Model name: model_name=MEAM_LAMMPS_AsadiZaeemNouranian_2015_Ni__MO_700541006254_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=3.5213917642831802
cohesive_energy=4.45034997785486
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: 0.018143781430992288
Energy: 0.901364586965844
Energy: 0.01814378143132279
Energy: 0.901364586965844
Energy: 0.018143781430992288
Energy: 0.901364586965844
Energy: 0.9013645869655135
Energy: 1.2364401941945695
Energy: 0.901364586965844
Energy: 1.2364401941932843
Energy: 0.9013645869655135
Energy: 1.2364401941935779
Energy: 0.018143781430992288
Energy: 0.901364586965844
Energy: 0.01814378143132279
Energy: 0.9013645869655135
Energy: 0.01814378143132279
Energy: 0.901364586965844
Energy: 0.9013645869655135
Energy: 1.2364401941939085
Energy: 0.901364586965844
Energy: 1.2364401941958547
Energy: 0.901364586965844
Energy: 1.2364401941945695
Energy: 0.018143781430992288
Energy: 0.9013645869655135
Energy: 0.01814378143132279
Energy: 0.901364586965844
Energy: 0.018143781430992288
Energy: 0.901364586965844
Energy: 0.9013645869655135
Energy: 1.2364401941939085
Energy: 0.901364586965844
Energy: 1.2364401941945695
Energy: 0.901364586965844
Energy: 1.2364401941926233

minimum gb energy = 0.018143781430992288 eV
minimum distance =  2.34454069340672 Angstroms
sigma value = 1


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

Energy: 1.4153119318181273
Energy: 1.5047161186769509
Energy: 1.4153119318181273
Energy: 1.5047161186761553
Energy: 1.4153119318181273
Energy: 1.5047161186761553
Energy: 1.515064538140066
Energy: 1.3029122807134885
Energy: 1.515064538140066
Energy: 1.3029122807134885
Energy: 1.515064538140066
Energy: 1.3029122807126927
Energy: 1.4063764428842735
Energy: 1.4102981012251798
Energy: 1.4063764428842735
Energy: 1.4102981012259754
Energy: 1.4063764428842735
Energy: 1.4102981012251798
Energy: 1.5597594081575572
Energy: 1.333778906418506
Energy: 1.5597594081575572
Energy: 1.333778906418506
Energy: 1.5597594081575572
Energy: 1.333778906418506
Energy: 1.4019231480796412
Energy: 1.4664399169660944
Energy: 1.4019231480812324
Energy: 1.4664399169660944
Energy: 1.4019231480804368
Energy: 1.4664399169652989
Energy: 1.4186494571418042
Energy: 1.300537959662141
Energy: 1.4186494571425998
Energy: 1.300537959662141
Energy: 1.4186494571418042
Energy: 1.300537959662141
Energy: 1.397703585760659
Energy: 1.4683861702184244
Energy: 1.397703585760659
Energy: 1.4683861702184244
Energy: 1.3977035857598634
Energy: 1.4683861702184244
Energy: 1.3725792161346373
Energy: 1.551097987452669
Energy: 1.372579216133842
Energy: 1.551097987452669
Energy: 1.3725792161346373
Energy: 1.551097987452669
Energy: 1.4617670489446903
Energy: 1.385529463875238
Energy: 1.4617670489462815
Energy: 1.3855294638760334
Energy: 1.461767048945486
Energy: 1.385529463875238
Energy: 1.2583747417851345
Energy: 1.5289770095559443
Energy: 1.2583747417851345
Energy: 1.5289770095567399
Energy: 1.2583747417851345
Energy: 1.528977009557535
Energy: 1.5923986532319088
Energy: 1.2989527702881296
Energy: 1.5923986532327044
Energy: 1.298952770287334
Energy: 1.5923986532319088
Energy: 1.298952770287334
Energy: 1.2504912608983012
Energy: 1.6677979733906414
Energy: 1.2504912608983012
Energy: 1.6677979733898456
Energy: 1.2504912608983012
Energy: 1.6677979733906414
Energy: 1.5055897601151087
Energy: 1.2607265489438806
Energy: 1.5055897601143131
Energy: 1.2607265489438806
Energy: 1.5055897601143131
Energy: 1.2607265489438806
Energy: 1.3230875892577467
Energy: 1.4110463162766103
Energy: 1.3230875892569511
Energy: 1.4110463162766103
Energy: 1.3230875892577467
Energy: 1.4110463162766103
Energy: 1.5807553455461558
Energy: 1.2735036769512569
Energy: 1.5807553455453602
Energy: 1.2735036769512569
Energy: 1.5807553455461558
Energy: 1.2735036769512569
Energy: 1.5592358601249243
Energy: 1.437936987884893
Energy: 1.5592358601249243
Energy: 1.4379369878856885
Energy: 1.5592358601249243
Energy: 1.4379369878856885
Energy: 1.4471596689193402
Energy: 1.3783769975915154
Energy: 1.4471596689193402
Energy: 1.3783769975923108
Energy: 1.4471596689193402
Energy: 1.3783769975915154
Energy: 1.4458456458973763
Energy: 1.3665692462790104
Energy: 1.4458456458981717
Energy: 1.3665692462782149
Energy: 1.4458456458981717
Energy: 1.3665692462790104
Energy: 1.3069456741655887
Energy: 1.4061170098568683
Energy: 1.3340161530648207
Energy: 1.4061170098560727
Energy: 1.334016153064025
Energy: 1.4061170098560727
Energy: 1.435144756391204
Energy: 1.2998837418451903
Energy: 1.435144756391204
Energy: 1.2998837418451903
Energy: 1.435144756391204
Energy: 1.299883741844395
Energy: 1.3003210306661
Energy: 1.6992199921526294
Energy: 1.3003210306668953
Energy: 1.6992199921526294
Energy: 1.3003210306661
Energy: 1.6992199921518336
Energy: 1.468642883184481
Energy: 1.3865758455360095
Energy: 1.468642883184481
Energy: 1.3865758455360095
Energy: 1.468642883184481
Energy: 1.3865758455360095
Energy: 1.307610292423256
Energy: 1.5110061400608532
Energy: 1.3076102924256428
Energy: 1.5110061400608532
Energy: 1.3076102924240514
Energy: 1.5110061400608532

minimum gb energy = 1.2504912608983012 eV
minimum distance =  2.25741768651555 Angstroms
sigma value = 33


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

Energy: 1.412471926668473
Energy: 1.4706204141346024
Energy: 1.3730043190108787
Energy: 1.4706204141341497
Energy: 1.4124719266680203
Energy: 1.4706204141346024
Energy: 1.533693440595659
Energy: 1.3361468016851277
Energy: 1.5336934405961116
Energy: 1.3361468016851277
Energy: 1.533693440595659
Energy: 1.3361468016873903
Energy: 1.2667298164807563
Energy: 1.3342962873411746
Energy: 1.2667298164807563
Energy: 1.3342962873411746
Energy: 1.2667298164807563
Energy: 1.3342962873402695
Energy: 1.4570195933386565
Energy: 1.470516807000086
Energy: 1.4570195933391088
Energy: 1.470516807000086
Energy: 1.4570195933386565
Energy: 1.4705168069991807
Energy: 1.3793848936401962
Energy: 1.4160271538699638
Energy: 1.3793848936406485
Energy: 1.4160271538699638
Energy: 1.3793848936401962
Energy: 1.416027153873584
Energy: 1.3640164426763617
Energy: 1.2745989527714394
Energy: 1.364016442678624
Energy: 1.274598952770987
Energy: 1.364016442675909
Energy: 1.2745989527705346
Energy: 1.4645199401257825
Energy: 1.4447334984537843
Energy: 1.4645199401262352
Energy: 1.4447334984533318
Energy: 1.4645199401262352
Energy: 1.4447334984546891
Energy: 1.2269847805829683
Energy: 1.478282575267089
Energy: 1.2269847805861358
Energy: 1.478282575267089
Energy: 1.2269847805834209
Energy: 1.4782825752652788
Energy: 1.390547991980107
Energy: 1.268198303563505
Energy: 1.3905479919823696
Energy: 1.2681983035630524
Energy: 1.3905479919805597
Energy: 1.2681983035612423
Energy: 1.2506759067721454
Energy: 1.4940456095689845
Energy: 1.250674539567787
Energy: 1.4940456095685317
Energy: 1.2506759067721454
Energy: 1.494045609569437
Energy: 1.524552572492032
Energy: 1.3056139339002262
Energy: 1.5245525724933893
Energy: 1.3056139339002262
Energy: 1.5245525724915794
Energy: 1.305613933899321
Energy: 1.2668823841896801
Energy: 1.4427421284929423
Energy: 1.2668828753184436
Energy: 1.4427421284924895
Energy: 1.2668823841892278
Energy: 1.4427421284956574
Energy: 1.4401826098739063
Energy: 1.2668667202535564
Energy: 1.4401826098748114
Energy: 1.2668667202535564
Energy: 1.4401826098743589
Energy: 1.2668667202571764
Energy: 1.3730039175396958
Energy: 1.471328985525262
Energy: 1.3730039175374331
Energy: 1.4713289855248095
Energy: 1.3730039175392432
Energy: 1.4713289855261669
Energy: 1.421185312036319
Energy: 1.3365455854238555
Energy: 1.4211853120376765
Energy: 1.3365455854238555
Energy: 1.421185312036319
Energy: 1.3365455854238555
Energy: 1.2697399362741901
Energy: 1.3348530432344092
Energy: 1.2697399362746429
Energy: 1.3348530432339565
Energy: 1.2697399362750952
Energy: 1.334853043233504
Energy: 1.4459671260765865
Energy: 1.3986216286854083
Energy: 1.445967126076134
Energy: 1.3986216286854083
Energy: 1.445967126077039
Energy: 1.3986216286890283
Energy: 1.3760585902971647
Energy: 1.265845989781664
Energy: 1.3760585902958073
Energy: 1.2658459897821168
Energy: 1.3760585902976172
Energy: 1.265845989781664
Energy: 1.3720724903498618
Energy: 1.339682083953313
Energy: 1.3720724903512194
Energy: 1.3396820839528605
Energy: 1.3720724903498618
Energy: 1.3396820839537653
Energy: 1.4721791989212063
Energy: 1.3778263584817603
Energy: 1.4721791989203015
Energy: 1.3778263584813077
Energy: 1.4721791989207538
Energy: 1.3778263584794976
Energy: 1.2305364553484675
Energy: 1.4759789756854627
Energy: 1.230536455349825
Energy: 1.475978975685915
Energy: 1.2305364553475626
Energy: 1.4759789756863677
Energy: 1.3363845844330047
Energy: 1.2687321423273148
Energy: 1.3363845844352673
Energy: 1.2687321423273148
Energy: 1.3363845844339095
Energy: 1.26873214232822
Energy: 1.2861969171083079
Energy: 1.4932088412575526
Energy: 1.2862051598119606
Energy: 1.4932088412571
Energy: 1.2861969171083079
Energy: 1.4932088412580051
Energy: 1.4965785034305867
Energy: 1.376118373980387
Energy: 1.496578503431039
Energy: 1.3761183739799345
Energy: 1.4965785034337542
Energy: 1.376118373977672
Energy: 1.2669981359996108
Energy: 1.3714001734723718
Energy: 1.2667796425980418
Energy: 1.3714001734416006
Energy: 1.2669981359996108
Energy: 1.371400173391413
Energy: 1.476472531333215
Energy: 1.45889998204764
Energy: 1.4400133480041635
Energy: 1.45889998204764
Energy: 1.4764725313327625
Energy: 1.4588999820503552
Energy: 1.4763201516808784
Energy: 1.4346191364186636
Energy: 1.4401272447326023
Energy: 1.434619136419116
Energy: 1.4763201516804259
Energy: 1.434619136420474
Energy: 1.2669640405180647
Energy: 1.3247831041627902
Energy: 1.2669640405171594
Energy: 1.3247831041623377
Energy: 1.2669640405180647
Energy: 1.3247831041627902
Energy: 1.4923287518493096
Energy: 1.335122144087303
Energy: 1.4923287518511195
Energy: 1.335122144087303
Energy: 1.4923287518493096
Energy: 1.3351221440845875
Energy: 1.3055093990861046
Energy: 1.5249788556555701
Energy: 1.3055093990851996
Energy: 1.5249788556555701
Energy: 1.3055093990861046
Energy: 1.524978855656475
Energy: 1.4005117095423605
Energy: 1.2683748580885015
Energy: 1.4005117095437178
Energy: 1.2683748580880492
Energy: 1.4005117095423605
Energy: 1.268374858088954
Energy: 1.2670053627928497
Energy: 1.4406052373485927
Energy: 1.2670053627923972
Energy: 1.4406052373481404
Energy: 1.267005362793302
Energy: 1.4406052373463303
Energy: 1.472650098970504
Energy: 1.3776835064285724
Energy: 1.472650098970504
Energy: 1.3776835064285724
Energy: 1.4726500989709566
Energy: 1.3776835064281197
Energy: 1.336970429838659
Energy: 1.4209099246130217
Energy: 1.3369704298391116
Energy: 1.4209099246130217
Energy: 1.3369704298391116
Energy: 1.420909924612569
Energy: 1.335131307332426
Energy: 1.2666155972465891
Energy: 1.3351313073333313
Energy: 1.2666155972465891
Energy: 1.335131307332426
Energy: 1.2666155972465891
Energy: 1.3977185554268574
Energy: 1.4458344582642695
Energy: 1.397718555428215
Energy: 1.4458344582638167
Energy: 1.3977185554268574
Energy: 1.4458344582665321
Energy: 1.2778327462039416
Energy: 1.3763797600580083
Energy: 1.277826168450876
Energy: 1.3763797600580083
Energy: 1.2778327462039416
Energy: 1.3763797600593657
Energy: 1.3409298048936429
Energy: 1.3617535890393124
Energy: 1.3409298048931906
Energy: 1.36175358903886
Energy: 1.3409298048936429
Energy: 1.3617535890370498
Energy: 1.3731687644724806
Energy: 1.4748952144717535
Energy: 1.3731687644738382
Energy: 1.4748952144726584
Energy: 1.373168764472933
Energy: 1.4748952144699436
Energy: 1.4776614366624519
Energy: 1.2273173921592129
Energy: 1.477661436665167
Energy: 1.2273173921592129
Energy: 1.4776614366624519
Energy: 1.2273173921619278
Energy: 1.2668428543897043
Energy: 1.3922698640990891
Energy: 1.2668428543883468
Energy: 1.3922698640995415
Energy: 1.2668428543901569
Energy: 1.3922698640977316

minimum gb energy = 1.2269847805829683 eV
minimum distance =  2.3167724075752 Angstroms
sigma value = 51


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

Energy: 1.4175597005348008
Energy: 1.4308176054028252
Energy: 1.4175597005337524
Energy: 1.4308176054028252
Energy: 1.4175597005348008
Energy: 1.4308176054028252
Energy: 1.478423191593118
Energy: 1.3704982578637666
Energy: 1.478423191593118
Energy: 1.3704982578637666
Energy: 1.478423191593118
Energy: 1.3704982578637666
Energy: 1.3584318534199897
Energy: 1.4028389862414306
Energy: 1.3584318534199897
Energy: 1.4028389862414306
Energy: 1.3584318534199897
Energy: 1.4028389862414306
Energy: 1.3937409158672358
Energy: 1.3427420025435697
Energy: 1.3937409158672358
Energy: 1.3427420025435697
Energy: 1.3937409158672358
Energy: 1.3427420025435697
Energy: 1.4656235764689187
Energy: 1.4181713564215632
Energy: 1.4656235764699672
Energy: 1.4181713564215632
Energy: 1.4656235764699672
Energy: 1.4181713564215632
Energy: 1.530402577545608
Energy: 1.419740411716711
Energy: 1.530402577545608
Energy: 1.419740411716711
Energy: 1.530402577545608
Energy: 1.4197404117156625
Energy: 1.383801173764517
Energy: 1.3645929176654121
Energy: 1.383801173764517
Energy: 1.3645929176643639
Energy: 1.3838011737655656
Energy: 1.3645929176643639
Energy: 1.3225290657600854
Energy: 1.4184665724937358
Energy: 1.3225290657590372
Energy: 1.4184665724937358
Energy: 1.3225290657590372
Energy: 1.4184665724937358
Energy: 1.602526256116124
Energy: 1.3413020249626209
Energy: 1.6025262561171725
Energy: 1.3413020249615728
Energy: 1.6025262561171725
Energy: 1.3413020249615728
Energy: 1.34137788607397
Energy: 1.6136635978668044
Energy: 1.34137788607397
Energy: 1.6136635978668044
Energy: 1.3413778860750185
Energy: 1.6136635978657559
Energy: 1.582608253588547
Energy: 1.25849270238113
Energy: 1.5826082535874986
Energy: 1.2584927023821788
Energy: 1.5826082535874986
Energy: 1.2584927023821788
Energy: 1.4171671652680171
Energy: 1.4319198395210073
Energy: 1.4171671652680171
Energy: 1.4319198395210073
Energy: 1.4171671652680171
Energy: 1.4319198395210073
Energy: 1.478017082231774
Energy: 1.4092386454203707
Energy: 1.478017082231774
Energy: 1.4092386454203707
Energy: 1.4780170822348715
Energy: 1.4092386454214194
Energy: 1.4015438557355349
Energy: 1.3414080358178442
Energy: 1.4015438557355349
Energy: 1.3414080358178442
Energy: 1.4015438557355349
Energy: 1.3414080358178442
Energy: 1.375547487655575
Energy: 1.3986503812297923
Energy: 1.375547487655575
Energy: 1.3986503812287439
Energy: 1.375547487655575
Energy: 1.3986503812287439
Energy: 1.463199761452279
Energy: 1.4213178187120874
Energy: 1.4631997614533272
Energy: 1.421317818711039
Energy: 1.4631997614533272
Energy: 1.4213178187120874
Energy: 1.465064295489046
Energy: 1.5076295001997302
Energy: 1.465064295489046
Energy: 1.5076295001997302
Energy: 1.4650642954900943
Energy: 1.5076295001997302
Energy: 1.39240503449671
Energy: 1.3675075268620593
Energy: 1.39240503449671
Energy: 1.3675075268620593
Energy: 1.39240503449671
Energy: 1.3675075268620593

minimum gb energy = 1.25849270238113 eV
minimum distance =  2.24221699867283 Angstroms
sigma value = 19


