Model name: model_name=MEAM_LAMMPS_ChoiKimSeol_2017_CoFe__MO_179158257180_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.863657310605049
cohesive_energy=4.290337405585514
mass=55.845
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: 0.013214709935783601
Energy: 0.013781140705432827
Energy: 0.013319754575489458
Energy: 0.013781140705432827
Energy: 0.013214709936255597
Energy: 0.013781140705432827
Energy: 0.013781140705432827
Energy: 2.5539246660584713
Energy: 0.013781140705932587
Energy: 2.553924666057999
Energy: 0.013781140705432827
Energy: 2.553924666057999
Energy: 0.013319754575489458
Energy: 0.013781140705432827
Energy: 0.013214709936255597
Energy: 0.013781140705432827
Energy: 0.013319754575489458
Energy: 0.013781140705932587
Energy: 0.013781140705432827
Energy: 2.553924666057999
Energy: 0.013781140705432827
Energy: 2.553924666057999
Energy: 0.013781140705432827
Energy: 2.553924666057999
Energy: 0.013214709935783601
Energy: 0.013781140705432827
Energy: 0.013319754575489458
Energy: 0.013781140705432827
Energy: 0.013214709936255597
Energy: 0.013781140705432827
Energy: 0.013781140705432827
Energy: 2.553924666057999
Energy: 0.013781140705432827
Energy: 2.553924666057999
Energy: 0.013781140705432827
Energy: 2.5539246660584713

minimum gb energy = 0.013214709935783601 eV
minimum distance =  2.40177645967196 Angstroms
sigma value = 1


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

Energy: 1.2990869568584482
Energy: 1.274160836037642
Energy: 1.2211878970415175
Energy: 1.274160836037642
Energy: 1.2990869568584482
Energy: 1.274160836037642
Energy: 1.2696143786206762
Energy: 1.2529564736688317
Energy: 1.2048118980355123
Energy: 1.2529564736676289
Energy: 1.2696143786206762
Energy: 1.2529564736676289
Energy: 1.2140239591915811
Energy: 1.2527286175364705
Energy: 1.2910632217763265
Energy: 1.2527286175364705
Energy: 1.2140239591915811
Energy: 1.2527286175364705
Energy: 1.361378291386352
Energy: 1.2332667348132118
Energy: 1.2121120524898188
Energy: 1.2332667348120088
Energy: 1.361378291386352
Energy: 1.2332667348120088
Energy: 1.3230206410220906
Energy: 1.2748192053646594
Energy: 1.2578969037346268
Energy: 1.2748192053634564
Energy: 1.3230206410220906
Energy: 1.2748192053634564
Energy: 1.2909150959987943
Energy: 1.2521983268756505
Energy: 1.2211695547118155
Energy: 1.2521983268756505
Energy: 1.2909150959987943
Energy: 1.2521983268744477
Energy: 1.2919874993051461
Energy: 1.252397667220931
Energy: 1.219138526954367
Energy: 1.252397667220931
Energy: 1.2919874993051461
Energy: 1.252397667220931
Energy: 1.3488770558974654
Energy: 1.2747391092051439
Energy: 1.201908113745853
Energy: 1.2747391092051439
Energy: 1.3488770558962624
Energy: 1.2747391092039408
Energy: 1.3578765383819378
Energy: 1.2335172038495903
Energy: 1.210678572011012
Energy: 1.2335172038495903
Energy: 1.3578765383819378
Energy: 1.2335172038507933
Energy: 1.293670169136315
Energy: 1.2526565962669722
Energy: 1.2221014284675715
Energy: 1.2526565962669722
Energy: 1.2936701691351118
Energy: 1.2526565962669722
Energy: 1.2578276641266382
Energy: 1.2429882145787756
Energy: 1.276981836682208
Energy: 1.2429882145787756
Energy: 1.2578276641266382
Energy: 1.2429882145787756
Energy: 1.2038314795372231
Energy: 1.2744706192036355
Energy: 1.204396224922405
Energy: 1.2744706192024322
Energy: 1.2038314795372231
Energy: 1.2744706192024322
Energy: 1.2770639729891942
Energy: 1.2429882145799784
Energy: 1.2556107593123054
Energy: 1.2429882145787756
Energy: 1.2770639729891942
Energy: 1.2429882145787756
Energy: 1.2221011831003012
Energy: 1.2526600638604164
Energy: 1.2936462988464776
Energy: 1.2526600638604164
Energy: 1.2221011831003012
Energy: 1.2526600638604164
Energy: 1.2106017914720453
Energy: 1.2332638790495385
Energy: 1.3579008322939305
Energy: 1.2332638790507415
Energy: 1.2106017914720453
Energy: 1.2332638790507415
Energy: 1.2019013363373552
Energy: 1.2746020846369754
Energy: 1.3483128381488179
Energy: 1.2746020846369754
Energy: 1.201901336338558
Energy: 1.2746020846369754
Energy: 1.219156785219552
Energy: 1.2525999504005514
Energy: 1.2918762466098583
Energy: 1.2525999504005514
Energy: 1.219156785219552
Energy: 1.2525999504005514
Energy: 1.2211516024763192
Energy: 1.2521955001607228
Energy: 1.2908775567000037
Energy: 1.2521955001619258
Energy: 1.2211516024763192
Energy: 1.2521955001619258
Energy: 1.2550700745473522
Energy: 1.2748613520261871
Energy: 1.3236397966679445
Energy: 1.2748613520261871
Energy: 1.2550700745461492
Energy: 1.2748613520261871
Energy: 1.2121244584855535
Energy: 1.233274732913543
Energy: 1.361374987539032
Energy: 1.233274732913543
Energy: 1.2121244584855535
Energy: 1.233274732913543
Energy: 1.291134784395051
Energy: 1.2527213551135152
Energy: 1.214035211362568
Energy: 1.2527213551135152
Energy: 1.291134784395051
Energy: 1.2527213551135152
Energy: 1.2061954578892917
Energy: 1.252972109155948
Energy: 1.2697103004733543
Energy: 1.252972109155948
Energy: 1.2061954578892917
Energy: 1.252972109155948
Energy: 1.2211878970439236
Energy: 1.274160836037642
Energy: 1.299086956857245
Energy: 1.274160836037642
Energy: 1.2211878970427203
Energy: 1.274160836037642

minimum gb energy = 1.2019013363373552 eV
minimum distance =  2.28940090997928 Angstroms
sigma value = 33


