Model name: model_name=EAM_Dynamo_PanBorovikovMendelev_2108_AgNi__MO_222110751402_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.5181212425231942
cohesive_energy=4.385853711507128
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.017912932724146676
Energy: 1.3305244722906961
Energy: 0.017912932724146676
Energy: 1.3305244722910272
Energy: 0.017912932724146676
Energy: 1.3305244722906961
Energy: 1.3305244722910272
Energy: 0.6494881213556009
Energy: 1.3305244722906961
Energy: 1.4877079562414195
Energy: 1.3305244722906961
Energy: 1.2906239782014912
Energy: 0.017912932724146676
Energy: 1.3305244722906961
Energy: 0.017912932724146676
Energy: 1.3305244722910272
Energy: 0.017912932724146676
Energy: 1.3305244722906961
Energy: 1.3305244722906961
Energy: 1.4877079562459448
Energy: 1.3305244722906961
Energy: 1.5540562902167794
Energy: 1.3305244722910272
Energy: 1.2906239782027789
Energy: 0.017912932724146676
Energy: 1.3305244722906961
Energy: 0.017912932724146676
Energy: 1.3305244722910272
Energy: 0.017912932724146676
Energy: 1.3305244722906961
Energy: 1.3305244722906961
Energy: 1.2906239782014912
Energy: 1.3305244722906961
Energy: 1.2906239782018223
Energy: 1.3305244722906961
Energy: 1.2906239782014912

minimum gb energy = 0.017912932724146676 eV
minimum distance =  2.24808029851003 Angstroms
sigma value = 1


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

Energy: 1.3613794311399712
Energy: 1.3024722108412623
Energy: 1.361379431140768
Energy: 1.3024722108428566
Energy: 1.3613794311383771
Energy: 1.3024722108428566
Energy: 1.465895953821346
Energy: 1.201961643414692
Energy: 1.4658959538317076
Energy: 1.201961643414692
Energy: 1.4658959538285192
Energy: 1.201961643414692
Energy: 1.3282630801901016
Energy: 1.3664768991922753
Energy: 1.3282630801893045
Energy: 1.3664768991890874
Energy: 1.3282630801885078
Energy: 1.3664768991882903
Energy: 1.4895601198301283
Energy: 1.254317959478433
Energy: 1.4895601198301283
Energy: 1.254317959477636
Energy: 1.4895601198301283
Energy: 1.254317959477636
Energy: 1.314713637328596
Energy: 1.43601194899693
Energy: 1.3147136373222195
Energy: 1.4360119489993208
Energy: 1.3147136373246107
Energy: 1.4360119490025092
Energy: 1.395764004912074
Energy: 1.2199971316918368
Energy: 1.395764004908886
Energy: 1.2199971316910396
Energy: 1.3957640049104802
Energy: 1.2199971316894453
Energy: 1.2462894049870443
Energy: 1.3385912796307675
Energy: 1.2462894049870443
Energy: 1.3385912796259853
Energy: 1.2462894049878412
Energy: 1.3385912796315647
Energy: 1.2473020086595799
Energy: 1.4434021753824933
Energy: 1.2473020086587827
Energy: 1.443402175376914
Energy: 1.2473020086587827
Energy: 1.4434021753832904
Energy: 1.4072003295529705
Energy: 1.3391170831637524
Energy: 1.4072003295537674
Energy: 1.3391170831621586
Energy: 1.4072003295545643
Energy: 1.3391170831621586
Energy: 1.1852825143206478
Energy: 1.4297889809694544
Energy: 1.1852825143198507
Energy: 1.429788980962281
Energy: 1.1852825143206478
Energy: 1.4297889809702515
Energy: 1.3694188923162316
Energy: 1.2197477802736656
Energy: 1.3694188923162316
Energy: 1.2197477802744627
Energy: 1.3694188923146375
Energy: 1.2197477802736656
Energy: 1.1496094918031805
Energy: 1.382128580677968
Energy: 1.1496094918039776
Energy: 1.3821285806851413
Energy: 1.1496094918039776
Energy: 1.3821285806843442
Energy: 1.5063922153149787
Energy: 1.1379772869703502
Energy: 1.5063922153197606
Energy: 1.137977286969553
Energy: 1.5063922153165727
Energy: 1.1379772869703502
Energy: 1.238100759588649
Energy: 1.280628509260493
Energy: 1.238100759587055
Energy: 1.2806285092596958
Energy: 1.238100759588649
Energy: 1.280628509258899
Energy: 1.528547901128366
Energy: 1.1900489417099978
Energy: 1.5285479011275689
Energy: 1.1900489417099978
Energy: 1.5285479011124252
Energy: 1.1900489417099978
Energy: 1.5269785638751743
Energy: 1.3710992495412393
Energy: 1.5269785638751743
Energy: 1.3710992495420364
Energy: 1.5269785638743774
Energy: 1.3710992495476158
Energy: 1.3279323222985573
Energy: 1.3226116510062396
Energy: 1.3279323223017456
Energy: 1.3226116510038484
Energy: 1.3279323222969635
Energy: 1.3226116510062396
Energy: 1.3289980836557942
Energy: 1.2615464337445335
Energy: 1.3289980836557942
Energy: 1.2615464337461277
Energy: 1.3289980836613737
Energy: 1.2615464337453306
Energy: 1.3109715155322361
Energy: 1.2537245990408463
Energy: 1.310971515530642
Energy: 1.2537245990424402
Energy: 1.3109715155322361
Energy: 1.2537245990424402
Energy: 1.3801568544442513
Energy: 1.219838814570181
Energy: 1.3801568544482368
Energy: 1.2198388145709782
Energy: 1.3801568544522218
Energy: 1.219838814570181
Energy: 1.2114175679976096
Energy: 1.4586362221664355
Energy: 1.2114175679976096
Energy: 1.4586362221728117
Energy: 1.2114175679976096
Energy: 1.4586362221680296
Energy: 1.3884296853244744
Energy: 1.3415568822787705
Energy: 1.3884296853196922
Energy: 1.3415568822795674
Energy: 1.3884296853244744
Energy: 1.3415568822787705
Energy: 1.2117947180496496
Energy: 1.5311545892895084
Energy: 1.2117947180496496
Energy: 1.5311545892895084
Energy: 1.2117947180496496
Energy: 1.5311545892911027

minimum gb energy = 1.137977286969553 eV
minimum distance =  2.25538116183143 Angstroms
sigma value = 33


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

Energy: 1.3666252474379563
Energy: 1.4333531344479455
Energy: 1.366625247438863
Energy: 1.4333531344479455
Energy: 1.3666252474384095
Energy: 1.433353134447492
Energy: 1.3939849471991834
Energy: 1.2688936154455175
Energy: 1.3939849472059838
Energy: 1.268893615447331
Energy: 1.3939849472041703
Energy: 1.2688936154477843
Energy: 1.1459231135198376
Energy: 1.2670958086983195
Energy: 1.1459231135193841
Energy: 1.2670958086924258
Energy: 1.145923113518931
Energy: 1.2670958086892523
Energy: 1.4000921644726827
Energy: 1.4348042614552263
Energy: 1.4000921644740427
Energy: 1.4348042614552263
Energy: 1.4000921644726827
Energy: 1.4348042614547731
Energy: 1.2683688737098289
Energy: 1.3274158692138824
Energy: 1.268368873707562
Energy: 1.3274158692156957
Energy: 1.2683688737057486
Energy: 1.3274158692102556
Energy: 1.2671554877738953
Energy: 1.1459378019306918
Energy: 1.2671554877743487
Energy: 1.1459378019320519
Energy: 1.2671554877825093
Energy: 1.1459378019306918
Energy: 1.4402545108090625
Energy: 1.3665426155641505
Energy: 1.4402545108072493
Energy: 1.3665426155641505
Energy: 1.440254510803169
Energy: 1.3665426155664173
Energy: 1.145695114339813
Energy: 1.3677219835884828
Energy: 1.1456951143375464
Energy: 1.367721983591615
Energy: 1.145695114339813
Energy: 1.3677219836015888
Energy: 1.2229359534766604
Energy: 1.1502567615922383
Energy: 1.2229359534807405
Energy: 1.150256761593145
Energy: 1.2229359534784738
Energy: 1.1502567615913315
Energy: 1.1329078103910981
Energy: 1.2819316339066762
Energy: 1.1329078103910981
Energy: 1.2819316339338775
Energy: 1.132907810390645
Energy: 1.2819316339338775
Energy: 1.282056675256763
Energy: 1.1372025677523478
Energy: 1.282056675244976
Energy: 1.1372025677523478
Energy: 1.2820566752585765
Energy: 1.1372025677518944
Energy: 1.1467980843374899
Energy: 1.2259237516713006
Energy: 1.1467980843383967
Energy: 1.2259237516708474
Energy: 1.1467980843388499
Energy: 1.2259237516713006
Energy: 1.3673422768193502
Energy: 1.1462463724243879
Energy: 1.3673422768334043
Energy: 1.1462463724257481
Energy: 1.3673422768311376
Energy: 1.1462463724243879
Energy: 1.3662979672557491
Energy: 1.4448011212082073
Energy: 1.366297967257109
Energy: 1.4448011212063938
Energy: 1.3662979672562026
Energy: 1.4448011212032204
Energy: 1.2796053024715437
Energy: 1.2680955256316104
Energy: 1.2796053024751703
Energy: 1.2680955256325173
Energy: 1.279605302471997
Energy: 1.268095525629797
Energy: 1.1461801890444538
Energy: 1.268881552072866
Energy: 1.1461801890444538
Energy: 1.2688815520773995
Energy: 1.1461801890435472
Energy: 1.268881552072866
Energy: 1.431608133958979
Energy: 1.4056667185745608
Energy: 1.4316081339576188
Energy: 1.4056667185754674
Energy: 1.4316081339607922
Energy: 1.4056667185745608
Energy: 1.2669245582345876
Energy: 1.146048086368172
Energy: 1.266924558242748
Energy: 1.1460480863686253
Energy: 1.266924558240028
Energy: 1.1460480863690783
Energy: 1.2691735637597024
Energy: 1.2795765205967977
Energy: 1.269173563757436
Energy: 1.2795765206085847
Energy: 1.2691735637597024
Energy: 1.2795765206131184
Energy: 1.4396180061769768
Energy: 1.3704395373893055
Energy: 1.4396180061796968
Energy: 1.3704395373906655
Energy: 1.4396180061815105
Energy: 1.3704395373906655
Energy: 1.1446170198775782
Energy: 1.4853119124748853
Energy: 1.1446170198753116
Energy: 1.485311912478512
Energy: 1.144617019878485
Energy: 1.485311912483952
Energy: 1.2674250026710439
Energy: 1.1501028549451533
Energy: 1.2674250026837377
Energy: 1.1501028549456067
Energy: 1.2674250026760308
Energy: 1.1501028549456067
Energy: 1.1334728939645111
Energy: 1.2819995799825132
Energy: 1.133472893965418
Energy: 1.281999579963019
Energy: 1.133472893965418
Energy: 1.2819995799861401
Energy: 1.27923155731026
Energy: 1.268779816961581
Energy: 1.279231557297113
Energy: 1.2687798169611277
Energy: 1.2792315572989263
Energy: 1.2687798169606743
Energy: 1.145899208921389
Energy: 1.2682812413017495
Energy: 1.1458992089227489
Energy: 1.2682812412899624
Energy: 1.1458992089241091
Energy: 1.2682812412881488
Energy: 1.3669836396094999
Energy: 1.3939580573429162
Energy: 1.3669836396076864
Energy: 1.3939580573343024
Energy: 1.3669836396076864
Energy: 1.3939580573392893
Energy: 1.3670039753608811
Energy: 1.3939597948791955
Energy: 1.3670039753649612
Energy: 1.3939597948810087
Energy: 1.3670039753613346
Energy: 1.3939597948728484
Energy: 1.1459560160054467
Energy: 1.2680612547611132
Energy: 1.1459560160049935
Energy: 1.2680612547502326
Energy: 1.1459560160036335
Energy: 1.268061254743432
Energy: 1.2795372578599087
Energy: 1.2687976630477569
Energy: 1.2795372578549218
Energy: 1.2687976630486635
Energy: 1.2795372578567352
Energy: 1.2687976630482103
Energy: 1.133232761057307
Energy: 1.2806974444389054
Energy: 1.1332327610577604
Energy: 1.280697444420771
Energy: 1.1332327610577604
Energy: 1.2806974444457058
Energy: 1.2676280286122692
Energy: 1.1504116230004386
Energy: 1.2676280286181627
Energy: 1.150411622995905
Energy: 1.267628028623603
Energy: 1.1504116229904648
Energy: 1.1446664731838037
Energy: 1.4855816948948046
Energy: 1.1446664731865237
Energy: 1.4855816948970715
Energy: 1.1446664731860705
Energy: 1.4855816948916312
Energy: 1.4396289576541104
Energy: 1.3703147679875078
Energy: 1.4396289576536572
Energy: 1.3703147679870544
Energy: 1.4396289576563772
Energy: 1.3703147679861476
Energy: 1.2694528608118234
Energy: 1.2795571841669053
Energy: 1.26945286081001
Energy: 1.2795571841687188
Energy: 1.26945286081137
Energy: 1.2795571841646385
Energy: 1.267052405317141
Energy: 1.1460568990168951
Energy: 1.267052405321221
Energy: 1.1460568990173483
Energy: 1.2670524053185008
Energy: 1.1460568990178015
Energy: 1.4318217761195595
Energy: 1.4008882319392546
Energy: 1.431821776120466
Energy: 1.4008882319424283
Energy: 1.431821776121373
Energy: 1.400888231944695
Energy: 1.1462224677875277
Energy: 1.267307713990576
Energy: 1.1462224677870745
Energy: 1.2673077139796955
Energy: 1.1462224677875277
Energy: 1.2673077139833222
Energy: 1.279439479803077
Energy: 1.2681341131396682
Energy: 1.279439479803077
Energy: 1.268134113137855
Energy: 1.2794394798053437
Energy: 1.2681341131346815
Energy: 1.366259661802684
Energy: 1.4447993671096278
Energy: 1.3662596618004172
Energy: 1.4447993671091743
Energy: 1.3662596617976974
Energy: 1.4447993671105344
Energy: 1.3672504122346378
Energy: 1.146197090944121
Energy: 1.3672504122418918
Energy: 1.146197090944121
Energy: 1.367250412250052
Energy: 1.1461970909436676
Energy: 1.1468004094905326
Energy: 1.2259406987472434
Energy: 1.146800409489626
Energy: 1.2259406987467902
Energy: 1.146800409489626
Energy: 1.2259406987476968

minimum gb energy = 1.132907810390645 eV
minimum distance =  2.32335910383504 Angstroms
sigma value = 51


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

Energy: 1.332121122802359
Energy: 1.3599326000805512
Energy: 1.332121122802359
Energy: 1.3599326000805512
Energy: 1.332121122802359
Energy: 1.3599326000805512
Energy: 1.4476988640883706
Energy: 1.2668381754766949
Energy: 1.4476988640873203
Energy: 1.2668381754766949
Energy: 1.4476988640852193
Energy: 1.2668381754766949
Energy: 1.2812463794337101
Energy: 1.3427954076211208
Energy: 1.2812463794337101
Energy: 1.342795407624272
Energy: 1.2812463794337101
Energy: 1.3427954076253226
Energy: 1.3242383186441073
Energy: 1.1640368858678578
Energy: 1.3242383186441073
Energy: 1.1640368858678578
Energy: 1.3242383186441073
Energy: 1.164036885866807
Energy: 1.349367495117738
Energy: 1.2931702946059003
Energy: 1.349367495117738
Energy: 1.2931702946069508
Energy: 1.3493674951145866
Energy: 1.2931702946069508
Energy: 1.2568324901589316
Energy: 1.293080652960266
Energy: 1.2568324901641839
Energy: 1.293080652960266
Energy: 1.2568324901610324
Energy: 1.293080652960266
Energy: 1.2810539020351572
Energy: 1.2928515300928658
Energy: 1.2810539020341067
Energy: 1.2928515300928658
Energy: 1.2810539020351572
Energy: 1.2928515300928658
Energy: 1.2450665443572628
Energy: 1.2944485460326605
Energy: 1.2450665443572628
Energy: 1.294448546033711
Energy: 1.2450665443572628
Energy: 1.294448546033711
Energy: 1.5077321106385881
Energy: 1.1641196810789762
Energy: 1.5077321106396386
Energy: 1.1641196810789762
Energy: 1.5077321106375379
Energy: 1.1641196810789762
Energy: 1.185987135830565
Energy: 1.5113458273621525
Energy: 1.1859871358316152
Energy: 1.5113458273632028
Energy: 1.1859871358295142
Energy: 1.511345827364253
Energy: 1.4103403076831114
Energy: 1.184664698932758
Energy: 1.4103403076789096
Energy: 1.184664698932758
Energy: 1.410340307682061
Energy: 1.184664698932758
Energy: 1.3292339026702027
Energy: 1.362911451257299
Energy: 1.3292339026723037
Energy: 1.362911451257299
Energy: 1.3292339026712532
Energy: 1.362911451257299
Energy: 1.4425825504310128
Energy: 1.2665058964546048
Energy: 1.4425825504331136
Energy: 1.2665058964546048
Energy: 1.4425825504352146
Energy: 1.2665058964546048
Energy: 1.2814268266818987
Energy: 1.2631580817002273
Energy: 1.2814268266818987
Energy: 1.2631580816981265
Energy: 1.2814268266808482
Energy: 1.2631580816981265
Energy: 1.3241280598360439
Energy: 1.3359445697338095
Energy: 1.3241280598360439
Energy: 1.3359445697338095
Energy: 1.3241280598360439
Energy: 1.33594456973486
Energy: 1.3494463089344126
Energy: 1.2930481438515293
Energy: 1.349446308933362
Energy: 1.2930481438515293
Energy: 1.349446308933362
Energy: 1.2930481438515293
Energy: 1.3496028877302706
Energy: 1.400769574345281
Energy: 1.34960288772922
Energy: 1.4007695743473818
Energy: 1.3496028877302706
Energy: 1.4007695743484325
Energy: 1.3359712466033242
Energy: 1.2981544096423532
Energy: 1.3359712466033242
Energy: 1.2981544096423532
Energy: 1.3359712466033242
Energy: 1.2981544096423532

minimum gb energy = 1.164036885866807 eV
minimum distance =  2.1899171683044 Angstroms
sigma value = 19