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

Energy: 1.239510278710997
Energy: 1.2329018495169237
Energy: 1.239510278711619
Energy: 1.2329018495169237
Energy: 1.239510278711619
Energy: 1.2329018495169237
Energy: 1.2913670129764963
Energy: 1.3858702834827037
Energy: 1.2913670129771182
Energy: 1.3858702834827037
Energy: 1.2913670129764963
Energy: 1.3858702834827037
Energy: 1.1791509294347073
Energy: 1.4634279824857437
Energy: 1.1791509294340854
Energy: 1.4634279824863659
Energy: 1.1791509294334637
Energy: 1.4634279824857437
Energy: 1.2753152591902228
Energy: 1.179204186238369
Energy: 1.275315259189601
Energy: 1.179204186238991
Energy: 1.275315259189601
Energy: 1.179204186238991
Energy: 1.2051783243256147
Energy: 1.2577838617408355
Energy: 1.2051783243249925
Energy: 1.2577838617408355
Energy: 1.2051783243249925
Energy: 1.2577838617408355
Energy: 1.2051168113061295
Energy: 1.2579534879577878
Energy: 1.2051168113067516
Energy: 1.2579534879571657
Energy: 1.2051168113073736
Energy: 1.2579534879571657
Energy: 1.2753291737887484
Energy: 1.1791693879003702
Energy: 1.2753291737881265
Energy: 1.1791693879003702
Energy: 1.2753291737881265
Energy: 1.1791693879009921
Energy: 1.1793105727825894
Energy: 1.4635396337544235
Energy: 1.179310572783211
Energy: 1.4635396337544235
Energy: 1.1793105727825894
Energy: 1.4635396337544235
Energy: 1.2914369448092495
Energy: 1.3859797069846138
Energy: 1.2914369448086276
Energy: 1.3859797069839919
Energy: 1.2914369448086276
Energy: 1.3859797069846138
Energy: 1.239510278710997
Energy: 1.2329018495169237
Energy: 1.239510278710997
Energy: 1.2329018495169237
Energy: 1.239510278710997
Energy: 1.2329018495169237
Energy: 1.2913670129764963
Energy: 1.3858702834827037
Energy: 1.2913670129764963
Energy: 1.3858702834833256
Energy: 1.2913670129764963
Energy: 1.3858702834833256
Energy: 1.1791509294340854
Energy: 1.4634279824863659
Energy: 1.1791509294340854
Energy: 1.4634279824863659
Energy: 1.1791509294340854
Energy: 1.4634279824863659
Energy: 1.2753152591902228
Energy: 1.179204186238991
Energy: 1.275315259189601
Energy: 1.1792041862377471
Energy: 1.2753152591902228
Energy: 1.179204186238369
Energy: 1.2051783243249925
Energy: 1.2577838617408355
Energy: 1.2051783243243708
Energy: 1.2577838617408355
Energy: 1.2051783243249925
Energy: 1.2577838617408355
Energy: 1.2051168113067516
Energy: 1.2579534879577878
Energy: 1.2051168113061295
Energy: 1.2579534879577878
Energy: 1.2051168113061295
Energy: 1.2579534879577878
Energy: 1.2753291737887484
Energy: 1.1791693878997482
Energy: 1.2753291737887484
Energy: 1.1791693879003702
Energy: 1.2753291737887484
Energy: 1.1791693879003702
Energy: 1.1793105727838329
Energy: 1.4635396337544235
Energy: 1.1793105727825894
Energy: 1.4635396337544235
Energy: 1.1793105727825894
Energy: 1.4635396337544235
Energy: 1.2914369448092495
Energy: 1.3859797069846138
Energy: 1.2914369448092495
Energy: 1.3859797069839919
Energy: 1.2914369448086276
Energy: 1.3859797069846138
Energy: 1.239510278710997
Energy: 1.2329018495169237
Energy: 1.2395102787103751
Energy: 1.2329018495169237
Energy: 1.239510278710997
Energy: 1.2329018495175457
Energy: 1.2913670129771182
Energy: 1.3858702834833256
Energy: 1.2913670129771182
Energy: 1.3858702834827037
Energy: 1.2913670129764963
Energy: 1.3858702834833256
Energy: 1.1791509294340854
Energy: 1.4634279824857437
Energy: 1.1791509294334637
Energy: 1.4634279824857437
Energy: 1.1791509294347073
Energy: 1.4634279824857437
Energy: 1.2753152591902228
Energy: 1.179204186238991
Energy: 1.2753152591902228
Energy: 1.179204186238991
Energy: 1.2753152591902228
Energy: 1.179204186238369
Energy: 1.2051783243249925
Energy: 1.2577838617408355
Energy: 1.2051783243249925
Energy: 1.2577838617408355
Energy: 1.2051783243243708
Energy: 1.2577838617408355
Energy: 1.2051168113067516
Energy: 1.2579534879565437
Energy: 1.2051168113067516
Energy: 1.2579534879565437
Energy: 1.2051168113067516
Energy: 1.2579534879565437
Energy: 1.2753291737887484
Energy: 1.1791693879003702
Energy: 1.2753291737887484
Energy: 1.1791693879003702
Energy: 1.2753291737887484
Energy: 1.1791693879003702
Energy: 1.1793105727819673
Energy: 1.4635396337544235
Energy: 1.1793105727819673
Energy: 1.4635396337544235
Energy: 1.1793105727819673
Energy: 1.4635396337538018
Energy: 1.2914369448092495
Energy: 1.3859797069846138
Energy: 1.2914369448086276
Energy: 1.3859797069846138
Energy: 1.2914369448080056
Energy: 1.3859797069846138
Energy: 1.239510278710997
Energy: 1.2329018495175457
Energy: 1.239510278711619
Energy: 1.2329018495175457
Energy: 1.239510278711619
Energy: 1.2329018495175457
Energy: 1.2913670129758745
Energy: 1.3858702834827037
Energy: 1.2913670129771182
Energy: 1.3858702834827037
Energy: 1.2913670129764963
Energy: 1.3858702834833256
Energy: 1.1791509294347073
Energy: 1.4634279824857437
Energy: 1.1791509294347073
Energy: 1.4634279824857437
Energy: 1.1791509294340854
Energy: 1.4634279824857437

minimum gb energy = 1.1791509294334637 eV
minimum distance =  2.28813321366643 Angstroms
sigma value = 27


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

Energy: 1.1846695250892567
Energy: 1.1192420488401529
Energy: 1.1846695250892567
Energy: 1.1192420488416766
Energy: 1.1846695250892567
Energy: 1.1192420488416766
Energy: 1.4418262564728752
Energy: 1.1709612425026836
Energy: 1.4418262564728752
Energy: 1.1709612425026836
Energy: 1.4418262564728752
Energy: 1.1709612425026836
Energy: 1.200324047818492
Energy: 1.285168752839377
Energy: 1.200324047818492
Energy: 1.28516875283633
Energy: 1.200324047818492
Energy: 1.2851687528378535
Energy: 1.388636452884857
Energy: 1.109905389387933
Energy: 1.388636452884857
Energy: 1.109905389387933
Energy: 1.3886364528833335
Energy: 1.109905389387933
Energy: 1.3171252346700932
Energy: 1.1085936036833752
Energy: 1.3171252346700932
Energy: 1.1085936036833752
Energy: 1.3171252346700932
Energy: 1.1085936036833752
Energy: 1.2873677314997272
Energy: 1.308285436963694
Energy: 1.2873677315012502
Energy: 1.308285436963694
Energy: 1.2873677314997272
Energy: 1.3082854369682642
Energy: 1.1870021893586
Energy: 1.1618770851250895
Energy: 1.1870021893586
Energy: 1.1618770851250895
Energy: 1.1870021893586
Energy: 1.1618770851250895
Energy: 1.1808090737867398
Energy: 1.1224493036224763
Energy: 1.1808090737867398
Energy: 1.1224493036224763
Energy: 1.1808090737867398
Energy: 1.1224493036224763
Energy: 1.2132908274869405
Energy: 1.200646508844624
Energy: 1.2132908274869405
Energy: 1.2006465088431006
Energy: 1.2132908274869405
Energy: 1.200646508844624
Energy: 1.3812667403743835
Energy: 1.2668532508658719
Energy: 1.3812667403743835
Energy: 1.2668532508658719
Energy: 1.3812667403743835
Energy: 1.2668532508658719
Energy: 1.2831353466164763
Energy: 1.1116845830707986
Energy: 1.283135346618
Energy: 1.1116845830707986
Energy: 1.1203940250531108
Energy: 1.1116845830707986
Energy: 1.2981818638720677
Energy: 1.2128343716844023
Energy: 1.298181863873591
Energy: 1.2128343716844023
Energy: 1.298181863873591
Energy: 1.2128343716844023

minimum gb energy = 1.1085936036833752 eV
minimum distance =  2.22953613319386 Angstroms
sigma value = 9


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

Energy: 1.0655534371135802
Energy: 1.1935812407176227
Energy: 1.0655534371135802
Energy: 1.1935812407171946
Energy: 1.065553437114008
Energy: 1.1935812407176227
Energy: 1.137791778331125
Energy: 1.0562650914109109
Energy: 1.137791778331125
Energy: 1.0417347132588615
Energy: 1.1377917783319813
Energy: 1.0749439193445405
Energy: 0.9956609382248175
Energy: 1.189934097856355
Energy: 0.9956609382256734
Energy: 1.1899340978567832
Energy: 0.9956609382239612
Energy: 1.1899340978559267
Energy: 0.9904728942172885
Energy: 0.9764451248393584
Energy: 0.9904728942168606
Energy: 0.9764451248385022
Energy: 0.9904728942172885
Energy: 0.9764451248393584
Energy: 1.0565171760425212
Energy: 1.093428472041793
Energy: 1.0565171760429493
Energy: 1.0934284720439336
Energy: 1.0565171760425212
Energy: 1.0934284720430771
Energy: 1.081954451622101
Energy: 1.0377592795313828
Energy: 1.0819544516225288
Energy: 1.0377592795386594
Energy: 1.081954451622101
Energy: 1.0661805216898665
Energy: 1.0032832297579224
Energy: 1.1488923655676109
Energy: 1.0032832297574943
Energy: 1.1488923655676109
Energy: 1.0032832297587784
Energy: 1.1488923655676109
Energy: 0.9483070826152353
Energy: 1.126754872816451
Energy: 0.9483070826148073
Energy: 1.126754872816451
Energy: 0.9483070826152353
Energy: 1.1267548728168792
Energy: 1.4179771545927928
Energy: 1.0930884647168555
Energy: 1.4179771545945048
Energy: 1.0930884647172836
Energy: 1.417977154594077
Energy: 1.0930884647177115
Energy: 1.0574377148180694
Energy: 1.3447891532467282
Energy: 1.0574377148180694
Energy: 1.344789153245444
Energy: 1.0574377148150729
Energy: 1.3447891532463
Energy: 0.9910693092158765
Energy: 0.9820114398339775
Energy: 0.9910693092158765
Energy: 0.9820114398339775
Energy: 0.9910693092163047
Energy: 0.9820114398344056
Energy: 1.0302233979473001
Energy: 1.080749105868268
Energy: 1.0302233979473001
Energy: 1.080749105868696
Energy: 1.0302233979477278
Energy: 1.080749105868696
Energy: 1.0425826730118273
Energy: 1.0435012533752188
Energy: 1.042582673012683
Energy: 1.0435012533747907
Energy: 1.042582673012683
Energy: 1.0435012533743626
Energy: 1.0625551760387282
Energy: 1.4472920138146088
Energy: 1.0625551760387282
Energy: 1.4472920138141812
Energy: 1.0625551760391565
Energy: 1.4472920138133247
Energy: 0.9788809752168125
Energy: 1.158269689729191
Energy: 0.9788809752168125
Energy: 1.158269689729191
Energy: 0.9788809752168125
Energy: 1.158269689729191
Energy: 0.9525208519639801
Energy: 1.002677969275362
Energy: 0.9525208519635523
Energy: 1.0026779692501078
Energy: 0.9525208519626961
Energy: 1.0026779692561003
Energy: 1.3327638829255966
Energy: 0.9753034518732602
Energy: 1.3327638829264528
Energy: 0.9753034518724042
Energy: 1.3327638829260247
Energy: 0.9753034518724042
Energy: 0.9932242985860084
Energy: 1.076228993304868
Energy: 0.9932242985855803
Energy: 1.0762289933052964
Energy: 0.9932242985855803
Energy: 1.076228993304868
Energy: 0.9477420614450722
Energy: 1.3291815421195323
Energy: 0.9477420614446443
Energy: 1.3291815421191042
Energy: 0.9477420614446443
Energy: 1.3291815421191042
Energy: 1.4053518603156459
Energy: 1.1648481491038851
Energy: 1.4053518603165018
Energy: 0.9788470124002293
Energy: 1.4053518603165018
Energy: 0.9911363630045217
Energy: 0.9477257574049852
Energy: 1.3292237865413667
Energy: 0.9477257574054133
Energy: 1.3292237865417944
Energy: 0.9477257574054133
Energy: 1.3292237865417944
Energy: 0.9932544272402039
Energy: 1.0762157012339058
Energy: 0.9932544272402039
Energy: 1.0762157012343339
Energy: 0.993254427239776
Energy: 1.0762157012343339
Energy: 1.3330583581737494
Energy: 0.9753423153094375
Energy: 1.3330583581733217
Energy: 0.9753423153094375
Energy: 1.3330583581733217
Energy: 0.9753423153120059
Energy: 0.9526330390795883
Energy: 1.0348342477283616
Energy: 0.9526330390783431
Energy: 1.0348342477275057
Energy: 0.9526330390783431
Energy: 1.0348342477236534
Energy: 0.9789766279870004
Energy: 1.1584403485515842
Energy: 0.9789766279874285
Energy: 1.1584403485520118
Energy: 0.9789766279870004
Energy: 1.1584403485520118
Energy: 1.0622725623232236
Energy: 1.1532485701718314
Energy: 1.0622725623223677
Energy: 1.1532485701726878
Energy: 1.0622725623236517
Energy: 1.1532485701722597
Energy: 1.042519323389917
Energy: 1.0436228650793058
Energy: 1.042519323389917
Energy: 1.0436228650797337
Energy: 1.0425193233912011
Energy: 1.0436228650797337
Energy: 1.0303004354153151
Energy: 1.0194749454192547
Energy: 1.030300435414459
Energy: 1.0194749454192547
Energy: 1.030300435415743
Energy: 1.0194749454196828
Energy: 0.9907609952348038
Energy: 0.9821664450906775
Energy: 0.9907609952343757
Energy: 0.9821664450911054
Energy: 0.9907609952348038
Energy: 0.9821664450915334
Energy: 1.0576209331736137
Energy: 1.0760480848499894
Energy: 1.0576209331710458
Energy: 1.0760480848504175
Energy: 1.0576209331714737
Energy: 1.0760480848517016
Energy: 1.4180655981165493
Energy: 1.0932846313722246
Energy: 1.4180655981186894
Energy: 1.0932846313709406
Energy: 1.4180655981174055
Energy: 1.0932846313726527
Energy: 0.9482208757311648
Energy: 1.1268048884588047
Energy: 0.9482208757311648
Energy: 1.1268048884579482
Energy: 0.9482208757315929
Energy: 1.1268048884588047
Energy: 1.0031457578477079
Energy: 1.149327962520709
Energy: 1.00314575784942
Energy: 1.149327962521565
Energy: 1.0031457578477079
Energy: 1.149327962521565
Energy: 1.082370078210183
Energy: 1.0541503570156723
Energy: 1.0823700782097547
Energy: 1.1033800913997278
Energy: 1.0823700782097547
Energy: 1.0884345538905444
Energy: 1.0564736391068499
Energy: 1.0933479149633072
Energy: 1.056473639107278
Energy: 1.093347914961595
Energy: 1.056473639107278
Energy: 1.093347914962023
Energy: 0.990814155722991
Energy: 0.9762745727352844
Energy: 0.9908141557225632
Energy: 0.9762745727357125
Energy: 0.9908141557225632
Energy: 0.9762745727369966
Energy: 0.9957008676846419
Energy: 1.1901057057769875
Energy: 0.9957008676850698
Energy: 1.1901057057765594
Energy: 0.9957008676837857
Energy: 1.1901057057791278
Energy: 1.1375190994975817
Energy: 0.9771843383427438
Energy: 1.1375190994950133
Energy: 0.9837956661894793
Energy: 1.1375190994980098
Energy: 0.9837956661890512
Energy: 1.0655534371148643
Energy: 1.1935812407176227
Energy: 1.0655534371148643
Energy: 1.193581240718051
Energy: 1.065553437114436
Energy: 1.1935812407176227
Energy: 1.1377917783345495
Energy: 1.0749439193436845
Energy: 1.1377917783345495
Energy: 1.0749439193441126
Energy: 1.1377917783345495
Energy: 1.0749439193436845
Energy: 0.9956609382252454
Energy: 1.189934097858495
Energy: 0.9956609382256734
Energy: 1.1899340978589232
Energy: 0.9956609382248175
Energy: 1.1899340978589232
Energy: 0.9904728942181447
Energy: 0.9764451248402144
Energy: 0.9904728942181447
Energy: 0.9764451248397863
Energy: 0.9904728942181447
Energy: 0.9764451248402144
Energy: 1.0565171760429493
Energy: 1.093428472041793
Energy: 1.0565171760442336
Energy: 1.0934284720426493
Energy: 1.056517176042093
Energy: 1.0934284720422212

minimum gb energy = 0.9477257574049852 eV
minimum distance =  2.30576342259348 Angstroms
sigma value = 57


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

Energy: 0.5176472665366739
Energy: 0.5123087564311007
Energy: 0.39321458220635397
Energy: 0.5123087564311007
Energy: 0.5176472665376483
Energy: 0.5123087564301265
Energy: 0.6728652432874965
Energy: 0.5097526689685805
Energy: 0.6728652432874965
Energy: 0.5097526689685805
Energy: 0.6728652432865222
Energy: 0.5097526689676063
Energy: 0.5745530905835161
Energy: 1.0625007821415189
Energy: 0.5745530905835161
Energy: 1.0625007821415189
Energy: 0.5745530905835161
Energy: 1.0625007821405446
Energy: 0.5137369497182743
Energy: 0.3929335046244632
Energy: 0.5137369497202231
Energy: 0.3929335046244632
Energy: 0.5137369497182743
Energy: 0.3929335046234888
Energy: 0.5633754080311313
Energy: 0.6792843817912192
Energy: 0.5633754080321056
Energy: 0.6792843817912192
Energy: 0.5633754080311313
Energy: 0.6792843817940981
Energy: 0.39311819364533884
Energy: 1.6095749803598816
Energy: 0.39311819364533884
Energy: 1.6095749803598816
Energy: 0.39311819364436446
Energy: 1.6095749803598816
Energy: 0.393228832998298
Energy: 0.4673671102342391
Energy: 0.39322883299732364
Energy: 0.4673671109403396
Energy: 0.393228832998298
Energy: 0.4673671101047379
Energy: 0.6731615269042504
Energy: 0.570052367637633
Energy: 0.6731615269023016
Energy: 0.570052367637633
Energy: 0.6731615269032759
Energy: 0.5700523676366587
Energy: 0.5137217572648287
Energy: 0.39293014660690584
Energy: 0.513721757265803
Energy: 0.39293014660690584
Energy: 0.5137217572648287
Energy: 0.3929301466059315
Energy: 0.4674958472971654
Energy: 1.2651733107535512
Energy: 0.46749584729619115
Energy: 1.2651733107535512
Energy: 0.46749584729619115
Energy: 1.2651733107535512
Energy: 0.5625639091821073
Energy: 1.3240376619562195
Energy: 0.5625639091821073
Energy: 1.3240376619591427
Energy: 0.5625639091821073
Energy: 1.3240376619581682
Energy: 0.5176472665366739
Energy: 0.5123087564311007
Energy: 0.39321458220635397
Energy: 0.5123087564311007
Energy: 0.5176472665366739
Energy: 0.5123087564320751
Energy: 0.6728652432865222
Energy: 0.5097526689685805
Energy: 0.6728652432874965
Energy: 0.509752668969555
Energy: 0.6728652432865222
Energy: 0.5097526689685805
Energy: 0.5745530905825417
Energy: 1.0625007821395702
Energy: 0.5745530905825417
Energy: 1.0625007821395702
Energy: 0.5745530905825417
Energy: 1.0625007821385957
Energy: 0.5137369497182743
Energy: 0.3929335046244632
Energy: 0.5137369497202231
Energy: 0.3929335046244632
Energy: 0.5137369497172999
Energy: 0.3929335046244632
Energy: 0.5633754080311313
Energy: 0.6792843817921936
Energy: 0.5633754080321056
Energy: 0.6792843817931238
Energy: 0.5633754080311313
Energy: 0.6792843817940981
Energy: 0.39311819364436446
Energy: 1.6095749803598816
Energy: 0.39311819364436446
Energy: 1.6095749803598816
Energy: 0.39311819364339007
Energy: 1.6095749803598816
Energy: 0.39322883299927236
Energy: 0.46736707327275995
Energy: 0.39322883299927236
Energy: 0.4673670739661937
Energy: 0.39322883299927236
Energy: 0.46736707254035176
Energy: 0.6731615269032759
Energy: 0.5700523676386074
Energy: 0.6731615269013272
Energy: 0.5700523676386074
Energy: 0.6731615269032759
Energy: 0.570052367637633

minimum gb energy = 0.3929301466059315 eV
minimum distance =  2.40107542069691 Angstroms
sigma value = 11


