energy: 1.61858400656956
Energy: 1.6809026660818749
Energy: 1.61858400656956
Energy: 1.6809026660818749
Energy: 1.61858400656956
Energy: 1.680902666082364
Energy: 1.5834119890595326
Energy: 1.6355027481971036
Energy: 1.5834119890595326
Energy: 1.6355027481975928
Energy: 1.5834119890595326
Energy: 1.6355027481975928
Energy: 1.9193585457506148
Energy: 1.4195924632120416
Energy: 1.9193585457506148
Energy: 1.4195924632115524
Energy: 1.9193585457506148
Energy: 1.4195924632115524
Energy: 1.570533266063803
Energy: 1.5796619485361436
Energy: 1.570533266063803
Energy: 1.5796619485361436
Energy: 1.570533266063314
Energy: 1.5796619485366328
Energy: 1.5444282312111275
Energy: 1.6467027655886495
Energy: 1.5444282312106385
Energy: 1.6467027655891389
Energy: 1.5444282312106385
Energy: 1.6467027655891389
Energy: 1.7349715416111038
Energy: 1.4617057328675267
Energy: 1.7349715416111038
Energy: 1.4617057328680159
Energy: 1.7349715416111038
Energy: 1.4617057328675267
Energy: 1.6031582247433547
Energy: 1.6562060874378057
Energy: 1.6031582247433547
Energy: 1.6562060874373163
Energy: 1.6031582247433547
Energy: 1.6562060874373163
Energy: 1.5678638626185502
Energy: 1.5144334120041898
Energy: 1.5678638626185502
Energy: 1.5144334120046792
Energy: 1.567863862618061
Energy: 1.5144334120046792
Energy: 1.6820732425335025
Energy: 1.4493007937114053
Energy: 1.6820732425335025
Energy: 1.4493007937114053
Energy: 1.6820732425335025
Energy: 1.4493007937114053
Energy: 1.4195079429072122
Energy: 1.7896661674058136
Energy: 1.4195079429072122
Energy: 1.7896661674058136
Energy: 1.4195079429072122
Energy: 1.7896661674063028
Energy: 1.5828157490819672
Energy: 1.6766971864360205
Energy: 1.5828157490819672
Energy: 1.6766971864355311
Energy: 1.5828157490819672
Energy: 1.6766971864355311
Energy: 1.8124684215920994
Energy: 1.4406109239126808
Energy: 1.8124684215916105
Energy: 1.4406109239126808
Energy: 1.8124684215916105
Energy: 1.4406109239126808
Energy: 1.4758665685683114
Energy: 1.738807954728339
Energy: 1.4758665685678223
Energy: 1.738807954728339
Energy: 1.4758665685683114
Energy: 1.738807954728339
Energy: 1.5795946595265151
Energy: 1.5898453857899928
Energy: 1.5795946595270043
Energy: 1.5898453857899928
Energy: 1.5795946595265151
Energy: 1.589845385790482
Energy: 1.7133172777088617
Energy: 1.4902420879691605
Energy: 1.7133172777088617
Energy: 1.4902420879691605
Energy: 1.7133172777088617
Energy: 1.4902420879691605