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

Energy: 1.7787232376457638
Energy: 1.3447375937400976
Energy: 1.3028863719779216
Energy: 1.344737593740782
Energy: 1.7787232376457638
Energy: 1.344737593740782
Energy: 1.280323396234261
Energy: 1.3123924035563133
Energy: 1.2947071900694263
Energy: 1.3123924035563133
Energy: 1.280323396234261
Energy: 1.3123924035563133
Energy: 1.2552018272613723
Energy: 1.342342511375466
Energy: 1.4200745482349415
Energy: 1.342342511375466
Energy: 1.2552018272613723
Energy: 1.3423425113761502
Energy: 1.2952260787050127
Energy: 1.3001517114593495
Energy: 1.447933801805199
Energy: 1.3001517114593495
Energy: 1.2952260787050127
Energy: 1.3001517114593495
Energy: 1.2954725829644271
Energy: 1.3206983830253758
Energy: 1.355600635209802
Energy: 1.3206983830253758
Energy: 1.295472582963743
Energy: 1.3206983830253758
Energy: 1.2877978020490606
Energy: 1.321830910716464
Energy: 1.2707875342471968
Energy: 1.321830910716464
Energy: 1.2877978020490606
Energy: 1.321830910716464
Energy: 1.2881931975430692
Energy: 1.3217164060111612
Energy: 1.3159071333141734
Energy: 1.3217164060111612
Energy: 1.2881931975437533
Energy: 1.3217164060111612
Energy: 1.271124066014745
Energy: 1.321004246075867
Energy: 1.3519067930700046
Energy: 1.321004246075867
Energy: 1.271124066014745
Energy: 1.321004246075867
Energy: 1.2947729138245818
Energy: 1.3001148268361098
Energy: 1.2881002758048314
Energy: 1.3001148268361098
Energy: 1.2947729138238975
Energy: 1.3001148268361098
Energy: 1.287493602827885
Energy: 1.3423648156502008
Energy: 1.2941780159738805
Energy: 1.3423648156508852
Energy: 1.287493602827885
Energy: 1.3423648156508852
Energy: 1.2799475084146013
Energy: 1.3147772517682996
Energy: 1.294907716609278
Energy: 1.3147772517689837
Energy: 1.2799475084146013
Energy: 1.3147772517689837
Energy: 1.416505203969914
Energy: 1.3213484980660926
Energy: 1.2936446396903625
Energy: 1.3213484980654082
Energy: 1.416505203969914
Energy: 1.3213484980660926
Energy: 1.4623243071041998
Energy: 1.310242232704548
Energy: 1.3077209797343463
Energy: 1.310242232704548
Energy: 1.4623243071041998
Energy: 1.310242232704548
Energy: 1.3488488094710536
Energy: 1.341899163473407
Energy: 1.293728024586047
Energy: 1.341899163473407
Energy: 1.3488488094710536
Energy: 1.341899163473407
Energy: 1.416770607235695
Energy: 1.3206558910914972
Energy: 1.3913160057657428
Energy: 1.3206558910914972
Energy: 1.4167706072363793
Energy: 1.3206558910914972
Energy: 1.4168330163115737
Energy: 1.320623107245732
Energy: 1.2821730013303136
Energy: 1.320623107245732
Energy: 1.4168330163115737
Energy: 1.320623107245732
Energy: 1.4321797532680083
Energy: 1.321660026691528
Energy: 1.2941877632947227
Energy: 1.321660026691528
Energy: 1.4321797532680083
Energy: 1.321660026691528
Energy: 1.4671743562309332
Energy: 1.311711443137736
Energy: 1.4671500533323385
Energy: 1.3117114431384203
Energy: 1.4671743562309332
Energy: 1.3117114431384203
Energy: 1.2705516097143275
Energy: 1.3211102736341875
Energy: 1.3209942496812337
Energy: 1.3211102736341875
Energy: 1.2705516097136431
Energy: 1.3211102736341875
Energy: 1.294369314794244
Energy: 1.3000216543858538
Energy: 1.2887424186113619
Energy: 1.3000216543858538
Energy: 1.294369314794244
Energy: 1.3000216543858538
Energy: 1.416764851156942
Energy: 1.3424056434141922
Energy: 1.2851214483840603
Energy: 1.3424056434141922
Energy: 1.416764851156942
Energy: 1.3424056434141922
Energy: 1.2792040401160931
Energy: 1.3154826592977642
Energy: 1.294636967199025
Energy: 1.31548265929708
Energy: 1.2792040401167777
Energy: 1.31548265929708
Energy: 1.293949687965874
Energy: 1.3214885252084412
Energy: 1.3558718288453555
Energy: 1.3214885252084412
Energy: 1.293949687965874
Energy: 1.3214885252084412
Energy: 1.4561451289821374
Energy: 1.311875365397806
Energy: 1.2942740284279632
Energy: 1.311875365397806
Energy: 1.4561451289828218
Energy: 1.311875365397806
Energy: 1.315518895124139
Energy: 1.3232221450032444
Energy: 1.4177940402386473
Energy: 1.3232221450039285
Energy: 1.3155188951234549
Energy: 1.3232221450032444
Energy: 1.29457253082633
Energy: 1.3423525179214346
Energy: 1.317473078512696
Energy: 1.3423525179214346
Energy: 1.29457253082633
Energy: 1.3423525179214346
Energy: 1.2945741090702512
Energy: 1.3423417955578418
Energy: 1.31595359400408
Energy: 1.3423417955578418
Energy: 1.2945741090702512
Energy: 1.3423417955578418
Energy: 1.3155304051665553
Energy: 1.3232042326236662
Energy: 1.4182348112680365
Energy: 1.3232042326229818
Energy: 1.3155304051665553
Energy: 1.3232042326229818
Energy: 1.4561549630024946
Energy: 1.311876987876877
Energy: 1.2941687893869878
Energy: 1.311876987876877
Energy: 1.456154963003179
Energy: 1.311876987876877
Energy: 1.2941513317258924
Energy: 1.32148543661148
Energy: 1.4324182586794165
Energy: 1.32148543661148
Energy: 1.294151331725208
Energy: 1.32148543661148
Energy: 1.2808019218270668
Energy: 1.3154826592957114
Energy: 1.2946251628626533
Energy: 1.3154826592957114
Energy: 1.2808019218277513
Energy: 1.3154826592957114
Energy: 1.416767176307418
Energy: 1.3424127350693353
Energy: 1.2850894316562351
Energy: 1.3424127350693353
Energy: 1.416767176307418
Energy: 1.3424127350693353
Energy: 1.294367879482782
Energy: 1.3002373968057022
Energy: 1.2890753628366203
Energy: 1.3002373968057022
Energy: 1.2943678794820974
Energy: 1.3002373968057022
Energy: 1.270562279230476
Energy: 1.3211084507400808
Energy: 1.351772920025256
Energy: 1.3211084507400808
Energy: 1.270562279230476
Energy: 1.3211084507400808
Energy: 1.4671280619268012
Energy: 1.3117062628264418
Energy: 1.3909271604986468
Energy: 1.3117062628264418
Energy: 1.4671280619268012
Energy: 1.3117062628257574
Energy: 1.4314538864980244
Energy: 1.3214788309703023
Energy: 1.2940916519620356
Energy: 1.3214788309703023
Energy: 1.4314538864966562
Energy: 1.3214788309703023
Energy: 1.4165188001463274
Energy: 1.3205398470883933
Energy: 1.314412862177731
Energy: 1.3205398470883933
Energy: 1.4165188001463274
Energy: 1.3205398470883933
Energy: 1.4169054185088974
Energy: 1.320685187411615
Energy: 1.391545817607303
Energy: 1.320685187411615
Energy: 1.4169054185095813
Energy: 1.320685187411615
Energy: 1.3488113503513246
Energy: 1.341866451501188
Energy: 1.2935283875452912
Energy: 1.341866451501188
Energy: 1.3488113503513246
Energy: 1.341866451501188
Energy: 1.4623346465975389
Energy: 1.3102465886547512
Energy: 1.3080110679032084
Energy: 1.3102465886547512
Energy: 1.4623346465975389
Energy: 1.3102465886547512
Energy: 1.4164916768881384
Energy: 1.321132926521467
Energy: 1.3144152922419579
Energy: 1.321132926521467
Energy: 1.4164916768881384
Energy: 1.321132926521467

minimum gb energy = 1.2552018272613723 eV
minimum distance =  2.25972322411468 Angstroms
sigma value = 51