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

Energy: 0.9492191589178572
Energy: 1.018555847300412
Energy: 0.9492191589178572
Energy: 1.0185558472996978
Energy: 0.9492191589178572
Energy: 1.018555847300412
Energy: 1.053123429907513
Energy: 0.9749057505568992
Energy: 1.053123429907513
Energy: 0.9749057505568992
Energy: 1.0531234299067993
Energy: 0.9749057505568992
Energy: 1.1798750959426778
Energy: 1.4405980481280305
Energy: 1.1798750959426778
Energy: 1.4405980481280305
Energy: 1.179875095941964
Energy: 1.440598048128744
Energy: 1.2595616856527831
Energy: 0.8416470456912087
Energy: 1.2595616856527831
Energy: 0.84164704569335
Energy: 1.2595616856527831
Energy: 0.8416470456940636
Energy: 1.010782716225916
Energy: 0.8804321748347808
Energy: 1.0107827162244885
Energy: 0.8804321748340669
Energy: 1.010782716225916
Energy: 0.8804321748340669
Energy: 0.9685501498395541
Energy: 1.0900420278723164
Energy: 0.968550149840268
Energy: 1.0900420278723164
Energy: 0.968550149840268
Energy: 1.0900420278723164
Energy: 0.8088995129327736
Energy: 1.145119337255113
Energy: 0.8088995129334873
Energy: 1.1451193372636779
Energy: 0.8088995129327736
Energy: 1.1451193372565405
Energy: 1.0306710075760621
Energy: 0.775897871996492
Energy: 1.0306710075760621
Energy: 0.775897871996492
Energy: 1.0306710075760621
Energy: 0.775897871996492
Energy: 1.0132809821541922
Energy: 0.77496309530257
Energy: 1.0132809821549058
Energy: 0.77496309530257
Energy: 1.0132809821541922
Energy: 0.7749630953032838
Energy: 0.7810142084471708
Energy: 1.1857646785635678
Energy: 0.7810142084464571
Energy: 1.1857646785635678
Energy: 0.7810142084485983
Energy: 1.1857646785621403
Energy: 0.9754024812349473
Energy: 1.229078119666789
Energy: 0.975402481232806
Energy: 1.229078119666789
Energy: 0.9754024812313784
Energy: 1.229078119666789
Energy: 1.002189443810689
Energy: 0.883924434477055
Energy: 1.002189443810689
Energy: 0.883924434477055
Energy: 1.002189443810689
Energy: 0.883924434477055
Energy: 1.0317344180870411
Energy: 0.8493222760551264
Energy: 1.0317344180877548
Energy: 0.8493222760544128
Energy: 1.0317344180877548
Energy: 0.8493222760551264
Energy: 1.1669363755680036
Energy: 1.4077306307854072
Energy: 1.1669363755680036
Energy: 1.4077306307846935
Energy: 1.1669363755680036
Energy: 1.4077306307854072
Energy: 1.0668137390051708
Energy: 0.9759547423721395
Energy: 1.0668137390030947
Energy: 0.9759547423721395
Energy: 1.0668137390051708
Energy: 0.9759547423714258
Energy: 0.8699978963629013
Energy: 1.0201706736607503
Energy: 0.8699978963636149
Energy: 1.0201706736607503
Energy: 0.8699978963614737
Energy: 1.0201706736607503
Energy: 0.8797048851546314
Energy: 0.9778427259153141
Energy: 0.8797048851539178
Energy: 0.9778427259153141
Energy: 0.8797048851546314
Energy: 0.9778427259153141
Energy: 1.2546023814885099
Energy: 1.2381496155131604
Energy: 1.2546023814885099
Energy: 1.2381496155124463
Energy: 1.2546023814885099
Energy: 1.2381496155117329
Energy: 1.1888731662298209
Energy: 0.8366058137055546
Energy: 1.1888731662341032
Energy: 0.8366058137062683
Energy: 1.188873166237672
Energy: 0.8366058137048409
Energy: 1.0020178393732166
Energy: 0.9066424659519313
Energy: 1.0020178393732166
Energy: 0.9066424659519313
Energy: 1.0020178393739307
Energy: 0.9066424659512177
Energy: 0.7984553739061949
Energy: 0.9052582752964747
Energy: 0.7984553739089851
Energy: 0.9052582752971884
Energy: 0.7984553739082714
Energy: 0.9052582752964747
Energy: 1.055638739912445
Energy: 1.1834721304763594
Energy: 1.0556387399131586
Energy: 1.1834721304756457
Energy: 1.055638739912445
Energy: 1.1834721304756457
Energy: 1.0305946017925918
Energy: 0.9329567692708447
Energy: 1.0305946017933056
Energy: 0.9329567692708447
Energy: 1.0305946017933056
Energy: 0.9329567692708447
Energy: 1.0152597214955563
Energy: 0.8908896992765007
Energy: 1.01525972149627
Energy: 0.890889699275787
Energy: 1.0152597214955563
Energy: 0.8908896992765007
Energy: 0.8195460999138329
Energy: 1.224058273371487
Energy: 0.8195460999124053
Energy: 1.2240582733757692
Energy: 0.8195460999131191
Energy: 1.224058273376483
Energy: 1.4524251644734656
Energy: 1.2429796408372475
Energy: 1.4524251644734656
Energy: 1.2429796408379612
Energy: 1.4524251644734656
Energy: 1.2429796408379612

minimum gb energy = 0.77496309530257 eV
minimum distance =  2.28893738214197 Angstroms
sigma value = 41


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

Energy: 1.0862535510858522
Energy: 0.9743148902423492
Energy: 1.0862535510864149
Energy: 0.9743148902423492
Energy: 1.0862535510864149
Energy: 0.9743148902423492
Energy: 1.1136496743466562
Energy: 1.1663700873950402
Energy: 1.1136496743460937
Energy: 1.1663700873950402
Energy: 1.1136496743466562
Energy: 1.1663700873956029
Energy: 1.3989342578499067
Energy: 1.6412330666148456
Energy: 1.3989342578499067
Energy: 1.6412330666148456
Energy: 1.3989342578499067
Energy: 1.6412330666148456
Energy: 1.1016328915426918
Energy: 0.9541468870960068
Energy: 1.1016328915398792
Energy: 0.9541468870948818
Energy: 1.1016328915398792
Energy: 0.9541468870954443
Energy: 0.8750126151561407
Energy: 1.0158938512220042
Energy: 0.8750126151561407
Energy: 1.0158938512220042
Energy: 0.8750126151567033
Energy: 1.0158938512220042
Energy: 1.1135245930795408
Energy: 1.3490267313052287
Energy: 1.1135245930789783
Energy: 1.3490267313052287
Energy: 1.1135245930789783
Energy: 1.3490267313052287
Energy: 0.9049856055059592
Energy: 1.0368991043192233
Energy: 0.9049856055065217
Energy: 1.0368991043197862
Energy: 0.9049856055065217
Energy: 1.0368991043197862
Energy: 0.910621061017826
Energy: 0.9540591834852141
Energy: 0.9106210610172635
Energy: 0.9540591834863392
Energy: 0.9106210610172635
Energy: 0.9540591834857767
Energy: 0.8836491535806597
Energy: 1.0100656613305259
Energy: 0.8836491535806597
Energy: 1.0100656613305259
Energy: 0.8836491535806597
Energy: 1.0100656613299634
Energy: 0.9807663543391345
Energy: 1.3741125352174952
Energy: 0.9807663543380094
Energy: 1.3741125352169328
Energy: 0.980766354338572
Energy: 1.3741125352174952
Energy: 0.9813292347658891
Energy: 1.3591012919757484
Energy: 0.9813292347658891
Energy: 1.3591012919757484
Energy: 0.9813292347653265
Energy: 1.3591012919763108
Energy: 0.8846487456658999
Energy: 1.1519469662848378
Energy: 0.8846487456658999
Energy: 1.0736799982360983
Energy: 0.8846487456664626
Energy: 1.0736799982360983
Energy: 0.8753205213289064
Energy: 0.9582633633114083
Energy: 0.8753205213289064
Energy: 0.9582633633114083
Energy: 0.8753205213283438
Energy: 0.9582633633114083
Energy: 0.8726414537592295
Energy: 1.2736819299680366
Energy: 0.8726414537592295
Energy: 1.273681929966912
Energy: 0.8726414537592295
Energy: 1.2736819299674742
Energy: 1.112256976357137
Energy: 1.3484148345245952
Energy: 1.1122569763560122
Energy: 1.3484148345245952
Energy: 1.1122569763565744
Energy: 1.3484148345245952
Energy: 0.8755286181433432
Energy: 1.0386370012984374
Energy: 0.8755286181439057
Energy: 1.0386370012961874
Energy: 0.8755286181433432
Energy: 1.0386370012956245
Energy: 0.9490067501720983
Energy: 0.9582399663978465
Energy: 0.9490067501726609
Energy: 0.9582399663984091
Energy: 0.9490067501726609
Energy: 0.9582399663972839
Energy: 1.1656338835406133
Energy: 1.6534919070577885
Energy: 1.1656338835394882
Energy: 1.6534919070589136
Energy: 1.1656338835400506
Energy: 1.6534919070577885
Energy: 1.1500180339152841
Energy: 1.150422754251211
Energy: 1.1500180339147217
Energy: 1.150422754251211
Energy: 1.1500180339147217
Energy: 1.1504227542506484
Energy: 0.981035502376312
Energy: 1.2188289230570146
Energy: 0.9810355023768745
Energy: 1.2188289230570146
Energy: 0.9810355023757494
Energy: 1.3252791853887413
Energy: 0.8830389058665585
Energy: 1.1699661230613656
Energy: 0.8830389058654335
Energy: 1.169966123063616
Energy: 0.883038905865996
Energy: 1.1699661230613656
Energy: 1.3970005556130918
Energy: 1.479914472569645
Energy: 1.3970005556130918
Energy: 1.479914472569645
Energy: 1.3970005556130918
Energy: 1.4799144725702074
Energy: 1.100019126180312
Energy: 0.9543314730867669
Energy: 1.100019126181437
Energy: 0.9543314730873295
Energy: 1.1000191261769365
Energy: 0.9543314730867669
Energy: 0.875464558810081
Energy: 1.2060074863406074
Energy: 0.875464558810081
Energy: 1.2060074863406074
Energy: 0.875464558810081
Energy: 1.2663454381588728
Energy: 0.8366850041407453
Energy: 1.2160758274129644
Energy: 0.8366850041407453
Energy: 1.2160758274146521
Energy: 0.8366850041407453
Energy: 1.216075827413527
Energy: 0.9043181305133267
Energy: 0.9070150008193176
Energy: 0.9043181305133267
Energy: 0.9070150008187551
Energy: 0.9043181305138892
Energy: 0.9070150008187551
Energy: 0.9093296010255163
Energy: 0.9542013082377357
Energy: 0.9093296010260788
Energy: 0.9542013082382984
Energy: 0.9093296010255163
Energy: 0.9542013082371732
Energy: 0.8833218989760563
Energy: 1.2102737556369776
Energy: 0.8833218989754937
Energy: 1.2102737556369776
Energy: 0.8833218989760563
Energy: 1.2386360640829428
Energy: 0.9805311135373873
Energy: 1.1650977075863633
Energy: 0.9805311135379499
Energy: 1.1650977075858007
Energy: 0.9805311135379499
Energy: 1.1650977075863633
Energy: 1.344962643381711
Energy: 0.8366195188834011
Energy: 1.3449626433682098
Energy: 0.8366195188834011
Energy: 1.3449626433794608
Energy: 0.8366195188834011
Energy: 0.8642781488965904
Energy: 1.0746311364729053
Energy: 0.8642781488977155
Energy: 1.0746311364723427
Energy: 0.8642781488943403
Energy: 1.0746311364729053
Energy: 0.9718764555115366
Energy: 0.9554362801582212
Energy: 0.9718764555120992
Energy: 0.9554362801582212
Energy: 0.9718764555120992
Energy: 0.9554362801576587
Energy: 0.8357635145127316
Energy: 1.0598926602744614
Energy: 0.8357635145127316
Energy: 1.0598926602744614
Energy: 0.8357635145127316
Energy: 1.0598926602744614

minimum gb energy = 0.8357635145127316 eV
minimum distance =  2.29910360643333 Angstroms
sigma value = 33


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

Energy: 1.0584456672785538
Energy: 0.9981866630075255
Energy: 1.0584456672797744
Energy: 0.9981866630067359
Energy: 1.0584456672797744
Energy: 0.9981866630055155
Energy: 1.5845843575818077
Energy: 0.920255833200548
Energy: 1.5845843575821668
Energy: 0.9202558332009786
Energy: 1.5845843575829563
Energy: 0.920255833200548
Energy: 1.0011519349515001
Energy: 1.8358628028089545
Energy: 1.0011519332107872
Energy: 1.8358628028085957
Energy: 1.0011519256414498
Energy: 1.835862802809744
Energy: 1.0161527350939665
Energy: 0.977542961056648
Energy: 1.0161527350943975
Energy: 0.9775429610570067
Energy: 1.0161527350939665
Energy: 0.9775429610570067
Energy: 0.9866368228528455
Energy: 1.4652292176164032
Energy: 0.986636822853994
Energy: 1.4652292176164032
Energy: 0.986636822853994
Energy: 1.4652292176156136
Energy: 1.2643970272304814
Energy: 0.9880966316552532
Energy: 1.2643970272301224
Energy: 0.988096631655684
Energy: 1.2643970272301224
Energy: 0.9880966316533151
Energy: 1.0051440175211077
Energy: 1.5320327116245571
Energy: 1.0051440175214665
Energy: 1.5320327116245571
Energy: 1.0051440175211077
Energy: 1.5320327116237673
Energy: 1.0501252179047442
Energy: 1.0627418410310847
Energy: 1.0501252179051745
Energy: 1.0627418410306537
Energy: 1.0501252179047442
Energy: 1.0627418410310847
Energy: 1.4634688373077498
Energy: 1.07576674915324
Energy: 1.4634688373081806
Energy: 1.0757667491528096
Energy: 1.4634688373081806
Energy: 1.0757667491524507
Energy: 1.315759355490908
Energy: 0.9545788278982145
Energy: 1.3157593554920564
Energy: 0.9545788278986452
Energy: 1.3157593554928462
Energy: 0.9545788278990041
Energy: 1.0508649625774087
Energy: 1.0492267843393133
Energy: 1.0508649625774087
Energy: 1.0492267843388825
Energy: 1.0508649625778392
Energy: 1.0492267843373035
Energy: 1.4732292779748675
Energy: 0.9769062677520968
Energy: 1.4732292779748675
Energy: 0.9769062677525275
Energy: 1.4732292779748675
Energy: 0.9769062677541066
Energy: 1.0765568732335684
Energy: 1.4607752678743617
Energy: 1.0765568732335684
Energy: 1.4607752678747925
Energy: 1.0765568732335684
Energy: 1.460775267874003
Energy: 1.0739364171644035
Energy: 1.0491821558097063
Energy: 1.0739364171648342
Energy: 1.0491821558092755
Energy: 1.073936417165193
Energy: 1.0491821558089165
Energy: 1.0595281318404242
Energy: 1.0059566207020565
Energy: 1.0595281318400651
Energy: 1.005956620702846
Energy: 1.0595281318404242
Energy: 1.0059566207032768
Energy: 1.002753032958087
Energy: 1.2660309708990745
Energy: 1.0027530329585177
Energy: 1.2660309708990745
Energy: 1.0027530329585177
Energy: 1.2660309708986437
Energy: 1.4725092926142833
Energy: 0.9879833739774311
Energy: 1.4725092926147139
Energy: 0.9879833739777899
Energy: 1.472509292615073
Energy: 0.9879833739782206
Energy: 0.9557193136102564
Energy: 1.0144141835494374
Energy: 0.9557193136102564
Energy: 1.014414183549868
Energy: 0.9557193136114768
Energy: 1.0144141835494374
Energy: 1.3136106547559143
Energy: 1.4832049531719305
Energy: 1.313610654756345
Energy: 1.4832049531715001
Energy: 1.3136106547574937
Energy: 1.4832049531715001
Energy: 1.2293460043585696
Energy: 1.0760632453804277
Energy: 1.2293460043581388
Energy: 1.0760632453804277
Energy: 1.2293460043534015
Energy: 1.076063245379997
Energy: 1.000642127602181
Energy: 1.059324357306352
Energy: 1.0006421276026118
Energy: 1.0593243573067828
Energy: 1.0006421276026118
Energy: 1.0593243573059932
Energy: 0.9484447366367803
Energy: 1.5870620325335583
Energy: 0.9484447366375698
Energy: 1.5870620325327687
Energy: 0.9484447366372111
Energy: 1.5870620325327687
Energy: 1.0580820163496072
Energy: 1.2498967176206972
Energy: 1.0580820163492481
Energy: 1.2498967176206972
Energy: 1.0580820163484586
Energy: 1.2498967176206972
Energy: 0.991674987008163
Energy: 1.0162653726817035
Energy: 0.9916749870089525
Energy: 1.0162653726931168
Energy: 0.991674987008163
Energy: 1.0162653726891688
Energy: 1.456016415946037
Energy: 0.9880024586573288
Energy: 1.4560164159464677
Energy: 0.9880024586573288
Energy: 1.4560164159464677
Energy: 0.9880024586573288
Energy: 0.969539384290242
Energy: 1.2611288741135043
Energy: 0.9695393842886628
Energy: 1.2611288741146527
Energy: 0.969539384290242
Energy: 1.2611288741135043
Energy: 1.0951622421723162
Energy: 1.0086608417904228
Energy: 1.0951623436385045
Energy: 1.0086608417912124
Energy: 1.0951621832882712
Energy: 1.0086608417899923
Energy: 1.0624755680499687
Energy: 1.0006473361684327
Energy: 1.0624755680507583
Energy: 1.0006473361680739
Energy: 1.0624755680507583
Energy: 1.0006473361688635
Energy: 1.073929943344896
Energy: 1.460619982236023
Energy: 1.0739299433437477
Energy: 1.460619982236023
Energy: 1.0739299433441067
Energy: 1.460619982236023
Energy: 0.9837324863808226
Energy: 1.3138393976940497
Energy: 0.9837324863808226
Energy: 1.3138393976948395
Energy: 0.9837324863808226
Energy: 1.3138393976944807
Energy: 1.016177019797272
Energy: 0.9552219461147736
Energy: 1.0161770197964826
Energy: 0.955221946115922
Energy: 1.0161770197956927
Energy: 0.955221946115922
Energy: 0.9919199626699586
Energy: 1.4834754268207844
Energy: 0.9919199626688101
Energy: 1.4834754268207844
Energy: 0.9919199626699586
Energy: 1.4834754268207844
Energy: 1.4644265515117976
Energy: 0.9999200818924407
Energy: 1.4644265515117976
Energy: 0.9999200818932302
Energy: 1.4644265515117976
Energy: 0.9999200818935893
Energy: 1.0475745915876202
Energy: 1.0647933575464519
Energy: 1.0475745915891992
Energy: 1.064793357546093
Energy: 1.0475745915891992
Energy: 1.0647933575464519
Energy: 1.0472161070845998
Energy: 1.064947919412679
Energy: 1.0472161070841692
Energy: 1.0649479194123201
Energy: 1.0472161070845998
Energy: 1.0649479194123201
Energy: 1.4646166328776276
Energy: 0.9996071134291225
Energy: 1.4646166328771968
Energy: 0.9996071134299123
Energy: 1.464616632876838
Energy: 0.9996071134299123
Energy: 0.9916769571029727
Energy: 1.4834594862522685
Energy: 0.9916769571041211
Energy: 1.4834594862522685
Energy: 0.9916769571049107
Energy: 1.4834594862519093
Energy: 1.0162858053460935
Energy: 0.9550741148587323
Energy: 1.0162858053448731
Energy: 0.9550741148583733
Energy: 1.016285805345663
Energy: 0.9550741148591632
Energy: 0.9839746495138499
Energy: 1.3139860039889188
Energy: 0.9839746495142088
Energy: 1.3139860039889188
Energy: 0.9839746495146395
Energy: 1.3139860039892777
Energy: 1.0738026816935824
Energy: 1.4606894246148496
Energy: 1.0738026816935824
Energy: 1.4606894246152802
Energy: 1.0738026816935824
Energy: 1.4606894246152802
Energy: 1.062534535152175
Energy: 1.000584529307771
Energy: 1.062534535152534
Energy: 1.0005845293081301
Energy: 1.0625345351513855
Energy: 1.0005845293093505
Energy: 1.5820876482289097
Energy: 1.0081651694828084
Energy: 1.5820876644306754
Energy: 1.0081651694828084
Energy: 1.5820876530606978
Energy: 1.0081651694823777
Energy: 0.9698394711523821
Energy: 1.2609752599204285
Energy: 0.9698394711531717
Energy: 1.2609752599196389
Energy: 0.9698394711527412
Energy: 1.2609752599188493
Energy: 1.4559979150314595
Energy: 0.9880069401302607
Energy: 1.4559979150314595
Energy: 0.9880069401302607
Energy: 1.4559979150318183
Energy: 0.9880069401302607
Energy: 0.9911215937339762
Energy: 1.2458228214995626
Energy: 0.9911215937339762
Energy: 1.2458228214995626
Energy: 0.9911215937328277
Energy: 1.2458228214992038
Energy: 1.054818672144202
Energy: 1.2497494887527323
Energy: 1.054818672144561
Energy: 1.249749488751943
Energy: 1.0548186721437716
Energy: 1.249749488752302
Energy: 0.948300561366144
Energy: 1.300907669865969
Energy: 0.9483005613649237
Energy: 1.3009076049086665
Energy: 0.9483005613653543
Energy: 1.3009076633163663

minimum gb energy = 0.920255833200548 eV
minimum distance =  2.30213801820828 Angstroms
sigma value = 67