Energy: 1.4646617545024017
Energy: 1.7725740683245226
Energy: 1.4646617545024017
Energy: 1.7725740683240336
Energy: 1.4646617545024017
Energy: 1.7725740683240336
Energy: 1.6461745072703873
Energy: 1.6188513307032537
Energy: 1.6461745072708767
Energy: 1.6188513307032537
Energy: 1.6461745072703873
Energy: 1.6188513307032537
Energy: 1.8352863610026853
Energy: 1.3819794590846501
Energy: 1.8352863610021959
Energy: 1.3819794590851393
Energy: 1.8352863610021959
Energy: 1.3819794590846501
Energy: 1.5669890495968102
Energy: 1.7030249513215256
Energy: 1.5669890495968102
Energy: 1.7030249513210365
Energy: 1.5669890495972991
Energy: 1.7030249513215256
Energy: 1.6168765117706516
Energy: 1.5532700585421564
Energy: 1.6168765117696733
Energy: 1.5532700585421564
Energy: 1.6168765117701627
Energy: 1.5532700585426458
Energy: 1.7690625722747984
Energy: 1.520195699944924
Energy: 1.7690625722752873
Energy: 1.520195699944924
Energy: 1.7690625722752873
Energy: 1.520195699944924
Energy: 1.4886921926656351
Energy: 1.7282905276920493
Energy: 1.4886921926656351
Energy: 1.72829052769156
Energy: 1.4886921926656351
Energy: 1.72829052769156
Energy: 1.6791783374181906
Energy: 1.5302823371900656
Energy: 1.6791783374181906
Energy: 1.5302823371900656
Energy: 1.6791783374181906
Energy: 1.5302823371900656
Energy: 1.7919871095518372
Energy: 1.4800799394898114
Energy: 1.7919871095518372
Energy: 1.4800799394898114
Energy: 1.7919871095513478
Energy: 1.4800799394898114
Energy: 1.387566689434789
Energy: 1.8130461312936785
Energy: 1.387566689434789
Energy: 1.8130461312936785
Energy: 1.387566689435278
Energy: 1.8130461312936785
Energy: 1.497284700356305
Energy: 1.6794316566265597
Energy: 1.4972847003558156
Energy: 1.6794316566265597
Energy: 1.497284700356305
Energy: 1.6794316566265597
Energy: 1.740383656149911
Energy: 1.5730040850427685
Energy: 1.7403836561504005
Energy: 1.5730040850427685
Energy: 1.740383656149911
Energy: 1.5730040850427685
Energy: 1.4269437945534464
Energy: 1.7752581074561198
Energy: 1.4269437945539356
Energy: 1.7752581074561198
Energy: 1.4269437945534464
Energy: 1.7752581074556308
Energy: 1.5272836644412573
Energy: 1.564034032748128
Energy: 1.5272836644412573
Energy: 1.5640340327486173
Energy: 1.5272836644412573
Energy: 1.564034032747639
Energy: 1.655573030677709
Energy: 1.5406030381089375
Energy: 1.655573030677709
Energy: 1.5406030381089375
Energy: 1.6555730306772196
Energy: 1.5406030381099158