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

Energy: 1.111080915450557
Energy: 1.138929179602985
Energy: 1.11108091545118
Energy: 1.1389291796023617
Energy: 1.1110809154524262
Energy: 1.138929179602985
Energy: 1.2467006511373029
Energy: 1.3390569710423441
Energy: 1.2467006511478953
Energy: 1.3390569710442133
Energy: 1.2467006511373029
Energy: 1.339056971040475
Energy: 1.0703279136798969
Energy: 1.3382830332429028
Energy: 1.07032791368052
Energy: 1.3382830332397873
Energy: 1.07032791368052
Energy: 1.3382830332435256
Energy: 1.1684632185611563
Energy: 1.070384614145771
Energy: 1.168463218559287
Energy: 1.07038461414764
Energy: 1.168463218555577
Energy: 1.07038461414764
Energy: 1.0973214039576182
Energy: 1.1075606700450333
Energy: 1.0973214039588641
Energy: 1.107560670043164
Energy: 1.0973214039576182
Energy: 1.1075606700456564
Energy: 1.0973710368848903
Energy: 1.1077548150526801
Energy: 1.0973710368855132
Energy: 1.1077548150476957
Energy: 1.0973710368848903
Energy: 1.107754815050811
Energy: 1.168455150790108
Energy: 1.0704304170554206
Energy: 1.168455150787021
Energy: 1.070430417056044
Energy: 1.1684551507894847
Energy: 1.070430417056044
Energy: 1.0703326394878379
Energy: 1.3388207519864157
Energy: 1.0703326394865917
Energy: 1.3388207519839233
Energy: 1.070332639487215
Energy: 1.3388207519857926
Energy: 1.2467119888292297
Energy: 1.339062049989692
Energy: 1.2467119888161453
Energy: 1.3390620499865766
Energy: 1.246711988814276
Energy: 1.339062049989692
Energy: 1.111080915451803
Energy: 1.1389291796023617
Energy: 1.111080915449934
Energy: 1.1389291796023617
Energy: 1.111080915451803
Energy: 1.1389291796023617
Energy: 1.246700651145403
Energy: 1.3390569710435902
Energy: 1.2467006511354337
Energy: 1.339056971040475
Energy: 1.2467006511348107
Energy: 1.3390569710448366
Energy: 1.0703279136798969
Energy: 1.3382830332416564
Energy: 1.0703279136792738
Energy: 1.3382830332422795
Energy: 1.0703279136798969
Energy: 1.3382830332441489
Energy: 1.16846321855991
Energy: 1.070384614147017
Energy: 1.1684632185605333
Energy: 1.0703846141451479
Energy: 1.16846321855991
Energy: 1.07038461414764
Energy: 1.097321403956995
Energy: 1.1075606700412948
Energy: 1.0973214039582413
Energy: 1.107560670043164
Energy: 1.0973214039576182
Energy: 1.1075606700475256
Energy: 1.0973710368848903
Energy: 1.1077548150489418
Energy: 1.0973710368848903
Energy: 1.1077548150520573
Energy: 1.0973710368855132
Energy: 1.1077548150476957
Energy: 1.1684551507845284
Energy: 1.0704304170554206
Energy: 1.1684551507888619
Energy: 1.0704304170554206
Energy: 1.1684551507882388
Energy: 1.0704304170554206
Energy: 1.0703326394865917
Energy: 1.3388207519882849
Energy: 1.0703326394865917
Energy: 1.3388207519851694
Energy: 1.0703326394878379
Energy: 1.338820751988908
Energy: 1.2467119888117837
Energy: 1.3390620499871995
Energy: 1.246711988812407
Energy: 1.339062049989692
Energy: 1.2467119888186375
Energy: 1.3390620499865766
Energy: 1.11108091545118
Energy: 1.1389291796023617
Energy: 1.111080915451803
Energy: 1.1389291796023617
Energy: 1.11108091545118
Energy: 1.138929179602985
Energy: 1.246700651145403
Energy: 1.3390569710442133
Energy: 1.2467006511410414
Energy: 1.3390569710454596
Energy: 1.246700651143534
Energy: 1.3390569710460827
Energy: 1.07032791368052
Energy: 1.3382830332429028
Energy: 1.0703279136792738
Energy: 1.3382830332416564
Energy: 1.0703279136792738
Energy: 1.338283033246018
Energy: 1.168463218559287
Energy: 1.070384614146394
Energy: 1.168463218559287
Energy: 1.07038461414764
Energy: 1.1684632185580692
Energy: 1.070384614147017
Energy: 1.097321403956995
Energy: 1.1075606700456564
Energy: 1.097321403956995
Energy: 1.107560670043787
Energy: 1.0973214039563721
Energy: 1.1075606700425409
Energy: 1.0973710368855132
Energy: 1.1077548150520573
Energy: 1.0973710368855132
Energy: 1.1077548150501881
Energy: 1.0973710368855132
Energy: 1.107754815051434
Energy: 1.168455150790108
Energy: 1.0704304170554206
Energy: 1.1684551507863978
Energy: 1.0704304170554206
Energy: 1.1684551507882388
Energy: 1.0704304170554206
Energy: 1.0703326394890842
Energy: 1.3388207519876618
Energy: 1.0703326394865917
Energy: 1.3388207519870385
Energy: 1.070332639487215
Energy: 1.338820751990154
Energy: 1.246711988815522
Energy: 1.3390620499865766
Energy: 1.2467119888086684
Energy: 1.3390620499884458
Energy: 1.2467119888180145
Energy: 1.3390620499859536
Energy: 1.11108091545118
Energy: 1.1389291796036078
Energy: 1.111080915451803
Energy: 1.1389291796036078
Energy: 1.111080915451803
Energy: 1.138929179601739
Energy: 1.2467006511391723
Energy: 1.3390569710435902
Energy: 1.2467006511466494
Energy: 1.339056971041098
Energy: 1.2467006511429106
Energy: 1.339056971041721
Energy: 1.0703279136798969
Energy: 1.3382830332435256
Energy: 1.0703279136792738
Energy: 1.3382830332416564
Energy: 1.0703279136792738
Energy: 1.3382830332435256

minimum gb energy = 1.0703279136792738 eV
minimum distance =  2.20535039866025 Angstroms
sigma value = 27


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

Energy: 1.1025775145984322
Energy: 1.0811337540579957
Energy: 1.1025775145984322
Energy: 1.0811337540579957
Energy: 1.1025775145984322
Energy: 1.0811337540579957
Energy: 1.2470277468318423
Energy: 1.121582986553068
Energy: 1.247027746833334
Energy: 1.121582986551542
Energy: 1.247027746833334
Energy: 1.121582986551542
Energy: 1.0567475709715497
Energy: 1.2455651539837607
Energy: 1.0567475709700234
Energy: 1.2455651539852868
Energy: 1.0567475709715497
Energy: 1.2455651539852868
Energy: 1.258125046004533
Energy: 1.0486326420724177
Energy: 1.258125046004533
Energy: 1.0486326420724177
Energy: 1.2581250459892708
Energy: 1.0486326420724177
Energy: 1.2553679049249353
Energy: 1.048632682610582
Energy: 1.2553679049234092
Energy: 1.048632682610582
Energy: 1.2553679049249353
Energy: 1.048632682610582
Energy: 1.2772726930375473
Energy: 1.3213645843221873
Energy: 1.2772726930390736
Energy: 1.3213645843252397
Energy: 1.2772726930329688
Energy: 1.3213645843221873
Energy: 1.1402124028281098
Energy: 1.1229289837455088
Energy: 1.1402124028265836
Energy: 1.1229289837439824
Energy: 1.2431779158672098
Energy: 1.1229289837455088
Energy: 1.0972405053679144
Energy: 1.082826602042594
Energy: 1.0972405053679144
Energy: 1.082826602042594
Energy: 1.0972405053679144
Energy: 1.082826602042594
Energy: 1.2495184246384596
Energy: 1.142054766365827
Energy: 1.2495184246369335
Energy: 1.1420547651606705
Energy: 1.2495184246384596
Energy: 1.1420547658288414
Energy: 1.2301586016550525
Energy: 1.2602439420708427
Energy: 1.2301586016550525
Energy: 1.2602439420708427
Energy: 1.2301586016550525
Energy: 1.2602439420708427
Energy: 1.1346191500973835
Energy: 1.0497462180272203
Energy: 1.134619150098875
Energy: 1.0497462180272203
Energy: 1.2829208966259507
Energy: 1.0497462180272203
Energy: 1.3231193089250202
Energy: 1.190925708851417
Energy: 1.3231193089265465
Energy: 1.1909257088498908
Energy: 1.3231193089265465
Energy: 1.1909257088483642

minimum gb energy = 1.0486326420724177 eV
minimum distance =  2.17287727516429 Angstroms
sigma value = 9


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

Energy: 1.112373323552274
Energy: 1.056819044515298
Energy: 1.112373323552703
Energy: 1.0568190445136216
Energy: 1.1123733235509874
Energy: 1.056819044515298
Energy: 1.061406669299826
Energy: 1.0300677174455517
Energy: 1.061406669297682
Energy: 1.1823439367129691
Energy: 1.0614066693006836
Energy: 1.0663156804509266
Energy: 0.9922965049715492
Energy: 1.1009647649154874
Energy: 0.9922965049689763
Energy: 1.1009647649236352
Energy: 0.9922965049711204
Energy: 1.1009647649253507
Energy: 1.0115443330481317
Energy: 0.9710252345215333
Energy: 1.0115443330485605
Energy: 0.971025234519389
Energy: 1.0115443330468454
Energy: 0.9710252345202468
Energy: 1.0721326920841714
Energy: 1.051336560812137
Energy: 1.0721326920841714
Energy: 1.051336560815139
Energy: 1.0721326920846002
Energy: 1.051336560812137
Energy: 1.079907199933955
Energy: 1.075128687182917
Energy: 1.0799071999373853
Energy: 1.164364282712346
Energy: 1.0799071999369565
Energy: 1.1098115227231755
Energy: 1.0291797589170866
Energy: 1.0831093080368897
Energy: 1.0291797589149423
Energy: 1.0831093080377476
Energy: 1.0291797589093676
Energy: 1.0831093080373186
Energy: 0.9553338861606249
Energy: 1.08733143896793
Energy: 0.9553338861606249
Energy: 1.0873314389670723
Energy: 0.9553338861610537
Energy: 1.0873314389683588
Energy: 1.1167313841218711
Energy: 1.052328282236958
Energy: 1.1167313841210136
Energy: 1.0523282822356717
Energy: 1.1167313841188693
Energy: 1.052328282236958
Energy: 1.1134900157881304
Energy: 1.0226622107604002
Energy: 1.113490015788559
Energy: 1.022662210878679
Energy: 1.113490015788988
Energy: 1.0226622110801513
Energy: 1.0089871375979191
Energy: 0.9784196269508673
Energy: 1.008987137595775
Energy: 0.9784196269500096
Energy: 1.0089871375970616
Energy: 0.9784196269512961
Energy: 1.0911104120650188
Energy: 1.0563021517683802
Energy: 1.0911104120633035
Energy: 1.056302151779101
Energy: 1.0911104120645898
Energy: 1.0563021517760989
Energy: 1.056078079025558
Energy: 1.0947483872483517
Energy: 1.0560780790294173
Energy: 1.0947483872509245
Energy: 1.0560780790289885
Energy: 1.0947483872453498
Energy: 1.1075887689994102
Energy: 1.0697972121119006
Energy: 1.1075887690015542
Energy: 1.069797212111043
Energy: 1.1075887689959796
Energy: 1.0697972121140447
Energy: 0.9931421409978198
Energy: 1.0696314669281564
Energy: 0.9931421409943891
Energy: 1.0696314669255833
Energy: 0.9931421409986775
Energy: 1.0696314669264408
Energy: 1.0310095746455812
Energy: 1.0931355132244351
Energy: 1.0310095746438661
Energy: 1.0931355132282945
Energy: 1.0310095746451524
Energy: 1.0931355132265792
Energy: 1.3109510956558326
Energy: 0.9719970857970142
Energy: 1.3109510956575479
Energy: 0.9719970857931547
Energy: 1.3109510956596921
Energy: 0.9719970857952989
Energy: 1.0021887484798773
Energy: 1.0381483644298983
Energy: 1.0021887484798773
Energy: 1.0381483644303269
Energy: 1.002188748477733
Energy: 1.0381483644307559
Energy: 0.9522936719763272
Energy: 1.278066395257529
Energy: 0.9522936719754695
Energy: 1.2780663952566715
Energy: 0.9522936719754695
Energy: 1.278066395257958
Energy: 1.1543542394182185
Energy: 1.155379177667181
Energy: 1.1543542394143589
Energy: 1.155379177667181
Energy: 1.154354239416932
Energy: 1.1142428439896792
Energy: 0.9522891192284466
Energy: 1.278282757230871
Energy: 0.9522891192288754
Energy: 1.278282757227869
Energy: 0.9522891192241583
Energy: 1.278282757230442
Energy: 1.00216779511154
Energy: 1.0380328578200657
Energy: 1.0021677951149706
Energy: 1.038032857819208
Energy: 1.002167795111111
Energy: 1.0380328578196367
Energy: 1.3110800370058107
Energy: 0.9717066352053436
Energy: 1.3110800370058107
Energy: 0.9717066352066303
Energy: 1.3110800370036664
Energy: 0.9717066352066303
Energy: 1.0307273556328036
Energy: 1.030551106771349
Energy: 1.0307273556328036
Energy: 1.030551106766632
Energy: 1.0307273556332321
Energy: 1.0305511067726356
Energy: 0.9931896905081128
Energy: 1.069531012023315
Energy: 0.9931896905076838
Energy: 1.0695310120220283
Energy: 0.9931896905076838
Energy: 1.069531012021171
Energy: 1.1076706747286733
Energy: 1.070079443944005
Energy: 1.1076706747269578
Energy: 1.0700794439474355
Energy: 1.1076706747308174
Energy: 1.0700794439504373
Energy: 1.0558717377611342
Energy: 1.094611693600335
Energy: 1.0558717377504134
Energy: 1.0946116936016215
Energy: 1.0558717377499847
Energy: 1.0946116936011927
Energy: 1.0906632334229982
Energy: 0.988321893564883
Energy: 1.0906632334238562
Energy: 0.9883218935665983
Energy: 1.0906632334208541
Energy: 0.9883218935661695
Energy: 1.0090287176456376
Energy: 0.9787731633173001
Energy: 1.0090287176434933
Energy: 0.978773163317729
Energy: 1.0090287176460662
Energy: 0.9787731633173001
Energy: 1.1124212697819542
Energy: 0.9718658171029488
Energy: 1.1124212697853848
Energy: 0.9718658171029488
Energy: 1.112421269782812
Energy: 0.9718658171038066
Energy: 1.117220060764856
Energy: 1.0522894380658887
Energy: 1.1172200607661424
Energy: 1.052289438067604
Energy: 1.117220060765285
Energy: 1.05228943806546
Energy: 0.9553465340080853
Energy: 1.0877031550062877
Energy: 0.9553465340101904
Energy: 1.0877031550050011
Energy: 0.9553465340076565
Energy: 1.0877031550045722
Energy: 1.0293706036707493
Energy: 1.0829513754998426
Energy: 1.0293706036681762
Energy: 1.0829513755007003
Energy: 1.0293706036681762
Energy: 1.0829513755007003
Energy: 1.0798585312148352
Energy: 1.001264617373701
Energy: 1.079858531220839
Energy: 1.0012646173732722
Energy: 1.079858531213549
Energy: 1.001264617373701
Energy: 1.0719748823163135
Energy: 1.0512266505803785
Energy: 1.071974882313312
Energy: 1.0512266505803785
Energy: 1.0719748823150272
Energy: 1.0512266505799497
Energy: 1.0115110936260145
Energy: 0.9707772321814985
Energy: 1.0115110936285874
Energy: 0.9707772321866446
Energy: 1.0115110936264433
Energy: 0.9707772321823561
Energy: 0.9923092587713975
Energy: 1.10103984139545
Energy: 0.9923092587696822
Energy: 1.101039841395021
Energy: 0.9923092587701111
Energy: 1.101039841398023
Energy: 1.0613374876172907
Energy: 1.0417957627049987
Energy: 1.061337487671713
Energy: 1.0417957627037124
Energy: 1.061337487604426
Energy: 1.0417957627015682
Energy: 1.1123733235432685
Energy: 1.0568190445119061
Energy: 1.1123733235441262
Energy: 1.0568190445144792
Energy: 1.1123733235411246
Energy: 1.0568190445127639
Energy: 1.0614066692981108
Energy: 1.0300677174374429
Energy: 1.0614066693015414
Energy: 1.0300677174361565
Energy: 1.0614066692985396
Energy: 1.0300677174361565
Energy: 0.9922965049672609
Energy: 1.1009647649124856
Energy: 0.9922965049642591
Energy: 1.1009647649124856
Energy: 0.9922965049668321
Energy: 1.100964764911199
Energy: 1.0115443330489895
Energy: 0.9710252345159583
Energy: 1.011544333049847
Energy: 0.9710252345159583
Energy: 1.0115443330507048
Energy: 0.9710252345172449
Energy: 1.0721326920824563
Energy: 1.0513365608177119
Energy: 1.0721326920807408
Energy: 1.0513365608164256
Energy: 1.0721326920764525
Energy: 1.0513365608168543

minimum gb energy = 0.9522891192241583 eV
minimum distance =  2.23582262251637 Angstroms
sigma value = 57


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

Energy: 0.5786389282497012
Energy: 0.591000614192178
Energy: 0.578638928248725
Energy: 0.5910006141892494
Energy: 0.5786389282477488
Energy: 0.5910006141902256
Energy: 0.6829501220848505
Energy: 0.5793920714450529
Energy: 0.6829501220672795
Energy: 0.5793920714304104
Energy: 0.6829501220828982
Energy: 0.5793920714323627
Energy: 0.6246775411008119
Energy: 0.6824756018762278
Energy: 0.6246775411017881
Energy: 0.682475601884969
Energy: 0.6246775411017881
Energy: 0.6824756018645138
Energy: 0.5910228150211353
Energy: 0.5783626609574861
Energy: 0.5910228150240636
Energy: 0.5783626609594384
Energy: 0.5910228150230874
Energy: 0.5783626609565099
Energy: 0.6832889573497694
Energy: 0.6829929244861653
Energy: 0.6832889573507456
Energy: 0.6829929244851892
Energy: 0.6832889573517217
Energy: 0.6829929244861653
Energy: 0.5786070309332313
Energy: 0.6249295965771366
Energy: 0.5786070309254219
Energy: 0.6249295965751843
Energy: 0.5786070309312789
Energy: 0.6249295965859223
Energy: 0.5786234789494528
Energy: 0.6249098987580116
Energy: 0.5786234789406671
Energy: 0.624909898771678
Energy: 0.57862347893481
Energy: 0.6249098987482499
Energy: 0.6830001564615742
Energy: 0.6829838929340449
Energy: 0.6830001564557171
Energy: 0.6829838929340449
Energy: 0.6830001564596219
Energy: 0.6829838929340449
Energy: 0.5910239339929902
Energy: 0.5783503895999247
Energy: 0.5910239339959188
Energy: 0.5783503895940678
Energy: 0.5910239339929902
Energy: 0.5783503895950439
Energy: 0.6248209846022312
Energy: 0.6822840849647361
Energy: 0.6248209846022312
Energy: 0.6822840849647361
Energy: 0.6248209846032075
Energy: 0.6822840849589235
Energy: 0.6828760438968046
Energy: 0.5793927595113225
Energy: 0.6828760438948522
Energy: 0.5793927595122987
Energy: 0.6828760438870428
Energy: 0.5793927595132748
Energy: 0.578638928248725
Energy: 0.5910006141892494
Energy: 0.5786389282497012
Energy: 0.5910006141843687
Energy: 0.5786389282477488
Energy: 0.5910006141882732
Energy: 0.6829501221151119
Energy: 0.5793920714431006
Energy: 0.6829501221082785
Energy: 0.5793920714362675
Energy: 0.6829501221053501
Energy: 0.5793920714391958
Energy: 0.6246775410998802
Energy: 0.6824756018752517
Energy: 0.6246775411008119
Energy: 0.6824756018625615
Energy: 0.6246775410998802
Energy: 0.6824756018703708
Energy: 0.5910228150240636
Energy: 0.5783626609447958
Energy: 0.5910228150250397
Energy: 0.5783626609487006
Energy: 0.5910228150240636
Energy: 0.5783626609418673
Energy: 0.6832889573390759
Energy: 0.6829929244851892
Energy: 0.683288957347817
Energy: 0.6829929244861653
Energy: 0.6832889573420043
Energy: 0.6829929244851892
Energy: 0.5786070309254219
Energy: 0.6249295965781129
Energy: 0.5786070309332313
Energy: 0.6249295965751843
Energy: 0.5786070309303027
Energy: 0.6249295965888507
Energy: 0.578623478928953
Energy: 0.6249098987482499
Energy: 0.5786234789435956
Energy: 0.6249098987531307
Energy: 0.5786234789270007
Energy: 0.6249098987648448
Energy: 0.6830001564459554
Energy: 0.6829838929340449
Energy: 0.6830001564518124
Energy: 0.6829838929340449
Energy: 0.6830001564527886
Energy: 0.6829838929340449

minimum gb energy = 0.5783503895940678 eV
minimum distance =  2.42719931496151 Angstroms
sigma value = 11