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

Energy: 0.9764734896795653
Energy: 0.9164789341097709
Energy: 0.9764734896795653
Energy: 0.9164789341097709
Energy: 0.9764734896795653
Energy: 0.9164789341097709
Energy: 0.881306692431128
Energy: 0.8259041091702475
Energy: 0.881306692431128
Energy: 0.8259041091702475
Energy: 0.881306692431128
Energy: 0.8259041091702475
Energy: 0.915825143509014
Energy: 1.281991292206773
Energy: 0.915825143509014
Energy: 1.2819912922094114
Energy: 0.915825143509014
Energy: 1.2819912922094114
Energy: 0.8812587633337586
Energy: 0.8257965233222166
Energy: 0.8812587633311201
Energy: 0.8257965233222166
Energy: 0.8812587633311201
Energy: 0.8257965233248551
Energy: 0.9764734896795653
Energy: 0.9164789341097709
Energy: 0.9764734896795653
Energy: 0.9164789341097709
Energy: 0.9764734896795653
Energy: 0.9164789341071323
Energy: 0.881306692431128
Energy: 0.8259041091728261
Energy: 0.881306692431128
Energy: 0.8259041091728261
Energy: 0.881306692431128
Energy: 0.8259041091728261
Energy: 0.915825143509014
Energy: 1.2819912922094114
Energy: 0.915825143509014
Energy: 1.2819912922094114
Energy: 0.915825143509014
Energy: 1.2819912922094114

minimum gb energy = 0.8257965233222166 eV
minimum distance =  2.35738704551144 Angstroms
sigma value = 3


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

Energy: 1.5012710002654792
Energy: 1.0912743234195998
Energy: 1.5012710002654792
Energy: 1.0912743234231903
Energy: 1.5012710002654792
Energy: 1.0912743234195998
Energy: 1.1744080275971895
Energy: 1.0725842024445995
Energy: 1.174408027615143
Energy: 1.0725842024445995
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Energy: 1.4544548661581733
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Energy: 1.4141508943779086
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Energy: 1.4790396023591597
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Energy: 1.4790396023591597
Energy: 1.1702714871134847
Energy: 1.4790396023591597
Energy: 1.2429068646720856
Energy: 1.2085077157403303
Energy: 1.2429068646720856
Energy: 1.2085077157403303
Energy: 1.2429068646720856
Energy: 1.2085077157403303
Energy: 1.5226662356199776
Energy: 1.1747952235781036
Energy: 1.5226662355912524
Energy: 1.1747952235781036
Energy: 1.5226662356415215
Energy: 1.1747952235781036
Energy: 1.0687763851617547
Energy: 1.4809512647460652
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Energy: 1.4809512647460652
Energy: 1.0687763851617547
Energy: 1.4809512647460652
Energy: 1.2621147538547273
Energy: 1.3384501238600703
Energy: 1.2621147538547273
Energy: 1.3384501238600703
Energy: 1.2621147538547273
Energy: 1.3384501238600703
Energy: 1.4477084355251661
Energy: 1.134852971820126
Energy: 1.4477084355251661
Energy: 1.134852971820126
Energy: 1.4477084355251661
Energy: 1.134852971820126
Energy: 1.50211644896839
Energy: 1.163408602207484
Energy: 1.502116448695631
Energy: 1.163408602207484
Energy: 1.5021164491981263
Energy: 1.163408602207484
Energy: 1.1397363925668018
Energy: 1.3949164145997697
Energy: 1.1397363925668018
Energy: 1.3949164145997697
Energy: 1.1397363925668018
Energy: 1.3949164145997697
Energy: 1.1339278716445638
Energy: 1.2436768589172533
Energy: 1.1339278716445638
Energy: 1.2436768589172533
Energy: 1.1339278716445638
Energy: 1.243676858920844
Energy: 1.2442452103461306
Energy: 1.2152374808977475
Energy: 1.2442452103461306
Energy: 1.2152374808941568
Energy: 1.2442452103461306
Energy: 1.2152374808977475
Energy: 1.331026664846258
Energy: 1.2275929876577585
Energy: 1.3310266646129312
Energy: 1.2275929876577585
Energy: 1.3310266645088678
Energy: 1.2275929876577585
Energy: 1.1965724171203465
Energy: 1.261578034092184
Energy: 1.1965724171203465
Energy: 1.2615780340885934
Energy: 1.1965724171203465
Energy: 1.2615780340957092

minimum gb energy = 1.0598324624674196 eV
minimum distance =  2.26448272477624 Angstroms
sigma value = 81


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

Energy: 1.1768815051598378
Energy: 1.1399262059904227
Energy: 1.1768815051603307
Energy: 1.1399262059904227
Energy: 1.1768815051603307
Energy: 1.13992620598993
Energy: 1.046349991141283
Energy: 1.2255185434298974
Energy: 1.04634999114079
Energy: 1.2255185434294047
Energy: 1.0463499911417757
Energy: 1.2255185434298974
Energy: 1.3696518176835393
Energy: 1.0395950481156633
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Energy: 1.0395950481151703
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Energy: 1.039595048113692
Energy: 1.1217315053859702
Energy: 1.2054395411521708
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Energy: 1.0414670622966782
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Energy: 1.0414670622961855
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Energy: 1.0912744859301726
Energy: 1.5310767104792151
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Energy: 1.115969088790875
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Energy: 1.0414783155298546
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Energy: 1.1771229874162512
Energy: 1.1439029575553201
Energy: 1.1771229874157585
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Energy: 1.374042997624247
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Energy: 1.26343506201732
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Energy: 1.2634350620163344
Energy: 1.2053818571563655
Energy: 1.2634350620158417
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Energy: 1.109669306780357
Energy: 1.0441664164284963
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Energy: 1.0395049282358846
Energy: 1.0262095979739347
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Energy: 1.0395825681555062
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Energy: 1.039582568155999
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Energy: 1.0439529677901545
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Energy: 1.0439529677881834
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Energy: 1.2635434253348996
Energy: 1.2057412741942204
Energy: 1.2635434253353923
Energy: 1.205741274194713
Energy: 1.2635434253353923
Energy: 1.0408004896234047
Energy: 1.3713397466404265
Energy: 1.0408004896238976
Energy: 1.3713397466399335
Energy: 1.0408004896234047
Energy: 1.3713397466399335
Energy: 1.016438020551717
Energy: 1.1218805251298267
Energy: 1.0164380205512242
Energy: 1.1218805251298267
Energy: 1.0164380205512242
Energy: 1.1218805251308122
Energy: 1.144089148077426
Energy: 1.1774201682736183
Energy: 1.1440891480779187
Energy: 1.1774201682736183
Energy: 1.1440891480779187
Energy: 1.1774201682741112
Energy: 1.1158308666295529
Energy: 1.041388811271877
Energy: 1.1158308666295529
Energy: 1.041388811271877
Energy: 1.1158308666295529
Energy: 1.041388811271877
Energy: 1.5206978169366008
Energy: 1.0890303355084459
Energy: 1.5206978169375862
Energy: 1.0890303355099242
Energy: 1.5206978169361078
Energy: 1.0890303355094315
Energy: 1.2090639608208398
Energy: 1.4992783566241767
Energy: 1.209063960820347
Energy: 1.4992783566093921
Energy: 1.209063960820347
Energy: 1.4992783566079138
Energy: 1.0424891935904352
Energy: 1.1100456631097029
Energy: 1.0424891935894496
Energy: 1.1100456631101958
Energy: 1.0424891935894496
Energy: 1.1100456631097029
Energy: 1.0394944747395585
Energy: 1.2007280113499286
Energy: 1.0394944747395585
Energy: 1.2007280113504213
Energy: 1.0394944747395585
Energy: 1.2007280113499286
Energy: 1.042275379353343
Energy: 1.0228854099198579
Energy: 1.042275379353836
Energy: 1.0228854099193652
Energy: 1.042275379353836
Energy: 1.0228854099198579
Energy: 1.2201113484948252
Energy: 1.600900854742308
Energy: 1.2201113484943322
Energy: 1.600900854739844
Energy: 1.2201113484943322
Energy: 1.6009008547413224
Energy: 1.338497275822439
Energy: 1.3404371801498027
Energy: 1.3384972758219462
Energy: 1.3404371801498027
Energy: 1.3384972758219462
Energy: 1.3404371801498027
Energy: 1.1160454461229639
Energy: 1.042977805688059
Energy: 1.1160454461234568
Energy: 1.042977805688059
Energy: 1.1160454461234568
Energy: 1.0429778056870733
Energy: 1.0257675742663757
Energy: 1.039405501272923
Energy: 1.0257675742663757
Energy: 1.039405501273416
Energy: 1.0257675742668686
Energy: 1.0394055012739087

minimum gb energy = 1.0163281153341828 eV
minimum distance =  2.36940391355061 Angstroms
sigma value = 43


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

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Energy: 1.1360095415758544
Energy: 1.4745031221387996
Energy: 1.1360095415758544
Energy: 1.4745031221394052
Energy: 1.1360095415758544
Energy: 1.3918677840753928
Energy: 1.075099439193065
Energy: 1.3918677840759983
Energy: 1.0750994391942759
Energy: 1.3918677840766036
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Energy: 1.4175712346790534
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Energy: 1.4175712346784481
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Energy: 1.3471773559175997
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Energy: 1.3040207201738552
Energy: 1.2070724971467728
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Energy: 1.2070724971461675
Energy: 1.304020720175066
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Energy: 1.3569304085088958
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Energy: 1.3498342757200539
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Energy: 1.281807841317606
Energy: 1.1885649333635957
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Energy: 1.1885649333629904
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Energy: 1.3551449824696293
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Energy: 1.0556006044953379
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Energy: 1.1936469269937682
Energy: 1.2571803988562023
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Energy: 1.2571803988555972
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Energy: 1.2944784504750875
Energy: 1.196782476023281
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Energy: 1.196782476023281
Energy: 1.2944784504750875
Energy: 1.196782476023281
Energy: 1.1995112154029905
Energy: 1.078812204009132
Energy: 1.199511215402385
Energy: 1.0788122040085268
Energy: 1.1995112154029905
Energy: 1.078812204009132
Energy: 1.3589568057067738
Energy: 1.249563188963075
Energy: 1.3589568057067738
Energy: 1.249563188963075
Energy: 1.3589568057067738
Energy: 1.2495631889624699
Energy: 1.2783771553701848
Energy: 1.2458128309125176
Energy: 1.2783771553689742
Energy: 1.2458128309125176
Energy: 1.2783771553695797
Energy: 1.2458128309125176
Energy: 1.199948833201188
Energy: 1.206416846791411
Energy: 1.199948833201188
Energy: 1.2064168467902003
Energy: 1.199948833201188
Energy: 1.2064168467908056
Energy: 1.2935696524509925
Energy: 1.2350309147942407
Energy: 1.2935696524509925
Energy: 1.2350309147942407
Energy: 1.2935696524509925
Energy: 1.2350309147942407
Energy: 1.2845226912166323
Energy: 1.1870073016302776
Energy: 1.2845226912166323
Energy: 1.1870073016302776
Energy: 1.2845226912160268
Energy: 1.1870073016302776
Energy: 1.060679363491331
Energy: 1.3148487282451558
Energy: 1.0606793634870937
Energy: 1.3148487282451558
Energy: 1.0606793634907254
Energy: 1.3148487282445502
Energy: 1.209708941605886
Energy: 1.425022795083713
Energy: 1.209708941605886
Energy: 1.425022795083713
Energy: 1.209708941605886
Energy: 1.425022795083713
Energy: 1.2366737991074994
Energy: 1.2581566710902685
Energy: 1.2366737991081047
Energy: 1.2581566710902685
Energy: 1.2366737991081047
Energy: 1.2581566710902685
Energy: 1.370465471956501
Energy: 1.2038669379737794
Energy: 1.3704654719619491
Energy: 1.2038669379743847
Energy: 1.370465471971029
Energy: 1.2038669379737794
Energy: 1.2940717265237822
Energy: 1.3313736691728173
Energy: 1.2940717265237822
Energy: 1.3313736691722118
Energy: 1.2940717265237822
Energy: 1.3313736691728173
Energy: 1.3299047559539703
Energy: 1.1587713071260557
Energy: 1.3299047559539703
Energy: 1.1587713071260557
Energy: 1.3299047559539703
Energy: 1.1587713071260557
Energy: 1.2372630695077245
Energy: 1.19195968859631
Energy: 1.237263069508935
Energy: 1.19195968859631
Energy: 1.2372630695077245
Energy: 1.19195968859631
Energy: 1.1854536954998285
Energy: 1.303382487646985
Energy: 1.1854536954913537
Energy: 1.303382487646985
Energy: 1.185453695501039
Energy: 1.3033824876475906
Energy: 1.2304580628690485
Energy: 1.1431573316003756
Energy: 1.2304580628690485
Energy: 1.1431573316009807
Energy: 1.2304580628690485
Energy: 1.1431573316003756

minimum gb energy = 1.0556006044953379 eV
minimum distance =  2.34361905069431 Angstroms
sigma value = 57


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

Energy: 1.245839830823231
Energy: 1.0785344542032465
Energy: 1.245839830823231
Energy: 1.0785344542032465
Energy: 1.245839830823231
Energy: 1.0785344542032465
Energy: 1.1600389074816606
Energy: 1.2102509867894373
Energy: 1.1600389074816606
Energy: 1.2102509867886535
Energy: 1.1600389074808768
Energy: 1.2102509867894373
Energy: 1.2305920643073696
Energy: 1.2945308966623734
Energy: 1.2305920643065857
Energy: 1.2945308966631572
Energy: 1.2305920643065857
Energy: 1.2945308966631572
Energy: 1.5291418020477128
Energy: 1.2237707125171233
Energy: 1.529141802046929
Energy: 1.2237707125155557
Energy: 1.5291418020477128
Energy: 1.2237707125179071
Energy: 1.5207412253486245
Energy: 1.2199222888089056
Energy: 1.5207412253486245
Energy: 1.2199222888089056
Energy: 1.5207412253486245
Energy: 1.2199222888081216
Energy: 1.231189575452084
Energy: 1.3217765030412951
Energy: 1.231189575452084
Energy: 1.3217765030412951
Energy: 1.231189575452084
Energy: 1.3217765030412951
Energy: 1.2950722215757127
Energy: 1.2572311106797034
Energy: 1.295072221574929
Energy: 1.2572311106797034
Energy: 1.2950722215757127
Energy: 1.2572311106789198
Energy: 1.2463176766640838
Energy: 1.0786449304301131
Energy: 1.2463176766640838
Energy: 1.0786449304301131
Energy: 1.2463176766633
Energy: 1.0786449304301131
Energy: 1.3581708754557746
Energy: 1.1300701230069006
Energy: 1.3581708754557746
Energy: 1.1300701230076844
Energy: 1.3581708754557746
Energy: 1.1300701230076844
Energy: 1.0049522877305663
Energy: 1.165636007742464
Energy: 1.00495228773135
Energy: 1.165636007742464
Energy: 1.00495228773135
Energy: 1.165636007742464
Energy: 1.2077208968839455
Energy: 1.4444465325334406
Energy: 1.2077208968839455
Energy: 1.4444465325342246
Energy: 1.2077208968847293
Energy: 1.4444465325342246
Energy: 1.3730948819057933
Energy: 1.207357875640212
Energy: 1.3730948819050095
Energy: 1.2073578756409957
Energy: 1.3730948819057933
Energy: 1.2073578756409957
Energy: 1.160754810864614
Energy: 1.1312586626572583
Energy: 1.160754810864614
Energy: 1.1312586626572583
Energy: 1.160754810864614
Energy: 1.1312586626572583
Energy: 1.2959416222091966
Energy: 1.082766075093934
Energy: 1.2959416222084126
Energy: 1.0827660750931503
Energy: 1.2959416222091966
Energy: 1.0827660750931503
Energy: 1.2937698854711204
Energy: 1.0791312889587827
Energy: 1.2937698854711204
Energy: 1.0791312889587827
Energy: 1.2937698854711204
Energy: 1.0791312889579994
Energy: 1.1703694997600178
Energy: 1.1302862689003372
Energy: 1.1703694997615857
Energy: 1.1302862689003372
Energy: 1.1703694997592342
Energy: 1.1302862688995534
Energy: 1.0049822491256564
Energy: 1.1604719417279268
Energy: 1.0049822491264402
Energy: 1.1604719417279268
Energy: 1.0049822491256564
Energy: 1.1604719417279268
Energy: 1.2054763274571862
Energy: 1.3582085980784249
Energy: 1.2054763274571862
Energy: 1.3582085980784249
Energy: 1.2054763274571862
Energy: 1.3582085980792087
Energy: 1.0051120562515916
Energy: 1.160077678664124
Energy: 1.0051120562515916
Energy: 1.1600776786649079
Energy: 1.0051120562515916
Energy: 1.160077678664124
Energy: 1.1701701233250472
Energy: 1.1301899004605651
Energy: 1.1701701233250472
Energy: 1.1301899004605651
Energy: 1.1701701233242636
Energy: 1.1301899004605651
Energy: 1.2937827544723508
Energy: 1.0788993785250713
Energy: 1.2937827544723508
Energy: 1.0788993785242875
Energy: 1.2937827544723508
Energy: 1.0788993785250713
Energy: 1.2960574516352277
Energy: 1.2945741438108753
Energy: 1.2960574516360113
Energy: 1.2945741438108753
Energy: 1.2960574516344439
Energy: 1.2945741438108753
Energy: 1.1608311257571742
Energy: 1.1311139777896766
Energy: 1.1608311257571742
Energy: 1.1311139777904604
Energy: 1.1608311257571742
Energy: 1.1311139777904604
Energy: 1.3722229370161725
Energy: 1.2069320158477999
Energy: 1.3722229370161725
Energy: 1.2069320158477999
Energy: 1.3722229370161725
Energy: 1.2069320158477999

minimum gb energy = 1.0049522877305663 eV
minimum distance =  2.27645795878958 Angstroms
sigma value = 17