minimum gb energy = 1.3819794590846501 eV
minimum distance =  2.54588243242341 Angstroms
sigma value = 57


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

Energy: 1.4226262827165934
Energy: 1.2754284924019814
Energy: 1.4226262827165934
Energy: 1.2754284924019814
Energy: 1.4226262827165934
Energy: 1.2754284924019814
Energy: 1.7492083598935038
Energy: 1.7603619417725627
Energy: 1.7492083598935038
Energy: 1.7603619417725627
Energy: 1.7492083598935038
Energy: 1.760361941771692
Energy: 1.5239035361416622
Energy: 1.4290356087347806
Energy: 1.5239035361416622
Energy: 1.4290356087339102
Energy: 1.5239035361416622
Energy: 1.4290356087339102
Energy: 1.904667333696148
Energy: 1.5759997159902317
Energy: 1.904667333696148
Energy: 1.5759997159902317
Energy: 1.904667333696148
Energy: 1.5759997159911023
Energy: 1.5237462481024435
Energy: 1.4290499033320188
Energy: 1.5237462481024435
Energy: 1.4290499033328892
Energy: 1.5237462481015733
Energy: 1.4290499033328892
Energy: 1.7492385048137757
Energy: 1.3986918974369362
Energy: 1.7492385048137757
Energy: 1.3986918974369362
Energy: 1.7492385048137757
Energy: 1.3986918974369362
Energy: 1.422626282715723
Energy: 1.2754284924019814
Energy: 1.422626282715723
Energy: 1.2754284924011112
Energy: 1.422626282715723
Energy: 1.2754284924019814
Energy: 1.7492083598935038
Energy: 1.7603619417725627
Energy: 1.7492083598935038
Energy: 1.7603619417725627
Energy: 1.7492083598935038
Energy: 1.7603619417725627
Energy: 1.5239035361416622
Energy: 1.4290356087339102
Energy: 1.5239035361416622
Energy: 1.4290356087339102
Energy: 1.5239035361416622
Energy: 1.4290356087339102
Energy: 1.904667333694407
Energy: 1.5759997159911023
Energy: 1.904667333694407
Energy: 1.5759997159911023
Energy: 1.904667333694407
Energy: 1.5759997159911023
Energy: 1.5237462481007027
Energy: 1.4290499033311483
Energy: 1.5237462481015733
Energy: 1.4290499033320188
Energy: 1.5237462481015733
Energy: 1.4290499033320188
Energy: 1.7492385048137757
Energy: 1.6217521579599061
Energy: 1.7492385048137757
Energy: 1.6217521579599061
Energy: 1.7492385048137757
Energy: 1.6217521579599061
Energy: 1.4226262827165934
Energy: 1.2754284924019814
Energy: 1.4226262827165934
Energy: 1.2754284924019814
Energy: 1.4226262827165934
Energy: 1.2754284924019814
Energy: 1.749208359894374
Energy: 1.760361941773433
Energy: 1.749208359894374
Energy: 1.7603619417725627
Energy: 1.7492083598935038
Energy: 1.7603619417725627
Energy: 1.5239035361407915
Energy: 1.4290356087339102
Energy: 1.5239035361416622
Energy: 1.4290356087347806
Energy: 1.5239035361416622
Energy: 1.4290356087347806
Energy: 1.904667333696148
Energy: 1.5759997159902317
Energy: 1.904667333696148
Energy: 1.5759997159902317
Energy: 1.904667333696148
Energy: 1.5759997159902317
Energy: 1.5237462481015733
Energy: 1.4290499033320188
Energy: 1.5237462481015733
Energy: 1.4290499033320188
Energy: 1.5237462481015733
Energy: 1.4290499033320188