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

Energy: 1.0012371895593368
Energy: 1.1232079162055186
Energy: 1.0012371895600518
Energy: 1.1232079162055186
Energy: 1.0012371895586216
Energy: 1.1232079162055186
Energy: 1.1400799741493812
Energy: 1.0052084623607944
Energy: 1.1400799741486662
Energy: 1.0052084623615096
Energy: 1.1400799741515266
Energy: 1.0052084623600794
Energy: 1.0471190102786874
Energy: 1.260295398957633
Energy: 1.188143117134917
Energy: 1.260295398959713
Energy: 1.1467951068470532
Energy: 1.260295398956918
Energy: 1.2872700900343192
Energy: 0.9343954519369337
Energy: 1.2872700900328888
Energy: 0.9343954519376488
Energy: 1.287270090035034
Energy: 0.9343954519369337
Energy: 1.098694107213419
Energy: 0.8945181085939554
Energy: 1.098694107213419
Energy: 0.8945181085932403
Energy: 1.098694107214134
Energy: 0.8945181085932403
Energy: 1.081404223052484
Energy: 0.9219631571990026
Energy: 1.0814042230510537
Energy: 0.9219631571975725
Energy: 1.0814042230503387
Energy: 0.9219631571990026
Energy: 0.9261115267936266
Energy: 0.9687648075461303
Energy: 0.98760155156402
Energy: 0.9687648075411248
Energy: 0.9113695271472695
Energy: 0.9687648075396946
Energy: 1.1413639971428886
Energy: 0.8785336123233911
Energy: 1.1413639971436036
Energy: 0.8785336123219608
Energy: 1.1413639971421736
Energy: 0.8785336123233911
Energy: 1.138376478261193
Energy: 0.8787106880946159
Energy: 1.1383764782619081
Energy: 0.8787106880939008
Energy: 1.1383764782619081
Energy: 0.878710688095331
Energy: 0.8988664269532771
Energy: 1.188854343312587
Energy: 0.8988664269525621
Energy: 1.188854343312587
Energy: 0.8988664269539923
Energy: 1.188854343311872
Energy: 1.1179705165654295
Energy: 1.09684990620387
Energy: 1.1179705165647145
Energy: 1.096849906201725
Energy: 1.1179705165647145
Energy: 1.0968499062081603
Energy: 1.0056378292821262
Energy: 0.8972090690288015
Energy: 1.0056378292828412
Energy: 0.8972090690273712
Energy: 1.0056378292814112
Energy: 0.8972090690280863
Energy: 1.1641042947904736
Energy: 0.9357263417467785
Energy: 1.1641042947897586
Energy: 0.9357263417453485
Energy: 1.1641042947897586
Energy: 0.9357263417453485
Energy: 1.1204166066504786
Energy: 1.2320442438986703
Energy: 1.1204166066526235
Energy: 1.2320442438993853
Energy: 1.1204166066519086
Energy: 1.232044243897955
Energy: 1.1605981508261884
Energy: 1.0360676054802949
Energy: 1.1605981508247583
Energy: 1.03606760548101
Energy: 1.1605981508276184
Energy: 1.036067605478865
Energy: 0.9634934544485141
Energy: 1.1479452360947981
Energy: 0.9634934544477991
Energy: 1.147945236094083
Energy: 0.9634934544477991
Energy: 1.1479452360947981
Energy: 0.9749863372228622
Energy: 1.00220940854015
Energy: 0.9749863372221473
Energy: 1.0022094085394349
Energy: 0.9749863372235774
Energy: 1.0022094085394349
Energy: 1.2714836170412693
Energy: 1.140896511167089
Energy: 1.2714836170412693
Energy: 1.1408965111656588
Energy: 1.2714836170426995
Energy: 1.140896511166374
Energy: 1.2859483627663453
Energy: 0.9347620514664208
Energy: 1.2859483627670603
Energy: 0.9347620514678511
Energy: 1.2859483627663453
Energy: 0.9347620514664208
Energy: 1.101253143333367
Energy: 1.0337214702313529
Energy: 1.1012531433326518
Energy: 1.0337214702320678
Energy: 1.1012531433326518
Energy: 1.0337214702313529
Energy: 0.8956033061501394
Energy: 0.9208638489768337
Energy: 0.8956033061501394
Energy: 0.9208638489725433
Energy: 0.8956033061494245
Energy: 0.9208638489754034
Energy: 0.95368619933903
Energy: 0.9771292459203536
Energy: 0.9536861993397451
Energy: 0.9771292459203536
Energy: 0.9536861993418903
Energy: 0.9771292459239288
Energy: 1.0266901525607766
Energy: 1.058027148045693
Energy: 1.0266901525600614
Energy: 1.0580271480449779
Energy: 1.0266901525622065
Energy: 1.0580271480449779
Energy: 1.1375123927932027
Energy: 0.9990233995620696
Energy: 1.137512392793918
Energy: 0.9990233995620696
Energy: 1.1375123927932027
Energy: 0.9990233995613547
Energy: 0.8961504977759424
Energy: 1.1904568966073488
Energy: 0.8961504977773724
Energy: 1.1904568966059188
Energy: 0.8961504977766575
Energy: 1.1904568966066338
Energy: 1.4631003948209047
Energy: 1.101136838547938
Energy: 1.4631003948216197
Energy: 1.101136838547938
Energy: 1.4631003948195394
Energy: 1.1011368385522287

minimum gb energy = 0.8785336123219608 eV
minimum distance =  2.2509833961267 Angstroms
sigma value = 41


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

Energy: 1.0925879579065598
Energy: 0.9729672002982744
Energy: 1.0925879579082505
Energy: 0.9729672002977108
Energy: 1.0925879579071234
Energy: 0.9729672002977108
Energy: 1.0502370790136604
Energy: 1.1945516870065287
Energy: 1.0502370790147875
Energy: 1.1945516870070925
Energy: 1.0502370790136604
Energy: 1.1945516870070925
Energy: 1.1435534337115938
Energy: 1.1320649389331967
Energy: 1.1435534337127211
Energy: 1.1320649389320694
Energy: 1.1435534337110302
Energy: 1.1320649389326332
Energy: 1.0298146453911847
Energy: 0.9728589261418175
Energy: 1.0298146453906214
Energy: 0.9728589261412539
Energy: 1.0298146453917485
Energy: 0.9728589261423811
Energy: 0.9491839895786885
Energy: 0.9978810702943445
Energy: 0.9491839895781249
Energy: 0.9978810702943445
Energy: 0.9491839895803792
Energy: 0.9978810702943445
Energy: 1.2231654403913272
Energy: 1.2099820433085782
Energy: 1.2231654403902001
Energy: 1.2099820433085782
Energy: 1.2231654403924543
Energy: 1.2099820433085782
Energy: 0.9837099042895785
Energy: 1.3035446829739747
Energy: 0.9837099042884513
Energy: 1.3035446829728476
Energy: 0.9837099042878878
Energy: 1.3035446829739747
Energy: 0.9609289404875223
Energy: 0.9725615983869421
Energy: 0.9609289404869588
Energy: 0.9725615983863786
Energy: 0.9609289404875223
Energy: 0.9725615983863786
Energy: 0.9502514938370173
Energy: 0.9836062555854385
Energy: 0.9502514938364537
Energy: 0.9836062555854385
Energy: 0.9502514938370173
Energy: 0.9836062555854385
Energy: 1.0305082692045413
Energy: 1.0550142434723324
Energy: 1.0305082692045413
Energy: 1.0550142434717686
Energy: 1.0305082692039775
Energy: 1.0550142434723324
Energy: 1.033444036268309
Energy: 1.3023913066006092
Energy: 1.033444036268309
Energy: 1.3023913065994819
Energy: 1.0334440362677453
Energy: 1.302391306595537
Energy: 0.9426482770668781
Energy: 1.1942319618678685
Energy: 0.9426482770668781
Energy: 1.389956720248361
Energy: 0.9426482770674418
Energy: 1.1733771597363416
Energy: 0.9612625947109994
Energy: 0.971721046321482
Energy: 0.9612625947093086
Energy: 0.9717210463220456
Energy: 0.9612625947104357
Energy: 0.9717210463220456
Energy: 0.9354403210225101
Energy: 1.066120065674647
Energy: 0.9354403210219464
Energy: 1.0661200656769014
Energy: 0.9354403210225101
Energy: 1.0661200656763379
Energy: 1.0319863612102804
Energy: 1.2108132820062887
Energy: 1.031986361209717
Energy: 1.2108132820057251
Energy: 1.031986361209717
Energy: 1.2108132820057251
Energy: 0.934881858753609
Energy: 1.1867353411697772
Energy: 0.9348818587530453
Energy: 1.3848768297139766
Energy: 0.9348818587524816
Energy: 1.1718451274595656
Energy: 0.9765237896625247
Energy: 0.9718149084871605
Energy: 0.9765237896630884
Energy: 0.9718149084871605
Energy: 0.9765237896613975
Energy: 0.9718149084871605
Energy: 0.999976582191965
Energy: 1.3741201450528535
Energy: 0.9999765821936557
Energy: 1.3741201450511626
Energy: 0.9999765821942193
Energy: 1.3741201450528535
Energy: 1.0487141678932868
Energy: 1.1944875838321283
Energy: 1.0487141678955412
Energy: 1.1944875838304372
Energy: 1.0487141678949776
Energy: 1.194487583831001
Energy: 1.0298207789311455
Energy: 1.3436653855816196
Energy: 1.0298207789322729
Energy: 1.376171552344201
Energy: 1.0298207789300184
Energy: 0.9788037978774842
Energy: 0.9501929984488421
Energy: 1.151895409459824
Energy: 0.9501929984494057
Energy: 1.151895409458133
Energy: 0.9501929984488421
Energy: 1.151895409458133
Energy: 1.0246134576625614
Energy: 1.3132594386255534
Energy: 1.0246134576642523
Energy: 1.313259438624426
Energy: 1.0246134576698882
Energy: 1.3132594386255534
Energy: 1.0291134323707274
Energy: 0.9729428736434387
Energy: 1.0291134323701636
Energy: 0.972942873642875
Energy: 1.0291134323707274
Energy: 0.9729428736434387
Energy: 0.9349604094177698
Energy: 1.2539256542168786
Energy: 0.9349604094194605
Energy: 1.247900982323967
Energy: 0.9349604094188969
Energy: 1.1488068086457643
Energy: 0.933993149266599
Energy: 1.3481059011130883
Energy: 0.9339931492643447
Energy: 1.3481059011136516
Energy: 0.9339931492660354
Energy: 1.3481059011130883
Energy: 0.9801933131184234
Energy: 1.0604643323519094
Energy: 0.9801933131172963
Energy: 1.0604643323513459
Energy: 0.980193313118987
Energy: 1.0604643323507823
Energy: 0.9595387151546901
Energy: 0.9727342408223709
Energy: 0.9595387151552538
Energy: 0.9727342408229345
Energy: 0.9595387151546901
Energy: 0.9727342408229345
Energy: 0.9506071370619141
Energy: 1.2143329158535412
Energy: 0.9506071370613505
Energy: 1.1769303124848152
Energy: 0.9506071370613505
Energy: 1.133911358985401
Energy: 1.0351249374905278
Energy: 1.2007811024471138
Energy: 1.0351249374905278
Energy: 1.2007811024471138
Energy: 1.035124937489401
Energy: 1.2007811024465502
Energy: 1.1167863807828673
Energy: 1.0206431199211907
Energy: 1.1167863807828673
Energy: 1.0206431199200634
Energy: 1.1167863807823035
Energy: 1.0206431199211907
Energy: 0.9401850956160033
Energy: 1.1755546837559523
Energy: 0.9401850956165668
Energy: 1.1755546837548252
Energy: 0.9401850956154398
Energy: 1.1755546837559523
Energy: 0.9636041547477929
Energy: 0.9849789646023124
Energy: 0.9636041547483566
Energy: 0.9849789646023124
Energy: 0.9636041547483566
Energy: 0.9849789646028759
Energy: 0.9338772648363439
Energy: 1.1726918944094926
Energy: 0.9338772648352167
Energy: 1.1726918944094926
Energy: 0.9338772648369076
Energy: 1.1726918944094926

minimum gb energy = 0.9338772648352167 eV
minimum distance =  2.29302584036078 Angstroms
sigma value = 33


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

Energy: 1.0945391760880234
Energy: 1.0169416532316926
Energy: 1.0945391760844274
Energy: 1.016941653232124
Energy: 1.0945391760872323
Energy: 1.0169416532329152
Energy: 1.1691282951577104
Energy: 1.0005524574442164
Energy: 1.1691282951624569
Energy: 1.000552457444576
Energy: 1.169128295167563
Energy: 1.000552457444576
Energy: 1.0788069417617312
Energy: 1.1624061271713382
Energy: 1.078806941758567
Energy: 1.1624061271709065
Energy: 1.0788069417581356
Energy: 1.1624061271697559
Energy: 1.1025947009976071
Energy: 1.0110627430482224
Energy: 1.1025947010007715
Energy: 1.011062743047863
Energy: 1.1025947009991894
Energy: 1.0110627430474315
Energy: 1.0392619215580172
Energy: 1.1031796993727356
Energy: 1.0392619215591679
Energy: 1.1031796993707221
Energy: 1.0392619215591679
Energy: 1.1031796993695715
Energy: 1.3838624812064713
Energy: 1.0245911195816333
Energy: 1.3838624812045295
Energy: 1.0245911195827841
Energy: 1.3838624812061118
Energy: 1.0245911195824244
Energy: 1.041393039787051
Energy: 1.1225610656057006
Energy: 1.0413930397826643
Energy: 1.1225610656033271
Energy: 1.0413930397854692
Energy: 1.1225610656021765
Energy: 1.082691257603654
Energy: 1.1019902431880733
Energy: 1.082691257603654
Energy: 1.1019902431888644
Energy: 1.0826912576052363
Energy: 1.1019902431896553
Energy: 1.1267582128780473
Energy: 1.0338703512127105
Energy: 1.12675821287927
Energy: 1.03387035121156
Energy: 1.1267582128788385
Energy: 1.03387035121156
Energy: 1.4326856522107647
Energy: 1.0179809365569188
Energy: 1.4326856522123466
Energy: 1.0179809365569188
Energy: 1.4326856522107647
Energy: 1.0179809365561276
Energy: 1.0807419827545839
Energy: 1.084026176727833
Energy: 1.0807419827550153
Energy: 1.0840261767281925
Energy: 1.0807419827553748
Energy: 1.084026176729415
Energy: 1.673441513389251
Energy: 1.011130380110277
Energy: 1.673441513387669
Energy: 1.011130380110277
Energy: 1.6734415133864464
Energy: 1.0111303801098452
Energy: 1.0348967571046221
Energy: 1.1296311521292763
Energy: 1.0348967571046221
Energy: 1.1296311521067668
Energy: 1.034896757107355
Energy: 1.1296311521166194
Energy: 1.0977541672886302
Energy: 1.079159839022149
Energy: 1.097754167287911
Energy: 1.0791598390217896
Energy: 1.0977541672890618
Energy: 1.0791598390217896
Energy: 1.0930235206549048
Energy: 1.0450462668855243
Energy: 1.0930235206552645
Energy: 1.0450462668851646
Energy: 1.0930235206536822
Energy: 1.0450462668859557
Energy: 1.026489399285323
Energy: 1.3862378298768332
Energy: 1.026489399287696
Energy: 1.3862378298772648
Energy: 1.0264893992865454
Energy: 1.3862378298764737
Energy: 1.3966655620544521
Energy: 1.021157318854929
Energy: 1.3966655620556028
Energy: 1.0211573188537064
Energy: 1.3966655620643047
Energy: 1.021157318853347
Energy: 1.0082096005134915
Energy: 1.0979937202483854
Energy: 1.0082096005138508
Energy: 1.097993720250399
Energy: 1.0082096005138508
Energy: 1.097993720248817
Energy: 1.1609772227558026
Energy: 1.0782331267620322
Energy: 1.1609772227561619
Energy: 1.0782331267616008
Energy: 1.1609772227577442
Energy: 1.0782331267616008
Energy: 1.390400541565293
Energy: 1.0372861176452544
Energy: 1.390400541561697
Energy: 1.0372861176424497
Energy: 1.390400541560906
Energy: 1.0372861176432409
Energy: 1.0204721258271305
Energy: 1.0995443811839003
Energy: 1.0204721258310858
Energy: 1.0995443811834689
Energy: 1.0204721258299352
Energy: 1.09954438118426
Energy: 0.9983818934303806
Energy: 1.1331624959591542
Energy: 0.9983818934315313
Energy: 1.1331624959580036
Energy: 0.9983818934299491
Energy: 1.1331624959572124
Energy: 1.0934048510718588
Energy: 0.9982192423729801
Energy: 1.0934048510722905
Energy: 0.9982192423729801
Energy: 1.0934048510707082
Energy: 0.9982192423729801
Energy: 1.0140868933206997
Energy: 1.110242189848041
Energy: 1.0140868933191176
Energy: 1.1102421898491917
Energy: 1.0140868933171039
Energy: 1.1102421898488322
Energy: 1.1031860728971332
Energy: 1.0213968838481604
Energy: 1.103186072893178
Energy: 1.0213968838489516
Energy: 1.1031860729082084
Energy: 1.0213968838497427
Energy: 1.0245948900562727
Energy: 1.0939595908615096
Energy: 1.024594890057855
Energy: 1.0939595908602873
Energy: 1.024594890054331
Energy: 1.093959590860719
Energy: 1.1327891584291656
Energy: 1.0400959051974228
Energy: 1.1327891584291656
Energy: 1.0400959051966314
Energy: 1.1327891584271517
Energy: 1.0400959051962722
Energy: 1.0875929833491695
Energy: 1.0159188497582627
Energy: 1.0875929833499607
Energy: 1.0159188497578313
Energy: 1.087592983348738
Energy: 1.0159188497574716
Energy: 1.0361307039409315
Energy: 1.1275392918415543
Energy: 1.0361307039409315
Energy: 1.127539291845078
Energy: 1.0361307039401404
Energy: 1.1275392918490335
Energy: 1.0187340601304575
Energy: 1.4319812987306177
Energy: 1.0187340601308175
Energy: 1.4319812987306177
Energy: 1.0187340601308175
Energy: 1.4319812987318403
Energy: 1.0612363394664988
Energy: 1.0096197511997267
Energy: 1.061236339462112
Energy: 1.0096197511997267
Energy: 1.0612363394641255
Energy: 1.0096197511997267
Energy: 1.0141793689539165
Energy: 1.3953809653304992
Energy: 1.014179368955139
Energy: 1.3953809653182736
Energy: 1.014179368954348
Energy: 1.3953809653312903
Energy: 1.3903919953555415
Energy: 1.0316317701927296
Energy: 1.3903919953519457
Energy: 1.0316317701922981
Energy: 1.390391995357915
Energy: 1.0316317701919384
Energy: 1.0787852397592397
Energy: 1.0937278653611455
Energy: 1.0787852397572981
Energy: 1.0937278653607858
Energy: 1.0787852397572981
Energy: 1.0937278653603544
Energy: 1.0785863264678137
Energy: 1.093740929652061
Energy: 1.0785863264666626
Energy: 1.093740929651701
Energy: 1.0785863264666626
Energy: 1.093740929652061
Energy: 1.3903746694797139
Energy: 1.0317308644100902
Energy: 1.3903746694856827
Energy: 1.0317308644088674
Energy: 1.3903746694844603
Energy: 1.0317308644104497
Energy: 1.0148810526013463
Energy: 1.39742343995386
Energy: 1.0148810526029286
Energy: 1.3974234399847119
Energy: 1.0148810526037195
Energy: 1.3974234399819072
Energy: 1.0608271284560076
Energy: 1.0092988327595522
Energy: 1.0608271284572302
Energy: 1.0092988327599837
Energy: 1.0608271284560076
Energy: 1.0092988327603436
Energy: 1.0187864291907476
Energy: 1.4319056129240413
Energy: 1.0187864291923296
Energy: 1.431905612924473
Energy: 1.0187864291923296
Energy: 1.4319056129240413
Energy: 1.0361413558142465
Energy: 1.1278858865072527
Energy: 1.0361413558126644
Energy: 1.127885886493373
Energy: 1.0361413558110824
Energy: 1.1278858864909997
Energy: 1.087581156484816
Energy: 1.0159230155226089
Energy: 1.0875811564856068
Energy: 1.0159230155226089
Energy: 1.0875811564852473
Energy: 1.0159230155226089
Energy: 1.13269404133821
Energy: 1.040060358709056
Energy: 1.1326940413377784
Energy: 1.040060358709056
Energy: 1.13269404133821
Energy: 1.040060358709847
Energy: 1.0246740887153274
Energy: 1.0937264825809974
Energy: 1.0246740887141048
Energy: 1.09372648258222
Energy: 1.024674088712163
Energy: 1.0937264825778332
Energy: 1.1029950371967427
Energy: 1.0214793572218852
Energy: 1.1029950371986845
Energy: 1.0214793572223169
Energy: 1.102995037193938
Energy: 1.0214793572218852
Energy: 1.0140538594600772
Energy: 1.1100022895474448
Energy: 1.0140538594605089
Energy: 1.1100022895442803
Energy: 1.0140538594616595
Energy: 1.1100022895450714
Energy: 1.0931454346787373
Energy: 1.0065809495853981
Energy: 1.0931454346811103
Energy: 1.0065809495853981
Energy: 1.0931454346787373
Energy: 1.006580949584607
Energy: 0.9983542909075281
Energy: 1.1323614258730104
Energy: 0.9983542909071687
Energy: 1.1323614258734418
Energy: 0.9983542909063775
Energy: 1.1323614258726507

minimum gb energy = 0.9982192423729801 eV
minimum distance =  2.29143345919438 Angstroms
sigma value = 67


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

Energy: 1.1697769352331737
Energy: 1.0798237644927606
Energy: 1.1697769352305303
Energy: 1.0798237644901172
Energy: 1.1697769352331737
Energy: 1.0798237644901172
Energy: 1.148940810896926
Energy: 1.0551729059031978
Energy: 1.148940810896926
Energy: 1.0551729059058415
Energy: 1.148940810896926
Energy: 1.0551729059058415
Energy: 1.3719387889158587
Energy: 1.2552841903865026
Energy: 1.5832461991314362
Energy: 1.2552841903865026
Energy: 1.564535219725866
Energy: 1.255284190389146
Energy: 1.148950216581361
Energy: 1.0553751462736236
Energy: 1.1489502165840046
Energy: 1.0553751462736236
Energy: 1.1489502165840046
Energy: 1.0553751462736236
Energy: 1.1697769352305303
Energy: 1.0798237644901172
Energy: 1.1697769352331737
Energy: 1.0798237644901172
Energy: 1.1697769352331737
Energy: 1.0798237644901172
Energy: 1.148940810896926
Energy: 1.0551729059006147
Energy: 1.1489408108942825
Energy: 1.0551729059006147
Energy: 1.1489408108942825
Energy: 1.0551729059006147
Energy: 1.4639168782954715
Energy: 1.2552841903917895
Energy: 1.4639168782954715
Energy: 1.2552841903917895
Energy: 1.4639168782954715
Energy: 1.2552841903917895

minimum gb energy = 1.0551729059006147 eV
minimum distance =  2.29110627876462 Angstroms
sigma value = 3