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

Energy: 1.1977313448683167
Energy: 1.076674531410669
Energy: 1.1977313448683167
Energy: 1.076674531410669
Energy: 1.1977313448683167
Energy: 1.076674531410669
Energy: 1.1851185135384343
Energy: 1.266042846328187
Energy: 1.1851185135384343
Energy: 1.266042846328187
Energy: 1.1851185135384343
Energy: 1.266042846328187
Energy: 1.1703588892666044
Energy: 1.177142895914578
Energy: 1.1703588892666044
Energy: 1.177142895914578
Energy: 1.1703588892666044
Energy: 1.177142895914578
Energy: 1.095615583551492
Energy: 1.3648008853811122
Energy: 1.095615583551492
Energy: 1.3648008853811122
Energy: 1.095615583551492
Energy: 1.3648008853788953
Energy: 1.3050627954586194
Energy: 1.3111869503935099
Energy: 1.3050627954586194
Energy: 1.3111869503935099
Energy: 1.3050627954586194
Energy: 1.3111869503935099
Energy: 1.2992187047784935
Energy: 1.1765272559307955
Energy: 1.2992187047784935
Energy: 1.176527255929687
Energy: 1.299218704779602
Energy: 1.1765272559307955
Energy: 1.1160481391309895
Energy: 1.2148609497203349
Energy: 1.1160481391320982
Energy: 1.2148609497203349
Energy: 1.1160481391309895
Energy: 1.2148609497192264
Energy: 1.0959893604773923
Energy: 1.3014851366448899
Energy: 1.0959893604773923
Energy: 1.301485136645998
Energy: 1.0959893604773923
Energy: 1.301485136645998
Energy: 1.0923024450821175
Energy: 1.2238788585329865
Energy: 1.0923024450821175
Energy: 1.2238788585329865
Energy: 1.0923024450821175
Energy: 1.223878858531878
Energy: 1.2659468863129604
Energy: 1.2543460227103982
Energy: 1.2659468863129604
Energy: 1.2543460227103982
Energy: 1.2659468863129604
Energy: 1.2543460227103982
Energy: 1.0716127475397756
Energy: 1.1693111235774474
Energy: 1.071612747540884
Energy: 1.1693111235774474
Energy: 1.071612747540884
Energy: 1.1693111235774474
Energy: 1.127241119669785
Energy: 1.34546286759587
Energy: 1.1272411196686762
Energy: 1.34546286759587
Energy: 1.1272411196686762
Energy: 1.34546286759587
Energy: 0.9565666319068167
Energy: 1.1758088349719475
Energy: 0.9565666319057082
Energy: 1.1758088349697304
Energy: 0.9565666319057082
Energy: 1.175808834970839
Energy: 1.0876910013384098
Energy: 1.1230781532845258
Energy: 1.0876910013384098
Energy: 1.123078153285634
Energy: 1.0876910013384098
Energy: 1.1230781532845258
Energy: 1.2845728033205195
Energy: 1.315818394626973
Energy: 1.2845728033205195
Energy: 1.315818394626973
Energy: 1.2845728033205195
Energy: 1.315818394626973
Energy: 1.07255603805661
Energy: 1.3489101365531926
Energy: 1.07255603805661
Energy: 1.3489101365520844
Energy: 1.0725560380577184
Energy: 1.3489101365520844
Energy: 1.0817015015827829
Energy: 1.1226053329726282
Energy: 1.0817015015827829
Energy: 1.1226053329726282
Energy: 1.0817015015827829
Energy: 1.1226053329726282

minimum gb energy = 0.9565666319057082 eV
minimum distance =  2.31190361710705 Angstroms
sigma value = 17


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

Energy: 1.4251793359869946
Energy: 1.0132945469915913
Energy: 1.3925143290826076
Energy: 1.0132945469950154
Energy: 1.4251793359878508
Energy: 1.0132945469950154
Energy: 1.1924996424200756
Energy: 1.0685487393841782
Energy: 1.1538562497552722
Energy: 1.0685487393841782
Energy: 1.1924996424217875
Energy: 1.0685487393854625
Energy: 1.1324293808546013
Energy: 1.0146620807987519
Energy: 1.1517425468062161
Energy: 1.014662080800892
Energy: 1.1324293808563135
Energy: 1.014662080800892
Energy: 1.2712872090336131
Energy: 1.0667831939692087
Energy: 1.2712556446281962
Energy: 1.0667831939679249
Energy: 1.2712872090323288
Energy: 1.0667831939679249
Energy: 1.3654881904115226
Energy: 1.1303205461897154
Energy: 1.3654881904102383
Energy: 1.1303205461901435
Energy: 1.3654881904093823
Energy: 1.1303205461901435
Energy: 1.0705218440685187
Energy: 1.0220502789861947
Energy: 1.0696795009589082
Energy: 1.0230375713755422
Energy: 1.0705218440685187
Energy: 1.0220502789874788
Energy: 1.1280531897201627
Energy: 1.203418209289233
Energy: 1.1280531897210189
Energy: 1.2034182092888048
Energy: 1.1280531897193065
Energy: 1.203418209288377
Energy: 1.2823794167495497
Energy: 1.22096584309442
Energy: 1.2823794167508338
Energy: 1.2209658430914627
Energy: 1.2823794167495497
Energy: 1.2209658430910344
Energy: 1.1293743770264
Energy: 1.1662466477901137
Energy: 1.1293743770264
Energy: 1.166246647791398
Energy: 1.1293743770251157
Energy: 1.166246647791398
Energy: 1.1422381781172397
Energy: 0.9217640605233448
Energy: 1.1422381781163837
Energy: 0.9217640605233448
Energy: 1.1422381781168118
Energy: 0.9217640605237728
Energy: 1.158010069356467
Energy: 1.190838214295922
Energy: 1.158010069355611
Energy: 1.19083821429635
Energy: 1.1580100693530428
Energy: 1.19083821429635
Energy: 1.0729618023258924
Energy: 1.3135473785081022
Energy: 1.0729618023276049
Energy: 1.3135473785093863
Energy: 1.0729618023276049
Energy: 1.3135473785102423
Energy: 1.2002363757711503
Energy: 1.1868406457871674
Energy: 1.200236375768582
Energy: 1.1868406457871674
Energy: 1.200236375768582
Energy: 1.1868406457871674
Energy: 0.9849978649599943
Energy: 1.125904892687017
Energy: 0.9849978649595663
Energy: 1.125904892687445
Energy: 0.9849978649617065
Energy: 1.125904892687017
Energy: 1.240865124581571
Energy: 1.3289622054565828
Energy: 1.2408675075048798
Energy: 1.3289622054552988
Energy: 1.2408651245832831
Energy: 1.3289622054552988
Energy: 1.1348326543654674
Energy: 1.1521598014352257
Energy: 1.1349495050297955
Energy: 1.1521598015610286
Energy: 1.1348326543658955
Energy: 1.1521598014557712
Energy: 0.9985656773428704
Energy: 1.0822637648001614
Energy: 0.9985656773432986
Energy: 1.0822637647993052
Energy: 0.9985656773450108
Energy: 1.0822637647993052
Energy: 1.3593005400231961
Energy: 1.255880462053936
Energy: 1.3593005424357893
Energy: 1.255880462051796
Energy: 1.359300542743857
Energy: 1.255880462051796
Energy: 1.2006766603251988
Energy: 1.3759537015933014
Energy: 1.2006766603243428
Energy: 1.3759537015945855
Energy: 1.2006766603243428
Energy: 1.3759537015945855
Energy: 0.9975447344689957
Energy: 1.0850570604671947
Energy: 0.9975447344689957
Energy: 1.0016256335954792
Energy: 0.9975447344681394
Energy: 1.0016256335954792
Energy: 1.1051501711190415
Energy: 1.3552138118538062
Energy: 1.1051501711181855
Energy: 1.3552138118503818
Energy: 1.1051501711173293
Energy: 1.3552138118508101
Energy: 1.1963726804276409
Energy: 1.2560619330002014
Energy: 1.1963726804246448
Energy: 1.2560619330010576
Energy: 1.1963726804242167
Energy: 1.2560619330006295
Energy: 1.0453889988513156
Energy: 1.0293085171121577
Energy: 1.0453889988513156
Energy: 1.0293085171125858
Energy: 1.0453889988500313
Energy: 1.0293085171125858
Energy: 1.1456348976032469
Energy: 1.2659497760887182
Energy: 1.1456348976015351
Energy: 1.265949776087473
Energy: 1.145634897602391
Energy: 1.265949776087473
Energy: 1.2073466542935356
Energy: 1.3056296922320447
Energy: 1.2073466542913953
Energy: 1.3056296922320447
Energy: 1.2073466542926794
Energy: 1.3056296922320447
Energy: 1.0217295918347318
Energy: 1.1230276384461741
Energy: 0.9852159268143744
Energy: 1.1230276384478863
Energy: 1.021729591833448
Energy: 1.1230276384478863
Energy: 1.2122773690520199
Energy: 1.176105389656127
Energy: 1.179972480119903
Energy: 1.1761053896591234
Energy: 1.2122773690515918
Energy: 1.1761053896591234
Energy: 1.1413044018717315
Energy: 1.3031437034783717
Energy: 1.1380532105590249
Energy: 1.3031437034728075
Energy: 1.1413044018717315
Energy: 1.3031437034736633
Energy: 1.279833179160882
Energy: 1.2369564554824077
Energy: 1.2800765115053678
Energy: 1.2369564554790224
Energy: 1.2798331791587414
Energy: 1.2369564554794505
Energy: 1.1276565939526881
Energy: 0.9198642278583751
Energy: 1.1276565939492638
Energy: 0.9198642278579471
Energy: 1.127656593950976
Energy: 0.9198642278575192
Energy: 1.1968172453321837
Energy: 1.1721603084036598
Energy: 1.1968172453317558
Energy: 1.172160308404088
Energy: 1.1968172453313277
Energy: 1.172160308404516
Energy: 1.2352943488511101
Energy: 1.2685756366084637
Energy: 1.2352943488515382
Energy: 1.2685756366101757
Energy: 1.235294348850682
Energy: 1.2685756366101757
Energy: 1.1253329123114602
Energy: 1.1299584469591797
Energy: 1.1253329123123161
Energy: 1.1299584469604638
Energy: 1.1253329123127445
Energy: 1.1299584469446653
Energy: 1.0385890248433327
Energy: 0.9993267114090532
Energy: 1.0385890248429046
Energy: 0.9993267114081973
Energy: 1.0385890248416205
Energy: 0.9993267114081973
Energy: 1.3457064029959833
Energy: 1.1445173602921952
Energy: 1.3457064029972674
Energy: 1.1445173602943353
Energy: 1.3457064029964112
Energy: 1.1445173602947631
Energy: 1.2803265117404294
Energy: 1.1397206616486624
Energy: 1.2803265117404294
Energy: 1.1397206616482343
Energy: 1.280326511737433
Energy: 1.1397206616482343
Energy: 1.0791560824084596
Energy: 1.0419611266024802
Energy: 1.0791560824118838
Energy: 1.041961126601196
Energy: 1.0791560824101718
Energy: 1.041961126601196
Energy: 1.1786252923513054
Energy: 0.975533851589562
Energy: 1.1786252923513054
Energy: 0.9755338515882778
Energy: 1.1786252923495935
Energy: 0.9755338515882778
Energy: 1.3925143290830357
Energy: 1.0132945469907353
Energy: 1.3925143290830357
Energy: 1.0132945469941597
Energy: 1.3925143290826076
Energy: 1.0132945469941597
Energy: 1.1538562497539884
Energy: 1.1747052241825349
Energy: 1.1538562497565565
Energy: 1.174705224182963
Energy: 1.1538562497569844
Energy: 1.1747052241782547
Energy: 1.1483069971935822
Energy: 1.020337896226937
Energy: 1.1483071063694765
Energy: 1.020337896226509
Energy: 1.1483069971935822
Energy: 1.020337896226081
Energy: 1.2712672042160402
Energy: 1.1139439333482695
Energy: 1.2712707084514983
Energy: 1.1139439333486976
Energy: 1.2712672042177524
Energy: 1.1139439333486976
Energy: 1.3654881904128067
Energy: 1.1370339516719619
Energy: 1.3654881904115226
Energy: 1.1370339516698218
Energy: 1.3654881904102383
Energy: 1.1370339516706778

minimum gb energy = 0.9198642278575192 eV
minimum distance =  2.26678010245093 Angstroms
sigma value = 57


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

Energy: 1.335533529011885
Energy: 0.9090776653557062
Energy: 1.335533529011885
Energy: 0.9090776653487366
Energy: 1.335533529011885
Energy: 0.9090776653557062
Energy: 1.0440694396141619
Energy: 0.8820112002815761
Energy: 1.0440694396155557
Energy: 0.8820112002794853
Energy: 1.0440694396134649
Energy: 0.882011200283667
Energy: 0.9889557785357465
Energy: 1.0505270441613004
Energy: 0.9889557785350496
Energy: 1.0505270441613004
Energy: 0.9889557785350496
Energy: 1.0505270441613004
Energy: 1.1970856983135612
Energy: 0.9583372339228096
Energy: 1.1970856983128642
Energy: 0.9583372339235066
Energy: 1.1970856983128642
Energy: 0.9583372339228096
Energy: 1.220011190330406
Energy: 0.8417159030502308
Energy: 1.220011190331103
Energy: 0.8417159030523216
Energy: 1.220011190330406
Energy: 0.8417159030516248
Energy: 0.9545905243612779
Energy: 0.8890805508878037
Energy: 0.954590524359884
Energy: 0.8890805508878037
Energy: 0.9545905243605811
Energy: 0.8890805508885008
Energy: 1.1637504012369833
Energy: 1.0617869805934117
Energy: 1.163750401238377
Energy: 1.061786980592715
Energy: 1.16375040123768
Energy: 1.0617869805934117
Energy: 1.1343843046322235
Energy: 1.1417421938857557
Energy: 1.1343843046322235
Energy: 1.1417421938857557
Energy: 1.1343843046322235
Energy: 1.1417421938864527
Energy: 1.0296426785774009
Energy: 1.0113436689357385
Energy: 1.0296426785774009
Energy: 1.0113436689364355
Energy: 1.0296426785780979
Energy: 1.0113436689364355
Energy: 1.039748899894172
Energy: 0.9087762387607612
Energy: 1.0397488998962627
Energy: 0.9087762387607612
Energy: 1.039748899894869
Energy: 0.9087762387614583
Energy: 1.163734507500066
Energy: 1.140331362611339
Energy: 1.163734507500066
Energy: 1.1403313626106422
Energy: 1.163734507500066
Energy: 1.140331362611339
Energy: 0.9224194747912221
Energy: 1.1630666377215724
Energy: 0.922419474791919
Energy: 1.1630666377208754
Energy: 0.9224194747912221
Energy: 1.1630666377215724
Energy: 1.040596110387607
Energy: 1.0130211173396222
Energy: 1.0405961103896977
Energy: 1.0130211173396222
Energy: 1.040596110386213
Energy: 1.0130211173396222
Energy: 1.1476407124216155
Energy: 1.2791268751055525
Energy: 1.1476407124230092
Energy: 1.2791268751062497
Energy: 1.1476407124223122
Energy: 1.2791268751055525
Energy: 0.9706326215389539
Energy: 1.2278731245200218
Energy: 0.970632621536863
Energy: 1.2278731245207188
Energy: 0.9706326215375599
Energy: 1.2278731245200218
Energy: 1.080484732574215
Energy: 1.0517891253348863
Energy: 1.0804847325756093
Energy: 1.0517891253341893
Energy: 1.080484732576306
Energy: 1.0517891253355836
Energy: 1.2172703002394796
Energy: 1.0318934733826524
Energy: 1.2172703002387826
Energy: 1.0318934733833494
Energy: 1.2172703002387826
Energy: 1.0318934733826524
Energy: 1.0875029046549616
Energy: 1.2276839400157484
Energy: 1.0875029046556588
Energy: 1.2276839400150517
Energy: 1.0875029046549616
Energy: 1.2276839400164454
Energy: 1.0481942106637323
Energy: 1.207483861907794
Energy: 1.0481942106637323
Energy: 1.207483861907794
Energy: 1.048194210664429
Energy: 1.207483861907794
Energy: 1.010428961265703
Energy: 0.9591107356574124
Energy: 1.0104289612636121
Energy: 0.9591107356574124
Energy: 1.010428961265006
Energy: 0.9591107356574124
Energy: 1.0636799609862315
Energy: 1.1842608234559067
Energy: 1.0636799609862315
Energy: 1.1842608234559067
Energy: 1.0636799609862315
Energy: 1.1842608234559067
Energy: 0.8554270337415925
Energy: 1.256525232231639
Energy: 0.8554270337422893
Energy: 1.256525232231639
Energy: 0.8554270337367138
Energy: 1.2565252322309421
Energy: 0.9278758238794085
Energy: 0.9198115444045869
Energy: 0.9278758238794085
Energy: 0.9198115444045869
Energy: 0.9278758238787114
Energy: 0.9198115444045869
Energy: 0.9424335101576342
Energy: 1.282508672930627
Energy: 0.9424335101562403
Energy: 1.282508672930627
Energy: 0.9424335101562403
Energy: 1.2825086729313238
Energy: 1.008977019620718
Energy: 1.161441267723751
Energy: 1.0089770196228085
Energy: 1.161441267723054
Energy: 1.008977019620718
Energy: 1.161441267723054
Energy: 1.038760504067462
Energy: 0.9196766476725355
Energy: 1.038760504067462
Energy: 0.9196766476718387
Energy: 1.038760504068159
Energy: 0.9196766476718387
Energy: 0.9845332328470537
Energy: 1.0916894836822577
Energy: 0.9845332328470537
Energy: 1.0916894823802445
Energy: 0.9845332328463566
Energy: 1.0916894836878333

minimum gb energy = 0.8417159030502308 eV
minimum distance =  2.28351936206899 Angstroms
sigma value = 43