minimum gb energy = 1.2754284924011112 eV
minimum distance =  2.53164964600117 Angstroms
sigma value = 9


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

Energy: 1.4505708357024256
Energy: 1.5166788512630496
Energy: 1.4505708357024256
Energy: 1.5166788512630496
Energy: 1.4505708357024256
Energy: 1.5166788512630496
Energy: 1.4869593765132798
Energy: 1.6484186426838805
Energy: 1.4869593765125693
Energy: 1.6484186426824592
Energy: 1.4869593765125693
Energy: 1.6484186426853018
Energy: 1.5875308562411974
Energy: 1.4654548150035398
Energy: 1.6201993841301603
Energy: 1.4654548150028286
Energy: 1.6201993841301603
Energy: 1.4654548150049609
Energy: 1.5273593453652183
Energy: 1.6452932108370575
Energy: 1.527359345364508
Energy: 1.6452932108370575
Energy: 1.5273593453652183
Energy: 1.6452932108370575
Energy: 1.863923513022745
Energy: 1.6689384691395626
Energy: 1.863923513022745
Energy: 1.6689384691395626
Energy: 1.863923513022745
Energy: 1.6689384691388516
Energy: 1.6671780392390678
Energy: 1.460080031157108
Energy: 1.6671780392390678
Energy: 1.460080031157108
Energy: 1.6671780392383573
Energy: 1.4600800311563973
Energy: 1.4351170640368451
Energy: 1.5089179991150057
Energy: 1.4351170640361344
Energy: 1.5089179991150057
Energy: 1.4351170640361344
Energy: 1.5089179991150057
Energy: 1.6408851952831212
Energy: 1.7420931594113012
Energy: 1.6408851952831212
Energy: 1.7420931594113012
Energy: 1.6408851952824108
Energy: 1.7420931594105904
Energy: 1.7882804702510806
Energy: 1.6039626487858665
Energy: 1.78828047025037
Energy: 1.6039626487858665
Energy: 1.7882804702510806
Energy: 1.6039626487858665
Energy: 1.4300069607552965
Energy: 1.4636961206689239
Energy: 1.430006960756007
Energy: 1.4636961206689239
Energy: 1.430006960756007
Energy: 1.4636961206689239
Energy: 1.660391054440248
Energy: 1.4902020252345634
Energy: 1.660391054440248
Energy: 1.4902020252345634
Energy: 1.6603910544409588
Energy: 1.490202025235274
Energy: 1.53394188239505
Energy: 1.4449797135938878
Energy: 1.5339418823964714
Energy: 1.4449797135938878
Energy: 1.533941882395761
Energy: 1.444979713593177
Energy: 1.4742023697501934
Energy: 1.7798557806563255
Energy: 1.4742023697480613
Energy: 1.7798557806556146
Energy: 1.4742023697501934
Energy: 1.7798557806556146
Energy: 1.8246426613924214
Energy: 1.6230404778236294
Energy: 1.8246426613917106
Energy: 1.6230404778207863
Energy: 1.8246426613924214
Energy: 1.623040477828604
Energy: 1.591296758902306
Energy: 1.7781116886811748
Energy: 1.5912967589015954
Energy: 1.7781116886811748
Energy: 1.591296758902306
Energy: 1.7781116886811748
Energy: 1.7022841900096501
Energy: 1.5457551820106759
Energy: 1.7022841900096501
Energy: 1.5457551820106759
Energy: 1.7022841900096501
Energy: 1.5457551820106759
Energy: 1.6521677971970836
Energy: 1.7089119502153638
Energy: 1.6521677971963726
Energy: 1.7089119502146526
Energy: 1.6521677971970836
Energy: 1.7089119502139423
Energy: 1.6670750473554061
Energy: 1.5669754562345484
Energy: 1.6670750473554061
Energy: 1.5669754562345484
Energy: 1.6670750473554061
Energy: 1.5669754562345484
Energy: 1.4607272649767185
Energy: 1.5724994111952137
Energy: 1.4607272649767185
Energy: 1.5724994111952137
Energy: 1.460727264975297
Energy: 1.5724994111945028
Energy: 1.6260490020445493
Energy: 1.4975292608301074
Energy: 1.6260490020438383
Energy: 1.4975292608293966
Energy: 1.6260490020452598
Energy: 1.4975292608301074
Energy: 1.5505661687326195
Energy: 1.4428647873864258
Energy: 1.5505661687333303
Energy: 1.4428647873864258
Energy: 1.5505661687333303
Energy: 1.4428647873871363