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

Energy: 1.5268468686013197
Energy: 1.3612367926096718
Energy: 1.4000930131527305
Energy: 1.3612367926112572
Energy: 1.5268468686013197
Energy: 1.3612367926096718
Energy: 1.267311436904297
Energy: 1.3596423426402142
Energy: 1.5952101802912357
Energy: 1.3596423426402142
Energy: 1.2673114369027116
Energy: 1.3596423426386288
Energy: 1.2665298902436217
Energy: 1.3613213261359374
Energy: 1.4160883393414567
Energy: 1.3613213261343518
Energy: 1.2665298902436217
Energy: 1.3613213261343518
Energy: 1.2802139473368275
Energy: 1.3129816555476286
Energy: 1.5964394604064
Energy: 1.3129816555476286
Energy: 1.2802139473368275
Energy: 1.3129816555476286
Energy: 1.2668612978177427
Energy: 1.3170489388435644
Energy: 1.3963520607685853
Energy: 1.3170489388419793
Energy: 1.2668612978177427
Energy: 1.3170489388419793
Energy: 1.5267205936586006
Energy: 1.3129552508959994
Energy: 1.6450977034820076
Energy: 1.3129552508975848
Energy: 1.5267205936601862
Energy: 1.3129552508975848
Energy: 1.5272482610644018
Energy: 1.3157895925847087
Energy: 1.3959341548302708
Energy: 1.3157895925862941
Energy: 1.5272482610644018
Energy: 1.3157895925862941
Energy: 1.2807735318633646
Energy: 1.3131227205537697
Energy: 1.2486251442226288
Energy: 1.3131227205537697
Energy: 1.2807735318633646
Energy: 1.3131227205537697
Energy: 1.5274617410197082
Energy: 1.3400793822003871
Energy: 1.2514091062499537
Energy: 1.3400793822003871
Energy: 1.5274617410197082
Energy: 1.3400793822003871
Energy: 1.2665969137409745
Energy: 1.3625809032746865
Energy: 1.2485413091391684
Energy: 1.3625809032731013
Energy: 1.2665969137409745
Energy: 1.3625809032731013
Energy: 1.598931209873018
Energy: 1.314341389085745
Energy: 1.5947773321819403
Energy: 1.314341389085745
Energy: 1.598931209873018
Energy: 1.314341389085745
Energy: 1.526472994399166
Energy: 1.3622041197431094
Energy: 1.6398623991347754
Energy: 1.3622041197431094
Energy: 1.526472994399166
Energy: 1.3622041197431094
Energy: 1.408983668886429
Energy: 1.313072249390147
Energy: 1.59483109493027
Energy: 1.313072249390147
Energy: 1.4089836688848434
Energy: 1.313072249390147
Energy: 1.266224383595306
Energy: 1.3620915857392484
Energy: 1.594828551709679
Energy: 1.3620915857392484
Energy: 1.266224383595306
Energy: 1.3620915857392484
Energy: 1.2662902598005614
Energy: 1.3667345292885607
Energy: 1.5959712579226857
Energy: 1.3667345292885607
Energy: 1.2662902598005614
Energy: 1.3667345292885607
Energy: 1.267213109532328
Energy: 1.3167634183976418
Energy: 1.5945495670870258
Energy: 1.3167634183976418
Energy: 1.267213109532328
Energy: 1.3167634183976418
Energy: 1.5270784333821232
Energy: 1.367042203519881
Energy: 1.6381950153973432
Energy: 1.367042203519881
Energy: 1.5270784333821232
Energy: 1.367042203519881
Energy: 1.5266157048260272
Energy: 1.318746367060234
Energy: 1.5943160870029467
Energy: 1.318746367060234
Energy: 1.5266157048260272
Energy: 1.318746367060234

minimum gb energy = 1.2485413091391684 eV
minimum distance =  2.25343585876189 Angstroms
sigma value = 19


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

Energy: 1.6530436510643296
Energy: 1.4215708401332234
Energy: 1.3176415070350045
Energy: 1.4215708401332234
Energy: 1.6530436510643296
Energy: 1.4215708401332234
Energy: 1.3013561813348116
Energy: 1.404937788121843
Energy: 1.340496926496018
Energy: 1.404937788121843
Energy: 1.3013561813348116
Energy: 1.404937788121843
Energy: 1.283979279172512
Energy: 1.415489757930266
Energy: 1.442657386967894
Energy: 1.415489757930266
Energy: 1.283979279172512
Energy: 1.415489757930266
Energy: 1.379300056105233
Energy: 1.389204586380139
Energy: 1.3402214905152827
Energy: 1.389204586380139
Energy: 1.379300056105233
Energy: 1.389204586380139
Energy: 1.3165262361435819
Energy: 1.4217961712514646
Energy: 1.3934368228808591
Energy: 1.4217961712514646
Energy: 1.3165262361435819
Energy: 1.4217961712514646
Energy: 1.3928248122888196
Energy: 1.4217826431455287
Energy: 1.3168204250664879
Energy: 1.4217826431455287
Energy: 1.3928248122888196
Energy: 1.4217826431455287
Energy: 1.3404620734229338
Energy: 1.3892054810024623
Energy: 1.3792724156427152
Energy: 1.3892054810024623
Energy: 1.3404620734238741
Energy: 1.3892054810024623
Energy: 1.4427247377832544
Energy: 1.4154918292394365
Energy: 1.2839673793646385
Energy: 1.4154918292394365
Energy: 1.4427247377832544
Energy: 1.4154918292394365
Energy: 1.340395742974493
Energy: 1.4048274651649832
Energy: 1.284033910300754
Energy: 1.4048274651649832
Energy: 1.340395742974493
Energy: 1.4048274651649832
Energy: 1.3176415070350045
Energy: 1.4215708401332234
Energy: 1.6530436510643296
Energy: 1.4215708401332234
Energy: 1.3176415070340641
Energy: 1.4215708401332234
Energy: 1.3404969264950777
Energy: 1.404937788121843
Energy: 1.317112953671456
Energy: 1.404937788121843
Energy: 1.3404969264950777
Energy: 1.4049377881227834
Energy: 1.442657386967894
Energy: 1.4154897579312065
Energy: 1.283979279172512
Energy: 1.4154897579312065
Energy: 1.442657386967894
Energy: 1.4154897579312065
Energy: 1.3402214905152827
Energy: 1.3892045863810794
Energy: 1.379300056105233
Energy: 1.389204586380139
Energy: 1.3402214905152827
Energy: 1.389204586380139
Energy: 1.3934368228817993
Energy: 1.4217961712514646
Energy: 1.3165262361426415
Energy: 1.4217961712514646
Energy: 1.3934368228808591
Energy: 1.4217961712514646
Energy: 1.3168204250664879
Energy: 1.4217826431455287
Energy: 1.3928248122888196
Energy: 1.4217826431455287
Energy: 1.3168204250664879
Energy: 1.4217826431455287
Energy: 1.3792724156417748
Energy: 1.389205481001522
Energy: 1.3404620734229338
Energy: 1.389205481001522
Energy: 1.3792724156417748
Energy: 1.3892054810024623
Energy: 1.2839673793646385
Energy: 1.4154918292384961
Energy: 1.4427247377832544
Energy: 1.4154918292394365
Energy: 1.2839673793646385
Energy: 1.4154918292394365
Energy: 1.284033910300754
Energy: 1.4048274651659236
Energy: 1.340395742974493
Energy: 1.4048274651649832
Energy: 1.284033910300754
Energy: 1.4048274651659236
Energy: 1.6530436510643296
Energy: 1.4215708401332234
Energy: 1.3176415070350045
Energy: 1.4215708401332234
Energy: 1.6530436510643296
Energy: 1.4215708401332234
Energy: 1.2840023725370275
Energy: 1.404937788121843
Energy: 1.3404969264950777
Energy: 1.404937788121843
Energy: 1.2840023725370275
Energy: 1.404937788121843
Energy: 1.283979279172512
Energy: 1.415489757930266
Energy: 1.442657386967894
Energy: 1.415489757930266
Energy: 1.283979279172512
Energy: 1.415489757930266
Energy: 1.379300056105233
Energy: 1.389204586380139
Energy: 1.3402214905152827
Energy: 1.389204586380139
Energy: 1.379300056105233
Energy: 1.389204586380139
Energy: 1.3165262361435819
Energy: 1.4217961712514646
Energy: 1.3934368228808591
Energy: 1.4217961712505243
Energy: 1.3165262361435819
Energy: 1.4217961712514646
Energy: 1.3928248122888196
Energy: 1.4217826431455287
Energy: 1.3168204250664879
Energy: 1.4217826431455287
Energy: 1.3928248122888196
Energy: 1.4217826431455287
Energy: 1.3404620734229338
Energy: 1.3892054810024623
Energy: 1.3492886191301139
Energy: 1.3892054810024623
Energy: 1.3404620734238741
Energy: 1.3892054810024623
Energy: 1.442724737784195
Energy: 1.4154918292394365
Energy: 1.2839673793646385
Energy: 1.4154918292394365
Energy: 1.4427247377832544
Energy: 1.4154918292394365
Energy: 1.340395742974493
Energy: 1.4048274651649832
Energy: 1.284033910300754
Energy: 1.4048274651649832
Energy: 1.3403957429735525
Energy: 1.4048274651649832
Energy: 1.3176415070350045
Energy: 1.4215708401332234
Energy: 1.6530436510643296
Energy: 1.4215708401332234
Energy: 1.3176415070350045
Energy: 1.4215708401332234
Energy: 1.3404969264950777
Energy: 1.404937788121843
Energy: 1.2840023725360872
Energy: 1.404937788121843
Energy: 1.3404969264950777
Energy: 1.404937788121843
Energy: 1.442657386967894
Energy: 1.4154897579312065
Energy: 1.283979279172512
Energy: 1.4154897579312065
Energy: 1.442657386967894
Energy: 1.4154897579312065