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

Energy: 1.264141858561991
Energy: 1.0227279171241863
Energy: 1.264141858561991
Energy: 1.0227279171236787
Energy: 1.264141858561991
Energy: 1.0227279171236787
Energy: 0.921179686644676
Energy: 0.9537869733340644
Energy: 0.9211796866441683
Energy: 0.9537869733345721
Energy: 0.9211796866436603
Energy: 0.9537869733345721
Energy: 0.8947014326710616
Energy: 0.9540970483927662
Energy: 0.8947014326710616
Energy: 0.9540970483927662
Energy: 0.8947014326710616
Energy: 0.9540970483922585
Energy: 1.0664477848313079
Energy: 0.8573092738642137
Energy: 1.0664477848328313
Energy: 0.857309273863706
Energy: 1.0664477848323235
Energy: 0.857309273863706
Energy: 1.042800450707094
Energy: 1.0245210378332479
Energy: 1.0428004507081097
Energy: 1.0245210378332479
Energy: 1.0428004507081097
Energy: 1.0245210378332479
Energy: 0.8341295110337598
Energy: 0.9014449756386651
Energy: 0.8341295110342678
Energy: 0.9014449756366341
Energy: 0.8341295110342678
Energy: 0.9014449756371418
Energy: 1.0520066171798457
Energy: 0.9011740872098819
Energy: 1.052006617179338
Energy: 0.9011740872103896
Energy: 1.0520066171798457
Energy: 0.9011740872108974
Energy: 1.077053514088498
Energy: 1.0043240008858123
Energy: 1.0770535140890058
Energy: 1.0043240008863201
Energy: 1.077053514088498
Energy: 1.0043240008858123
Energy: 0.7958159263238785
Energy: 0.8911701071566975
Energy: 0.7958159263233706
Energy: 0.8911701071566975
Energy: 0.7958159263233706
Energy: 0.8911701071572055
Energy: 0.9073299581288938
Energy: 0.8714131087631024
Energy: 0.9073299581294015
Energy: 0.8714131087631024
Energy: 0.9073299581299094
Energy: 0.8714131087636102
Energy: 0.9936346039029836
Energy: 0.9597855491858323
Energy: 0.9936346039015065
Energy: 0.9597855491853245
Energy: 0.9936346039020142
Energy: 0.9597855491858323
Energy: 0.9325279386307603
Energy: 0.8900592286045678
Energy: 0.932527938631268
Energy: 0.8900592286050755
Energy: 0.932527938631268
Energy: 0.8900592286045678
Energy: 0.9146852741158493
Energy: 0.7542638870670335
Energy: 0.9146852741158493
Energy: 0.7542638870670335
Energy: 0.9146852741153414
Energy: 0.7542638870670335
Energy: 1.0175032164691118
Energy: 1.0030952619448654
Energy: 1.017503216468604
Energy: 1.003095261945373
Energy: 1.0175032164691118
Energy: 1.003095261945373
Energy: 0.8643803545293032
Energy: 0.8898527106486017
Energy: 0.8643803545293032
Energy: 0.8898527106486017
Energy: 0.864380354529811
Energy: 0.8898527106491095
Energy: 0.9397426573002806
Energy: 0.8281045247538696
Energy: 0.9397426573007883
Energy: 0.8281045247533619
Energy: 0.9397426573002806
Energy: 0.8281045247533619
Energy: 1.0039873867713693
Energy: 0.9999499977548315
Energy: 1.0039873867708615
Energy: 0.9999499977543238
Energy: 1.0039873867708615
Energy: 0.9999499977543238
Energy: 0.8044435199649215
Energy: 1.07509164813969
Energy: 0.8044435199649215
Energy: 1.0750916481401975
Energy: 0.8044435199649215
Energy: 1.075091648139182
Energy: 0.9091623464180228
Energy: 0.8827719706128628
Energy: 0.9091623464195463
Energy: 0.8827719706128628
Energy: 0.9091623464180228
Energy: 0.8827719706133709
Energy: 1.0659471161818412
Energy: 1.0102237750313374
Energy: 1.0659471161818412
Energy: 1.0102237750318452
Energy: 1.0659471161818412
Energy: 1.0102237750313374
Energy: 0.8768267943125747
Energy: 1.1420517828424
Energy: 0.8768267943120668
Energy: 1.1420517828429082
Energy: 0.8768267943130824
Energy: 1.1420517828424
Energy: 0.9638261123447255
Energy: 0.9261097398463772
Energy: 0.9638261123447255
Energy: 0.9261097397651763
Energy: 0.9638261123437099
Energy: 0.9261097398128626
Energy: 1.0719800194808606
Energy: 0.900537121260603
Energy: 1.0719800194803528
Energy: 0.900537121261111
Energy: 1.071980019479845
Energy: 0.900537121260603
Energy: 0.9342956799489167
Energy: 1.0788197133180584
Energy: 0.9342956799494244
Energy: 1.0788197133170427
Energy: 0.934295679948409
Energy: 1.0788197133175506
Energy: 0.9107016798805277
Energy: 0.9275143163998784
Energy: 0.9107016798805277
Energy: 0.9275143163998784
Energy: 0.9107016798810356
Energy: 0.9275143163998784
Energy: 1.022695237049053
Energy: 0.8467962555324751
Energy: 1.0226952370495608
Energy: 0.8467962555324751
Energy: 1.022695237049053
Energy: 0.8467962555319671
Energy: 0.829548362959215
Energy: 1.1361624369796628
Energy: 0.8295483629617537
Energy: 1.1361624369796628
Energy: 0.8407436765489233
Energy: 1.1361624369796628
Energy: 0.8812546880447131
Energy: 1.046990873260566
Energy: 0.8812546880447131
Energy: 1.046990873260566
Energy: 0.8812546880447131
Energy: 1.046990873260566
Energy: 0.8844478199212904
Energy: 0.7936527437179601
Energy: 0.8844478199212904
Energy: 0.7936527437174524
Energy: 0.8844478199217984
Energy: 0.7936527437174524
Energy: 0.86426296867184
Energy: 1.0312280694525773
Energy: 0.86426296867184
Energy: 1.0312280694525773
Energy: 0.86426296867184
Energy: 1.0312280694535927
Energy: 0.8654040207618571
Energy: 1.091972020499734
Energy: 0.8654040207618571
Energy: 1.091972020499734
Energy: 0.8654040207618571
Energy: 1.091972020499734
Energy: 0.8839037165424358
Energy: 0.7702971456017585
Energy: 0.8839037165419281
Energy: 0.7702971456017585
Energy: 0.8839037165424358
Energy: 0.7702971456017585
Energy: 0.7626875155979048
Energy: 1.089800156440234
Energy: 0.7626875155989205
Energy: 1.0898001564407418
Energy: 0.7626875155973971
Energy: 1.0898001564407418
Energy: 0.998118478236594
Energy: 1.01003252503404
Energy: 0.998118478236594
Energy: 1.01003252503404
Energy: 0.998118478236594
Energy: 1.0100325250345479
Energy: 0.9108055180140849
Energy: 0.8470506878250939
Energy: 0.9108055180140849
Energy: 0.8470506878256017
Energy: 0.9108055180140849
Energy: 0.8470506878250939
Energy: 0.7973909083150712
Energy: 0.8838329876382055
Energy: 0.7973909083150712
Energy: 0.8838329876376976
Energy: 0.7973909083145633
Energy: 0.883832987639729

minimum gb energy = 0.7542638870670335 eV
minimum distance =  2.28358267220833 Angstroms
sigma value = 81


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

Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.573231654011594
Energy: 0.05350834557964943
Energy: 0.5732316540134598
Energy: 0.05350834559084398
Energy: 0.573231654011594
Energy: 0.05350834561883031
Energy: 0.57323053859648
Energy: 0.053109601326838146
Energy: 0.57323053859648
Energy: 0.0531096013417218
Energy: 0.57323053859648
Energy: 0.053109601293254545
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.573231654011594
Energy: 0.05350834554051097
Energy: 0.573231654011594
Energy: 0.053508345574094576
Energy: 0.5732316540134598
Energy: 0.05350834558711246
Energy: 0.57323053859648
Energy: 0.053109601324972396
Energy: 0.57323053859648
Energy: 0.05310960131937513
Energy: 0.57323053859648
Energy: 0.053109601282060014
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.5732316540134598
Energy: 0.05350834556663154
Energy: 0.5732316540134598
Energy: 0.05350834558524671
Energy: 0.573231654011594
Energy: 0.053508345547973984
Energy: 0.57323053859648
Energy: 0.053109601375305404
Energy: 0.57323053859648
Energy: 0.05310960132124089
Energy: 0.57323053859648
Energy: 0.05310960130631484
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401
Energy: 0.05219835797554892
Energy: 0.10894796419321401

minimum gb energy = 0.05219835797554892 eV
minimum distance =  2.46632891340474 Angstroms
sigma value = 3


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

Energy: 1.0039453472144069
Energy: 0.796787843629844
Energy: 1.003945347214965
Energy: 0.796787843629844
Energy: 1.003945347214965
Energy: 0.7967878436304022
Energy: 0.8142768410970642
Energy: 0.9506532545566602
Energy: 0.8142768410976226
Energy: 0.9506532545566602
Energy: 0.8142768410976226
Energy: 0.9506532545561018
Energy: 0.8945794137133146
Energy: 0.9538084171320826
Energy: 0.8518623178132583
Energy: 0.9538084171320826
Energy: 0.8518623178132583
Energy: 0.9538084171320826
Energy: 0.9345843736392315
Energy: 0.8440969174623468
Energy: 0.9345843736397899
Energy: 0.8440969174623468
Energy: 0.9345843736392315
Energy: 0.8440969174629053
Energy: 0.7007213796368247
Energy: 1.0155934939700129
Energy: 0.7007213796351496
Energy: 1.0155934939700129
Energy: 0.7007213796357079
Energy: 1.015593493970571
Energy: 0.8674137009428134
Energy: 0.9063402628530476
Energy: 0.8674137009433717
Energy: 0.906340262852489
Energy: 0.8674137009428134
Energy: 0.9063402628619809
Energy: 0.9101840922407328
Energy: 0.9016123123330836
Energy: 0.9101840922396162
Energy: 0.9016123123330836
Energy: 0.9101840922401743
Energy: 0.9016123123319668
Energy: 0.8526994166480272
Energy: 1.1195223385168935
Energy: 0.8526994166485854
Energy: 1.1195223385163353
Energy: 0.8526994166480272
Energy: 1.1195223385163353
Energy: 0.8808132721695088
Energy: 0.9039430394511732
Energy: 0.8808132721695088
Energy: 0.9039430394511732
Energy: 0.8808132721700671
Energy: 0.9039430394511732
Energy: 0.8057319977021388
Energy: 0.8491843161911231
Energy: 0.8057319977032555
Energy: 0.8491843161905648
Energy: 0.8057319977026971
Energy: 0.8491843161905648
Energy: 0.8821099120535109
Energy: 0.8334903638034397
Energy: 0.8821099120529526
Energy: 0.8334903638028813
Energy: 0.8821099120529526
Energy: 0.8334903638023229
Energy: 0.9092624462637352
Energy: 0.9227538967422287
Energy: 0.9092624462598269
Energy: 0.9227538967422287
Energy: 0.9092624462631766
Energy: 0.9227538967422287
Energy: 0.9429900432840943
Energy: 0.8597087294532314
Energy: 0.9429900432840943
Energy: 0.8597087294532314
Energy: 0.9429900432840943
Energy: 0.8597087294526731
Energy: 0.8708646851462587
Energy: 0.8907180163398188
Energy: 0.8708646851462587
Energy: 0.8907180163398188
Energy: 0.8708646851462587
Energy: 0.8907180163387023
Energy: 0.8948515209825407
Energy: 0.8903623187958877
Energy: 0.894851520983099
Energy: 0.8903623187958877
Energy: 0.894851520983099
Energy: 0.8903623187958877
Energy: 0.9155786043733802
Energy: 0.8846693383619332
Energy: 0.9155786043733802
Energy: 0.8846693383624915
Energy: 0.915578604372822
Energy: 0.8846693383624915
Energy: 0.8065533620421087
Energy: 0.9209099822379593
Energy: 0.806553362039317
Energy: 0.9209099822379593
Energy: 0.8065533620415505
Energy: 0.9209099822379593
Energy: 0.9517047116225491
Energy: 0.842017845171852
Energy: 0.9517047116225491
Energy: 0.842017845171852
Energy: 0.9517047116225491
Energy: 0.842017845171852
Energy: 0.9507031935962404
Energy: 0.9520628928811723
Energy: 0.9507031935962404
Energy: 0.952062892962638
Energy: 0.9507031935962404
Energy: 0.9520628930552706
Energy: 0.8341397677122313
Energy: 0.9846413928569034
Energy: 0.8341397677127896
Energy: 0.9846413928552283
Energy: 0.8341397677127896
Energy: 0.9846413928563451
Energy: 0.901643160657795
Energy: 0.8317997036210973
Energy: 0.9016431606583535
Energy: 0.8317997036210973
Energy: 0.9016431606583535
Energy: 0.8317997036216558
Energy: 0.9811984971728615
Energy: 0.850732117896195
Energy: 0.9811984971728615
Energy: 0.850732117896195
Energy: 0.981198497172303
Energy: 0.8507321178967534
Energy: 0.8660466665959505
Energy: 0.9989149352007531
Energy: 0.866046666596458
Energy: 0.9989149352018698
Energy: 0.866046666596458
Energy: 0.998914935202428
Energy: 0.9534731021042432
Energy: 0.8320100776493471
Energy: 0.9534731021042432
Energy: 0.8320100776493471
Energy: 0.9534731021042432
Energy: 0.8320100776493471
Energy: 0.9245247089394202
Energy: 0.8706422552187062
Energy: 0.924524708938862
Energy: 0.8706422552187062
Energy: 0.924524708938862
Energy: 0.8706422552187062
Energy: 0.8058416917731116
Energy: 0.986421691549708
Energy: 0.8058416917731116
Energy: 0.986421691549708
Energy: 0.8058416917731116
Energy: 0.9864216915502665
Energy: 0.9754687617392329
Energy: 0.7328495503579671
Energy: 0.9754687617392329
Energy: 0.7328495503568504
Energy: 0.9754687617386746
Energy: 0.7328495503574087
Energy: 0.8938132668934783
Energy: 0.8821462860749532
Energy: 0.8938132668934783
Energy: 0.8821462860755116
Energy: 0.8938132668934783
Energy: 0.8821462860749532
Energy: 0.767747863946917
Energy: 0.8348303478274428
Energy: 0.7677478639474752
Energy: 0.8348303478274428
Energy: 0.767747863946917
Energy: 0.8348303478268843
Energy: 0.9747888423816684
Energy: 0.7935435142940467
Energy: 0.9747888423822267
Energy: 0.7935435142940467
Energy: 0.974788842382785
Energy: 0.7935435142940467
Energy: 0.9960515675160362
Energy: 0.9001336092514316
Energy: 0.9960515675165945
Energy: 0.9001336092508733
Energy: 0.9960515675160362
Energy: 0.9001336092508733
Energy: 0.8358882607326854
Energy: 0.9207812889488418
Energy: 0.8358882607326854
Energy: 0.9207812889494004
Energy: 0.8358882607326854
Energy: 0.9207812889488418
Energy: 0.8793186113735135
Energy: 0.9051354768904554
Energy: 0.8793186113729553
Energy: 0.9051354768904554
Energy: 0.8793186113735135
Energy: 0.9051354768904554

minimum gb energy = 0.7007213796351496 eV
minimum distance =  2.34265672658037 Angstroms
sigma value = 67


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

Energy: 1.1549270790206358
Energy: 0.9999299785736656
Energy: 1.1549270790214312
Energy: 0.9999299785728699
Energy: 1.1549270790190445
Energy: 0.9999299785728699
Energy: 1.0082139150907259
Energy: 1.108487828218115
Energy: 1.008213915092317
Energy: 1.108487828218115
Energy: 1.0082139150907259
Energy: 1.108487828218115
Energy: 1.1505078601689862
Energy: 1.103441801939505
Energy: 1.1505078601713727
Energy: 1.103441801939505
Energy: 1.0731452747744004
Energy: 1.103441801939505
Energy: 1.126730797599517
Energy: 0.9836191075706843
Energy: 1.1267307976003127
Energy: 0.9836191075698886
Energy: 1.1267307976019039
Energy: 0.9836191075698886
Energy: 0.9787071936497971
Energy: 1.0056599330687412
Energy: 0.9787071936497971
Energy: 1.0056599330687412
Energy: 0.9787071936490015
Energy: 1.0056599330687412
Energy: 1.061373046452991
Energy: 1.0761172076202483
Energy: 1.0613730464521953
Energy: 1.0761172076202483
Energy: 1.0613730464521953
Energy: 1.076117207621044
Energy: 1.0376175570356672
Energy: 1.0715142182707944
Energy: 1.0376175570372583
Energy: 1.07151421827159
Energy: 1.037617557039645
Energy: 1.07151421827159
Energy: 0.9699313691107162
Energy: 0.9759561250443213
Energy: 0.9699313691107162
Energy: 0.9759561250451169
Energy: 0.9699313691115117
Energy: 0.9759561250451169
Energy: 1.1273043829905094
Energy: 1.117402196439082
Energy: 1.1273043829905094
Energy: 1.117402196439082
Energy: 1.1273043829905094
Energy: 1.117402196439082
Energy: 1.0844662340144917
Energy: 1.065754881187858
Energy: 1.0844662340144917
Energy: 1.0657548811886537
Energy: 1.084466234013696
Energy: 1.065754881187858
Energy: 1.0809315178165018
Energy: 1.072136349865714
Energy: 1.0809315178165018
Energy: 1.072136349865714
Energy: 1.0809315178165018
Energy: 1.072136349865714
Energy: 1.0741812836510505
Energy: 1.0620771705758179
Energy: 1.0741812836510505
Energy: 1.0620771705758179
Energy: 1.0741812836510505
Energy: 1.0620771705758179
Energy: 1.0706812885232453
Energy: 1.1042305945521205
Energy: 1.0706812885232453
Energy: 1.1042305945529158
Energy: 1.0706812885232453
Energy: 1.1042305945529158
Energy: 1.0676524019962865
Energy: 1.1557561396741767
Energy: 1.0676524019962865
Energy: 1.1557561396733813
Energy: 1.0676524019970821
Energy: 1.1557561396725857
Energy: 1.0172343215755315
Energy: 0.9962479862524096
Energy: 1.0172343215763273
Energy: 0.9962479862524096
Energy: 1.0172343215763273
Energy: 0.9962479862524096
Energy: 1.0169200620270167
Energy: 1.0326608982433825
Energy: 1.0169200620270167
Energy: 1.0326608982433825
Energy: 1.0169200620278123
Energy: 1.0326608982433825
Energy: 1.0121768189209244
Energy: 1.153145200934208
Energy: 1.0121768189209244
Energy: 1.1531452009350036
Energy: 1.0121768189201286
Energy: 1.153145200934208
Energy: 1.0563973563708875
Energy: 0.9837583599530364
Energy: 1.0563973563708875
Energy: 0.9837583599530364
Energy: 1.0563973563708875
Energy: 0.9837583599530364
Energy: 1.1309300942429525
Energy: 1.1052346197375629
Energy: 1.1309300942429525
Energy: 1.1052346197375629
Energy: 1.1309300942429525
Energy: 1.1052346197375629
Energy: 1.0930867085943592
Energy: 1.1241887836479398
Energy: 1.0930867085935638
Energy: 1.1241887836479398
Energy: 1.0930867085943592
Energy: 1.1241887836487354
Energy: 1.1206560723923185
Energy: 0.9865826483949303
Energy: 1.120656072393114
Energy: 0.9865826483957257
Energy: 1.120656072393114
Energy: 0.9865826483957257
Energy: 1.1193220775273984
Energy: 1.1498650596666653
Energy: 1.1193220775273984
Energy: 1.1498650596658697
Energy: 1.1193220775273984
Energy: 1.1498650596666653
Energy: 1.0915496866559231
Energy: 1.1204906772031658
Energy: 1.0587198133519902
Energy: 1.1204906772031658
Energy: 1.0587198133519902
Energy: 1.1204906772023704

minimum gb energy = 0.9699313691107162 eV
minimum distance =  2.32584228912399 Angstroms
sigma value = 33