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

Energy: 1.4473713568689948
Energy: 1.27404388279092
Energy: 1.4473713568689948
Energy: 1.27404388279092
Energy: 1.4473713568689948
Energy: 1.27404388279092
Energy: 1.2673622400975502
Energy: 1.20130771336255
Energy: 1.2673622400975502
Energy: 1.20130771336255
Energy: 1.2673622400975502
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Energy: 1.2803578019561284
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Energy: 1.2206496202333827
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Energy: 1.2304438736346925
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Energy: 1.2997923162787224
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Energy: 1.3467560916413448
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Energy: 1.2741028261697676
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Energy: 1.2596701920405922
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Energy: 1.2752865755917757
Energy: 1.2292344908783137
Energy: 1.275286575595373
Energy: 1.2697237215148458
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Energy: 1.2697237215112485
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Energy: 1.2181755510267946
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Energy: 1.1915299269844921
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Energy: 1.1915299269844921
Energy: 1.3246208919195408
Energy: 1.2585006190395205
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Energy: 1.2585006190395205
Energy: 1.3246208919159435
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Energy: 1.3767541543984037
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Energy: 1.2005169633853
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Energy: 1.296354474247195
Energy: 1.3516774830622362
Energy: 1.2963544742507924
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Energy: 1.2963544742507924
Energy: 1.243420877043197
Energy: 1.2430493362675346
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Energy: 1.2430493362675346
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Energy: 1.243049336271132
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Energy: 1.2661466975621567
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Energy: 1.2661466975657538
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Energy: 1.2661466975657538
Energy: 1.2036031402644627
Energy: 1.2961252642086771
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Energy: 1.2961252642014827
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Energy: 1.2459521532441706
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Energy: 1.4280146153551863
Energy: 1.2459521532441706
Energy: 1.1746011414166735
Energy: 1.3045046986249231
Energy: 1.1746011414166735
Energy: 1.3045046986249231
Energy: 1.1746011414166735
Energy: 1.3045046986249231
Energy: 1.3187345999392546
Energy: 1.2661985093858381
Energy: 1.3187345999320599
Energy: 1.2661985093858381
Energy: 1.318734599942852
Energy: 1.2661985093894355
Energy: 1.2234616823667028
Energy: 1.319592168923318
Energy: 1.2234616823667028
Energy: 1.3195921689269152
Energy: 1.2234616823631055
Energy: 1.3195921689269152
Energy: 1.3945081371738948
Energy: 1.1867960280724226
Energy: 1.3945081371738948
Energy: 1.1867960280724226
Energy: 1.3945081371702974
Energy: 1.18679602807602
Energy: 1.1897240350970395
Energy: 1.2440632040797708
Energy: 1.1897240350970395
Energy: 1.2440632040797708
Energy: 1.1897240350970395
Energy: 1.2440632040833681
Energy: 1.3122000560047609
Energy: 1.189381981149339
Energy: 1.3122000560227474
Energy: 1.189381981149339
Energy: 1.3122000560119556
Energy: 1.189381981149339
Energy: 1.274933162050992
Energy: 1.293419661950572
Energy: 1.274933162050992
Energy: 1.293419661950572
Energy: 1.274933162050992
Energy: 1.293419661961364
Energy: 1.3473332409201035
Energy: 1.193630227455929
Energy: 1.3473332409201035
Energy: 1.193630227455929
Energy: 1.3473332409201035
Energy: 1.193630227455929
Energy: 1.2294059115498097
Energy: 1.2403691348063584
Energy: 1.229405911553407
Energy: 1.2403691348063584
Energy: 1.229405911553407
Energy: 1.2403691348063584
Energy: 1.287617339766821
Energy: 1.2022650533053367
Energy: 1.2876173397596262
Energy: 1.2022650533053367
Energy: 1.2876173397596262
Energy: 1.202265053308934
Energy: 1.2232142441764127
Energy: 1.3258359210107036
Energy: 1.22321424418001
Energy: 1.325835921014301
Energy: 1.22321424418001
Energy: 1.325835921014301
Energy: 1.2727544055737234
Energy: 1.2744544845951282
Energy: 1.2727544055773208
Energy: 1.2744544845951282
Energy: 1.272754405570126
Energy: 1.2744544845987256
Energy: 1.2517149802982073
Energy: 1.2788240593463114
Energy: 1.2517149803018046
Energy: 1.2788240593427138
Energy: 1.2517149802982073
Energy: 1.2788240593463114

minimum gb energy = 1.1746011414166735 eV
minimum distance =  2.19799244600393 Angstroms
sigma value = 81


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

Energy: 1.3541956570294054
Energy: 1.241921660659453
Energy: 1.3541956570289115
Energy: 1.2419216606599468
Energy: 1.354195657029899
Energy: 1.241921660659453
Energy: 1.2747439807114724
Energy: 1.2664478437942635
Energy: 1.2747439807124599
Energy: 1.2664478437927822
Energy: 1.2747439807124599
Energy: 1.266447843793276
Energy: 1.3467042688431483
Energy: 1.1604450823313806
Energy: 1.3467042688431483
Energy: 1.160445082332368
Energy: 1.3467042688446296
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Energy: 1.2816475173654491
Energy: 1.2809334660979328
Energy: 1.2816475173659427
Energy: 1.2809334660979328
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Energy: 1.280933466097439
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Energy: 1.2482768693222395
Energy: 1.3114596584812872
Energy: 1.2482768693177957
Energy: 1.3114596584802998
Energy: 1.2482768693192772
Energy: 1.1985954940534023
Energy: 1.1569195050512584
Energy: 1.1985954940529084
Energy: 1.1569195050517522
Energy: 1.1985954940538959
Energy: 1.1569195050512584
Energy: 1.1311100617297003
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Energy: 1.1311100617292067
Energy: 1.160701022075292
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Energy: 1.299106609733717
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Energy: 1.1995767780576747
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Energy: 1.1995767780556998
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Energy: 1.315192412400075
Energy: 1.2806538322654872
Energy: 1.315192412400075
Energy: 1.2806538322659808
Energy: 1.315192412399581
Energy: 1.3199610903285135
Energy: 1.158197743759589
Energy: 1.3199610903285135
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Energy: 1.319961090327526
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Energy: 1.299320904935426
Energy: 1.1834884511874542
Energy: 1.2993209049349321
Energy: 1.1834884511869606
Energy: 1.2993209049349321
Energy: 1.1834884511869606
Energy: 1.317272229858062
Energy: 1.248913453351461
Energy: 1.317272229857568
Energy: 1.2489134533524484
Energy: 1.3172722298590493
Energy: 1.2489134533519546
Energy: 1.30426674454075
Energy: 1.157132880115947
Energy: 1.30426674454075
Energy: 1.1571328801154532
Energy: 1.30426674454075
Energy: 1.157132880115947
Energy: 1.149112215093346
Energy: 1.3105613940641163
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Energy: 1.3105613940636227
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Energy: 1.3105613940641163
Energy: 1.3002785189214239
Energy: 1.306238842537219
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Energy: 1.3062388425382063
Energy: 1.300278518922905
Energy: 1.3062388425387002
Energy: 1.2805322527858598
Energy: 1.365447279743101
Energy: 1.2805322527868475
Energy: 1.3654472797435948
Energy: 1.280532252787835
Energy: 1.3654472797455697
Energy: 1.2732126385583173
Energy: 1.3151280952160243
Energy: 1.2732126385588112
Energy: 1.3151280952160243
Energy: 1.27321263855733
Energy: 1.3151280952160243
Energy: 1.2179233549428359
Energy: 1.1714918981030948
Energy: 1.2179233549413546
Energy: 1.171491898102601
Energy: 1.2179233549433295
Energy: 1.171491898102601
Energy: 1.217476661411202
Energy: 1.1152626229096156
Energy: 1.2174766614116956
Energy: 1.1152626229096156
Energy: 1.2174766614126833
Energy: 1.1152626229096156
Energy: 1.2917682911659563
Energy: 1.312389191632383
Energy: 1.2917682911649688
Energy: 1.312389191632383
Energy: 1.2917682911659563
Energy: 1.312389191632383
Energy: 1.317850755759585
Energy: 1.333661309620702
Energy: 1.3178507557660035
Energy: 1.3336613096177394
Energy: 1.3178507557590915
Energy: 1.3336613096172458
Energy: 1.3007845927506143
Energy: 1.436578228036307
Energy: 1.3007845927516017
Energy: 1.4365782280358133
Energy: 1.3007845927516017
Energy: 1.4365782280368007
Energy: 1.1486804318539774
Energy: 1.2822850170388052
Energy: 1.1486804318559523
Energy: 1.2822850170392988
Energy: 1.1486804318544712
Energy: 1.2822850170392988
Energy: 1.2553452877080131
Energy: 1.1571877804490545
Energy: 1.255345287706038
Energy: 1.1571877804490545
Energy: 1.2553452877065319
Energy: 1.1571877804495485
Energy: 1.2658016288809724
Energy: 1.2812970781878235
Energy: 1.2658016288814662
Energy: 1.281297078188811
Energy: 1.2658016288814662
Energy: 1.281297078188811
Energy: 1.1592178592994347
Energy: 1.1609411883176854
Energy: 1.159217859298447
Energy: 1.1609411883176854
Energy: 1.1592178593009157
Energy: 1.1609411883181793
Energy: 1.2837514117498048
Energy: 1.300026746353632
Energy: 1.2837514117488174
Energy: 1.3000267463546193
Energy: 1.2837514117493112
Energy: 1.3000267463531383
Energy: 1.248221277298075
Energy: 1.3124494650098213
Energy: 1.248221277299556
Energy: 1.312449465010315
Energy: 1.2482212772990624
Energy: 1.312449465010315
Energy: 1.1562665498770972
Energy: 1.2017482352227742
Energy: 1.1562665498766036
Energy: 1.2017482352257365
Energy: 1.1562665498785785
Energy: 1.2017482352252427
Energy: 1.1575320771669553
Energy: 1.1297100697272595
Energy: 1.1575320771659678
Energy: 1.1297100697272595
Energy: 1.157532077167449
Energy: 1.1297100697267657
Energy: 1.2103858584200349
Energy: 1.479281835045673
Energy: 1.2103858584195413
Energy: 1.4792818350451793
Energy: 1.2103858584205287
Energy: 1.4792818350466603
Energy: 1.3842683737053851
Energy: 1.2790607786784798
Energy: 1.3842683737083477
Energy: 1.279060778677986
Energy: 1.3842683737063726
Energy: 1.2790607786814423
Energy: 1.2660267026896148
Energy: 1.2764964042300582
Energy: 1.266026702689121
Energy: 1.2764964042295646
Energy: 1.2660267026896148
Energy: 1.2764964042300582
Energy: 1.1696294304246029
Energy: 1.1608519472506187
Energy: 1.1696294304246029
Energy: 1.1608519472501249
Energy: 1.169629430424109
Energy: 1.1608519472506187

minimum gb energy = 1.1152626229096156 eV
minimum distance =  2.2923691000666 Angstroms
sigma value = 43


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

Energy: 1.4199132053738288
Energy: 1.262051572672342
Energy: 1.4199132053732224
Energy: 1.2620515726717358
Energy: 1.4199132053750416
Energy: 1.2620515726717358
Energy: 1.2697404948213669
Energy: 1.1779652556877889
Energy: 1.2697404948207605
Energy: 1.1779652556871825
Energy: 1.269740494820154
Energy: 1.1779652556883953
Energy: 1.238391688407489
Energy: 1.401361006204954
Energy: 1.238391688407489
Energy: 1.4013610062031345
Energy: 1.3104862880747714
Energy: 1.401361006204954
Energy: 1.1928110608873164
Energy: 1.2120471504582284
Energy: 1.1928110608867097
Energy: 1.2120471504582284
Energy: 1.1928110608867097
Energy: 1.2120471504582284
Energy: 1.2715779120638957
Energy: 1.2652684644748344
Energy: 1.2715779120638957
Energy: 1.2652684644790795
Energy: 1.271577912064502
Energy: 1.2652684644815053
Energy: 1.2427419202972187
Energy: 1.265912664848896
Energy: 1.242741920294793
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Energy: 1.2427419202966123
Energy: 1.2659126648495023
Energy: 1.2415861958413328
Energy: 1.3450685459085732
Energy: 1.2415861958407264
Energy: 1.3450685459085732
Energy: 1.2415861958419392
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Energy: 1.227763202887355
Energy: 1.29928692406689
Energy: 1.2277632028879617
Energy: 1.29928692406689
Energy: 1.227763202887355
Energy: 1.29928692406689
Energy: 1.3528232776697269
Energy: 1.1632845882394216
Energy: 1.3528232776715463
Energy: 1.1632845882394216
Energy: 1.3528232776727593
Energy: 1.1632845882400282
Energy: 1.2030871434282397
Energy: 1.260335989642725
Energy: 1.2030871434282397
Energy: 1.2603359896378734
Energy: 1.2030871434288464
Energy: 1.260335989637267
Energy: 1.3073885390270872
Energy: 1.2410227166203747
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Energy: 1.3073885390270872
Energy: 1.2410227166197683
Energy: 1.2275763964613875
Energy: 1.2917672492153711
Energy: 1.227576396460781
Energy: 1.291767247202209
Energy: 1.2275763964613875
Energy: 1.2917672428619051
Energy: 1.304297942338235
Energy: 1.2656898562844143
Energy: 1.3042979423400543
Energy: 1.2656898562844143
Energy: 1.3042979423406607
Energy: 1.265689856285021
Energy: 1.1462264340104833
Energy: 1.3553393937504858
Energy: 1.1462264340110897
Energy: 1.3553393937510922
Energy: 1.1462264340104833
Energy: 1.3553393937510922
Energy: 1.2099866024960115
Energy: 1.2657168098483529
Energy: 1.2099866024966182
Energy: 1.2657168098489593
Energy: 1.2099866024966182
Energy: 1.2657168098489593
Energy: 1.239839256534906
Energy: 1.284838458782121
Energy: 1.239839256534906
Energy: 1.284838458782121
Energy: 1.239839256534906
Energy: 1.2848384587833341
Energy: 1.3234189358106896
Energy: 1.1781954990192434
Energy: 1.3234189358137216
Energy: 1.178195499018637
Energy: 1.3234189358149346
Energy: 1.178195499018637
Energy: 1.3269806879512425
Energy: 1.2270779295816818
Energy: 1.3269806879518486
Energy: 1.2270779295816818
Energy: 1.326980687952455
Energy: 1.2270779295816818
Energy: 1.3269495182816087
Energy: 1.2337704174474955
Energy: 1.3269495182822153
Energy: 1.2337704174468893
Energy: 1.3269495182803959
Energy: 1.2337704174468893
Energy: 1.320910448609897
Energy: 1.1799338825589953
Energy: 1.3209104486105034
Energy: 1.179933882558389
Energy: 1.32091044861111
Energy: 1.179933882558389
Energy: 1.2408042825956311
Energy: 1.3003251445743693
Energy: 1.2408042825956311
Energy: 1.3003251445743693
Energy: 1.2408042825962375
Energy: 1.3003251445743693
Energy: 1.351094656215559
Energy: 1.2569924182256593
Energy: 1.351094656215559
Energy: 1.256992418225053
Energy: 1.3510946562161656
Energy: 1.256992418225053
Energy: 1.1463242923037087
Energy: 1.2894678805144826
Energy: 1.1463242923049217
Energy: 1.289467880515089
Energy: 1.146324292304315
Energy: 1.2894678805156952
Energy: 1.3020886219158507
Energy: 1.265858563333218
Energy: 1.3020886219164571
Energy: 1.2658585633326114
Energy: 1.3020886219140313
Energy: 1.265858563333218
Energy: 1.2278190682123047
Energy: 1.245804019668411
Energy: 1.2278190682116983
Energy: 1.245804019668411
Energy: 1.2278190682123047
Energy: 1.2458040196678046
Energy: 1.3581185872382011
Energy: 1.2533274207937206
Energy: 1.3581185872375947
Energy: 1.2533274207937206
Energy: 1.358118587236988
Energy: 1.253327420794327
Energy: 1.1995019158251183
Energy: 1.3375234164166685
Energy: 1.1995019158257245
Energy: 1.3375234164160619
Energy: 1.2616724216432786
Energy: 1.3375234164190941
Energy: 1.3489912019197339
Energy: 1.252951138607184
Energy: 1.3489912019203125
Energy: 1.252951138607184
Energy: 1.348991201917308
Energy: 1.2529511386065777
Energy: 1.2277040915339759
Energy: 1.2970527885853251
Energy: 1.2277040915333695
Energy: 1.2970527885853251
Energy: 1.227704091532763
Energy: 1.2970527885853251
Energy: 1.2720388056863365
Energy: 1.2852290757816212
Energy: 1.2720388056863365
Energy: 1.2852290757816212
Energy: 1.272038805686943
Energy: 1.2852290757816212
Energy: 1.301281635246318
Energy: 1.2656482367084858
Energy: 1.3012816352457113
Energy: 1.2656482367084858
Energy: 1.3414836254447235
Energy: 1.265648236707273

minimum gb energy = 1.1462264340104833 eV
minimum distance =  2.25389357527039 Angstroms
sigma value = 57


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

Energy: 1.3145932403079486
Energy: 1.1553340687371263
Energy: 1.314593240308734
Energy: 1.1553340687371263
Energy: 1.314593240308734
Energy: 1.155334068736341
Energy: 1.237530910175785
Energy: 1.1101061036021374
Energy: 1.2375309101742142
Energy: 1.110106103601352
Energy: 1.2375309101749996
Energy: 1.110106103601352
Energy: 1.2554540457521344
Energy: 1.352530885163603
Energy: 1.2554540457529197
Energy: 1.3525308851643885
Energy: 1.2554540457513492
Energy: 1.352530885163603
Energy: 1.2345213870789207
Energy: 1.2512210792511116
Energy: 1.2345213870789207
Energy: 1.2512210792511116
Energy: 1.2345213870789207
Energy: 1.2512210792526821
Energy: 1.3227507977335138
Energy: 1.2489823404025964
Energy: 1.3227507977295878
Energy: 1.248982340399491
Energy: 1.322750797728017
Energy: 1.248982340404952
Energy: 1.252770590250269
Energy: 1.1101662362764433
Energy: 1.2527705902518391
Energy: 1.1101662362772284
Energy: 1.2527705902447723
Energy: 1.1101662362772284
Energy: 1.2251121051827056
Energy: 1.3057247358659692
Energy: 1.2251121051827056
Energy: 1.3057247358659692
Energy: 1.225112105183491
Energy: 1.3057247358659692
Energy: 1.3244114936526707
Energy: 1.1569292011249566
Energy: 1.3244114936534561
Energy: 1.1569292011249566
Energy: 1.3244114936518856
Energy: 1.1569292011249566
Energy: 1.2414844942048968
Energy: 1.1082955319991235
Energy: 1.2414844942064673
Energy: 1.1082955319991235
Energy: 1.2414844942064673
Energy: 1.1082955319991235
Energy: 1.0879701899177041
Energy: 1.1104004159099023
Energy: 1.0879701899177041
Energy: 1.1785428933196345
Energy: 1.0879701899177041
Energy: 1.2375696285080027
Energy: 1.2248230953640553
Energy: 1.2505240840808534
Energy: 1.2248230953640553
Energy: 1.2505240840816385
Energy: 1.22482309536327
Energy: 1.2505240840816385
Energy: 1.3576463785136024
Energy: 1.3041551734242602
Energy: 1.357646378512032
Energy: 1.3041551734234749
Energy: 1.3576463785143877
Energy: 1.304155173426616
Energy: 1.2367326616602439
Energy: 1.1087690044435925
Energy: 1.2367326616602439
Energy: 1.1087690044443779
Energy: 1.2367326616602439
Energy: 1.1087690044428073
Energy: 1.3126547644569035
Energy: 1.138136718677582
Energy: 1.312654764457689
Energy: 1.1717877356462925
Energy: 1.3126547644553332
Energy: 1.1152935166929254
Energy: 1.2052930860591418
Energy: 1.1146461320420398
Energy: 1.2052930860567859
Energy: 1.1146461320428251
Energy: 1.2052930860560007
Energy: 1.1146461320420398
Energy: 1.2416663433001836
Energy: 1.194311595405706
Energy: 1.2416663432970425
Energy: 1.194311595405706
Energy: 1.241666343293152
Energy: 1.194311595405706
Energy: 1.08408593271662
Energy: 1.2204206017635388
Energy: 1.084085932717405
Energy: 1.2204206017572925
Energy: 1.0840859327181904
Energy: 1.2204206017627535
Energy: 1.2270937348320818
Energy: 1.1636345437231854
Energy: 1.2270937348320818
Energy: 1.418048057032471
Energy: 1.2270937348336521
Energy: 1.238063019455995
Energy: 1.0841275157700156
Energy: 1.2205390902879818
Energy: 1.0841275157708008
Energy: 1.2205390902832702
Energy: 1.0841275157700156
Energy: 1.2205390902832702
Energy: 1.2426478886316163
Energy: 1.194348116805276
Energy: 1.2426478886339722
Energy: 1.194348116804491
Energy: 1.2426478886300458
Energy: 1.194348116804491
Energy: 1.2054712673353256
Energy: 1.1129004762857306
Energy: 1.2054712673345402
Energy: 1.1129004762857306
Energy: 1.2054712673353256
Energy: 1.1129004762849453
Energy: 1.3127311388136922
Energy: 1.1411512279566414
Energy: 1.3127311388144771
Energy: 1.1411512279574265
Energy: 1.3127311388136922
Energy: 1.1411512279574265
Energy: 1.236818276244326
Energy: 1.1087867703370429
Energy: 1.236818276245111
Energy: 1.1087867703370429
Energy: 1.2368182762435407
Energy: 1.1087867703370429
Energy: 1.3577721378676095
Energy: 1.304122283911852
Energy: 1.3577721378668242
Energy: 1.304122283908711
Energy: 1.3577721378668242
Energy: 1.304122283908711

minimum gb energy = 1.08408593271662 eV
minimum distance =  2.2770530236463 Angstroms
sigma value = 17