minimum gb energy = 1.4300069607552965 eV
minimum distance =  2.53296576709361 Angstroms
sigma value = 27


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

Energy: 1.437642084273176
Energy: 1.6270323239309923
Energy: 1.4376420842725768
Energy: 1.6270323239309923
Energy: 1.437642084273176
Energy: 1.6270323239303932
Energy: 1.4597466999448845
Energy: 1.4416408829665008
Energy: 1.4597466999454838
Energy: 1.4416408829665008
Energy: 1.4597466999454838
Energy: 1.4416408829665008
Energy: 1.5128327491452622
Energy: 1.398223313578475
Energy: 1.5128327491452622
Energy: 1.398223313579074
Energy: 1.5128327491452622
Energy: 1.398223313578475
Energy: 1.3149667170375507
Energy: 1.405560152512714
Energy: 1.31496671703815
Energy: 1.4055601525109167
Energy: 1.31496671703815
Energy: 1.405560152512714
Energy: 1.4310248821592662
Energy: 1.706777393852274
Energy: 1.4310248821592662
Energy: 1.706777393852274
Energy: 1.4310248821592662
Energy: 1.706777393852274
Energy: 1.4706283908068314
Energy: 1.3998175297030326
Energy: 1.470628390814619
Energy: 1.3998175297036317
Energy: 1.470628390805633
Energy: 1.3998175297030326
Energy: 1.440792746859586
Energy: 1.4605769933529227
Energy: 1.440792746859586
Energy: 1.460576993353522
Energy: 1.440792746859586
Energy: 1.4605769933529227
Energy: 1.4078429188477457
Energy: 1.514437192590816
Energy: 1.4078429188477457
Energy: 1.514437192591415
Energy: 1.4078429188471466
Energy: 1.514437192591415
Energy: 1.4131462030614133
Energy: 1.3200580194513483
Energy: 1.413146203060215
Energy: 1.3200580194513483
Energy: 1.413146203060215
Energy: 1.3200580194513483
Energy: 1.3151043875607167
Energy: 1.497545704461092
Energy: 1.3151043875607167
Energy: 1.497545704461092
Energy: 1.3151043875601178
Energy: 1.4975457044604932
Energy: 1.3150716445942976
Energy: 1.6685605948886504
Energy: 1.3150716445942976
Energy: 1.6685605948886504
Energy: 1.3150716445942976
Energy: 1.6685605948886504
Energy: 1.4602577806775197
Energy: 1.3680338398998497
Energy: 1.4602577806775197
Energy: 1.3680338398998497
Energy: 1.4602577806781187
Energy: 1.3680338398998497
Energy: 1.5251228114757094
Energy: 1.4076231358616789
Energy: 1.5251228114751105
Energy: 1.4076231358616789
Energy: 1.5251228114751105
Energy: 1.4076231358616789
Energy: 1.4384267823071888
Energy: 1.420671556997268
Energy: 1.4384267823065897
Energy: 1.4206715569978672
Energy: 1.4384267823071888
Energy: 1.4206715569978672
Energy: 1.5108974265431345
Energy: 1.4062815749773776
Energy: 1.5108974265425354
Energy: 1.4062815749779767
Energy: 1.5108974265425354
Energy: 1.4062815749767787
Energy: 1.4432682873039957
Energy: 1.6081321054071307
Energy: 1.4432682873033968
Energy: 1.6081321054059325
Energy: 1.4432682873039957
Energy: 1.6081321054071307
Energy: 1.3700090842258825
Energy: 1.6512848115096594
Energy: 1.3700090842252832
Energy: 1.6512848115096594
Energy: 1.3700090842258825
Energy: 1.6512848115096594
Energy: 1.4047912142357006
Energy: 1.3601296277595052
Energy: 1.4047912142362995
Energy: 1.3601296277595052
Energy: 1.4047912142362995
Energy: 1.360129627758307
Energy: 1.398136518261929
Energy: 1.429275206822943
Energy: 1.3981365182625283
Energy: 1.429275206822943
Energy: 1.398136518261929
Energy: 1.429275206822943
Energy: 1.4376420842719777
Energy: 1.6270323239309923
Energy: 1.4376420842719777
Energy: 1.6270323239303932
Energy: 1.4376420842713789
Energy: 1.6270323239303932
Energy: 1.4597466999460826
Energy: 1.4416408829671001
Energy: 1.4597466999460826
Energy: 1.4416408829665008
Energy: 1.459746699946682
Energy: 1.4416408829665008
Energy: 1.5128327491452622
Energy: 1.398223313578475
Energy: 1.5128327491446634
Energy: 1.398223313579074
Energy: 1.5128327491452622
Energy: 1.398223313579074
Energy: 1.314966717038749
Energy: 1.4055601525109167
Energy: 1.314966717038749
Energy: 1.4055601525103176
Energy: 1.31496671703815
Energy: 1.4055601525109167
Energy: 1.4310248821592662
Energy: 1.7067773938516746
Energy: 1.4310248821586669
Energy: 1.7067773938510757
Energy: 1.4310248821586669
Energy: 1.7067773938516746
Energy: 1.4706283907720852
Energy: 1.3998175297042306
Energy: 1.4706283907918547
Energy: 1.3998175297036317
Energy: 1.4706283907732833
Energy: 1.3998175297042306

minimum gb energy = 1.3149667170375507 eV
minimum distance =  2.54388252645635 Angstroms
sigma value = 19