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

Energy: 1.315904877738157
Energy: 1.0580607109374272
Energy: 1.3159048777376523
Energy: 1.0580607109369224
Energy: 1.315904877738157
Energy: 1.0580607109379319
Energy: 1.1028211100585281
Energy: 1.1929669338868953
Energy: 1.1028211100590328
Energy: 1.1929669338868953
Energy: 1.1028211100585281
Energy: 1.1929669338863906
Energy: 1.2115802722601057
Energy: 1.1939119257872193
Energy: 1.2115802722606104
Energy: 1.1939119257872193
Energy: 1.2115802722606104
Energy: 1.1939119257872193
Energy: 1.2171162178417518
Energy: 1.0561706393346686
Energy: 1.2171162178412471
Energy: 1.056170639334164
Energy: 1.2171162178407422
Energy: 1.0561706393346686
Energy: 1.108218331290078
Energy: 1.2301300722808952
Energy: 1.1082183312890683
Energy: 1.2301300722808952
Energy: 1.108218331290078
Energy: 1.2301300722814
Energy: 1.3208638460074564
Energy: 1.2589554037397734
Energy: 1.3208638460074564
Energy: 1.2589554037397734
Energy: 1.3208638460074564
Energy: 1.2589554037402781
Energy: 1.1051740214473207
Energy: 1.2176474749120856
Energy: 1.1051740214478254
Energy: 1.2176474749115809
Energy: 1.105174021446816
Energy: 1.2176474749115809
Energy: 1.1796597838229586
Energy: 1.2034904217116487
Energy: 1.179659783822454
Energy: 1.2034904217116487
Energy: 1.179659783822454
Energy: 1.2034904217116487
Energy: 1.1700284236346663
Energy: 1.2016622642094623
Energy: 1.1700284236346663
Energy: 1.2016622642094623
Energy: 1.1700284236336569
Energy: 1.2016622642094623
Energy: 1.2865861937478564
Energy: 1.2735822424271934
Energy: 1.2865861937478564
Energy: 1.2490111731958344
Energy: 1.2865861937473517
Energy: 1.2490111731943203
Energy: 1.1691886960666786
Energy: 1.230735831700567
Energy: 1.1691886960666786
Energy: 1.2307358317010715
Energy: 1.1691886960666786
Energy: 1.2307358317010715
Energy: 1.1188824831601345
Energy: 1.116321003346146
Energy: 1.118882483160639
Energy: 1.1163210033456412
Energy: 1.1188824831601345
Energy: 1.116321003346146
Energy: 1.2658564761477074
Energy: 1.1224912393807536
Energy: 1.2658564761477074
Energy: 1.1224912393807536
Energy: 1.265856476148212
Energy: 1.1224912393807536
Energy: 1.1408511717283765
Energy: 1.1990035284700469
Energy: 1.1408511717293859
Energy: 1.1990035284695422
Energy: 1.1408511717293859
Energy: 1.1990035284695422
Energy: 1.1642314143961265
Energy: 1.126891586248445
Energy: 1.1642314143961265
Energy: 1.1268915862489497
Energy: 1.1642314143961265
Energy: 1.126891586248445
Energy: 1.2169637101254327
Energy: 1.1989140184925902
Energy: 1.2169637101254327
Energy: 1.1989140184925902
Energy: 1.2169637101254327
Energy: 1.1989140184925902
Energy: 1.1913677887044398
Energy: 1.2020172530876072
Energy: 1.1913677887049445
Energy: 1.2020172530876072
Energy: 1.191367788702926
Energy: 1.2020172530876072
Energy: 1.245760208176989
Energy: 1.251554988252097
Energy: 1.245760208176989
Energy: 1.251554988252097
Energy: 1.245760208176989
Energy: 1.251554988252097
Energy: 1.106381346260715
Energy: 1.2541533738423567
Energy: 1.106381346260715
Energy: 1.2541533738423567
Energy: 1.1063813462602103
Energy: 1.2541533738423567
Energy: 1.2151610737935936
Energy: 1.2322774724336973
Energy: 1.2151610737935936
Energy: 1.2322774724336973
Energy: 1.215161073793089
Energy: 1.2322774724331929
Energy: 1.2576013040164449
Energy: 1.1972024851910736
Energy: 1.2576013040169496
Energy: 1.1972024851910736
Energy: 1.2576013040174543
Energy: 1.1972024851910736
Energy: 1.16747358627118
Energy: 1.0937893856055878
Energy: 1.16747358627118
Energy: 1.0937893856055878
Energy: 1.16747358627118
Energy: 1.0937893856055878
Energy: 1.0963928719297729
Energy: 1.2305751603632282
Energy: 1.0963928719297729
Energy: 1.2305751603627235
Energy: 1.0963928719302776
Energy: 1.2305751603637327
Energy: 1.2641956881739773
Energy: 1.1431289666695374
Energy: 1.2641956881739773
Energy: 1.1431289666695374
Energy: 1.2641956881739773
Energy: 1.1431289666700422
Energy: 1.1182171839536659
Energy: 1.1115648170336714
Energy: 1.1182171839536659
Energy: 1.111564817033167
Energy: 1.1182171839536659
Energy: 1.1115648170336714
Energy: 1.1027194255986064
Energy: 1.2662113975965092
Energy: 1.1027194255986064
Energy: 1.266211397597014
Energy: 1.1027194255981017
Energy: 1.2662113975965092
Energy: 1.162779587596546
Energy: 1.1895550320671766
Energy: 1.162779587596546
Energy: 1.1895550320666721
Energy: 1.162779587596546
Energy: 1.1895550320671766
Energy: 1.2581831699943262
Energy: 1.2664081951788249
Energy: 1.2581831699938217
Energy: 1.2517621712050793
Energy: 1.258183169994831
Energy: 1.2517621712050793
Energy: 1.2188438754819717
Energy: 1.230269914444275
Energy: 1.218843875482981
Energy: 1.230269914444275
Energy: 1.218843875482981
Energy: 1.2302699144437703
Energy: 1.1074560996657774
Energy: 1.2383043946828172
Energy: 1.1074560996662821
Energy: 1.2383043946833219
Energy: 1.1074560996657774
Energy: 1.2383043946838266
Energy: 1.3225253364708374
Energy: 1.2672177082448088
Energy: 1.3225253364708374
Energy: 1.2672177082448088
Energy: 1.3225253364708374
Energy: 1.2672177082448088
Energy: 1.2109377074787644
Energy: 1.2047975290424442
Energy: 1.2109377074782597
Energy: 1.2047975290424442
Energy: 1.2109377074787644
Energy: 1.2047975290419395
Energy: 1.2102970781714135
Energy: 1.1966479661641811
Energy: 1.2102970781719182
Energy: 1.1966479661641811
Energy: 1.2102970781714135
Energy: 1.1966479661641811
Energy: 1.1648277673776353
Energy: 1.1928637400382294
Energy: 1.1648277673771306
Energy: 1.1928637400382294
Energy: 1.164827767376121
Energy: 1.192863740038734
Energy: 1.1429733900600076
Energy: 1.193541333432525
Energy: 1.1429733900600076
Energy: 1.193541333432525
Energy: 1.1429733900600076
Energy: 1.193541333432525
Energy: 1.2867034993057163
Energy: 1.1217198920280496
Energy: 1.2867034993052116
Energy: 1.1217198920280496
Energy: 1.2867034993057163
Energy: 1.1217198920285543
Energy: 1.1062189542914995
Energy: 1.1322750037319202
Energy: 1.1062189542899854
Energy: 1.1322750037319202
Energy: 1.1062189542909948
Energy: 1.132275003732425

minimum gb energy = 1.056170639334164 eV
minimum distance =  2.32778634828588 Angstroms
sigma value = 41


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

Energy: 1.3923421591411698
Energy: 1.184481334486855
Energy: 1.3923421591411698
Energy: 1.184481334486855
Energy: 1.3923421591411698
Energy: 1.184481334486855
Energy: 1.2104553102686946
Energy: 1.3079759158060484
Energy: 1.2104553102686946
Energy: 1.3079759158060484
Energy: 1.2104553102686946
Energy: 1.3079759158060484
Energy: 1.5495243656052369
Energy: 1.3093089507775966
Energy: 1.4580525933469783
Energy: 1.3093089507775966
Energy: 1.4580525933469783
Energy: 1.3093089507775966
Energy: 1.3592377535965363
Energy: 1.413557453417989
Energy: 1.3592377535951585
Energy: 1.413557453417989
Energy: 1.3592377535951585
Energy: 1.413557453417989
Energy: 1.3184110330310843
Energy: 1.3072772741235448
Energy: 1.3184110330310843
Energy: 1.3072772741235448
Energy: 1.3184110330310843
Energy: 1.3072772741235448
Energy: 1.4291077164771007
Energy: 1.3169489573417859
Energy: 1.4291077164771007
Energy: 1.3169489573417859
Energy: 1.4291077164771007
Energy: 1.3169489573417859
Energy: 1.3532714936179795
Energy: 1.365253077329142
Energy: 1.3532714936179795
Energy: 1.365253077329142
Energy: 1.3532714936179795
Energy: 1.365253077329142
Energy: 1.3021496891264768
Energy: 1.3382264804962756
Energy: 1.302149689127855
Energy: 1.3382264804962756
Energy: 1.3021496891264768
Energy: 1.3382264804962756
Energy: 1.2265927654428053
Energy: 1.2203759542640344
Energy: 1.226592765444183
Energy: 1.2203759542654127
Energy: 1.2265927654428053
Energy: 1.2203759542654127
Energy: 1.3784213798979603
Energy: 1.226570924224914
Energy: 1.3784213798979603
Energy: 1.226570924224914
Energy: 1.3784213798979603
Energy: 1.226570924224914
Energy: 1.2157431023991425
Energy: 1.3094408812161116
Energy: 1.2157431023991425
Energy: 1.3094408812161116
Energy: 1.2157431023991425
Energy: 1.3094408812161116
Energy: 1.2942465812527
Energy: 1.3084863071003103
Energy: 1.2942465812527
Energy: 1.3084863070989325
Energy: 1.2942465812527
Energy: 1.3084863071003103
Energy: 1.3804393796293983
Energy: 1.3438502823477851
Energy: 1.3804393796293983
Energy: 1.3438502823477851
Energy: 1.3804393796293983
Energy: 1.3438502823477851
Energy: 1.4325627827062328
Energy: 1.310078006689848
Energy: 1.4325627827062328
Energy: 1.310078006689848
Energy: 1.4325627827062328
Energy: 1.310078006689848

minimum gb energy = 1.184481334486855 eV
minimum distance =  2.26346766857447 Angstroms
sigma value = 11


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

Energy: 1.4375930578522567
Energy: 1.4551571315464813
Energy: 1.4375930578516511
Energy: 1.4551571315464813
Energy: 1.4375930578516511
Energy: 1.4551571315464813
Energy: 1.409824789976629
Energy: 1.4130576672196589
Energy: 1.4098247899754184
Energy: 1.4130576672190538
Energy: 1.409824789976629
Energy: 1.4130576672190538
Energy: 1.4514004341856244
Energy: 1.3640211047431905
Energy: 1.4514004341856244
Energy: 1.3640211047431905
Energy: 1.3898236865840707
Energy: 1.3640211047431905
Energy: 1.405184331104744
Energy: 1.3045083425891306
Energy: 1.405184331104744
Energy: 1.3045083425891306
Energy: 1.405184331104744
Energy: 1.3045083425891306
Energy: 1.3977091847348952
Energy: 1.3804749912544314
Energy: 1.3977091847355008
Energy: 1.3804749912544314
Energy: 1.3977091847355008
Energy: 1.3804749912544314
Energy: 1.34459517378869
Energy: 1.4042166775573788
Energy: 1.3445951737880848
Energy: 1.4042166775573788
Energy: 1.3445951737880848
Energy: 1.4042166775573788
Energy: 1.391817258713075
Energy: 1.3505649655328928
Energy: 1.391817258713075
Energy: 1.3505649655328928
Energy: 1.391817258713075
Energy: 1.3505649655334981
Energy: 1.425399134131994
Energy: 1.3625305196350193
Energy: 1.425399134131994
Energy: 1.3625305196356248
Energy: 1.4253991341325993
Energy: 1.3625305196356248
Energy: 1.3799307975966533
Energy: 1.3713909672026925
Energy: 1.3799307975972586
Energy: 1.3713909672026925
Energy: 1.3799307975972586
Energy: 1.3713909672026925
Energy: 1.3734900451885148
Energy: 1.4005530462064566
Energy: 1.3734900451885148
Energy: 1.4005530462064566
Energy: 1.3734900451879093
Energy: 1.4005530462064566
Energy: 1.3359839955883663
Energy: 1.4517650803565538
Energy: 1.3359839955883663
Energy: 1.4517650803565538
Energy: 1.3359839955883663
Energy: 1.4517650803565538
Energy: 1.3823106254447775
Energy: 1.4280051745549398
Energy: 1.3823106254441722
Energy: 1.4280051745543343
Energy: 1.3823106254441722
Energy: 1.4280051745549398
Energy: 1.4187490916100256
Energy: 1.3578697193206222
Energy: 1.4187490916094203
Energy: 1.3578697193206222
Energy: 1.4187490916100256
Energy: 1.3578697193206222
Energy: 1.3407391047081583
Energy: 1.414199048976064
Energy: 1.3407391047081583
Energy: 1.414199048976064
Energy: 1.3407391047081583
Energy: 1.414199048976064
Energy: 1.316024886342333
Energy: 1.3262971256777152
Energy: 1.316024886342333
Energy: 1.3262971256777152
Energy: 1.316024886342333
Energy: 1.3262971256771097
Energy: 1.3907067511222369
Energy: 1.3561755474218828
Energy: 1.3907067511222369
Energy: 1.3561755474218828
Energy: 1.3907067511222369
Energy: 1.3561755474218828
Energy: 1.3421064706874917
Energy: 1.4297210592803686
Energy: 1.3421064706874917
Energy: 1.4297210592803686
Energy: 1.342106470686281
Energy: 1.4297210592803686
Energy: 1.4907476275540246
Energy: 1.4491641203482883
Energy: 1.4907476275540246
Energy: 1.4491641203482883
Energy: 1.4907476275540246
Energy: 1.4491641203482883
Energy: 1.3415303715213012
Energy: 1.323251584204446
Energy: 1.3415303715213012
Energy: 1.323251584204446
Energy: 1.3415303715213012
Energy: 1.323251584204446
Energy: 1.3437502968475528
Energy: 1.3866372004157501
Energy: 1.343750296846975
Energy: 1.3866372004157501
Energy: 1.3437502968475528
Energy: 1.3866372004157501
Energy: 1.2708807460351812
Energy: 1.315116037485716
Energy: 1.2708807460345761
Energy: 1.3151160374851105
Energy: 1.2708807460345761
Energy: 1.315116037485716
Energy: 1.4434097886632327
Energy: 1.4698383595179625
Energy: 1.4434097886632327
Energy: 1.469838359517357
Energy: 1.4434097886632327
Energy: 1.469838359517357
Energy: 1.3942586737325877
Energy: 1.3648467316734947
Energy: 1.3942586737331932
Energy: 1.3648467316734947
Energy: 1.3942586737331932
Energy: 1.3648467316734947
Energy: 1.4099489939087995
Energy: 1.4131967778362526
Energy: 1.4099489939087995
Energy: 1.4131967778356471
Energy: 1.4099489939087995
Energy: 1.4131967778362526
Energy: 1.3710709205670857
Energy: 1.3550886315055253
Energy: 1.3710709205670857
Energy: 1.3550886315061303
Energy: 1.3710709205670857
Energy: 1.3550886315043145
Energy: 1.272716017405803
Energy: 1.39973178778888
Energy: 1.272716017405803
Energy: 1.3997317877882745
Energy: 1.272716017405803
Energy: 1.39973178778888
Energy: 1.3531731011497408
Energy: 1.4055306469225677
Energy: 1.3531731011497408
Energy: 1.4055306469225677
Energy: 1.3531731011497408
Energy: 1.4055306469225677
Energy: 1.4225795704911997
Energy: 1.3956861476956446
Energy: 1.4225795704911997
Energy: 1.3956861476956446
Energy: 1.4225795704911997
Energy: 1.3956861476950393
Energy: 1.343911459465856
Energy: 1.4115678349029572
Energy: 1.343911459465856
Energy: 1.4115678349035625
Energy: 1.3439114594664616
Energy: 1.4115678349029572
Energy: 1.3108687476186194
Energy: 1.2468392528322452
Energy: 1.3108687476192245
Energy: 1.2468392528322452
Energy: 1.31086874761983
Energy: 1.2468392528322452
Energy: 1.3733173491785065
Energy: 1.4353135105991275
Energy: 1.3733173491785065
Energy: 1.4353135105991275
Energy: 1.3733173491785065
Energy: 1.4353135105991275

minimum gb energy = 1.2468392528322452 eV
minimum distance =  2.23320418796307 Angstroms
sigma value = 57


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

Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.3515488250819578
Energy: 1.3038752216165557
Energy: 1.3515488250819578
Energy: 1.3038752216165557
Energy: 1.3515488250819578
Energy: 1.3038752216176326
Energy: 1.3968137524596786
Energy: 1.3021776539022683
Energy: 1.3968137524596786
Energy: 1.3021776539022683
Energy: 1.3968137524607556
Energy: 1.3021776539022683
Energy: 1.212462712694138
Energy: 1.2862488699815045
Energy: 1.212462712694138
Energy: 1.2862488699815045
Energy: 1.212462712694138
Energy: 1.2862488699815045
Energy: 1.3968093761884803
Energy: 1.3021801980498773
Energy: 1.3968093761884803
Energy: 1.3021801980498773
Energy: 1.3968093761884803
Energy: 1.3021801980498773
Energy: 1.3513235085698276
Energy: 1.2093425396179658
Energy: 1.3513235085698276
Energy: 1.209342539619043
Energy: 1.3513235085698276
Energy: 1.209342539619043
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.3515488250819578
Energy: 1.3038752216219416
Energy: 1.3515488250819578
Energy: 1.303875221619787
Energy: 1.3515488250819578
Energy: 1.30387522161871
Energy: 1.3968137524596786
Energy: 1.3021776539022683
Energy: 1.3968137524596786
Energy: 1.3021776539022683
Energy: 1.3968137524596786
Energy: 1.3021776539022683
Energy: 1.2124627126952154
Energy: 1.2862488699836587
Energy: 1.2124627126952154
Energy: 1.2862488699836587
Energy: 1.2124627126952154
Energy: 1.2862488699836587
Energy: 1.3968093761895575
Energy: 1.3021801980488001
Energy: 1.3968093761895575
Energy: 1.3021801980488001
Energy: 1.3968093761895575
Energy: 1.3021801980488001
Energy: 1.3513235085698276
Energy: 1.2093425396201203
Energy: 1.3513235085709046
Energy: 1.209342539619043
Energy: 1.3513235085709046
Energy: 1.209342539619043
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.2323868051995013
Energy: 1.1276127206779032
Energy: 1.3515488250819578
Energy: 1.3038752216208642
Energy: 1.3515488250830348
Energy: 1.3038752216154783
Energy: 1.3515488250819578
Energy: 1.303875221619787
Energy: 1.3968137524596786
Energy: 1.3021776539022683
Energy: 1.3968137524607556
Energy: 1.3021776539022683
Energy: 1.3968137524607556
Energy: 1.3021776539022683
Energy: 1.212462712694138
Energy: 1.2862488699815045
Energy: 1.212462712694138
Energy: 1.2862488699815045
Energy: 1.212462712694138
Energy: 1.2862488699815045
Energy: 1.3968093761884803
Energy: 1.3021801980498773
Energy: 1.3968093761884803
Energy: 1.3021801980498773
Energy: 1.3968093761884803
Energy: 1.3021801980498773

minimum gb energy = 1.1276127206779032 eV
minimum distance =  2.33743247168624 Angstroms
sigma value = 9


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

Energy: 1.348212642374425
Energy: 1.4159706569061996
Energy: 1.348212642374425
Energy: 1.4159706569061996
Energy: 1.348212642374425
Energy: 1.4159706569061996
Energy: 1.3981415762858953
Energy: 1.397794362775488
Energy: 1.3981415762850156
Energy: 1.397794362775488
Energy: 1.3981415762850156
Energy: 1.397794362775488
Energy: 1.4850235753028638
Energy: 1.2940756153666968
Energy: 1.4850235753019845
Energy: 1.2940756153666968
Energy: 1.4850235753019845
Energy: 1.2940756153666968
Energy: 1.3568978376797114
Energy: 1.4783717472061422
Energy: 1.3568978376797114
Energy: 1.478371747207022
Energy: 1.3568978376797114
Energy: 1.478371747207022
Energy: 1.308668046632391
Energy: 1.3963165260687431
Energy: 1.308668046632391
Energy: 1.3963165260687431
Energy: 1.3086680466332703
Energy: 1.3963165260687431
Energy: 1.5281466274007627
Energy: 1.3517015675688357
Energy: 1.5281466274007627
Energy: 1.3517015675679562
Energy: 1.5281466274016424
Energy: 1.3517015675688357
Energy: 1.2857482352652911
Energy: 1.301919341558371
Energy: 1.2857482352644118
Energy: 1.3019193415574917
Energy: 1.2857482352652911
Energy: 1.3019193415574917
Energy: 1.539844607885079
Energy: 1.3240155929619764
Energy: 1.539844607885079
Energy: 1.3240155929619764
Energy: 1.5398446078841996
Energy: 1.3240155929619764
Energy: 1.6014651748964324
Energy: 1.3976354955059744
Energy: 1.6014651748964324
Energy: 1.3976354955059744
Energy: 1.6014651748964324
Energy: 1.3976354955059744
Energy: 1.317259292043386
Energy: 1.343166667845544
Energy: 1.317259292043386
Energy: 1.3431666678464238
Energy: 1.317259292043386
Energy: 1.343166667845544
Energy: 1.2746156337288748
Energy: 1.289208776448054
Energy: 1.2746156337288748
Energy: 1.289208776448054
Energy: 1.2746156337288748
Energy: 1.289208776448054
Energy: 1.3478460430654227
Energy: 1.3330273435915572
Energy: 1.3478460430654227
Energy: 1.333027343592437
Energy: 1.3478460430654227
Energy: 1.333027343592437
Energy: 1.3191828432618218
Energy: 1.5688719212933615
Energy: 1.3191828432627013
Energy: 1.5688719212933615
Energy: 1.3191828432635808
Energy: 1.5688719212933615
Energy: 1.311974279181453
Energy: 1.3464682120396465
Energy: 1.311974279181453
Energy: 1.3464682120405258
Energy: 1.3119742791805737
Energy: 1.3464682120396465
Energy: 1.3919638187410721
Energy: 1.3746853615801253
Energy: 1.3919638187410721
Energy: 1.3746853615792458
Energy: 1.3919638187410721
Energy: 1.3746853615792458
Energy: 1.3447484398760507
Energy: 1.3691412137272594
Energy: 1.3447484398760507
Energy: 1.3691412137272594
Energy: 1.3447484398760507
Energy: 1.3691412137272594
Energy: 1.4172639656477635
Energy: 1.3690004979353811
Energy: 1.417263965648643
Energy: 1.3690004979353811
Energy: 1.4172639656477635
Energy: 1.3690004979345016
Energy: 1.4703328817229269
Energy: 1.3721368554082776
Energy: 1.4703328817229269
Energy: 1.3721368554073978
Energy: 1.4703328817229269
Energy: 1.3721368554073978
Energy: 1.281832591127164
Energy: 1.3479033296943712
Energy: 1.281832591127164
Energy: 1.3479033296943712
Energy: 1.281832591127164
Energy: 1.3479033296943712
Energy: 1.4039526705988978
Energy: 1.334656467929229
Energy: 1.4039526705988978
Energy: 1.334656467929229
Energy: 1.4039526705988978
Energy: 1.334656467929229
Energy: 1.348632204586639
Energy: 1.3309512989781196
Energy: 1.348632204586639
Energy: 1.3309512989781196
Energy: 1.348632204586639
Energy: 1.3309512989781196

minimum gb energy = 1.2746156337288748 eV
minimum distance =  2.28015048570476 Angstroms
sigma value = 27