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

Energy: 1.212645048674224
Energy: 1.093883120699369
Energy: 1.212645048674224
Energy: 1.093883120699369
Energy: 1.212645048674224
Energy: 1.093883120699369
Energy: 1.0471148720425734
Energy: 1.0447695474160141
Energy: 1.0471148720425734
Energy: 1.0447695474149037
Energy: 1.0471148720425734
Energy: 1.0447695474149037
Energy: 1.1642695458480214
Energy: 1.2328736843087864
Energy: 1.164269545849132
Energy: 1.232873684307676
Energy: 1.1642695458480214
Energy: 1.2328736843087864
Energy: 0.9785784063245154
Energy: 1.195666327576062
Energy: 0.9785784063256259
Energy: 1.1956663275738408
Energy: 0.9785784063245154
Energy: 1.1956663275749515
Energy: 1.1794034795549382
Energy: 1.1401750421635952
Energy: 1.1794034795538275
Energy: 1.1401750421624846
Energy: 1.1794034795549382
Energy: 1.1401750421624846
Energy: 1.0857301299178301
Energy: 1.1719004622236284
Energy: 1.0857301299178301
Energy: 1.1719004622247389
Energy: 1.0857301299178301
Energy: 1.1719004622225178
Energy: 1.1099211506307272
Energy: 1.0369236900136236
Energy: 1.1099211506318378
Energy: 1.0369236900136236
Energy: 1.1099211506318378
Energy: 1.0369236900136236
Energy: 0.9784178673559207
Energy: 1.1830613079546242
Energy: 0.9784178673559207
Energy: 1.1830613079557348
Energy: 0.9784178673559207
Energy: 1.1830613079568453
Energy: 1.1445022609874826
Energy: 1.043786133598198
Energy: 1.1445022609874826
Energy: 1.043786133598198
Energy: 1.144502260988593
Energy: 1.043786133598198
Energy: 1.1179110187417078
Energy: 1.049097797396359
Energy: 1.1179110187417078
Energy: 1.049097797396359
Energy: 1.1179110187417078
Energy: 1.049097797396359
Energy: 1.1009169148274878
Energy: 1.1436414373428463
Energy: 1.1009169148263773
Energy: 1.1436414373439567
Energy: 1.1009169148263773
Energy: 1.1436414373439567
Energy: 1.1268470262532777
Energy: 1.0475227214702594
Energy: 1.1268470262532777
Energy: 1.0475227214691492
Energy: 1.1268470262532777
Energy: 1.0475227214702594
Energy: 0.9785821653403294
Energy: 1.1737319211545427
Energy: 0.9785821653403294
Energy: 1.1737319211545427
Energy: 0.9785821653403294
Energy: 1.1737319211545427
Energy: 1.1174711730121432
Energy: 1.1454219571527882
Energy: 1.1174711730121432
Energy: 1.1454219571527882
Energy: 1.1174711730132536
Energy: 1.145421957151678
Energy: 1.0845353347003155
Energy: 1.2406553334318478
Energy: 1.0845353347025368
Energy: 1.2406553334318478
Energy: 1.0845353347025368
Energy: 1.2406553334318478
Energy: 1.0853434332003469
Energy: 1.1689618995816815
Energy: 1.0853434332003469
Energy: 1.1689618995816815
Energy: 1.0853434332014573
Energy: 1.1689618995816815
Energy: 1.1168728571167303
Energy: 1.1474743787921486
Energy: 1.11687285711562
Energy: 1.1474743787932593
Energy: 1.11687285711562
Energy: 1.1474743787921486

minimum gb energy = 0.9784178673559207 eV
minimum distance =  2.2205147509225 Angstroms
sigma value = 17


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

Energy: 1.0968429087496259
Energy: 0.9801476283071479
Energy: 1.0968429087509122
Energy: 0.9801476283075766
Energy: 1.0968429087513412
Energy: 0.9801476283075766
Energy: 0.987496181790975
Energy: 0.9442858506174414
Energy: 0.9874961817892597
Energy: 0.9442858506174414
Energy: 0.9874961817944058
Energy: 0.9442858506174414
Energy: 1.0861078380037275
Energy: 1.0579047935053323
Energy: 1.0861078380045852
Energy: 1.0579047935036168
Energy: 1.0861078380054427
Energy: 1.0579047935044747
Energy: 0.9160638978861512
Energy: 1.0126868099431336
Energy: 0.9160638978852935
Energy: 1.0126868099435626
Energy: 0.9160638978904395
Energy: 1.0126868099452782
Energy: 1.0878830984614916
Energy: 0.9470197255571735
Energy: 1.0878830984614916
Energy: 0.9470197255567447
Energy: 1.087883098460634
Energy: 0.947019725556316
Energy: 1.0227503386620187
Energy: 0.958896735320098
Energy: 1.0227503386641628
Energy: 0.9588967353205268
Energy: 1.0227503386598744
Energy: 0.958896735320098
Energy: 0.9894470971713518
Energy: 0.9680674336860752
Energy: 0.989447097181176
Energy: 0.9680674336856464
Energy: 0.9894470971700653
Energy: 0.9680674336847886
Energy: 0.9933716142212663
Energy: 1.1765325567622011
Energy: 0.9933716142272699
Energy: 1.1765325567622011
Energy: 0.9933716142127287
Energy: 1.1765325567630587
Energy: 1.0045618684498778
Energy: 1.046978760052576
Energy: 1.0045618684485913
Energy: 1.0469787600560068
Energy: 1.0045618684485913
Energy: 1.046978760052576
Energy: 0.9910456907107469
Energy: 0.8923170223890933
Energy: 0.9910456907111758
Energy: 0.892317022389951
Energy: 0.9910456907103181
Energy: 0.8923170223882356
Energy: 0.9162982690164928
Energy: 1.140191708345611
Energy: 0.9162982690156353
Energy: 1.1401917083460396
Energy: 0.9162982690126333
Energy: 1.1401917083464685
Energy: 1.0793690236710345
Energy: 0.9734394600743534
Energy: 1.0793690236706057
Energy: 0.9734394600726383
Energy: 1.0793690236701767
Energy: 0.9734394600739247
Energy: 1.0166329913950216
Energy: 0.974062958789374
Energy: 1.0166329913924874
Energy: 0.9740629587859435
Energy: 1.0166329913877705
Energy: 0.9740629587863723
Energy: 1.00002769713089
Energy: 1.0607131042099958
Energy: 1.0000276971313187
Energy: 1.0607131042104248
Energy: 1.00002769713089
Energy: 1.0607131042099958
Energy: 1.0456997686879004
Energy: 1.0788938209399428
Energy: 1.0456997686870426
Energy: 1.0788938209416579
Energy: 1.0456997686904732
Energy: 1.0788938209416579
Energy: 0.9173111054578141
Energy: 1.149577913241979
Energy: 0.91731110545567
Energy: 1.1625635566925034
Energy: 0.9173111054582431
Energy: 1.1190847579274932
Energy: 1.015551467235002
Energy: 1.0123633170534831
Energy: 1.0155514672337154
Energy: 1.0123633170534831
Energy: 1.0155514672354307
Energy: 1.0123633170530544
Energy: 1.0366724207482656
Energy: 1.1784720771932111
Energy: 1.036672420747408
Energy: 1.1784720771932111
Energy: 1.0366724207504099
Energy: 1.1784720771932111
Energy: 0.9937815853470647
Energy: 1.1208969097031078
Energy: 0.9937815853474935
Energy: 1.1208969097031078
Energy: 0.9937815853462071
Energy: 1.1208969097031078
Energy: 1.0146384918869646
Energy: 0.9803432504684693
Energy: 1.0146384918865359
Energy: 0.9986233259788169
Energy: 1.014638491889538
Energy: 0.9693749567458323
Energy: 0.9934897886693491
Energy: 1.1211450428887602
Energy: 0.9934897886650608
Energy: 1.1211450428883314
Energy: 0.9934897886667761
Energy: 1.1211450428883314
Energy: 1.0367035043262431
Energy: 1.178455275731687
Energy: 1.036703504331818
Energy: 1.1784552757308298
Energy: 1.0367035043288162
Energy: 1.178455275731687
Energy: 1.0156043913066943
Energy: 1.0124521683767782
Energy: 1.0156043913087995
Energy: 1.0124521683763885
Energy: 1.0156043913075519
Energy: 1.0124521683763885
Energy: 0.9171764101764186
Energy: 1.1760490678395878
Energy: 0.917176410170844
Energy: 1.1760490678383015
Energy: 0.9171764101768476
Energy: 1.176049067839159
Energy: 1.0455216111569055
Energy: 1.0791516987580982
Energy: 1.045521611158621
Energy: 1.079151698755954
Energy: 1.0455216111569055
Energy: 1.0791516987495215
Energy: 0.9999397758316035
Energy: 1.0606392278098788
Energy: 0.9999397758324612
Energy: 1.0606392278111654
Energy: 0.9999397758316035
Energy: 1.0606392278103076
Energy: 1.01690769480282
Energy: 0.9738909938364372
Energy: 1.0169076948036775
Energy: 0.973890993842012
Energy: 1.0169076948019622
Energy: 0.9738909938351508
Energy: 1.079352242244993
Energy: 0.9735321720237632
Energy: 1.0793522422432777
Energy: 0.9735321720237632
Energy: 1.0793522422445643
Energy: 0.9735321720233343
Energy: 0.9160429406823586
Energy: 1.140323109604161
Energy: 0.9160429406823586
Energy: 1.1403231095985864
Energy: 0.9160429406840739
Energy: 1.1403231096007307
Energy: 0.991340182885506
Energy: 1.0674840934550762
Energy: 0.9913401828863636
Energy: 1.0674840934550762
Energy: 0.9913401828850771
Energy: 1.0674840934546472
Energy: 1.0061158248505488
Energy: 1.0468060635498804
Energy: 1.0061158248501199
Energy: 1.0468060635507381
Energy: 1.0061158248522641
Energy: 1.0468060635494516
Energy: 0.9932864504380524
Energy: 1.1764801812540313
Energy: 0.9932864504684994
Energy: 1.1764801812548888
Energy: 0.9932864504427698
Energy: 1.1764801812548888
Energy: 0.9890562025027193
Energy: 0.9678902942122316
Energy: 0.9890562024997174
Energy: 0.9678902942083722
Energy: 0.9890562025044345
Energy: 0.9678902942096586
Energy: 1.0227814617978468
Energy: 0.9700630925371174
Energy: 1.022781461796989
Energy: 0.9700630925366888
Energy: 1.0227814617948447
Energy: 0.9700630925371174
Energy: 1.0879897290375349
Energy: 0.9470873059776814
Energy: 1.0879897290375349
Energy: 0.9470873059785392
Energy: 1.0879897290345333
Energy: 0.9470873059776814
Energy: 0.9158655845590862
Energy: 1.012567312547853
Energy: 0.9158655845595148
Energy: 1.0125673125448513
Energy: 0.9158655845552267
Energy: 1.0125673125469954
Energy: 1.0863437568607668
Energy: 1.058032849456519
Energy: 1.086343756860338
Energy: 1.0580328494556612
Energy: 1.0863437568607668
Energy: 1.0580328494552325
Energy: 0.9894126196752087
Energy: 0.9557612838609741
Energy: 0.9894126196756375
Energy: 0.9557612838605453
Energy: 0.9894126196764952
Energy: 0.95576128385883
Energy: 1.096842908761204
Energy: 0.980147628309292
Energy: 1.096842908761204
Energy: 0.980147628309292
Energy: 1.0968429087603464
Energy: 0.980147628309292
Energy: 0.9874961817914039
Energy: 0.944285850613153
Energy: 0.9874961817901174
Energy: 0.9442858506135817
Energy: 0.9874961817914039
Energy: 0.9442858506127241
Energy: 1.0861078380093023
Energy: 1.0579047934950403
Energy: 1.0861078380101599
Energy: 1.0579047934963268
Energy: 1.0861078380097313
Energy: 1.0579047934963268
Energy: 0.9160638978934413
Energy: 1.0444893860895674
Energy: 0.9160638978934413
Energy: 1.0444893860878521
Energy: 0.9160638978904395
Energy: 1.0444893860925692
Energy: 1.0878830984614916
Energy: 0.9470197255520276
Energy: 1.0878830984619203
Energy: 0.9470197255528854
Energy: 1.0878830984597763
Energy: 0.947019725553743

minimum gb energy = 0.8923170223882356 eV
minimum distance =  2.28406891844099 Angstroms
sigma value = 57


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

Energy: 1.0086495244048823
Energy: 0.9072273661932468
Energy: 1.0086495244055806
Energy: 0.9072273661925487
Energy: 1.008649524404184
Energy: 0.9072273661932468
Energy: 1.0266125998473672
Energy: 0.8829185728878881
Energy: 1.0266125998473672
Energy: 0.8829185728885863
Energy: 1.0266125998480653
Energy: 0.8829185728892845
Energy: 1.0100305107162506
Energy: 0.9923246779437837
Energy: 1.0100305107155523
Energy: 0.9923246779437837
Energy: 1.0100305107162506
Energy: 0.9923246779444818
Energy: 0.8641051963780697
Energy: 0.9715326305603141
Energy: 0.864105196378768
Energy: 0.9715326305610125
Energy: 0.864105196378768
Energy: 0.9715326305610125
Energy: 0.9976085524031604
Energy: 0.8377539585833599
Energy: 0.9976085524045568
Energy: 0.8377539585840581
Energy: 0.9976085524038586
Energy: 0.8377539585868511
Energy: 0.9629324335242866
Energy: 0.8928807710073636
Energy: 0.9629324335242866
Energy: 0.8928807710073636
Energy: 0.9629324335235883
Energy: 0.8928807710080618
Energy: 1.0677863173149111
Energy: 0.939931442787558
Energy: 1.0677863173128168
Energy: 0.9399314427868598
Energy: 1.067786317314213
Energy: 0.9399314427889545
Energy: 1.1076381758397398
Energy: 1.0830898411270913
Energy: 1.1076381758411362
Energy: 1.083089841125695
Energy: 1.107638175840438
Energy: 1.0830898411270913
Energy: 0.8846738613746493
Energy: 0.8950647749493251
Energy: 0.8846738613753476
Energy: 0.8950647749486269
Energy: 0.8846738613732529
Energy: 0.8950647749493251
Energy: 0.998156938950675
Energy: 0.9024548214277117
Energy: 0.9981569389492786
Energy: 0.90245482142841
Energy: 0.9981569389499769
Energy: 0.9024548214277117
Energy: 1.0682078194245987
Energy: 1.0960670632033864
Energy: 1.0682078194245987
Energy: 1.0960670632026879
Energy: 1.068207819425297
Energy: 1.0960670632033864
Energy: 0.9237433429843497
Energy: 0.8556716269372554
Energy: 0.9237433429801604
Energy: 0.8556716269386518
Energy: 0.9237433429829532
Energy: 0.8556716269498237
Energy: 0.9105933170484664
Energy: 1.001239333184999
Energy: 0.910593317049863
Energy: 1.001239333184999
Energy: 0.910593317049863
Energy: 1.0012393331843008
Energy: 0.8626721838079976
Energy: 1.0358412090617435
Energy: 0.8626721838045063
Energy: 1.0358412090617435
Energy: 0.8626721838052044
Energy: 1.0358412090638385
Energy: 0.9917411818775339
Energy: 0.9089285236800223
Energy: 0.9917411818810251
Energy: 0.9089285236807206
Energy: 0.9917411818789303
Energy: 0.9089285236807206
Energy: 0.9100201743465376
Energy: 0.991069004311055
Energy: 0.9100201743437447
Energy: 0.9910690043103567
Energy: 0.9100201743437447
Energy: 0.991069004311055
Energy: 0.9251536699275751
Energy: 0.9997190680957501
Energy: 0.9251536699296699
Energy: 0.9997190680957501
Energy: 0.9251536699275751
Energy: 0.9997190680943536
Energy: 1.0449494834151123
Energy: 1.0552531417246327
Energy: 1.0449494834144142
Energy: 1.0552531417246327
Energy: 1.0449494834158104
Energy: 1.0552531417232363
Energy: 0.8681500503561194
Energy: 1.0503296058864844
Energy: 0.8681500503568178
Energy: 1.0503296058864844
Energy: 0.8681500503589125
Energy: 1.0503296058871827
Energy: 0.8679954009874922
Energy: 0.9644147516589817
Energy: 0.8679954009826046
Energy: 0.9644147516603782
Energy: 0.867995400986794
Energy: 0.96441475165968
Energy: 0.9495177627860094
Energy: 1.0995183811925309
Energy: 0.9495177627818199
Energy: 1.0995183811939275
Energy: 0.9495177627832163
Energy: 1.0995183811939275
Energy: 0.8460908661132042
Energy: 1.0539731215728345
Energy: 0.846090866109713
Energy: 1.0539731215735326
Energy: 0.8460908661132042
Energy: 1.053973121574231
Energy: 0.9378376072677274
Energy: 0.922169974427407
Energy: 0.9378376072677274
Energy: 0.922169974427407
Energy: 0.9378376072677274
Energy: 0.9221699744267088
Energy: 0.9131057347514031
Energy: 1.0534844348112025
Energy: 0.9131057347500067
Energy: 1.05348443480422
Energy: 0.9131057347562908
Energy: 1.053484434809806
Energy: 1.031803175240409
Energy: 1.1019300236638117
Energy: 1.031803175240409
Energy: 1.10193002366451
Energy: 1.031803175239711
Energy: 1.1019300236638117
Energy: 0.9079105061535013
Energy: 0.9211156383937943
Energy: 0.907910506155596
Energy: 0.9211156383944926
Energy: 0.9079105061562942
Energy: 0.9211156383951907
Energy: 0.8459417435801582
Energy: 1.05027843919485
Energy: 0.8459417435780635
Energy: 1.0502784391934537
Energy: 0.8459417435780635
Energy: 1.05027843919485

minimum gb energy = 0.8377539585833599 eV
minimum distance =  2.22205843910137 Angstroms
sigma value = 43