minimum gb energy = 1.2839673793646385 eV
minimum distance =  2.24758623249896 Angstroms
sigma value = 27


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

Energy: 1.1923054889455171
Energy: 1.3333858188705738
Energy: 1.248616571050673
Energy: 1.3333858188705738
Energy: 1.1923054889455171
Energy: 1.3333858188705738
Energy: 1.182806839561787
Energy: 1.3078656912558162
Energy: 1.2121090461220794
Energy: 1.3078656912560518
Energy: 1.1828068395615514
Energy: 1.3078656912560518
Energy: 1.212965392671603
Energy: 1.49563448755116
Energy: 1.2137621452455385
Energy: 1.49563448755116
Energy: 1.212965392671603
Energy: 1.49563448755116
Energy: 1.188721650047495
Energy: 1.3350623966434996
Energy: 1.212453717404598
Energy: 1.3350623966434996
Energy: 1.188721650047495
Energy: 1.3350623966434996
Energy: 1.2402033085212532
Energy: 1.3340130563478512
Energy: 1.2090077273856665
Energy: 1.3340130563476418
Energy: 1.2402033085210178
Energy: 1.3340130563476418
Energy: 1.2122704477258455
Energy: 1.497611726861818
Energy: 1.212442205969479
Energy: 1.497611726861818
Energy: 1.2122704477256099
Energy: 1.4976117268620537
Energy: 1.2130822118426237
Energy: 1.3105369670792342
Energy: 1.2129859802783174
Energy: 1.3105369670792342
Energy: 1.2130822118426237
Energy: 1.3105369670797054
Energy: 1.1886966389486695
Energy: 1.3341870523029427
Energy: 1.2126270905922136
Energy: 1.3341870523031782
Energy: 1.1886966389486695
Energy: 1.334187052303414
Energy: 1.2127558310202502
Energy: 1.3345323898173411
Energy: 1.1824468177820842
Energy: 1.3345323898171058
Energy: 1.212755831020486
Energy: 1.3345323898171058
Energy: 1.2125849589143538
Energy: 1.4960061790776573
Energy: 1.2125694762621169
Energy: 1.4960061790776573
Energy: 1.2125849589143538
Energy: 1.4960061790776573
Energy: 1.183894695149487
Energy: 1.3345028833030679
Energy: 1.212855479973874
Energy: 1.334502883302832
Energy: 1.183894695149042
Energy: 1.334502883302623
Energy: 1.2127353780967767
Energy: 1.3341833621942105
Energy: 1.1887374318163588
Energy: 1.3341833621944459
Energy: 1.2127353780967767
Energy: 1.3341833621944459

minimum gb energy = 1.1824468177820842 eV
minimum distance =  2.26538981787518 Angstroms
sigma value = 9