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

Energy: 1.3402673712385378
Energy: 1.568621626334287
Energy: 1.3402673712395718
Energy: 1.568621626334287
Energy: 1.340267371239055
Energy: 1.568621626334287
Energy: 1.5582072078351088
Energy: 1.4922281758210965
Energy: 1.5582072078366604
Energy: 1.4922281758210965
Energy: 1.5582072078356262
Energy: 1.4922281758205789
Energy: 1.7283087478706853
Energy: 1.3030546438578186
Energy: 1.7283087478712023
Energy: 1.3030546438578186
Energy: 1.7283087478712023
Energy: 1.3030546438578186
Energy: 1.2885147624435205
Energy: 1.569680450992422
Energy: 1.2885147624430036
Energy: 1.5696804509929392
Energy: 1.2885147624430036
Energy: 1.569680450992422
Energy: 1.4386219714930883
Energy: 1.462108203323329
Energy: 1.4386219714946396
Energy: 1.4621082033228119
Energy: 1.4386219714936055
Energy: 1.4621082033228119
Energy: 1.5099894538232714
Energy: 1.296534496682175
Energy: 1.5099894538232714
Energy: 1.2965344966826922
Energy: 1.5099894538232714
Energy: 1.296534496682175
Energy: 1.3444159145753802
Energy: 1.5879033266370124
Energy: 1.3444159145753802
Energy: 1.5879033266370124
Energy: 1.3444159145753802
Energy: 1.5879033266370124
Energy: 1.367223646244901
Energy: 1.6996758709264381
Energy: 1.367223646244901
Energy: 1.6996758709264381
Energy: 1.367223646244901
Energy: 1.6996758709264381
Energy: 1.4990697305190712
Energy: 1.2693303839934604
Energy: 1.4990697305190712
Energy: 1.2693303839934604
Energy: 1.4990697305195884
Energy: 1.2693303839934604
Energy: 1.4639441036488137
Energy: 1.6380240563975863
Energy: 1.4639441036493306
Energy: 1.6380240563970692
Energy: 1.4639441036488137
Energy: 1.6380240563970692
Energy: 1.2728225929801678
Energy: 1.6284968136329976
Energy: 1.2728225929801678
Energy: 1.6284968136329976
Energy: 1.2728225929801678
Energy: 1.6284968136335147
Energy: 1.6727502187473042
Energy: 1.2957700675859645
Energy: 1.6727502187478214
Energy: 1.2957700675859645
Energy: 1.6727502187478214
Energy: 1.2957700675859645
Energy: 1.6378336942501728
Energy: 1.5678050624338835
Energy: 1.6378336942496554
Energy: 1.5678050624338835
Energy: 1.6378336942491383
Energy: 1.5678050624338835
Energy: 1.29670534581242
Energy: 1.4835676810818859
Energy: 1.2967053458129374
Energy: 1.4835676810818859
Energy: 1.29670534581242
Energy: 1.4835676810818859
Energy: 1.6575282529516295
Energy: 1.4039450568664407
Energy: 1.6575282529511126
Energy: 1.4039450568664407
Energy: 1.6575282529511126
Energy: 1.4039450568664407
Energy: 1.6356016504215647
Energy: 1.269503794493287
Energy: 1.6356016504210473
Energy: 1.269503794493287
Energy: 1.6356016504215647
Energy: 1.269503794493287
Energy: 1.303903282832767
Energy: 1.6678838293791958
Energy: 1.303903282832767
Energy: 1.6678838293797131
Energy: 1.303903282832767
Energy: 1.6678838293791958
Energy: 1.539434668157179
Energy: 1.5053363210793642
Energy: 1.5394346681566622
Energy: 1.5053363210793642
Energy: 1.539434668157179
Energy: 1.5053363210793642
Energy: 1.5755889432380419
Energy: 1.3005966855292401
Energy: 1.575588943238559
Energy: 1.3005966855292401
Energy: 1.5755889432380419
Energy: 1.3005966855297102
Energy: 1.3756269835856203
Energy: 1.635080375988404
Energy: 1.3756269835856203
Energy: 1.635080375988404
Energy: 1.3756269835861372
Energy: 1.635080375988404
Energy: 1.262727167905943
Energy: 1.6431282099492486
Energy: 1.262727167905943
Energy: 1.6431282099487317
Energy: 1.262727167905426
Energy: 1.6431282099487317
Energy: 1.6198352291310156
Energy: 1.3027043536556555
Energy: 1.6198352291310156
Energy: 1.3027043536556555
Energy: 1.6198352291304987
Energy: 1.3027043536556555
Energy: 1.5260039262591227
Energy: 1.6726225234724588
Energy: 1.5260039262586054
Energy: 1.6726225234729761
Energy: 1.5260039262586054
Energy: 1.6726225234724588
Energy: 1.329283029588315
Energy: 1.5918506092868234
Energy: 1.329283029588832
Energy: 1.5918506092868234
Energy: 1.329283029588832
Energy: 1.5918506092868234
Energy: 1.6065287432349793
Energy: 1.303131752018098
Energy: 1.6065287432349793
Energy: 1.3031317520175811
Energy: 1.6065287432349793
Energy: 1.303131752018098
Energy: 1.652161721423893
Energy: 1.677344830649896
Energy: 1.65216172142441
Energy: 1.677344830649896
Energy: 1.652161721423376
Energy: 1.677344830649896
Energy: 1.2659208026292832
Energy: 1.4233762977444495
Energy: 1.2659208026298001
Energy: 1.4233762977444495
Energy: 1.2659208026292832
Energy: 1.4233762977439324
Energy: 1.7100179277407561
Energy: 1.5202372985692705
Energy: 1.7100179277412735
Energy: 1.5202372985692705
Energy: 1.7100179277412735
Energy: 1.5202372985697874
Energy: 1.6678941376675798
Energy: 1.3013860502469414
Energy: 1.6678941376670626
Energy: 1.3013860502479757
Energy: 1.6678941376675798
Energy: 1.3013860502469414

minimum gb energy = 1.262727167905426 eV
minimum distance =  2.52598298034886 Angstroms
sigma value = 101