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

Energy: 1.072999658519754
Energy: 0.8267839259805335
Energy: 1.0729996585182282
Energy: 0.8267839259795161
Energy: 1.072999658519754
Energy: 0.8267839259800248
Energy: 0.8815908310113258
Energy: 0.9180207329092132
Energy: 0.8815908310113258
Energy: 0.9180207329097221
Energy: 0.8815908310118346
Energy: 0.9180207329102308
Energy: 0.8724508838444045
Energy: 0.9204841169649377
Energy: 0.8724508838454221
Energy: 0.9204841169649377
Energy: 0.8724508838438958
Energy: 0.9204841169649377
Energy: 1.0159222055614416
Energy: 0.8455391052537419
Energy: 1.015922205560933
Energy: 0.8455391052532332
Energy: 1.0159222055639852
Energy: 0.8455391052542507
Energy: 0.8747436103702256
Energy: 0.8716827609349997
Energy: 0.8747436103697169
Energy: 0.8716827609355086
Energy: 0.8747436103707344
Energy: 0.8716827609349997
Energy: 0.8304506198999618
Energy: 0.8816069354025994
Energy: 0.8304506198999618
Energy: 0.8816069354031081
Energy: 0.8304506199009792
Energy: 0.8816069354025994
Energy: 0.9490857642217503
Energy: 0.8264307777907492
Energy: 0.9490857642207328
Energy: 0.8264307777912578
Energy: 0.9490857642207328
Energy: 0.8264307777912578
Energy: 0.8738153082053332
Energy: 0.9213991130442709
Energy: 0.8738153082058419
Energy: 0.9213991130442709
Energy: 0.8738153082038068
Energy: 0.9213991130447796
Energy: 0.7933063785115834
Energy: 0.8688765240491471
Energy: 0.7933063785126009
Energy: 0.8688765240491471
Energy: 0.7933063785131097
Energy: 0.8688765240491471
Energy: 0.885735202562183
Energy: 0.7887666622679012
Energy: 0.8857352025616743
Energy: 0.7887666622673923
Energy: 0.885735202562183
Energy: 0.7887666622694273
Energy: 0.9428562252382879
Energy: 0.9314295640923385
Energy: 0.9428562252377791
Energy: 0.9314295640923385
Energy: 0.9428562252367616
Energy: 0.9314295640918296
Energy: 0.7606658059823721
Energy: 0.8678639473442993
Energy: 0.7606658059818634
Energy: 0.867863947344808
Energy: 0.7606658059808458
Energy: 0.8678639473442993
Energy: 0.8866487541256022
Energy: 0.7496170583559729
Energy: 0.8866487541250934
Energy: 0.7496170583569903
Energy: 0.8866487541266197
Energy: 0.7496170583569903
Energy: 0.9357338496514493
Energy: 0.9361809509903676
Energy: 0.9357338496519582
Energy: 0.9361809509893501
Energy: 0.9357338496519582
Energy: 0.9361809509898589
Energy: 0.7834732597762994
Energy: 0.8676871029478044
Energy: 0.7834732597762994
Energy: 0.8676871029483131
Energy: 0.7834732597768082
Energy: 0.8676871029483131
Energy: 0.91170611842124
Energy: 0.8245881261490667
Energy: 0.9117061184217488
Energy: 0.8245881261495754
Energy: 0.9117061184217488
Energy: 0.824588126148558
Energy: 0.9512613940491504
Energy: 0.9333704353537016
Energy: 0.9512613940501681
Energy: 0.9333704353531929
Energy: 0.9512613940486417
Energy: 0.9333704353531929
Energy: 0.8066124302392409
Energy: 0.9408283207222056
Energy: 0.8066124302392409
Energy: 0.9408283207222056
Energy: 0.8066124302397496
Energy: 0.9408283207227144
Energy: 0.870138266796593
Energy: 0.8769107629785797
Energy: 0.8701382667971017
Energy: 0.8769107629790884
Energy: 0.870138266796593
Energy: 0.876910762978071
Energy: 0.9834451179176587
Energy: 0.8594901785137021
Energy: 0.9834451179181674
Energy: 0.8594901785106496
Energy: 0.9834451179166412
Energy: 0.8594901785121759
Energy: 0.8674357195349265
Energy: 0.8144880389163729
Energy: 0.8674357195349265
Energy: 0.8144880389163729
Energy: 0.8674357195354353
Energy: 0.8144880389163729
Energy: 0.929140801828552
Energy: 0.8732509886826861
Energy: 0.9291408018290607
Energy: 0.8732509886801424
Energy: 0.9291408018280432
Energy: 0.8732509886821773
Energy: 0.9261593648183595
Energy: 0.8723684471781215
Energy: 0.9261593648163244
Energy: 0.8723684471781215
Energy: 0.9261593648183595
Energy: 0.8723684471786302
Energy: 0.9060187413113496
Energy: 0.8157795982843168
Energy: 0.9060187413108409
Energy: 0.8157795982848256
Energy: 0.9060187413118586
Energy: 0.8157795982843168
Energy: 0.8712778220532426
Energy: 0.8562414123635452
Energy: 0.8712778220517164
Energy: 0.8562414123559143
Energy: 0.8712778220537514
Energy: 0.8562414123671065
Energy: 0.8708206567567898
Energy: 0.8429937352909793
Energy: 0.8708206567557722
Energy: 0.842993735291488
Energy: 0.870820656756281
Energy: 0.8429937352899619
Energy: 0.8059746585298063
Energy: 0.9713750200475078
Energy: 0.8059746585298063
Energy: 0.9713750200480165
Energy: 0.8411781327082903
Energy: 0.9713750200475078
Energy: 0.8369949442640989
Energy: 0.848771309963608
Energy: 0.8369949442640989
Energy: 0.8487713099641166
Energy: 0.8369949442635902
Energy: 0.8487713099630991
Energy: 0.7917520033795641
Energy: 0.7962220352374011
Energy: 0.7917520033790554
Energy: 0.7962220352379098
Energy: 0.7917520033785467
Energy: 0.7962220352384185
Energy: 0.7824488216561852
Energy: 0.92360812562119
Energy: 0.7824488216566939
Energy: 0.9236081256272948
Energy: 0.782448821654659
Energy: 0.9236081256186464
Energy: 0.8231999891544928
Energy: 0.8485546895459586
Energy: 0.8231999891539841
Energy: 0.8485546895444323
Energy: 0.7837444850422788
Energy: 0.8485546895439235
Energy: 0.7926906234571153
Energy: 0.769501503079524
Energy: 0.7926906234560979
Energy: 0.7695015030790153
Energy: 0.7926906234550803
Energy: 0.769501503079524
Energy: 0.7564292254777266
Energy: 0.8553989190213382
Energy: 0.7564292254782353
Energy: 0.8553989190223558
Energy: 0.7564292254777266
Energy: 0.8553989190218471
Energy: 0.9411322554853753
Energy: 0.9488882581313912
Energy: 0.9411322554858841
Energy: 0.9488882581308824
Energy: 0.9411322554869016
Energy: 0.948888258129865
Energy: 0.7955157617945164
Energy: 0.7482686042464969
Energy: 0.795515761793499
Energy: 0.7482686042449707
Energy: 0.7955157617950251
Energy: 0.7482686042464969
Energy: 0.7098662308995807
Energy: 0.8541983227167684
Energy: 0.709866230899072
Energy: 0.8541983227147334
Energy: 0.709866230899072
Energy: 0.8541983227162596

minimum gb energy = 0.709866230899072 eV
minimum distance =  2.20645298706278 Angstroms
sigma value = 81


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

Energy: 0.4456497695805469
Energy: 0.4899409789128354
Energy: 0.11716483661854882
Energy: 0.4899409789147045
Energy: 0.4456497695805469
Energy: 0.4899409789165738
Energy: 0.9810438140980395
Energy: 0.11886001051693346
Energy: 0.9810438140961703
Energy: 0.11886001051693346
Energy: 0.9810438140980395
Energy: 0.11886001051506423
Energy: 0.4943317870415851
Energy: 0.11772634005903128
Energy: 0.4943317870434544
Energy: 0.11772634005903128
Energy: 0.4943317870415851
Energy: 0.11772634006276975
Energy: 0.11716483661854882
Energy: 0.4899409789147045
Energy: 0.11716483661854882
Energy: 0.4899409789147045
Energy: 0.11716483661667959
Energy: 0.4899409789147045
Energy: 0.9810438141017778
Energy: 0.11886001051506423
Energy: 0.9810438140999085
Energy: 0.11886001051506423
Energy: 0.9810438141017778
Energy: 0.11886001050945653
Energy: 0.4943317870415851
Energy: 0.11772634006090052
Energy: 0.4943317870434544
Energy: 0.11772634006090052
Energy: 0.4943317870415851
Energy: 0.11772634006090052
Energy: 0.4456497695805469
Energy: 0.4899409789147045
Energy: 0.11716483661854882
Energy: 0.4899409789147045
Energy: 0.4456497695805469
Energy: 0.4899409789147045
Energy: 0.981043814103647
Energy: 0.1188600105057181
Energy: 0.9810438141017778
Energy: 0.1188600105057181
Energy: 0.981043814103647
Energy: 0.11886001050758731
Energy: 0.4943317870415851
Energy: 0.11772634005903128
Energy: 0.4943317870415851
Energy: 0.11772634005903128
Energy: 0.4943317870415851
Energy: 0.11772634006090052
Energy: 0.11716483661854882
Energy: 0.4899409789165738
Energy: 0.11716483661854882
Energy: 0.4899409789165738
Energy: 0.11716483661667959
Energy: 0.4899409789165738

minimum gb energy = 0.11716483661667959 eV
minimum distance =  2.44293700721653 Angstroms
sigma value = 3


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

Energy: 0.9462969410486305
Energy: 0.8286235844073598
Energy: 0.9462969410491898
Energy: 0.8286235844079192
Energy: 0.9462969410497492
Energy: 0.8286235844079192
Energy: 0.7996232646687397
Energy: 0.8222273081629069
Energy: 0.7996232646698584
Energy: 0.8222273081629069
Energy: 0.7996232646698584
Energy: 0.8222273081623477
Energy: 0.8111454369273119
Energy: 0.8360729282730172
Energy: 0.8628851469660433
Energy: 0.8360729282730172
Energy: 0.8127983392388857
Energy: 0.8360729282730172
Energy: 0.8760165087888353
Energy: 0.8553858176021804
Energy: 0.8760165087882759
Energy: 0.8553858176021804
Energy: 0.8760165087877165
Energy: 0.8553858176021804
Energy: 0.7084136773059729
Energy: 0.8222396981331032
Energy: 0.7084136773065324
Energy: 0.822239698134222
Energy: 0.7084136773065324
Energy: 0.8222396981331032
Energy: 0.817953242772648
Energy: 0.8190393112729045
Energy: 0.8179532427720887
Energy: 0.8190393112745827
Energy: 0.8179532427720887
Energy: 0.8190393112745827
Energy: 0.8086875495865756
Energy: 0.8501441613056497
Energy: 0.8086875495876945
Energy: 0.8501441613050902
Energy: 0.8086875495871351
Energy: 0.8501441613050902
Energy: 0.7086674870447801
Energy: 0.8217547799814545
Energy: 0.7086674870470177
Energy: 0.8217547799814545
Energy: 0.7086674870458989
Energy: 0.8217547799814545
Energy: 0.8241861612725253
Energy: 0.8203437755704004
Energy: 0.8241861612680504
Energy: 0.8203437755698411
Energy: 0.8241861612848316
Energy: 0.820343775571519
Energy: 0.810306055000462
Energy: 0.7425674072437115
Energy: 0.8103060550015807
Energy: 0.7425674072431521
Energy: 0.8103060550015807
Energy: 0.7425674072437115
Energy: 0.7450810369203884
Energy: 0.8270018201851247
Energy: 0.7450810369203884
Energy: 0.8270018201851247
Energy: 0.7450810369209477
Energy: 0.827001820185684
Energy: 0.8427782742287163
Energy: 0.857581777094164
Energy: 0.8427782742270381
Energy: 0.8575817770936046
Energy: 0.8427782742292756
Energy: 0.8575817770936046
Energy: 0.8334673757572414
Energy: 0.7070905274197722
Energy: 0.8334673757572414
Energy: 0.7070905274203315
Energy: 0.8334673757572414
Energy: 0.7070905274192127
Energy: 0.7694294315427663
Energy: 0.8378096208824739
Energy: 0.7694294315427663
Energy: 0.8378096208824739
Energy: 0.7694294315427663
Energy: 0.8378096208824739
Energy: 0.8094862866258125
Energy: 0.8372754603965737
Energy: 0.8094862866263717
Energy: 0.8372754603960143
Energy: 0.8094862866252531
Energy: 0.8372754603960143
Energy: 0.8330975698935472
Energy: 0.7018231258484704
Energy: 0.8330975698929879
Energy: 0.7018231258495891
Energy: 0.8330975698935472
Energy: 0.7018231258490297
Energy: 0.8213320749063681
Energy: 0.867906550602872
Energy: 0.8213320749058087
Energy: 0.8679065506039397
Energy: 0.8213320749074867
Energy: 0.867906550602872
Energy: 0.825931150095184
Energy: 0.8194024050117085
Energy: 0.825931150095184
Energy: 0.8194024050055554
Energy: 0.8259311500946247
Energy: 0.8194024049982835
Energy: 0.8324204391102198
Energy: 0.782576919186967
Energy: 0.8324204391096605
Energy: 0.7825769191864077
Energy: 0.8324204391091009
Energy: 0.7825769191864077
Energy: 0.798444895308815
Energy: 0.9256227407939602
Energy: 0.7984448953071368
Energy: 0.9256227407928416
Energy: 0.7984448953071368
Energy: 0.9256227407934009
Energy: 0.8637789750610232
Energy: 0.8056236348104758
Energy: 0.8637789750615825
Energy: 0.8056236348104758
Energy: 0.8637789750615825
Energy: 0.8056236348110354
Energy: 0.8756101907841243
Energy: 0.7997782806983613
Energy: 0.8756101907835648
Energy: 0.7997782806989208
Energy: 0.8756101907846836
Energy: 0.7997782806989208
Energy: 0.825373471461608
Energy: 0.8711190917458895
Energy: 0.8253734714604893
Energy: 0.871119091746449
Energy: 0.825373471461608
Energy: 0.8711190917458895
Energy: 0.8196733079689591
Energy: 0.7837798844724903
Energy: 0.8196733079683999
Energy: 0.7837798844736089
Energy: 0.819673307970078
Energy: 0.7837798844730495
Energy: 0.8326624364768185
Energy: 0.8203147526372312
Energy: 0.8326624364779373
Energy: 0.8203147526372312
Energy: 0.8326624364768185
Energy: 0.8203147526377905
Energy: 0.7900065496435479
Energy: 0.8354267652240808
Energy: 0.7900065496429886
Energy: 0.8354267652235216
Energy: 0.7900065496435479
Energy: 0.8354267652246403
Energy: 0.8364532377929873
Energy: 0.7219603755103597
Energy: 0.8364532377946654
Energy: 0.7219603755098003
Energy: 0.8364532377935467
Energy: 0.7219603755125972
Energy: 0.8090539736997411
Energy: 0.8247752332265377
Energy: 0.8090539736997411
Energy: 0.8247752332265377
Energy: 0.8090539737008599
Energy: 0.8247752332265377
Energy: 0.7604914228488349
Energy: 0.8356184310072248
Energy: 0.7604914228482755
Energy: 0.8356184310055467
Energy: 0.7604914228477163
Energy: 0.8356184310061061
Energy: 0.9112723217584748
Energy: 0.7598625718279115
Energy: 0.9112723217607124
Energy: 0.7598625718245553
Energy: 0.911272321760153
Energy: 0.7598625718245553
Energy: 0.81201245242557
Energy: 0.8225433208302135
Energy: 0.8120124524261293
Energy: 0.8225433208302135
Energy: 0.8120124524261293
Energy: 0.822543320830773
Energy: 0.734322571327848
Energy: 0.8197172659736687
Energy: 0.7343225713267292
Energy: 0.8197172659736687
Energy: 0.7343225713284074
Energy: 0.8197172659736687
Energy: 0.8208565543096132
Energy: 0.8142761806153729
Energy: 0.8208565543096132
Energy: 0.814276180617051
Energy: 0.8208565543096132
Energy: 0.814276180617051

minimum gb energy = 0.7018231258484704 eV
minimum distance =  2.2809865858478 Angstroms
sigma value = 67


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

Energy: 1.0532594161321074
Energy: 1.0043552543333565
Energy: 1.0532594161344981
Energy: 1.0043552543325596
Energy: 1.0532594161321074
Energy: 1.0043552543325596
Energy: 0.943976177056098
Energy: 0.9836843287051482
Energy: 0.9439761770553011
Energy: 0.9836843287051482
Energy: 0.9439761770553011
Energy: 0.9836843287059452
Energy: 0.9752892592591866
Energy: 0.9835019465384102
Energy: 0.9752892592583895
Energy: 0.983501946537613
Energy: 1.0328201044184617
Energy: 0.9835019465384102
Energy: 0.9986317646147423
Energy: 0.9548451669352076
Energy: 0.9986317646131481
Energy: 0.9548451669352076
Energy: 0.9986317646139452
Energy: 0.9548451669352076
Energy: 0.86449146275091
Energy: 0.9260388379766755
Energy: 0.864491462750113
Energy: 0.9260388379766755
Energy: 0.864491462750113
Energy: 0.9260388379766755
Energy: 0.9783979137266436
Energy: 0.9606233402214079
Energy: 0.9783979137266436
Energy: 0.9606233402214079
Energy: 0.9783979137258466
Energy: 0.960623340220611
Energy: 0.9569567968474678
Energy: 0.9286390106918548
Energy: 0.956956796848265
Energy: 0.9286390106918548
Energy: 0.9569567968474678
Energy: 0.928639010692652
Energy: 0.9334058333476168
Energy: 0.9157139803624914
Energy: 0.9334058333460228
Energy: 0.9157139803632885
Energy: 0.9334058333468199
Energy: 0.9157139803632885
Energy: 0.9990326181918011
Energy: 1.0078565340118606
Energy: 0.9990326181918011
Energy: 1.0078565340126577
Energy: 0.9990326181918011
Energy: 1.0078565340126577
Energy: 0.9530961331059764
Energy: 0.8811980398628847
Energy: 0.9530961331051793
Energy: 0.8811980398620876
Energy: 0.9530961331043823
Energy: 0.8811980398636817
Energy: 0.9867913329785871
Energy: 0.9664617019597647
Energy: 0.9867913329793842
Energy: 0.9664617019605616
Energy: 0.9867913329785871
Energy: 0.9664617019605616
Energy: 0.951853713574341
Energy: 0.9752192322804797
Energy: 0.9518537135727467
Energy: 0.9752192322804797
Energy: 0.951853713574341
Energy: 0.9752192322804797
Energy: 0.951456586895081
Energy: 0.924476297781018
Energy: 0.9514565868942838
Energy: 0.924476297781018
Energy: 0.951456586895081
Energy: 0.9244762977802211
Energy: 0.9638975062581459
Energy: 1.0034897507695928
Energy: 0.9638975062581459
Energy: 1.0034897507679987
Energy: 0.9638975062581459
Energy: 1.00348975077039
Energy: 0.9554164046874984
Energy: 0.9416053566368401
Energy: 0.9554164046882956
Energy: 0.9416053566368401
Energy: 0.9554164046898899
Energy: 0.941605356636043
Energy: 0.9881342786156513
Energy: 0.9520464898009933
Energy: 0.9881342786140571
Energy: 0.9520464898009933
Energy: 0.9881342786140571
Energy: 0.9520464898009933
Energy: 0.9889698361008108
Energy: 0.9893156053284932
Energy: 0.9889698361016077
Energy: 0.9893156053292902
Energy: 0.9889698360992165
Energy: 0.9893156053292902
Energy: 0.9744974886473593
Energy: 0.9233126639511896
Energy: 0.9744974886497506
Energy: 0.9233126639527838
Energy: 0.9744974886473593
Energy: 0.9233126639519866
Energy: 0.9574852375491064
Energy: 0.9869816366648001
Energy: 0.9574852375491064
Energy: 0.9869816366648001
Energy: 0.9574852375491064
Energy: 0.9869816366648001
Energy: 0.9172850694702365
Energy: 0.9844632486756266
Energy: 0.9172850694694396
Energy: 0.9844632486756266
Energy: 0.9172850694686426
Energy: 0.9844632486756266
Energy: 1.0127717320366585
Energy: 0.9257390877363251
Energy: 1.0127717320382525
Energy: 0.9257390877363251
Energy: 1.0127717320366585
Energy: 0.9257390877363251
Energy: 0.9964404793591523
Energy: 1.0077278310475108
Energy: 0.9964404793591523
Energy: 1.0077278310475108
Energy: 0.9964404793591523
Energy: 1.007727831048308
Energy: 0.9122081304210022
Energy: 0.9833949702535077
Energy: 0.9122081304210022
Energy: 0.9833949702527107
Energy: 0.9122081304194081
Energy: 0.9833949702519137

minimum gb energy = 0.864491462750113 eV
minimum distance =  2.29796302351759 Angstroms
sigma value = 33