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

Energy: 1.3445338486739822
Energy: 1.348700881946863
Energy: 1.3445338486739822
Energy: 1.348700881946863
Energy: 1.3445338486739822
Energy: 1.348700881946863
Energy: 1.3004096330814956
Energy: 1.3041041687193222
Energy: 1.3004096330814956
Energy: 1.3041041687193222
Energy: 1.3004096330814956
Energy: 1.3041041687193222
Energy: 1.2440340370051366
Energy: 1.260953494346078
Energy: 1.2440340370058782
Energy: 1.260953494346078
Energy: 1.2440340370058782
Energy: 1.260953494346078
Energy: 1.2668486014423117
Energy: 1.7150669952683821
Energy: 1.2668486014423117
Energy: 1.7150669952683821
Energy: 1.2668486014430531
Energy: 1.7150669952683821
Energy: 1.2378249919845097
Energy: 1.2113717710405392
Energy: 1.2378249919845097
Energy: 1.2113717710412808
Energy: 1.2378249919845097
Energy: 1.2113717710405392
Energy: 1.2035362594659718
Energy: 1.2665980987122145
Energy: 1.2035362594659718
Energy: 1.2665980987136973
Energy: 1.2035362594659718
Energy: 1.266598098712956
Energy: 1.3121670390640894
Energy: 1.280495017975374
Energy: 1.3121670390648308
Energy: 1.280495017975374
Energy: 1.3121670390648308
Energy: 1.280495017975374
Energy: 1.3047559581531791
Energy: 1.2438763278446097
Energy: 1.3047559581516963
Energy: 1.2438763278438685
Energy: 1.3047559581524377
Energy: 1.2438763278446097
Energy: 1.2680210497900284
Energy: 1.266554193815471
Energy: 1.2680210497900284
Energy: 1.2665541938147296
Energy: 1.2680210497900284
Energy: 1.2665541938147296
Energy: 1.2673141652937712
Energy: 1.2620381001002037
Energy: 1.2673141652937712
Energy: 1.2620381000994623
Energy: 1.2673141652937712
Energy: 1.2620381000994623
Energy: 1.2669662919135576
Energy: 1.3403494266167748
Energy: 1.266966291914299
Energy: 1.3403494266167748
Energy: 1.266966291914299
Energy: 1.3403494266167748
Energy: 1.2779410936269548
Energy: 1.3120277809617085
Energy: 1.2779410936269548
Energy: 1.3120277809617085
Energy: 1.2779410936269548
Energy: 1.3120277809617085
Energy: 1.3080656747734887
Energy: 1.303814406199659
Energy: 1.3080656747734887
Energy: 1.303814406199659
Energy: 1.30806567477423
Energy: 1.303814406199659
Energy: 1.2668942532013117
Energy: 1.2682506759324896
Energy: 1.266894253202053
Energy: 1.268250675933231
Energy: 1.266894253202053
Energy: 1.2682506759324896
Energy: 1.2033206232023843
Energy: 1.2666408288106652
Energy: 1.2033206232023843
Energy: 1.2666408288106652
Energy: 1.2033206232023843
Energy: 1.2666408288106652
Energy: 1.3029286550026453
Energy: 1.211195581378579
Energy: 1.3029286550026453
Energy: 1.211195581378579
Energy: 1.3029286550026453
Energy: 1.211195581378579
Energy: 1.3102843144990708
Energy: 1.5048091631913265
Energy: 1.3102843144990708
Energy: 1.5048095018091108
Energy: 1.3102843144990708
Energy: 1.504809172698938
Energy: 1.3016757081486123
Energy: 1.2753061037533553
Energy: 1.3016757081493535
Energy: 1.2753061037533553
Energy: 1.3016757081486123
Energy: 1.2753061037533553
Energy: 1.1951907743346017
Energy: 1.2362722592436963
Energy: 1.195190774333119
Energy: 1.2362722592436963
Energy: 1.1951907743338606
Energy: 1.2362722592436963
Energy: 1.3445338486739822
Energy: 1.3487008819461217
Energy: 1.3445338486739822
Energy: 1.3487008819461217
Energy: 1.3445338486739822
Energy: 1.3487008819461217
Energy: 1.3004096330800126
Energy: 1.3041041687193222
Energy: 1.3004096330800126
Energy: 1.3041041687193222
Energy: 1.3004096330800126
Energy: 1.304104168718581
Energy: 1.2440340370051366
Energy: 1.2609534943468192
Energy: 1.2440340370051366
Energy: 1.2609534943468192
Energy: 1.2440340370051366
Energy: 1.2609534943468192
Energy: 1.2668486014423117
Energy: 1.7150669952683821
Energy: 1.2668486014430531
Energy: 1.7150669952683821
Energy: 1.2668486014430531
Energy: 1.7150669952676405
Energy: 1.2378249919845097
Energy: 1.2113717710397978
Energy: 1.2378249919852509
Energy: 1.2113717710397978
Energy: 1.2378249919845097
Energy: 1.2113717710397978
Energy: 1.2035362594652304
Energy: 1.2665980987122145
Energy: 1.2035362594652304
Energy: 1.2665980987122145
Energy: 1.2035362594652304
Energy: 1.2665980987122145

minimum gb energy = 1.195190774333119 eV
minimum distance =  2.30951155589932 Angstroms
sigma value = 19


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

Energy: 1.3095386726682263
Energy: 1.4234502127522146
Energy: 1.3095386726682263
Energy: 1.4234502127522146
Energy: 1.3095386726682263
Energy: 1.4234502127528543
Energy: 1.435796573852953
Energy: 1.3474463848081737
Energy: 1.435796573853593
Energy: 1.3474463848081737
Energy: 1.435796573853593
Energy: 1.3474463848081737
Energy: 1.3709533738368849
Energy: 1.264299143524522
Energy: 1.3709533738368849
Energy: 1.264299143524522
Energy: 1.3709533738368849
Energy: 1.264299143524522
Energy: 1.2550252568055151
Energy: 1.4225766316949833
Energy: 1.255025256806155
Energy: 1.4225766316962634
Energy: 1.2550252568055151
Energy: 1.4225766316949833
Energy: 1.3606784866578894
Energy: 1.376396489456409
Energy: 1.3606784866578894
Energy: 1.376396489456409
Energy: 1.3606784866572492
Energy: 1.376396489456409
Energy: 1.3497080808454578
Energy: 1.2633741402225387
Energy: 1.3497080808454578
Energy: 1.2633741402231786
Energy: 1.3497080808454578
Energy: 1.2633741402231786
Energy: 1.2648350954420162
Energy: 1.5945256488271766
Energy: 1.2648350954420162
Energy: 1.5945256488425354
Energy: 1.2648350954420162
Energy: 1.5945256488156576
Energy: 1.2881726484856113
Energy: 1.527220325366702
Energy: 1.2881726484856113
Energy: 1.527220325366062
Energy: 1.2881726484856113
Energy: 1.527220325366062
Energy: 1.357810767728479
Energy: 1.2333510922671738
Energy: 1.357810767728479
Energy: 1.2333510922671738
Energy: 1.357810767728479
Energy: 1.2333510922671738
Energy: 1.3818871208696981
Energy: 1.3700907962752573
Energy: 1.381887120869058
Energy: 1.3700907962752573
Energy: 1.3818871208696981
Energy: 1.3700907962752573
Energy: 1.2444327785150586
Energy: 1.4615523065166196
Energy: 1.2444327785150586
Energy: 1.4615523065166196
Energy: 1.2444327785150586
Energy: 1.4615523065166196
Energy: 1.4578496528573754
Energy: 1.2619229128780538
Energy: 1.4578496528573754
Energy: 1.2619229128780538
Energy: 1.4578496528580154
Energy: 1.2619229128774136
Energy: 1.5024205311691634
Energy: 1.2736863742252476
Energy: 1.5024205311698033
Energy: 1.2736863742258873
Energy: 1.5024205311691634
Energy: 1.2736863742252476
Energy: 1.261908593678782
Energy: 1.3357473762156737
Energy: 1.261908593678782
Energy: 1.3357473762156737
Energy: 1.2619085936794217
Energy: 1.3357473762156737
Energy: 1.3851052232285697
Energy: 1.2347243116420397
Energy: 1.3851052232266496
Energy: 1.2347243116420397
Energy: 1.3851052232272896
Energy: 1.2347243116420397
Energy: 1.4802703866874924
Energy: 1.2334010242353595
Energy: 1.4802703866874924
Energy: 1.2334010242353595
Energy: 1.4802703866881324
Energy: 1.2334010242359994
Energy: 1.2715551818323543
Energy: 1.3397469190511992
Energy: 1.2715551818323543
Energy: 1.3397469190511992
Energy: 1.2715551818323543
Energy: 1.3397469190511992
Energy: 1.3456793932935074
Energy: 1.5345506293286069
Energy: 1.3456793932928675
Energy: 1.5345506293286069
Energy: 1.3456793932928675
Energy: 1.5345506293286069
Energy: 1.3941203748284778
Energy: 1.2619997841151447
Energy: 1.3941203748284778
Energy: 1.2619997841151447
Energy: 1.3941203748284778
Energy: 1.2619997841151447
Energy: 1.2703014566754023
Energy: 1.455753701850371
Energy: 1.2703014566760422
Energy: 1.455753701850371
Energy: 1.2703014566754023
Energy: 1.455753701850371
Energy: 1.269064475052918
Energy: 1.5025252067604302
Energy: 1.2690644750535578
Energy: 1.5025252067597903
Energy: 1.2690644750535578
Energy: 1.5025252067597903
Energy: 1.4538209576210916
Energy: 1.2639014787920932
Energy: 1.4538209576210916
Energy: 1.2639014787920932
Energy: 1.4538209576210916
Energy: 1.263901478791453
Energy: 1.4236710018350935
Energy: 1.3402357043519832
Energy: 1.4236710018350935
Energy: 1.3402357043519832
Energy: 1.4236710018350935
Energy: 1.3402357043519832
Energy: 1.2968095255806131
Energy: 1.4601901079127235
Energy: 1.2968095255806131
Energy: 1.4601901079127235
Energy: 1.2968095255806131
Energy: 1.4601901079127235
Energy: 1.4354571976520636
Energy: 1.2640380192173055
Energy: 1.4354571976539834
Energy: 1.2640380192173055
Energy: 1.4354571976539834
Energy: 1.2640380192173055
Energy: 1.5050313958003043
Energy: 1.2796363056230198
Energy: 1.505031395798385
Energy: 1.2796363056230198
Energy: 1.5050313958009445
Energy: 1.2796363056230198
Energy: 1.2373026445418498
Energy: 1.3084804756299553
Energy: 1.2373026445418498
Energy: 1.3084804756299553
Energy: 1.2373026445418498
Energy: 1.3084804756299553
Energy: 1.395792091410277
Energy: 1.2879758476114582
Energy: 1.3957920914089974
Energy: 1.2879758476114582
Energy: 1.3957920914083575
Energy: 1.2879758476108183
Energy: 1.386170049696967
Energy: 1.2622246345258712
Energy: 1.386170049696967
Energy: 1.2622246345258712
Energy: 1.386170049696967
Energy: 1.2622246345252313

minimum gb energy = 1.2333510922671738 eV
minimum distance =  2.2727516655872 Angstroms
sigma value = 101


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

Energy: 1.2383399579558192
Energy: 1.370672862329192
Energy: 1.2383399579558192
Energy: 1.3706728623297546
Energy: 1.2383399579558192
Energy: 1.3706728623297546
Energy: 1.625868469792988
Energy: 1.2513534530674943
Energy: 1.625868469792988
Energy: 1.2513534530669317
Energy: 1.625868469792988
Energy: 1.2513534530669317
Energy: 1.3553606252996862
Energy: 1.217534949368936
Energy: 1.3553606252991235
Energy: 1.2175349493694987
Energy: 1.3553606252991235
Energy: 1.217534949368936
Energy: 1.177818693577427
Energy: 1.6515230955146125
Energy: 1.1778186935768646
Energy: 1.4932696631460438
Energy: 1.177818693577427
Energy: 1.4932696631443563
Energy: 1.2001887729888017
Energy: 1.3266525460483827
Energy: 1.2001887729888017
Energy: 1.3266525460483827
Energy: 1.2001887729888017
Energy: 1.3266525460478202
Energy: 1.3451986092106156
Energy: 1.1974016885155658
Energy: 1.3451986092106156
Energy: 1.1974016885155658
Energy: 1.3451986092106156
Energy: 1.1974016885155658
Energy: 1.213176579435321
Energy: 1.6097265456642778
Energy: 1.213176579435321
Energy: 1.6097265456642778
Energy: 1.2131765794358835
Energy: 1.6097265456648404
Energy: 1.196398240765238
Energy: 1.6551875868963315
Energy: 1.1963982407646754
Energy: 1.4115079963510386
Energy: 1.1963982407646754
Energy: 1.4115079963521637
Energy: 1.3452608624278317
Energy: 1.1989291693766986
Energy: 1.3452608624272693
Energy: 1.1989291693766986
Energy: 1.3452608624272693
Energy: 1.1989291693766986
Energy: 1.2661071022522987
Energy: 1.369760755015878
Energy: 1.2661071022522987
Energy: 1.2827008947748038
Energy: 1.2661071022522987
Energy: 1.2827008947748038
Energy: 1.1766209340755782
Energy: 1.4160959287782102
Energy: 1.1766209340755782
Energy: 1.4160959287782102
Energy: 1.1766209340755782
Energy: 1.4160959287782102
Energy: 1.6158974326005648
Energy: 1.2505661957299998
Energy: 1.6158974326011273
Energy: 1.2131051738909737
Energy: 1.6158974326011273
Energy: 1.2131051738909737
Energy: 1.3080574691367592
Energy: 1.2175402056080675
Energy: 1.3080574691373217
Energy: 1.2175402056080675
Energy: 1.3080574691367592
Energy: 1.2175402056080675
Energy: 1.2383724381138956
Energy: 1.4256053646596152
Energy: 1.2383724381144583
Energy: 1.4256053646596152
Energy: 1.2383724381144583
Energy: 1.4256053646590527
Energy: 1.3273707345389105
Energy: 1.298109015893607
Energy: 1.3273707345394734
Energy: 1.2981090158941697
Energy: 1.3273707345389105
Energy: 1.298109015893607
Energy: 1.4937977631161525
Energy: 1.2204118945092155
Energy: 1.4937977631161525
Energy: 1.220411894509778
Energy: 1.4937977631161525
Energy: 1.220411894509778
Energy: 1.1765762667364341
Energy: 1.6121922384870033
Energy: 1.1765762667364341
Energy: 1.6121922384870033
Energy: 1.1765762667364341
Energy: 1.6121922384870033
Energy: 1.176930237451404
Energy: 1.4807031668558566
Energy: 1.1769302374519666
Energy: 1.4807031668558566
Energy: 1.176930237451404
Energy: 1.4807031668558566
Energy: 1.3448764300796363
Energy: 1.1975010983326793
Energy: 1.3448764300796363
Energy: 1.197501098332117
Energy: 1.344876430080199
Energy: 1.197501098332117
Energy: 1.289294067371426
Energy: 1.4796772715076356
Energy: 1.2892940673719884
Energy: 1.4796772715076356
Energy: 1.289294067371426
Energy: 1.4796772715076356
Energy: 1.1963379310838242
Energy: 1.499839925776971
Energy: 1.1963379310838242
Energy: 1.4998399257764086
Energy: 1.1963379310832616
Energy: 1.499839925776971
Energy: 1.5884378873531462
Energy: 1.1972878022285685
Energy: 1.5884378873531462
Energy: 1.1972878022285685
Energy: 1.5884378873531462
Energy: 1.197287802229131
Energy: 1.298049832827417
Energy: 1.1974246353352236
Energy: 1.2980498328279795
Energy: 1.197424635335786
Energy: 1.2980498328279795
Energy: 1.197424635335786
Energy: 1.1774199263266587
Energy: 1.3205725898591958
Energy: 1.1774199263266587
Energy: 1.3205725898591958
Energy: 1.1774199263272211
Energy: 1.3205725898591958
Energy: 1.6507011551590176
Energy: 1.2277993789418304
Energy: 1.6507011551590176
Energy: 1.2277993789418304
Energy: 1.6507011551590176
Energy: 1.2277993789418304
Energy: 1.454930573936182
Energy: 1.2198594833543825
Energy: 1.454930573936182
Energy: 1.2198594833538199
Energy: 1.454930573936182
Energy: 1.2198594833538199
Energy: 1.238251494090433
Energy: 1.5209199203795896
Energy: 1.238251494090433
Energy: 1.5209199203795896
Energy: 1.238251494090433
Energy: 1.520919920380152
Energy: 1.3300916574106845
Energy: 1.3579170612227298
Energy: 1.3300916574112471
Energy: 1.3579170612221674
Energy: 1.3300916574118098
Energy: 1.3579170612227298
Energy: 1.3204895497169784
Energy: 1.217344617138953
Energy: 1.320489549717541
Energy: 1.2173446171395155
Energy: 1.320489549717541
Energy: 1.2173446171395155
Energy: 1.177745743398519
Energy: 1.5907387932461419
Energy: 1.1777457433980076
Energy: 1.5907387932461419
Energy: 1.1777457433990817
Energy: 1.5907387932461419
Energy: 1.176563873383055
Energy: 1.2500520967556088
Energy: 1.1765638733841801
Energy: 1.2500520967556088
Energy: 1.1765638733841801
Energy: 1.2500520967556088
Energy: 1.4106892809259035
Energy: 1.197160439355387
Energy: 1.4106892809208407
Energy: 1.1971604393548243
Energy: 1.4106892809287164
Energy: 1.1971604393548243
Energy: 1.4475723877260593
Energy: 1.1973774639836299
Energy: 1.4475724006369641
Energy: 1.1973774639836299
Energy: 1.4475723919792698
Energy: 1.1973774639836299

minimum gb energy = 1.176563873383055 eV
minimum distance =  2.29326062332479 Angstroms
sigma value = 33


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

Energy: 0.02052193273580114
Energy: 1.1292642667012742
Energy: 0.02052193273580114
Energy: 1.1292642667008068
Energy: 0.02052193273580114
Energy: 1.1292642667012742
Energy: 0.021257524453646686
Energy: 1.8142222641867956
Energy: 0.021257524453646686
Energy: 1.8142222641886134
Energy: 0.021257524453646686
Energy: 1.8142222641895482
Energy: 1.1302307357931307
Energy: 0.4612406222742015
Energy: 1.1302307358173316
Energy: 0.46124062227373397
Energy: 1.130230735821902
Energy: 0.46124062227508433
Energy: 0.02125752445276382
Energy: 1.8142222641890808
Energy: 0.021257524453646686
Energy: 1.8142222641895482
Energy: 0.021257524453646686
Energy: 1.814222264188146

minimum gb energy = 0.02052193273580114 eV
minimum distance =  2.44519001787328 Angstroms
sigma value = 1