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

Energy: 1.6614274381966232
Energy: 1.5073120593102467
Energy: 1.322809896016127
Energy: 1.5073120593102467
Energy: 1.6614274381966232
Energy: 1.5073120593102467
Energy: 1.3643686466421758
Energy: 1.4895866328897773
Energy: 1.325078715359312
Energy: 1.4895866328897773
Energy: 1.3643686466421758
Energy: 1.4895866328897773
Energy: 1.3261872030007356
Energy: 1.489665648112476
Energy: 1.3252146313988196
Energy: 1.489665648112476
Energy: 1.3261872030007356
Energy: 1.489665648112476
Energy: 1.286372711528446
Energy: 1.462082446818559
Energy: 1.25181884561779
Energy: 1.462082446818559
Energy: 1.286372711528446
Energy: 1.462082446818559
Energy: 1.2850335270665156
Energy: 1.4608482998895538
Energy: 1.2718207591975452
Energy: 1.4608482998889065
Energy: 1.2850335270665156
Energy: 1.4608482998889065
Energy: 1.2626666431360043
Energy: 1.4458450165732788
Energy: 1.3255763179990367
Energy: 1.4458450165739258
Energy: 1.2626666431360043
Energy: 1.4458450165732788
Energy: 1.416090984725539
Energy: 1.4750320738301874
Energy: 1.3231592611394636
Energy: 1.4750320738301874
Energy: 1.416090984725539
Energy: 1.4750320738301874
Energy: 1.4741119858918903
Energy: 1.4619860358561074
Energy: 1.3425133127371207
Energy: 1.4619860358561074
Energy: 1.4741119858918903
Energy: 1.4619860358567545
Energy: 1.323340179102426
Energy: 1.4178479250011875
Energy: 1.3449231176148002
Energy: 1.4178479250011875
Energy: 1.323340179105015
Energy: 1.4178479250011875
Energy: 1.4695586151217717
Energy: 1.4906469050346285
Energy: 1.284283969451885
Energy: 1.4906469050346285
Energy: 1.4695586151217717
Energy: 1.4906469050346285
Energy: 1.359106638255111
Energy: 1.4549070867079639
Energy: 1.3251200724188172
Energy: 1.4549070867079639
Energy: 1.3591066382557582
Energy: 1.4549070867079639
Energy: 1.3397233541031246
Energy: 1.4620093768958096
Energy: 1.3347410671254456
Energy: 1.4620093768958096
Energy: 1.3397233541031246
Energy: 1.462009376895162
Energy: 1.2615962457770136
Energy: 1.4095024508931926
Energy: 1.2571277851078917
Energy: 1.4095024508925453
Energy: 1.2615962457770136
Energy: 1.4095024508931926
Energy: 1.4155080648611527
Energy: 1.4911264474626917
Energy: 1.2559045776388844
Energy: 1.4911264474626917
Energy: 1.4155080648611527
Energy: 1.4911264474626917
Energy: 1.3421023558879168
Energy: 1.4644911489043355
Energy: 1.3262719018664408
Energy: 1.4644911489043355
Energy: 1.3421023558879168
Energy: 1.4644911489043355
Energy: 1.3525612306367545
Energy: 1.4472137960327085
Energy: 1.3344320062252326
Energy: 1.4472137960327085
Energy: 1.3525612306367545
Energy: 1.4472137960333558
Energy: 1.3335456956387457
Energy: 1.493194338489513
Energy: 1.2852833614704824
Energy: 1.493194338489513
Energy: 1.3335456956387457
Energy: 1.493194338489513
Energy: 1.253193660122412
Energy: 1.407767169890613
Energy: 1.3376653349820293
Energy: 1.4077671698899656
Energy: 1.2531936601217648
Energy: 1.4077671698899656
Energy: 1.3254604272654744
Energy: 1.4947154366563378
Energy: 1.2615216619525575
Energy: 1.4947154366563378
Energy: 1.3254604272648272
Energy: 1.494715436656985
Energy: 1.2616581833531098
Energy: 1.5390163573167435
Energy: 1.2613757084090285
Energy: 1.5390163573167435
Energy: 1.2616581833524623
Energy: 1.5390163573167435
Energy: 1.2614459764471544
Energy: 1.4947485809744299
Energy: 1.3250047169793575
Energy: 1.4947485809744299
Energy: 1.2614459764471544
Energy: 1.4947485809744299
Energy: 1.3389592850954333
Energy: 1.407785410420755
Energy: 1.252733178337865
Energy: 1.407785410420755
Energy: 1.3389592850954333
Energy: 1.407785410420755
Energy: 1.2849432853226876
Energy: 1.4930116371837934
Energy: 1.3333834465144572
Energy: 1.4930116371844404
Energy: 1.2849432853226876
Energy: 1.4930116371844404
Energy: 1.3342720150131677
Energy: 1.447285596017299
Energy: 1.3525335320182967
Energy: 1.4472855960166517
Energy: 1.3342720150131677
Energy: 1.4472855960166517
Energy: 1.326243784696814
Energy: 1.4640957251129865
Energy: 1.3420788732906983
Energy: 1.4640957251129865
Energy: 1.326243784696814
Energy: 1.4640957251129865
Energy: 1.2557883813778752
Energy: 1.491111720093902
Energy: 1.4154805515930466
Energy: 1.491111720093902
Energy: 1.255788381377228
Energy: 1.491111720093902
Energy: 1.2572912111367693
Energy: 1.4095276505556043
Energy: 1.2616231412652361
Energy: 1.4095276505556043
Energy: 1.2572912111354748
Energy: 1.4095276505556043
Energy: 1.3347474293174257
Energy: 1.461965673971661
Energy: 1.3398598948099916
Energy: 1.4619656739723084
Energy: 1.3347474293174257
Energy: 1.4619656739723084
Energy: 1.3251557712738373
Energy: 1.4549770781225115
Energy: 1.3231071409350328
Energy: 1.454977078121864
Energy: 1.3251557712738373
Energy: 1.454977078121864
Energy: 1.2842738827374904
Energy: 1.4906487256696768
Energy: 1.4695777408861481
Energy: 1.4906487256696768
Energy: 1.2842738827381377
Energy: 1.4906487256696768
Energy: 1.339340817638204
Energy: 1.4178479250011875
Energy: 1.3236004916614106
Energy: 1.4178479250011875
Energy: 1.339340817638204
Energy: 1.4178479250005402
Energy: 1.3425654460818264
Energy: 1.4619812504391863
Energy: 1.4741034270896023
Energy: 1.4619812504391863
Energy: 1.3425654460818264
Energy: 1.4619812504391863
Energy: 1.3233533070896886
Energy: 1.4750320541111108
Energy: 1.5798756129951383
Energy: 1.4750320541111108
Energy: 1.3233533070896886
Energy: 1.4750320541111108
Energy: 1.325327806822678
Energy: 1.4079770929647193
Energy: 1.2626675677773531
Energy: 1.4079770929653663
Energy: 1.325327806822678
Energy: 1.4079770929653663
Energy: 1.289567551882474
Energy: 1.4608130527257792
Energy: 1.2850299055886334
Energy: 1.460813052725132
Energy: 1.289567551882474
Energy: 1.460813052725132
Energy: 1.251879689641231
Energy: 1.4621535213769525
Energy: 1.2863512737887113
Energy: 1.4621535213769525
Energy: 1.2518796896418782
Energy: 1.4621535213769525
Energy: 1.325414331626525
Energy: 1.4896279571232933
Energy: 1.3261863553621418
Energy: 1.4896279571239406
Energy: 1.3254143316271723
Energy: 1.4896279571239406
Energy: 1.325140890147312
Energy: 1.4504199978181789
Energy: 1.3646560740350793
Energy: 1.4504199978188261
Energy: 1.3251408901479593
Energy: 1.4504199978188261
Energy: 1.3457911446337552
Energy: 1.5073120593102467
Energy: 1.6614274381966232
Energy: 1.5073120593102467
Energy: 1.3457911446337552
Energy: 1.5073120593102467
Energy: 1.325078715358665
Energy: 1.4895866328897773
Energy: 1.3643686466421758
Energy: 1.48958663288913
Energy: 1.325078715358665
Energy: 1.48958663288913
Energy: 1.325214631397525
Energy: 1.489665648112476
Energy: 1.3261872030007356
Energy: 1.489665648112476
Energy: 1.325214631397525
Energy: 1.489665648112476
Energy: 1.25181884561779
Energy: 1.462082446818559
Energy: 1.286372711529093
Energy: 1.462082446818559
Energy: 1.25181884561779
Energy: 1.462082446818559
Energy: 1.2524598067326878
Energy: 1.4608482998895538
Energy: 1.2850335270665156
Energy: 1.4608482998895538
Energy: 1.252459806732041
Energy: 1.4608482998895538

minimum gb energy = 1.25181884561779 eV
minimum distance =  2.24735571630171 Angstroms
sigma value = 57