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

Energy: 1.1454408178992561
Energy: 1.080325912074209
Energy: 1.1454408178992561
Energy: 1.080325912074209
Energy: 1.1454408178992561
Energy: 1.080325912074209
Energy: 1.051695544031032
Energy: 1.0600606703208497
Energy: 1.0516955440315376
Energy: 1.0600606703213553
Energy: 1.051695544031032
Energy: 1.060060670321861
Energy: 1.0987545227507796
Energy: 1.0571988579694873
Energy: 1.0987545227512852
Energy: 1.0571988579689817
Energy: 1.098754522750274
Energy: 1.0571988579689817
Energy: 1.0836117989995189
Energy: 1.0846040286266385
Energy: 1.0836117990000245
Energy: 1.0846040286261331
Energy: 1.0836117990000245
Energy: 1.0846040286266385
Energy: 1.0430149279006147
Energy: 1.0570142499423305
Energy: 1.0430149279011203
Energy: 1.0570142499413193
Energy: 1.0430149279021315
Energy: 1.0570142499408135
Energy: 1.1380949635472282
Energy: 1.0568430795927504
Energy: 1.1380949635472282
Energy: 1.1059486680199935
Energy: 1.1380949635472282
Energy: 1.089139265613434
Energy: 1.078682741889287
Energy: 1.037706414058606
Energy: 1.0786827418887814
Energy: 1.0377064140581005
Energy: 1.0786827418882758
Energy: 1.0377064140575947
Energy: 1.1020738632466265
Energy: 1.062776601438987
Energy: 1.1020738632461207
Energy: 1.062776601438987
Energy: 1.1020738632471319
Energy: 1.062776601438987
Energy: 1.0342739708081836
Energy: 1.0857160578164746
Energy: 1.034273970807678
Energy: 1.0857160578184974
Energy: 1.0342739708097006
Energy: 1.0857160578174863
Energy: 1.127437589659712
Energy: 1.0399361724397373
Energy: 1.1274375896581952
Energy: 1.0461529169640484
Energy: 1.1274375896592064
Energy: 1.0361647100686893
Energy: 1.0670138807702079
Energy: 1.0575046149972427
Energy: 1.0670138807707137
Energy: 1.0575046149967373
Energy: 1.0670138807702079
Energy: 1.0575046149967373
Energy: 1.0528781679135306
Energy: 1.0432707779704278
Energy: 1.052878167914542
Energy: 1.0432707779704278
Energy: 1.052878167914542
Energy: 1.0432707779709336
Energy: 1.1301705051173743
Energy: 1.0597110026239065
Energy: 1.1301705051168687
Energy: 1.0597110026234011
Energy: 1.1301705051173743
Energy: 1.0597110026239065
Energy: 1.0383771339326755
Energy: 1.0611975953102981
Energy: 1.038377133933181
Energy: 1.0611975953102981
Energy: 1.0383771339336867
Energy: 1.0611975953102981
Energy: 1.083978947803646
Energy: 1.074356377305336
Energy: 1.0839789478041517
Energy: 1.0743563773048304
Energy: 1.083978947803646
Energy: 1.074356377305336
Energy: 1.0835357991631922
Energy: 1.0897764800396366
Energy: 1.0835357991626866
Energy: 1.0897764800396366
Energy: 1.0835357991626866
Energy: 1.0897764800396366
Energy: 1.0213679259063138
Energy: 1.0576105591877776
Energy: 1.0213679259068191
Energy: 1.0576105591877776
Energy: 1.021367925907325
Energy: 1.0576105591877776
Energy: 1.123862793863141
Energy: 1.121060675762773
Energy: 1.123862793863141
Energy: 1.121060675762773
Energy: 1.123862793863141
Energy: 1.121060675762773
Energy: 1.043384745821251
Energy: 1.131695753066996
Energy: 1.0433847458202399
Energy: 1.1316957530664906
Energy: 1.0433847458197343
Energy: 1.131695753066996
Energy: 1.0546217702549916
Energy: 1.0606798984150387
Energy: 1.0546217702585308
Energy: 1.0606798984150387
Energy: 1.0546217702590364
Energy: 1.0606798984155443
Energy: 1.07919986386596
Energy: 1.0896905687119303
Energy: 1.0791998638654543
Energy: 1.0896905687124359
Energy: 1.07919986386596
Energy: 1.0896905687129415
Energy: 1.0800354425445318
Energy: 1.0242921487981065
Energy: 1.0800354425450371
Energy: 1.0242921487986123
Energy: 1.0800354425450371
Energy: 1.0242921487981065
Energy: 1.087435512141005
Energy: 1.0577626246715208
Energy: 1.0874355121420163
Energy: 1.0577626246720264
Energy: 1.0874355121425219
Energy: 1.0577626246725322
Energy: 1.1272908425363581
Energy: 1.0389574575680425
Energy: 1.1272908425363581
Energy: 1.0389574575675369
Energy: 1.1272908425358525
Energy: 1.0389574575680425
Energy: 1.0506990138430747
Energy: 1.0382459050950725
Energy: 1.0506990138435806
Energy: 1.038245905094567
Energy: 1.0506990138430747
Energy: 1.0382459050950725
Energy: 1.0856901559187253
Energy: 1.0807552308169113
Energy: 1.0856901559187253
Energy: 1.0807552308174169
Energy: 1.0856901559187253
Energy: 1.0807552308169113
Energy: 1.051511881935794
Energy: 1.0247258388812153
Energy: 1.051511881935794
Energy: 1.0247258388817206
Energy: 1.0515118819368052
Energy: 1.0247258388812153
Energy: 1.075405235548289
Energy: 1.1152475447863277
Energy: 1.075405235546772
Energy: 1.1152475447863277
Energy: 1.0754052355472778
Energy: 1.1152475447863277
Energy: 1.0526513976908716
Energy: 1.0570016049149307
Energy: 1.0526513976918828
Energy: 1.0570016049154363
Energy: 1.0526513976954224
Energy: 1.0570016049154363
Energy: 1.042856971249028
Energy: 1.0354650545898763
Energy: 1.0428569712500393
Energy: 1.0354650545903816
Energy: 1.0428569712485225
Energy: 1.0354650545898763
Energy: 1.1414750989951945
Energy: 1.117960031330813
Energy: 1.141475098994689
Energy: 1.1179600313313185
Energy: 1.141475098994689
Energy: 1.1179600313313185
Energy: 1.0414447487153682
Energy: 1.060583130992823
Energy: 1.0414447487148626
Energy: 1.0605831309938343
Energy: 1.0414447487148626
Energy: 1.0605831309938343
Energy: 1.0813451600070139
Energy: 1.089058092689597
Energy: 1.0813451600065083
Energy: 1.0890580926890912
Energy: 1.0813451600080255
Energy: 1.0890580926885858
Energy: 1.0811725351063621
Energy: 1.0596923693420803
Energy: 1.0811725351058568
Energy: 1.0596923693415747
Energy: 1.0811725351048456
Energy: 1.0596923693420803
Energy: 1.039554661577336
Energy: 1.0575466456847
Energy: 1.039554661577336
Energy: 1.0575466456841942
Energy: 1.039554661577336
Energy: 1.0575466456852054
Energy: 1.148377521130809
Energy: 1.06466976413967
Energy: 1.1483775211313145
Energy: 1.0646697641386589
Energy: 1.1483775211313145
Energy: 1.0646697641391645
Energy: 1.0514384920710795
Energy: 1.0820499640066008
Energy: 1.051438492070574
Energy: 1.0820499640060952
Energy: 1.0514384920700683
Energy: 1.0820499640066008

minimum gb energy = 1.0213679259063138 eV
minimum distance =  2.26816267016905 Angstroms
sigma value = 41


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

Energy: 1.2437478586624304
Energy: 1.2315142271621913
Energy: 1.243747858663811
Energy: 1.2315142271621913
Energy: 1.243747858663811
Energy: 1.2315142271621913
Energy: 1.2044210091298484
Energy: 1.1784155573828474
Energy: 1.2044210091312288
Energy: 1.1784155573828474
Energy: 1.2044210091312288
Energy: 1.1784155573828474
Energy: 1.321232824787401
Energy: 1.1726897274140493
Energy: 1.3844359893391454
Energy: 1.17268972741543
Energy: 1.3029116085760766
Energy: 1.17268972741543
Energy: 1.2262359162936611
Energy: 1.274107317431853
Energy: 1.2262359162922805
Energy: 1.2741073174332336
Energy: 1.2262359162936611
Energy: 1.274107317431853
Energy: 1.2941905486750105
Energy: 1.1973108529717464
Energy: 1.2941905486736298
Energy: 1.1973108529717464
Energy: 1.2941905486750105
Energy: 1.1973108529717464
Energy: 1.3150254313632017
Energy: 1.2829419351717106
Energy: 1.3150254313632017
Energy: 1.2829419351730909
Energy: 1.3150254313618213
Energy: 1.2829419351717106
Energy: 1.2244800592122225
Energy: 1.1563663532156303
Energy: 1.2244800592136031
Energy: 1.1563663532142496
Energy: 1.2244800592136031
Energy: 1.1563663532142496
Energy: 1.2591366126898387
Energy: 1.1789877447768784
Energy: 1.2591366126898387
Energy: 1.1789877447768784
Energy: 1.2591366126898387
Energy: 1.1789877447754977
Energy: 1.2059301065787114
Energy: 1.2058225644458453
Energy: 1.205930106577331
Energy: 1.205822564447226
Energy: 1.2059301065759505
Energy: 1.205822564447226
Energy: 1.2255803823594547
Energy: 1.1995128573647664
Energy: 1.225580382358074
Energy: 1.1995128573647664
Energy: 1.2255803823594547
Energy: 1.1995128573661469
Energy: 1.2030659886409525
Energy: 1.1730430401987235
Energy: 1.2030659886409525
Energy: 1.1730430401987235
Energy: 1.203065988642333
Energy: 1.1730430401987235
Energy: 1.249462917901683
Energy: 1.1774204660869818
Energy: 1.249462917901683
Energy: 1.1774204660883623
Energy: 1.2494629179003025
Energy: 1.1774204660869818
Energy: 1.2448980614170042
Energy: 1.2734795875564673
Energy: 1.2448980614170042
Energy: 1.2734795875578477
Energy: 1.244898061415624
Energy: 1.2734795875564673
Energy: 1.2913244610066004
Energy: 1.1795969831999504
Energy: 1.291324461007981
Energy: 1.1795969831999504
Energy: 1.291324461007981
Energy: 1.1795969831999504

minimum gb energy = 1.1563663532142496 eV
minimum distance =  2.27080196427799 Angstroms
sigma value = 11


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

Energy: 1.432940355289857
Energy: 1.4300945001646537
Energy: 1.432940355289857
Energy: 1.4300945001634409
Energy: 1.4329403552910702
Energy: 1.4300945001652325
Energy: 1.3673828343298642
Energy: 1.3490493490632933
Energy: 1.3673828343304704
Energy: 1.3490493490632933
Energy: 1.3673828343298642
Energy: 1.3490493490632933
Energy: 1.4172011371023892
Energy: 1.3395330702363049
Energy: 1.4172011371017827
Energy: 1.3395330702369113
Energy: 1.4411172689812823
Energy: 1.3395330702363049
Energy: 1.36512924969037
Energy: 1.3529191475081876
Energy: 1.3651292496915832
Energy: 1.3529191475081876
Energy: 1.3651292496897638
Energy: 1.3529191475087938
Energy: 1.4368897863454655
Energy: 1.342380969364498
Energy: 1.436889786346072
Energy: 1.342380969364498
Energy: 1.4368897863454655
Energy: 1.342380969364498
Energy: 1.3631858141542854
Energy: 1.4164721369653341
Energy: 1.3631858141548918
Energy: 1.4164721369653341
Energy: 1.3631858141542854
Energy: 1.4164721369653341
Energy: 1.3723689656556544
Energy: 1.390521632873479
Energy: 1.3723689656568672
Energy: 1.390521632873479
Energy: 1.3723689656568672
Energy: 1.3905216328728727
Energy: 1.366740977687295
Energy: 1.3718497539574386
Energy: 1.366740977687295
Energy: 1.3718497539574386
Energy: 1.366740977687295
Energy: 1.371849753956832
Energy: 1.4000010094470219
Energy: 1.3705309137655324
Energy: 1.4000010094464155
Energy: 1.370530913764926
Energy: 1.4000010094464155
Energy: 1.3705309137643193
Energy: 1.3459696813153048
Energy: 1.4172798620612865
Energy: 1.3459696813153048
Energy: 1.4172798620612865
Energy: 1.3459696813159112
Energy: 1.4172798620606801
Energy: 1.393810479793856
Energy: 1.3558295075117055
Energy: 1.393810479799893
Energy: 1.3558295075117055
Energy: 1.3938104798059576
Energy: 1.355829507511099
Energy: 1.3999401000061986
Energy: 1.4006807415553275
Energy: 1.399940100006805
Energy: 1.4006807415553275
Energy: 1.3999401000061986
Energy: 1.4006807415553275
Energy: 1.3658717721524811
Energy: 1.3665420328857427
Energy: 1.3658717721530875
Energy: 1.3665420328863491
Energy: 1.3658717721524811
Energy: 1.3665420328857427
Energy: 1.422939973907573
Energy: 1.372887430889798
Energy: 1.4229399739081794
Energy: 1.3728874308891914
Energy: 1.422939973907573
Energy: 1.372887430889798
Energy: 1.3616667866581191
Energy: 1.4083245110704559
Energy: 1.3782708241294515
Energy: 1.4083245110704559
Energy: 1.3673486703283164
Energy: 1.4083245110710625
Energy: 1.3706686092718778
Energy: 1.3902451493216534
Energy: 1.3706686092706648
Energy: 1.3902451493234727
Energy: 1.3706686092712712
Energy: 1.3902451493228665
Energy: 1.3379066359641192
Energy: 1.3481266587931742
Energy: 1.3379066359647256
Energy: 1.3481266587943872
Energy: 1.3379066359641192
Energy: 1.3481266587931742
Energy: 1.3949662490351709
Energy: 1.3838521563657038
Energy: 1.3949662490351709
Energy: 1.3838521563657038
Energy: 1.3949662490351709
Energy: 1.3838521563657038
Energy: 1.3474057719218675
Energy: 1.3260692573223958
Energy: 1.3474057719212609
Energy: 1.326069257321817
Energy: 1.3474057719218675
Energy: 1.3260692573236088
Energy: 1.4085380965203882
Energy: 1.3476173576037414
Energy: 1.4085380965173557
Energy: 1.3476173576037414
Energy: 1.4085380965209946
Energy: 1.3476173576031623
Energy: 1.3851828895561829
Energy: 1.367084576961833
Energy: 1.3851828895561829
Energy: 1.367084576961833
Energy: 1.3851828895567895
Energy: 1.367084576961833
Energy: 1.41646318336923
Energy: 1.4016193559121735
Energy: 1.4164631833686236
Energy: 1.4016193559127799
Energy: 1.4164631833686236
Energy: 1.4016193559109604
Energy: 1.3770747991774166
Energy: 1.3400136048996425
Energy: 1.3770747991774166
Energy: 1.3400136048996425
Energy: 1.37707479917681
Energy: 1.3400136048996425
Energy: 1.4198227790992777
Energy: 1.340029132205697
Energy: 1.4198227790998843
Energy: 1.3400291322069098
Energy: 1.4198227790992777
Energy: 1.340029132205697
Energy: 1.3607695583479105
Energy: 1.3917769047637798
Energy: 1.3607695583485169
Energy: 1.3917769047637798
Energy: 1.3607695583485169
Energy: 1.3917769047643862
Energy: 1.3849489488558446
Energy: 1.3480777493916078
Energy: 1.3849489488558446
Energy: 1.3480777493910012
Energy: 1.3849489488558446
Energy: 1.348077749390395
Energy: 1.3531592730947983
Energy: 1.4181426361761094
Energy: 1.353159273094192
Energy: 1.418142636176716
Energy: 1.3531592730947983
Energy: 1.418142636176716
Energy: 1.3668670706228603
Energy: 1.3662922207355497
Energy: 1.3668670706228603
Energy: 1.3662922207361559
Energy: 1.3668670706222537
Energy: 1.3662922207355497
Energy: 1.40322938011436
Energy: 1.3731111746331321
Energy: 1.4032293801149665
Energy: 1.3731111746331321
Energy: 1.40322938011436
Energy: 1.3731111746331321
Energy: 1.3822774404345837
Energy: 1.3599813148314734
Energy: 1.3822774404351903
Energy: 1.3599813148314734
Energy: 1.3822774404351903
Energy: 1.35998131483208
Energy: 1.3417385839785734
Energy: 1.4358194486224323
Energy: 1.3417385839797864
Energy: 1.4358194486224323
Energy: 1.3417385839785734
Energy: 1.4358194486224323

minimum gb energy = 1.326069257321817 eV
minimum distance =  2.20209643822867 Angstroms
sigma value = 57


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

Energy: 1.3441311556981876
Energy: 1.443819086029863
Energy: 1.3441311556992668
Energy: 1.4438190860287838
Energy: 1.3441311556992668
Energy: 1.4438190860287838
Energy: 1.3838364073054052
Energy: 1.388297173097775
Energy: 1.3838364073064844
Energy: 1.388297173097775
Energy: 1.3838364073054052
Energy: 1.388297173097775
Energy: 1.4191964435612612
Energy: 1.353345603928224
Energy: 1.4191964435623403
Energy: 1.3533456039293033
Energy: 1.4191964435623403
Energy: 1.353345603928224
Energy: 1.3359035552041774
Energy: 1.6120667362811272
Energy: 1.3359035552041774
Energy: 1.7453914475830474
Energy: 1.3359035552041774
Energy: 1.506214186635734
Energy: 1.4191770004373558
Energy: 1.353363480236054
Energy: 1.4191770004362765
Energy: 1.353363480236054
Energy: 1.4191770004362765
Energy: 1.353363480236054
Energy: 1.3840669776641554
Energy: 1.3881938104544596
Energy: 1.3840669776641554
Energy: 1.4342341735987918
Energy: 1.3840669776641554
Energy: 1.403994366027735
Energy: 1.3441311556960294
Energy: 1.4438190860287838
Energy: 1.3441311556971083
Energy: 1.4438190860277043
Energy: 1.3441311556971083
Energy: 1.4438190860287838
Energy: 1.3838364073054052
Energy: 1.3882971730956164
Energy: 1.3838364073064844
Energy: 1.3882971730956164
Energy: 1.3838364073054052
Energy: 1.3882971730956164
Energy: 1.419196443559103
Energy: 1.3533456039239073
Energy: 1.419196443559103
Energy: 1.3533456039239073
Energy: 1.419196443559103
Energy: 1.3533456039249865
Energy: 1.3359035552052567
Energy: 1.5932488257866426
Energy: 1.3359035552052567
Energy: 1.5954353190920594
Energy: 1.3359035552041774
Energy: 1.5062141866378922
Energy: 1.419177000434118
Energy: 1.353363480237133
Energy: 1.419177000434118
Energy: 1.353363480237133
Energy: 1.419177000434118
Energy: 1.353363480237133
Energy: 1.3840669776663137
Energy: 1.3881938104523008
Energy: 1.3840669776663137
Energy: 1.3881938104523008
Energy: 1.3840669776663137
Energy: 1.3881938104523008
Energy: 1.3441311556992668
Energy: 1.4438190860287838
Energy: 1.3441311556992668
Energy: 1.4438190860287838
Energy: 1.3441311556992668
Energy: 1.4438190860287838
Energy: 1.383836407304326
Energy: 1.388297173097775
Energy: 1.3838364073054052
Energy: 1.388297173098854
Energy: 1.3838364073054052
Energy: 1.388297173097775
Energy: 1.4191964435623403
Energy: 1.353345603928224
Energy: 1.4191964435634197
Energy: 1.3533456039293033
Energy: 1.4191964435634197
Energy: 1.3533456039293033
Energy: 1.3359035552030982
Energy: 1.506214186635734
Energy: 1.3359035552041774
Energy: 1.5062141866346543
Energy: 1.3359035552030982
Energy: 1.506214186635734
Energy: 1.4191770004373558
Energy: 1.353363480236054
Energy: 1.4191770004373558
Energy: 1.353363480236054
Energy: 1.4191770004373558
Energy: 1.353363480236054

minimum gb energy = 1.3359035552030982 eV
minimum distance =  2.25173400612888 Angstroms
sigma value = 9


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

Energy: 1.4593421308219965
Energy: 1.5164303285184761
Energy: 1.4593421308228778
Energy: 1.5164303285184761
Energy: 1.4593421308219965
Energy: 1.5164303285184761
Energy: 1.4925910012337917
Energy: 1.4649425697991514
Energy: 1.4925910012320296
Energy: 1.4649425697991514
Energy: 1.4925910012337917
Energy: 1.4649425697991514
Energy: 1.468364511458389
Energy: 1.4297020762039414
Energy: 1.519300214713583
Energy: 1.4297020762039414
Energy: 1.5035016559052485
Energy: 1.4297020762039414
Energy: 1.397145302012997
Energy: 1.5504533814072898
Energy: 1.3971453020138782
Energy: 1.5504533814090524
Energy: 1.3971453020121158
Energy: 1.5504533814081711
Energy: 1.4548013815676277
Energy: 1.4235297818129413
Energy: 1.454801381568509
Energy: 1.4235297818129413
Energy: 1.4548013815667467
Energy: 1.4235297818129413
Energy: 1.4714306101256942
Energy: 1.4263575247168145
Energy: 1.4714306101256942
Energy: 1.4263575247168145
Energy: 1.4714306101256942
Energy: 1.4263575247159337
Energy: 1.3948854336581173
Energy: 1.5071351700654632
Energy: 1.3948854336589986
Energy: 1.5071351700654632
Energy: 1.3948854336581173
Energy: 1.5071351700654632
Energy: 1.3997182780403628
Energy: 1.4880198616330425
Energy: 1.399718278042125
Energy: 1.4880198616339235
Energy: 1.3997182780412438
Energy: 1.4880198616339235
Energy: 1.5626144183556154
Energy: 1.4273158680342675
Energy: 1.5626144183591402
Energy: 1.4273158680342675
Energy: 1.562614418358259
Energy: 1.4273158680342675
Energy: 1.39427652193467
Energy: 1.4816044300914386
Energy: 1.394276521935551
Energy: 1.4816044300914386
Energy: 1.39427652193467
Energy: 1.4816044300914386
Energy: 1.4682820739465967
Energy: 1.4910687089188632
Energy: 1.4682820739457156
Energy: 1.4910687089188632
Energy: 1.4682820739492402
Energy: 1.4910687089188632
Energy: 1.5257835251123246
Energy: 1.427077458041933
Energy: 1.5257835251123246
Energy: 1.427077458041933
Energy: 1.5257835251140868
Energy: 1.4270774580410521
Energy: 1.4039551066354137
Energy: 1.5067965148999347
Energy: 1.4039551066345324
Energy: 1.5067965148990532
Energy: 1.403955106636295
Energy: 1.5067965148981721
Energy: 1.4576016048690725
Energy: 1.4714923270407818
Energy: 1.4576016048690725
Energy: 1.4714923270416633
Energy: 1.4576016048681917
Energy: 1.4714923270407818
Energy: 1.535387880465913
Energy: 1.4218422684036396
Energy: 1.5353878804676753
Energy: 1.4218422684036396
Energy: 1.5353878804667938
Energy: 1.4218422684036396
Energy: 1.4532358189102834
Energy: 1.5279324800440108
Energy: 1.4532358189120458
Energy: 1.5279324800431298
Energy: 1.4532358189120458
Energy: 1.5279324800440108
Energy: 1.4513040002948094
Energy: 1.4927471215217039
Energy: 1.4513040002956905
Energy: 1.4927471215217039
Energy: 1.4513040002948094
Energy: 1.4927471215217039
Energy: 1.607745430976306
Energy: 1.4291211645824804
Energy: 1.6077454309736623
Energy: 1.4291211645824804
Energy: 1.6077454309754247
Energy: 1.4291211645824804
Energy: 1.4104914692673098
Energy: 1.4820352924353002
Energy: 1.410491469268191
Energy: 1.4820352924353002
Energy: 1.410491469268191
Energy: 1.4820352924361813
Energy: 1.4602419782541396
Energy: 1.466341890906931
Energy: 1.4602419782541396
Energy: 1.4663418909078123
Energy: 1.4602419782541396
Energy: 1.466341890906931
Energy: 1.5575636067184517
Energy: 1.4228802610973357
Energy: 1.5575636067175704
Energy: 1.4228802610982167
Energy: 1.5575636067184517
Energy: 1.4228802610982167

minimum gb energy = 1.39427652193467 eV
minimum distance =  2.21550662514656 Angstroms
sigma value = 27