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

Energy: 1.2601400111902838
Energy: 1.5078995199597283
Energy: 1.2601400111902838
Energy: 1.507899519959274
Energy: 1.2601400111902838
Energy: 1.5078995199597283
Energy: 1.540098550152741
Energy: 1.373843182583851
Energy: 1.5400985501518323
Energy: 1.3738431825843056
Energy: 1.5400985501518323
Energy: 1.373843182583851
Energy: 1.6666675197268317
Energy: 1.2457134121437068
Energy: 1.666667519726377
Energy: 1.2457134121437068
Energy: 1.6666675197268317
Energy: 1.2457134121432523
Energy: 1.2064357769970777
Energy: 1.813774322525006
Energy: 1.2064357769966232
Energy: 1.6698856366463135
Energy: 1.2064357769975322
Energy: 1.6698856366467683
Energy: 1.4253877575516294
Energy: 1.5724608718401556
Energy: 1.4253877575511749
Energy: 1.57246087184061
Energy: 1.4253877575516294
Energy: 1.57246087184061
Energy: 1.5084660764091555
Energy: 1.2272739004284736
Energy: 1.5084660764091555
Energy: 1.2272739004284736
Energy: 1.5084660764091555
Energy: 1.2272739004280189
Energy: 1.3730946473460588
Energy: 1.5083865048946505
Energy: 1.3730946473460588
Energy: 1.5083865048987417
Energy: 1.3730946473460588
Energy: 1.5083865048991962
Energy: 1.2234506234592764
Energy: 1.8992430712457395
Energy: 1.2234506234592764
Energy: 1.8992430712457395
Energy: 1.2234506234592764
Energy: 1.8992430712457395
Energy: 1.5086592390291071
Energy: 1.2295027563713685
Energy: 1.5086592390300162
Energy: 1.229502756371823
Energy: 1.5086592390291071
Energy: 1.2295027563713685
Energy: 1.4251401105634312
Energy: 1.437464189224107
Energy: 1.4251401105634312
Energy: 1.4374641892250162
Energy: 1.4251401105629766
Energy: 1.4374641892245614
Energy: 1.205403265842677
Energy: 1.528192213835512
Energy: 1.2054032658430902
Energy: 1.528192213835512
Energy: 1.2054032658435447
Energy: 1.5281922138359667
Energy: 1.809082808940534
Energy: 1.2379925375398189
Energy: 1.8090828089409883
Energy: 1.2379925375402736
Energy: 1.8090828089409883
Energy: 1.2379925375398189
Energy: 1.5630682047758275
Energy: 1.246578534312603
Energy: 1.5630682047753734
Energy: 1.2465785343121483
Energy: 1.5630682047762823
Energy: 1.2465785343121483
Energy: 1.2647162907142118
Energy: 1.5643006107736217
Energy: 1.2647162907137572
Energy: 1.5643006107736217
Energy: 1.2647162907137572
Energy: 1.5643006107731672
Energy: 1.517051263284871
Energy: 1.5534332654824148
Energy: 1.517051263284871
Energy: 1.5534332654805967
Energy: 1.5170512632853252
Energy: 1.553433265481506
Energy: 1.6774917643157803
Energy: 1.248571103374209
Energy: 1.6774917643153255
Energy: 1.248571103374209
Energy: 1.6774917643153255
Energy: 1.248571103374209
Energy: 1.2057353522617444
Energy: 1.7607617803698226
Energy: 1.2057353522621987
Energy: 1.7607617803698226
Energy: 1.2057353522617444
Energy: 1.7607617803698226
Energy: 1.2060858817236646
Energy: 1.7947289132954314
Energy: 1.2060858817241193
Energy: 1.7947289132949773
Energy: 1.2060858817236646
Energy: 1.7947289132954314
Energy: 1.508542042407998
Energy: 1.2291805917811383
Energy: 1.508542042407544
Energy: 1.2291805917811383
Energy: 1.508542042407998
Energy: 1.2291805917815928
Energy: 1.53010381355189