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

Energy: 1.384349277769456
Energy: 1.4172704368552118
Energy: 1.1618861786023442
Energy: 1.4172704368552118
Energy: 1.384349277769456
Energy: 1.4172704368552118
Energy: 1.1333574654421636
Energy: 1.4169417635197454
Energy: 1.1641627100013017
Energy: 1.4169417635197454
Energy: 1.1333574654421636
Energy: 1.4169417635197454
Energy: 1.1270816960526562
Energy: 1.3760366910821722
Energy: 1.1627776918031378
Energy: 1.3760366910821722
Energy: 1.1270816960526562
Energy: 1.3760366910821722
Energy: 1.162014371815469
Energy: 1.3938693324741154
Energy: 1.1644416190214568
Energy: 1.3938693324741154
Energy: 1.1620143718169422
Energy: 1.3938693324741154
Energy: 1.162520399894643
Energy: 1.4176808128133855
Energy: 1.1338089271718523
Energy: 1.4176808128133855
Energy: 1.162520399894643
Energy: 1.4176808128133855
Energy: 1.162229063136671
Energy: 1.3759513849353284
Energy: 1.1253077088364671
Energy: 1.3759513849353284
Energy: 1.1622290631381442
Energy: 1.3759513849353284
Energy: 1.1622198051234987
Energy: 1.3759753046516212
Energy: 1.1254135458010814
Energy: 1.3759753046516212
Energy: 1.1622198051234987
Energy: 1.3759753046516212
Energy: 1.1625203779190678
Energy: 1.4176713727897985
Energy: 1.1643894781730277
Energy: 1.4176713727897985
Energy: 1.1625203779190678
Energy: 1.4176713727897985
Energy: 1.1620025324120378
Energy: 1.3938823766291604
Energy: 1.164853735051506
Energy: 1.3938823766291604
Energy: 1.1620025324120378
Energy: 1.3938823766291604
Energy: 1.1270849528341995
Energy: 1.3760572176968457
Energy: 1.1624234967720852
Energy: 1.3760572176968457
Energy: 1.1270849528341995
Energy: 1.3760572176968457
Energy: 1.133426594936068
Energy: 1.4169417635197454
Energy: 1.1642538650220895
Energy: 1.4169417635197454
Energy: 1.133426594936068
Energy: 1.4169417635197454
Energy: 1.384349277769456
Energy: 1.4172704368537385
Energy: 1.1618861786038177
Energy: 1.4172704368552118
Energy: 1.384349277769456
Energy: 1.4172704368552118
Energy: 1.1333574654421636
Energy: 1.4169417635197454
Energy: 1.1641627100013017
Energy: 1.4169417635197454
Energy: 1.1333574654421636
Energy: 1.4169417635197454
Energy: 1.1270816960526562
Energy: 1.3760366910821722
Energy: 1.1627776918031378
Energy: 1.3760366910821722
Energy: 1.1270816960526562
Energy: 1.3760366910821722
Energy: 1.1620143718169422
Energy: 1.3938693324741154
Energy: 1.1644416190214568
Energy: 1.3938693324741154
Energy: 1.162014371815469
Energy: 1.3938693324741154
Energy: 1.162520399894643
Energy: 1.4176808128133855
Energy: 1.1338089271718523
Energy: 1.4176808128133855
Energy: 1.162520399894643
Energy: 1.4176808128133855
Energy: 1.1622290631381442
Energy: 1.3759513849353284
Energy: 1.1253077088364671
Energy: 1.3759513849353284
Energy: 1.1622290631381442
Energy: 1.3759513849353284
Energy: 1.1622198051234987
Energy: 1.3759753046516212
Energy: 1.1254135458010814
Energy: 1.3759753046516212
Energy: 1.1622198051234987
Energy: 1.3759753046516212
Energy: 1.1625203779175945
Energy: 1.4176713727897985
Energy: 1.1643894781745012
Energy: 1.4176713727897985
Energy: 1.1625203779190678
Energy: 1.4176713727897985

minimum gb energy = 1.1253077088364671 eV
minimum distance =  2.2305557471253 Angstroms
sigma value = 11


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

Energy: 1.273899510102566
Energy: 1.2703164060116792
Energy: 1.2163511944881997
Energy: 1.2703164060127583
Energy: 1.2738995101036452
Energy: 1.2703164060149168
Energy: 1.22453130490086
Energy: 1.2965324663916438
Energy: 1.0445389755391772
Energy: 1.2965324663916438
Energy: 1.2245313049019388
Energy: 1.2965324663916438
Energy: 1.2410472517159852
Energy: 1.3303218755478603
Energy: 1.1089707561781643
Energy: 1.330321875546781
Energy: 1.2410472517159852
Energy: 1.330321875546781
Energy: 1.055018589092118
Energy: 1.3136393988707076
Energy: 1.092143103376549
Energy: 1.313639398871787
Energy: 1.055018589092118
Energy: 1.3136393988707076
Energy: 1.0898610405034226
Energy: 1.3605578588332938
Energy: 1.0944016742475287
Energy: 1.3605578588343732
Energy: 1.0898610405034226
Energy: 1.3605578588332938
Energy: 1.1631433200275776
Energy: 1.3361294714723568
Energy: 1.149703116559834
Energy: 1.3361294714723568
Energy: 1.1631433200275776
Energy: 1.3361294714723568
Energy: 1.1077516076035634
Energy: 1.2830260683667152
Energy: 1.150182291353417
Energy: 1.2830260683656356
Energy: 1.1077516076035634
Energy: 1.2830260683656356
Energy: 1.1474428259727179
Energy: 1.361752045830981
Energy: 1.0566857515279704
Energy: 1.361752045829902
Energy: 1.1474428259748761
Energy: 1.361752045829902
Energy: 1.1437663483269565
Energy: 1.3603465983310525
Energy: 1.0523861169772641
Energy: 1.3603465983310525
Energy: 1.1437663483269565
Energy: 1.3603465983310525
Energy: 1.107426899707054
Energy: 1.28332749641032
Energy: 1.1496132246366995
Energy: 1.283327496409241
Energy: 1.107426899707054
Energy: 1.283327496409241
Energy: 1.1631857813038156
Energy: 1.33436422288178
Energy: 1.1504087588550023
Energy: 1.3343642228828594
Energy: 1.1631857813038156
Energy: 1.3343642228828594
Energy: 1.0902627174074984
Energy: 1.3624233496282647
Energy: 1.092230010828735
Energy: 1.3624233496282647
Energy: 1.0902627174074984
Energy: 1.3624233496282647
Energy: 1.2363835942728085
Energy: 1.3200567050127296
Energy: 1.0946463849361596
Energy: 1.3200567050148881
Energy: 1.2363835942738877
Energy: 1.3200567050159677
Energy: 1.1486357786673886
Energy: 1.3316730917767394
Energy: 1.1090724030309973
Energy: 1.331673091774581
Energy: 1.1486357786673886
Energy: 1.331673091774581
Energy: 1.2244560333114265
Energy: 1.2983694941944812
Energy: 1.0452670857413795
Energy: 1.298369494193402
Energy: 1.2244560333103471
Energy: 1.298369494193402
Energy: 1.1717664704169335
Energy: 1.2692169144866106
Energy: 1.148156009896388
Energy: 1.2692169144855312
Energy: 1.1717664704169335
Energy: 1.2692169144855312
Energy: 1.0541783999876788
Energy: 1.2971570813997293
Energy: 1.0715731606813637
Energy: 1.2971570814008087
Energy: 1.0541783999952339
Energy: 1.2971570813997293
Energy: 1.1489758855653434
Energy: 1.3306266404681106
Energy: 1.1067691408318139
Energy: 1.3306266404691898
Energy: 1.1489758855653434
Energy: 1.3306266404691898
Energy: 1.1111171007300689
Energy: 1.3124654997649765
Energy: 1.0907738178047548
Energy: 1.312465499767135
Energy: 1.1111171007300689
Energy: 1.312465499767135
Energy: 1.0900566362817035
Energy: 1.3612223898917941
Energy: 1.146784713492186
Energy: 1.3612223898907148
Energy: 1.0900566362817035
Energy: 1.3612223898917941
Energy: 1.2884734295253406
Energy: 1.338285588375341
Energy: 1.149868083987174
Energy: 1.3382855883721032
Energy: 1.2884734295263707
Energy: 1.3382855883731826
Energy: 1.107713734863217
Energy: 1.283168775542186
Energy: 1.1496953143685515
Energy: 1.2831687755411068
Energy: 1.107713734863217
Energy: 1.2831687755411068
Energy: 1.1472779146656005
Energy: 1.3647604225966283
Energy: 1.0562270682425334
Energy: 1.3647604225966283
Energy: 1.1472779146666794
Energy: 1.3647604225955492
Energy: 1.046974212627399
Energy: 1.3609335559283613
Energy: 1.0475877279331864
Energy: 1.3609335559283613
Energy: 1.0469742126284292
Energy: 1.3609335559283613
Energy: 1.1077086439789843
Energy: 1.2840189314793027
Energy: 1.1497778967570105
Energy: 1.2840189314793027
Energy: 1.1077086439789843
Energy: 1.2840189314782235
Energy: 1.1659096491017147
Energy: 1.3349797878183083
Energy: 1.150252788185999
Energy: 1.334979787820467
Energy: 1.1659096491017147
Energy: 1.334979787820467