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

Energy: 1.4285855806385175
Energy: 1.4333527614565773
Energy: 1.3705407067546553
Energy: 1.4333527614565773
Energy: 1.4285855806392604
Energy: 1.4333527614506354
Energy: 1.4282738592239888
Energy: 1.4061484925656065
Energy: 1.428273859221018
Energy: 1.4061484925663492
Energy: 1.4282738592239888
Energy: 1.4061484925693204
Energy: 1.462810842961697
Energy: 1.3730655262267588
Energy: 1.462810842967639
Energy: 1.3730655262267588
Energy: 1.4628108429624398
Energy: 1.3730655262349294
Energy: 1.3696697104463607
Energy: 1.5022300830323947
Energy: 1.3696697104471034
Energy: 1.5022300830338802
Energy: 1.3696697104448752
Energy: 1.5022300830353656
Energy: 1.4103467100393947
Energy: 1.3654335529766235
Energy: 1.4103467100356808
Energy: 1.3654335529766235
Energy: 1.4103467100401375
Energy: 1.365433552975138
Energy: 1.4331805161191187
Energy: 1.3737391897764941
Energy: 1.4331805161183757
Energy: 1.3737391897764941
Energy: 1.433180516117633
Energy: 1.3737391897698092
Energy: 1.3699079958655527
Energy: 1.4595731704844956
Energy: 1.3699079958640674
Energy: 1.4595731704837531
Energy: 1.3699079958655527
Energy: 1.459573170486724
Energy: 1.529829579816692
Energy: 1.4631475264922424
Energy: 1.5298295798144979
Energy: 1.4631475264922424
Energy: 1.529829579816692
Energy: 1.4631475264892717
Energy: 1.3917980387625624
Energy: 1.3740004799462766
Energy: 1.3917980387655333
Energy: 1.3740004799455339
Energy: 1.391798038763305
Energy: 1.3740004799470193
Energy: 1.369999226067577
Energy: 1.3897727013952024
Energy: 1.3699992260631206
Energy: 1.3897727013952024
Energy: 1.3699992260683198
Energy: 1.3897727013914887
Energy: 1.370221199209518
Energy: 1.4360106547297153
Energy: 1.3702211992073234
Energy: 1.436010654731201
Energy: 1.370221199209518
Energy: 1.4360106547393712
Energy: 1.4653534948625082
Energy: 1.3796493690049847
Energy: 1.4653534948617652
Energy: 1.3796493690042417
Energy: 1.4653534948625082
Energy: 1.3796493690042417
Energy: 1.4619374602074136
Energy: 1.5404230312479386
Energy: 1.4619374602111277
Energy: 1.5404230312471958
Energy: 1.4619374602074136
Energy: 1.540423031246453
Energy: 1.3702251376397343
Energy: 1.3435717433235663
Energy: 1.3702251376419623
Energy: 1.3435717433228234
Energy: 1.3702251376404768
Energy: 1.3435717433250518
Energy: 1.4379947000893312
Energy: 1.3736805739562288
Energy: 1.4379947000908166
Energy: 1.3736805739554858
Energy: 1.4379947000885884
Energy: 1.373680573961428
Energy: 1.4096902863529368
Energy: 1.365240629923422
Energy: 1.4096902863514509
Energy: 1.365240629923422
Energy: 1.4096902863521936
Energy: 1.365240629923422
Energy: 1.377186240937578
Energy: 1.4773232501602316
Energy: 1.377186240933864
Energy: 1.4773232501609745
Energy: 1.3771862409383209
Energy: 1.4773232501661737
Energy: 1.5427096774311428
Energy: 1.374502155085517
Energy: 1.5427096774318856
Energy: 1.374502155085517
Energy: 1.5427096774311428
Energy: 1.3745021550870025
Energy: 1.3939580103043012
Energy: 1.4065620273913373
Energy: 1.3470227912368578
Energy: 1.4065620273913373
Energy: 1.3939580103035585
Energy: 1.4065620273809387
Energy: 1.4285855806429741
Energy: 1.4333527614528634
Energy: 1.3705407067561408
Energy: 1.4333527614528634
Energy: 1.4285855806429741
Energy: 1.4333527614491497
Energy: 1.4282738592277027
Energy: 1.4061484925678347
Energy: 1.4282738592239888
Energy: 1.406148492567092
Energy: 1.4282738592291881
Energy: 1.4061484925715486
Energy: 1.4628108429609543
Energy: 1.3730655262252733
Energy: 1.46281084297061
Energy: 1.3730655262252733
Energy: 1.4628108429609543
Energy: 1.3730655262327007
Energy: 1.3696697104493318
Energy: 1.5022300830413078
Energy: 1.3696697104493318
Energy: 1.5022300830398225
Energy: 1.3696697104500746
Energy: 1.5022300830383368
Energy: 1.4103467100393947
Energy: 1.3654335529855366
Energy: 1.4103467100356808
Energy: 1.3654335529855366
Energy: 1.4103467100393947
Energy: 1.3654335529803372
Energy: 1.433180516112434
Energy: 1.3737391897824023
Energy: 1.4331805161079771
Energy: 1.3737391897816595
Energy: 1.433180516112434
Energy: 1.3737391897772366

minimum gb energy = 1.3435717433228234 eV
minimum distance =  2.25641087469755 Angstroms
sigma value = 19


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

Energy: 1.3739115407961142
Energy: 1.4546641448147846
Energy: 1.3739115407961142
Energy: 1.4546641448141435
Energy: 1.3739115407961142
Energy: 1.4546641448141435
Energy: 1.413697627006616
Energy: 1.326401473595206
Energy: 1.413697627007257
Energy: 1.3264014735971292
Energy: 1.413697627006616
Energy: 1.3264014735971292
Energy: 1.4192625414000344
Energy: 1.2901129666686482
Energy: 1.455122622436088
Energy: 1.2901129666686482
Energy: 1.4278292186269603
Energy: 1.2901129666686482
Energy: 1.305228264157368
Energy: 1.4097871208639077
Energy: 1.3052282641554447
Energy: 1.4097871208632666
Energy: 1.305228264156727
Energy: 1.4097871208639077
Energy: 1.3140407629829527
Energy: 1.36541948180269
Energy: 1.3140407629823114
Energy: 1.3654194818020489
Energy: 1.3140407629829527
Energy: 1.36541948180269
Energy: 1.4366686370534745
Energy: 1.3289622349281476
Energy: 1.4366686370547566
Energy: 1.3289622349281476
Energy: 1.4366686370541157
Energy: 1.3289622349281476
Energy: 1.2807217887969455
Energy: 1.3571108108352403
Energy: 1.2807217887969455
Energy: 1.3571108108352403
Energy: 1.2807217887963045
Energy: 1.3571108108358814
Energy: 1.329848145165698
Energy: 1.416602721704082
Energy: 1.3298481451644157
Energy: 1.4166027217047232
Energy: 1.3298481451644157
Energy: 1.416602721704082
Energy: 1.4954100382327657
Energy: 1.289862930513853
Energy: 1.4954100382327657
Energy: 1.2898629305132117
Energy: 1.495410038233407
Energy: 1.2898629305132117
Energy: 1.3316119628710268
Energy: 1.3777067701102517
Energy: 1.331611962872309
Energy: 1.3777067701102517
Energy: 1.3316119628716678
Energy: 1.3777067701102517
Energy: 1.2984981197472476
Energy: 1.4442552925620884
Energy: 1.2984981197478886
Energy: 1.444255292560806
Energy: 1.298498119749171
Energy: 1.4442552925576004
Energy: 1.4338264041709188
Energy: 1.3060204394944765
Energy: 1.4338264041741244
Energy: 1.3060204394938355
Energy: 1.4338264041715598
Energy: 1.3060204394938355
Energy: 1.3245263105054592
Energy: 1.3445390529661676
Energy: 1.3245263105061005
Energy: 1.3445390529661676
Energy: 1.3245263105061005
Energy: 1.3445390529661676
Energy: 1.3212160965011124
Energy: 1.416381958911303
Energy: 1.3212160965017536
Energy: 1.4163819589093798
Energy: 1.3212160965004713
Energy: 1.416381958911303
Energy: 1.441521796820815
Energy: 1.2891615813730386
Energy: 1.441521796820174
Energy: 1.2891615813723973
Energy: 1.441521796820815
Energy: 1.2891615813723973
Energy: 1.4249017722261939
Energy: 1.2886095517547593
Energy: 1.4249017722261939
Energy: 1.2886095517547593
Energy: 1.4249017722255526
Energy: 1.2886095517547593
Energy: 1.3170723440933012
Energy: 1.414934460268455
Energy: 1.3170723440933012
Energy: 1.414934460268455
Energy: 1.3170723440933012
Energy: 1.4149344602690963
Energy: 1.398702291545623
Energy: 1.3824964815502656
Energy: 1.398702291545623
Energy: 1.3824964815502656
Energy: 1.3987022915449818
Energy: 1.3824964815502656
Energy: 1.4257508485622117
Energy: 1.3267610376717969
Energy: 1.4257508485622117
Energy: 1.3267610376717969
Energy: 1.4702819555155786
Energy: 1.3267610376717969
Energy: 1.3130433635369763
Energy: 1.4401953647794516
Energy: 1.313043363536335
Energy: 1.4401953647794516
Energy: 1.3130433635382586
Energy: 1.440195364780093
Energy: 1.2764877096828209
Energy: 1.4295426609841153
Energy: 1.2764877096828209
Energy: 1.4295426609841153
Energy: 1.2764877096821798
Energy: 1.4295426609834745
Energy: 1.4921234506479961
Energy: 1.3043395435546241
Energy: 1.4921234506467136
Energy: 1.3043395435546241
Energy: 1.4921234506467136
Energy: 1.3043395435552654
Energy: 1.3693729106849513
Energy: 1.3694762811688779
Energy: 1.369372910683669
Energy: 1.369476281168237
Energy: 1.36937291068431
Energy: 1.369476281168237
Energy: 1.3676645813610058
Energy: 1.4554012247401593
Energy: 1.367664581361647
Energy: 1.4554012247401593
Energy: 1.367664581361647
Energy: 1.4554012247401593
Energy: 1.436400047843879
Energy: 1.3042733022314164
Energy: 1.436400047843879
Energy: 1.304273302230775
Energy: 1.436400047843879
Energy: 1.304273302230775
Energy: 1.346596222665529
Energy: 1.3290131508317475
Energy: 1.34659622266617
Energy: 1.3290131508323888
Energy: 1.3465962226668111
Energy: 1.3290131508323888
Energy: 1.2778561658996148
Energy: 1.4208574904255884
Energy: 1.277856165900256
Energy: 1.4208574904262297
Energy: 1.277856165900256
Energy: 1.4208574904262297
Energy: 1.4167825064507835
Energy: 1.3264254624731615
Energy: 1.4167825064514248
Energy: 1.3264254624725202
Energy: 1.4167825064514248
Energy: 1.3264254624725202
Energy: 1.4280380304860054
Energy: 1.3261763688035986
Energy: 1.4280380304853642
Energy: 1.3261763688035986
Energy: 1.4280380304866174
Energy: 1.3261763688035986

minimum gb energy = 1.2764877096821798 eV
minimum distance =  2.20557435486816 Angstroms
sigma value = 101


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

Energy: 1.2833371934645887
Energy: 1.419440428807502
Energy: 1.283337193464025
Energy: 1.4194404288080653
Energy: 1.283337193464025
Energy: 1.419440428807502
Energy: 1.3632297645678393
Energy: 1.2794407033029422
Energy: 1.3632297645672755
Energy: 1.2954920298059602
Energy: 1.3632297645655849
Energy: 1.2540536347640867
Energy: 1.3732676741736765
Energy: 1.24914088634851
Energy: 1.3732676741748036
Energy: 1.24914088634851
Energy: 1.3732676741736765
Energy: 1.249140886347383
Energy: 1.2095231100333281
Energy: 1.3851813009762506
Energy: 1.209523110033892
Energy: 1.4609867608973859
Energy: 1.2095231100333281
Energy: 1.3750451188801232
Energy: 1.2398798717131434
Energy: 1.2955332778269137
Energy: 1.2398798717153978
Energy: 1.2955332778269137
Energy: 1.2398798717108892
Energy: 1.2955332778274773
Energy: 1.3848648383331508
Energy: 1.2364689641835422
Energy: 1.384864838332587
Energy: 1.2364689641841058
Energy: 1.384864838332587
Energy: 1.2364689641841058
Energy: 1.2464267867942893
Energy: 1.3330053884830766
Energy: 1.2464267867942893
Energy: 1.3330053884830766
Energy: 1.2464267867942893
Energy: 1.3330053884825128
Energy: 1.2085957958777789
Energy: 1.33330175677393
Energy: 1.2085957958777789
Energy: 1.47421982606664
Energy: 1.208595795878906
Energy: 1.3711832544913691
Energy: 1.3619229665676895
Energy: 1.2374061698977314
Energy: 1.3619229665682533
Energy: 1.237406169897168
Energy: 1.3619229665721984
Energy: 1.237406169898295
Energy: 1.296377398046968
Energy: 1.276964436020955
Energy: 1.296377398048095
Energy: 1.438548842225683
Energy: 1.296377398046968
Energy: 1.3156265193080368
Energy: 1.2078628175375843
Energy: 1.52309600022968
Energy: 1.2078628175370207
Energy: 1.5230960002302436
Energy: 1.2078628175364572
Energy: 1.5230960002302436
Energy: 1.3464420837963407
Energy: 1.2800545286693021
Energy: 1.346442083799722
Energy: 1.295272832649136
Energy: 1.3464420837974678
Energy: 1.2552409822562784
Energy: 1.3736817510979065
Energy: 1.249314691944821
Energy: 1.3736817510979065
Energy: 1.249314691944821
Energy: 1.373681751097343
Energy: 1.249314691944821
Energy: 1.2863670725123755
Energy: 1.386799906738713
Energy: 1.2863670725129392
Energy: 1.4601240373795656
Energy: 1.2863670725118121
Energy: 1.4046211405413713
Energy: 1.2850542896318087
Energy: 1.3072536995659574
Energy: 1.2850542896306818
Energy: 1.3072536995659574
Energy: 1.2850542896323724
Energy: 1.307253699566521
Energy: 1.3727513646087144
Energy: 1.2519142077427259
Energy: 1.3727513646070237
Energy: 1.251914207742162
Energy: 1.372751364608151
Energy: 1.2519142077427259
Energy: 1.2077311448510064
Energy: 1.3249801875381277
Energy: 1.2077311448487522
Energy: 1.3249801875370009
Energy: 1.2077311448504429
Energy: 1.324980187539255
Energy: 1.2042125135598412
Energy: 1.3551388719102493
Energy: 1.2042125135609683
Energy: 1.3551388719102493
Energy: 1.2042125135609683
Energy: 1.3551388719096857
Energy: 1.3604165616288084
Energy: 1.237389906751328
Energy: 1.3604165616293722
Energy: 1.2373899067518914
Energy: 1.3604165616299355
Energy: 1.237389906745692
Energy: 1.2540807351774343
Energy: 1.2912799503852668
Energy: 1.2540807351757435
Energy: 1.2912799503841397
Energy: 1.2540807351751797
Energy: 1.2912799503841397
Energy: 1.2234570517310106
Energy: 1.5077631372939282
Energy: 1.2234570517315744
Energy: 1.5077631372944917
Energy: 1.2234570517315744
Energy: 1.507763137295619
Energy: 1.3907227352078149
Energy: 1.2353372012884967
Energy: 1.3907227352066878
Energy: 1.2353372012890604
Energy: 1.3907227352083784
Energy: 1.2353372012890604
Energy: 1.3971035957311806
Energy: 1.2353747657333132
Energy: 1.3971035957311806
Energy: 1.2353747657333132
Energy: 1.3971035957300537
Energy: 1.2353747657338767
Energy: 1.2097709582315541
Energy: 1.4181572933310493
Energy: 1.2097709582321179
Energy: 1.4181572933310493
Energy: 1.2097709582321179
Energy: 1.4181572933310493
Energy: 1.3463505873847235
Energy: 1.2930286951375602
Energy: 1.3463505873852872
Energy: 1.293028695138124
Energy: 1.3463505873824688
Energy: 1.2930286951369967
Energy: 1.3726326260710537
Energy: 1.251943783836902
Energy: 1.3726326260710537
Energy: 1.251943783835775
Energy: 1.3726326260727446
Energy: 1.2519437838363388
Energy: 1.2827233723847122
Energy: 1.3878091608263927
Energy: 1.2827233723824578
Energy: 1.3878091608263927
Energy: 1.2827233723841485
Energy: 1.3878091608269563
Energy: 1.2833281484130197
Energy: 1.3190107085076637
Energy: 1.2833281484130197
Energy: 1.3190107085076637
Energy: 1.2833281484118926
Energy: 1.3190107085076637
Energy: 1.4177506205512893
Energy: 1.2493723493217315
Energy: 1.4177506205495987
Energy: 1.249372349322295
Energy: 1.417750620551853
Energy: 1.2493723493228588
Energy: 1.2042871259334378
Energy: 1.3176093216528975
Energy: 1.2042871259340013
Energy: 1.3176093216500793
Energy: 1.2042871259323107
Energy: 1.317609321649516
Energy: 1.2075181880574601
Energy: 1.3823309592633943
Energy: 1.2075181880580237
Energy: 1.3823309592633943
Energy: 1.2075181880574601
Energy: 1.3823309592633943
Energy: 1.4245531952023363
Energy: 1.2353206399596843
Energy: 1.4245531952017725
Energy: 1.2353206399591208
Energy: 1.4245531952012602
Energy: 1.2353206399596843
Energy: 1.39508734479717
Energy: 1.2355563132070526
Energy: 1.3950873447977334
Energy: 1.2355563132087435
Energy: 1.3950873447966063
Energy: 1.2355563132087435

minimum gb energy = 1.2042125135598412 eV
minimum distance =  2.23345549477242 Angstroms
sigma value = 33


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

Energy: 0.02025632789012438
Energy: 0.8979468184125416
Energy: 0.02025632789012438
Energy: 0.8979468184125416
Energy: 0.02025632789012438
Energy: 0.897946818414831
Energy: 0.02102902928657364
Energy: 0.4362786444698004
Energy: 0.0210290292861574
Energy: 0.4362786444688639
Energy: 0.021029029285689126
Energy: 0.4362786444693322
Energy: 1.2074094935584907
Energy: 0.43767551505511854
Energy: 2.0498104813964146
Energy: 0.4376755150519447
Energy: 2.4270830227948217
Energy: 0.4376755150496553
Energy: 0.021029029288862966
Energy: 0.4362786444702167
Energy: 0.021029029288446726
Energy: 0.4362786444702167
Energy: 0.021029029288446726
Energy: 0.4362786444698004

minimum gb energy = 0.02025632789012438 eV
minimum distance =  2.48313029023438 Angstroms
sigma value = 1