Energy: 1.5086521606473022
Energy: 1.53010381355189
Energy: 1.5086521606477568
Energy: 1.53010381355189
Energy: 1.5086521606459387
Energy: 1.227424944515313
Energy: 1.6742422567229598
Energy: 1.2274249445157674
Energy: 1.6742422567229598
Energy: 1.227424944515313
Energy: 1.6742422567229598
Energy: 1.7749108574955312
Energy: 1.2272269329046357
Energy: 1.7749108574950765
Energy: 1.2272269329037266
Energy: 1.7749108574959855
Energy: 1.2272269329041812
Energy: 1.523191832125403
Energy: 1.4917000526875421
Energy: 1.5231918321249485
Energy: 1.4917000526875421
Energy: 1.5231918321258577
Energy: 1.4917000526875421
Energy: 1.2077275017968812
Energy: 1.4103739918088205
Energy: 1.2077275017968812
Energy: 1.4103739918088205
Energy: 1.2077275017968812
Energy: 1.410373991809275
Energy: 1.5396271523003269
Energy: 1.487271808682092
Energy: 1.539627152298963
Energy: 1.4872718086830012
Energy: 1.539627152298963
Energy: 1.487271808682092
Energy: 1.6120770196787642
Energy: 1.2485721518626598
Energy: 1.6120770196787642
Energy: 1.2485721518631143
Energy: 1.6120770196787642
Energy: 1.2485721518635688
Energy: 1.2606657535315007
Energy: 1.6695946797489916
Energy: 1.2606657535315007
Energy: 1.6695946797485368
Energy: 1.2606657535315007
Energy: 1.6695946797489916
Energy: 1.4523385093980294
Energy: 1.6837402840872384
Energy: 1.4523385093984842
Energy: 1.6837402840872384
Energy: 1.4523385093975747
Energy: 1.6837402840872384
Energy: 1.420359397237262
Energy: 1.2456291840511253
Energy: 1.420359397237262
Energy: 1.24562918405158
Energy: 1.4203593972368074
Energy: 1.24562918405158
Energy: 1.2057985640402356
Energy: 1.7205441832966386
Energy: 1.2057985640397813
Energy: 1.7205441832966386
Energy: 1.2057985640397813
Energy: 1.7205441832961839
Energy: 1.205597661574025
Energy: 1.4738010755682245
Energy: 1.205597661574025
Energy: 1.4738010755682245
Energy: 1.205597661574025
Energy: 1.4738010755682245
Energy: 1.5219119662952978
Energy: 1.2271400358629065
Energy: 1.5219119662957523
Energy: 1.2271400358629065
Energy: 1.5219119662952978
Energy: 1.2271400358629065
Energy: 1.6799181287501246
Energy: 1.4098474475728113
Energy: 1.6799181287501246
Energy: 1.4098474475723568
Energy: 1.6799181287501246
Energy: 1.4098474475728113

minimum gb energy = 1.205403265842677 eV
minimum distance =  2.53769272402906 Angstroms
sigma value = 33


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

Energy: 0.02149445271896943
Energy: 1.383847041436302
Energy: 0.02149445271896943
Energy: 1.3838470414414636
Energy: 0.02149445271896943
Energy: 1.3838470414377706
Energy: 0.02217869211436455
Energy: 0.3549638540347785
Energy: 0.02217869211436455
Energy: 0.35496385403440084
Energy: 0.022178692114742233
Energy: 0.35496385403440084
Energy: 1.4913796760929672
Energy: 0.3563907708455589
Energy: 1.4934694141261375
Energy: 0.35639077084593657
Energy: 1.4909685980630927
Energy: 0.35639077084593657
Energy: 0.022178692115119917
Energy: 0.3549638540340231
Energy: 0.022178692114742233
Energy: 0.35496385403364544
Energy: 0.022178692115119917
Energy: 0.35496385403440084

minimum gb energy = 0.02149445271896943 eV
minimum distance =  2.75739251095356 Angstroms
sigma value = 1