minimum gb energy = 1.0445389755391772 eV
minimum distance =  2.23754806762575 Angstroms
sigma value = 41


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

Energy: 1.4164837436045923
Energy: 1.2988357200202827
Energy: 0.9886118364161712
Energy: 1.2988357200211333
Energy: 1.4164837436037419
Energy: 1.2988357200211333
Energy: 1.1907206751998949
Energy: 1.1999677754489566
Energy: 0.9555500385480115
Energy: 1.1999677754489566
Energy: 1.1907206752007455
Energy: 1.1999677754489566
Energy: 1.0639762246560005
Energy: 1.2451828265246003
Energy: 0.9908412609823289
Energy: 1.2451828265254508
Energy: 1.0639762246560005
Energy: 1.2451828265246003
Energy: 1.1971621767194405
Energy: 1.1677874894568723
Energy: 0.9558058776126069
Energy: 1.1677874894568723
Energy: 1.1971621767185898
Energy: 1.1677874894568723
Energy: 1.071428011791058
Energy: 1.1620636206120334
Energy: 1.0097063016468868
Energy: 1.1620636206120334
Energy: 1.071428011791058
Energy: 1.1620636206120334
Energy: 1.211564205305577
Energy: 1.240588423818194
Energy: 0.9554947674428758
Energy: 1.240588423818194
Energy: 1.2115642053064277
Energy: 1.240588423818194
Energy: 0.9563914269021486
Energy: 1.2447035635676478
Energy: 0.9563487146730499
Energy: 1.2447035635676478
Energy: 0.9563914269021486
Energy: 1.2447035635676478
Energy: 1.0592545361987897
Energy: 1.2584275506948177
Energy: 0.9590260207667582
Energy: 1.2584275506956681
Energy: 1.0592545361996402
Energy: 1.2584275506956681
Energy: 0.9878863825535036
Energy: 1.1621787436025033
Energy: 1.1388914491116695
Energy: 1.1621787436016526
Energy: 0.9878863825535036
Energy: 1.1621787436016526
Energy: 1.2209300196254467
Energy: 1.2463876989402587
Energy: 1.2063849608886845
Energy: 1.2463876989411096
Energy: 1.2209300196254467
Energy: 1.2463876989411096
Energy: 1.2195939888267637
Energy: 1.2446172892574845
Energy: 1.2611349359333408
Energy: 1.2446172892574845
Energy: 1.2195939888267637
Energy: 1.2446172892574845
Energy: 0.9901375395066012
Energy: 1.271510122076724
Energy: 0.9588258257249251
Energy: 1.279005008490089
Energy: 0.9901375395066012
Energy: 1.271510122076724
Energy: 0.9876568573353974
Energy: 1.2243588342527887
Energy: 1.1389670467626405
Energy: 1.2243588342527887
Energy: 0.9876568573353974
Energy: 1.2243588342527887
Energy: 0.9591118160978788
Energy: 1.246486487804899
Energy: 0.9556841353131271
Energy: 1.246486487804899
Energy: 0.9591118160978788
Energy: 1.246486487804899
Energy: 1.208197090887297
Energy: 1.245296466445797
Energy: 0.9559703702362642
Energy: 1.2452964664466475
Energy: 1.208197090887297
Energy: 1.2452964664466475
Energy: 0.9557088941181547
Energy: 1.2579647553019497
Energy: 0.9563079825691505
Energy: 1.278926517541262
Energy: 0.9557088941181547
Energy: 1.2579647553019497
Energy: 1.192225069857977
Energy: 1.2598450848570084
Energy: 1.0091107822735321
Energy: 1.2598450848570084
Energy: 1.192225069857977
Energy: 1.2598450848570084
Energy: 0.9584010766391815
Energy: 1.2466323086419606
Energy: 0.9880530126261614
Energy: 1.2466323086419606
Energy: 0.9584010766391815
Energy: 1.2466323086419606
Energy: 1.1905996981642162
Energy: 1.19300711439376
Energy: 0.9557194876626816
Energy: 1.19300711439376
Energy: 1.1905996981633655
Energy: 1.19300711439376
Energy: 1.2071681814379327
Energy: 1.2713845714233787
Energy: 1.108289369773393
Energy: 1.2789277432060804
Energy: 1.2071681814353807
Energy: 1.2575436574792285
Energy: 1.2245903182602598
Energy: 1.1966314585635351
Energy: 0.9881932092086891
Energy: 1.1966314585635351
Energy: 1.2245903182602598
Energy: 1.1966314585635351
Energy: 0.9583122743610534
Energy: 1.2465434059948128
Energy: 1.0294395243492918
Energy: 1.2465434059948128
Energy: 0.9583122743610534
Energy: 1.2465434059948128
Energy: 1.2089364947669103
Energy: 1.1648844380022187
Energy: 0.9558757123238181
Energy: 1.1648844380022187
Energy: 1.20893649476606
Energy: 1.1648844380022187
Energy: 0.9554921416515819
Energy: 1.2246927945378998
Energy: 0.9910099289894342
Energy: 1.200483848146701
Energy: 0.9554921416515819
Energy: 1.2246927945387502
Energy: 1.0984040902064605
Energy: 1.2244364390085882
Energy: 0.9551512107024418
Energy: 1.2244364390085882
Energy: 1.0984040902064605
Energy: 1.2244364390085882
Energy: 0.9589209837780998
Energy: 1.1629164433016603
Energy: 0.9585759925827395
Energy: 1.1629164433016603
Energy: 0.9589209837780998
Energy: 1.1629164433008095
Energy: 1.0580677938268133
Energy: 1.2448189017098812
Energy: 0.958272417452932
Energy: 1.2448189017098812
Energy: 1.0580677938268133
Energy: 1.2448189017098812
Energy: 0.9902241205501413
Energy: 1.2245481477199425
Energy: 1.1898497815590998
Energy: 1.2173778324170919
Energy: 0.9902241205509921
Energy: 1.2245481477199425
Energy: 1.2187794952395838
Energy: 1.2448927861333898
Energy: 1.2605487721933593
Energy: 1.2448927861333898
Energy: 1.2187794952404345
Energy: 1.2448927861333898
Energy: 0.9592670496106336
Energy: 1.16592398091546
Energy: 1.260644671980046
Energy: 1.16592398091546
Energy: 0.9592670496106336
Energy: 1.16592398091546
Energy: 0.9879808943970643
Energy: 1.244707368314689
Energy: 0.9586379168226087
Energy: 1.244707368313838
Energy: 0.9879808943970643
Energy: 1.244707368313838
Energy: 0.9905253875204529
Energy: 1.2439664613387913
Energy: 1.1897183052694436
Energy: 1.243966461339642
Energy: 0.9905253875204529
Energy: 1.243966461339642
Energy: 0.9559791403943855
Energy: 1.244680696267666
Energy: 0.9553062128617438
Energy: 1.2446806962685166
Energy: 0.9559791403943855
Energy: 1.2446806962685166

minimum gb energy = 0.9551512107024418 eV
minimum distance =  2.24867579167643 Angstroms
sigma value = 33


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

Energy: 1.275057635456982
Energy: 1.0679372211482054
Energy: 0.9445252081817654
Energy: 1.0679372211482054
Energy: 1.275057635456982
Energy: 1.0679372211482054
Energy: 1.646806169896844
Energy: 0.8833051415421412
Energy: 0.8486338193686191
Energy: 0.8833051415433352
Energy: 1.646806169896844
Energy: 0.8833051415433352
Energy: 1.2488172396782435
Energy: 1.127854070420902
Energy: 0.8804662168309483
Energy: 1.1278540704238866
Energy: 1.2488172396782435
Energy: 1.1278540704238866
Energy: 1.5671519569952843
Energy: 0.8793183758447534
Energy: 0.8698343419654441
Energy: 0.8793183758429625
Energy: 1.5671519569946872
Energy: 0.8793183758441565
Energy: 0.9736526847297641
Energy: 1.1065901112022551
Energy: 0.8646979474358109
Energy: 1.1065901112016585
Energy: 0.973652684730958
Energy: 1.1065901112016585
Energy: 1.416007362476702
Energy: 1.083865932023621
Energy: 0.8923751327528054
Energy: 1.0838659320242183
Energy: 1.416007362476702
Energy: 1.0838659320242183
Energy: 0.9630663706795045
Energy: 1.0869616446687105
Energy: 0.8979350385336008
Energy: 1.0869616446663224
Energy: 0.9630663706777135
Energy: 1.0869616446663224
Energy: 1.3503586395656466
Energy: 1.0896452658220546
Energy: 0.8970991038178759
Energy: 1.0896452658226512
Energy: 1.3503586395656466
Energy: 1.0896452658226512
Energy: 0.8667125499329105
Energy: 1.1060624110895665
Energy: 1.0371014350429864
Energy: 1.1060624110895665
Energy: 0.8667125499329105
Energy: 1.1060624110895665
Energy: 1.1087163414678447
Energy: 1.1026718832618188
Energy: 1.103351829544464
Energy: 1.1026718832618188
Energy: 1.1087163414678447
Energy: 1.1026718832618188
Energy: 0.8661529171276837
Energy: 1.076255772711975
Energy: 1.1149606955880553
Energy: 1.0762557727113777
Energy: 0.8661529171282808
Energy: 1.0762557727113777
Energy: 1.2646195097667732
Energy: 1.1226057241168572
Energy: 1.138266344443442
Energy: 1.1226057241150664
Energy: 1.2646195097667732
Energy: 1.1226057241150664
Energy: 0.9808972258209816
Energy: 1.0983831318734243
Energy: 1.3491509247662155
Energy: 1.0983831318722304
Energy: 0.9808972258209816
Energy: 1.0983831318722304
Energy: 0.9934614360900909
Energy: 1.1139186609292615
Energy: 1.3497566026421914
Energy: 1.1139186609274705
Energy: 0.9934614360906877
Energy: 1.1139186609274705
Energy: 0.991707783077674
Energy: 1.07690494534423
Energy: 1.349325794764512
Energy: 1.0769049453430362
Energy: 0.991707783077674
Energy: 1.0769049453430362
Energy: 0.9850922637200017
Energy: 1.1226894973381996
Energy: 1.1489511770374239
Energy: 1.1226894973381996
Energy: 0.9850922637200017
Energy: 1.1226894973381996
Energy: 1.0265284098867848
Energy: 1.0998629549398624
Energy: 1.3465424446206151
Energy: 1.0998629549380714
Energy: 1.026528409887382
Energy: 1.0998629549380714
Energy: 0.8659471464045095
Energy: 1.113551594984631
Energy: 1.1033894576123475
Energy: 1.1135515949834371
Energy: 0.8659471464051065
Energy: 1.1135515949834371
Energy: 1.1140581695637104
Energy: 1.0918676705753794
Energy: 1.1155005314179947
Energy: 1.0918676705741852
Energy: 1.1140581695637104
Energy: 1.0918676705741852
Energy: 0.8675620055397162
Energy: 1.1154718175287397
Energy: 0.8938089208718153
Energy: 1.1154718175281426
Energy: 0.8675620055397162
Energy: 1.1154718175281426
Energy: 1.1048269544308553
Energy: 1.1013121892072089
Energy: 1.0589117222010729
Energy: 1.1013121892084028
Energy: 1.1048269544308553
Energy: 1.1013121892084028
Energy: 0.8941185718983868
Energy: 1.113402113708103
Energy: 0.892625127325212
Energy: 1.113402113708103
Energy: 0.8941185718977898
Energy: 1.113402113708103
Energy: 1.4226882028664793
Energy: 1.1024772170870027
Energy: 0.8967927498684486
Energy: 1.102477217086406
Energy: 1.4226882028658825
Energy: 1.102477217086406
Energy: 0.919639279620112
Energy: 1.115551534345809
Energy: 0.8700919107990732
Energy: 1.1155515343440179
Energy: 0.919639279620112
Energy: 1.1155515343440179
Energy: 1.4199944799738684
Energy: 1.0472872351072273
Energy: 0.9829782126265442
Energy: 1.0472872351060334
Energy: 1.4199944799738684
Energy: 1.0472872351060334
Energy: 1.1481782580325959
Energy: 1.1220302849255968
Energy: 0.8830136772102071
Energy: 1.1220302849244026
Energy: 1.148178258033193
Energy: 1.1220302849238057
Energy: 1.6442965585055114
Energy: 0.8790482829840695
Energy: 0.8532217666652381
Energy: 0.8790482829835267
Energy: 1.6442965584046205
Energy: 0.8790482829840695
Energy: 1.1760835365911544
Energy: 1.1157609699435223
Energy: 0.9911079143206554
Energy: 1.115760969945856
Energy: 1.1760835365911544
Energy: 1.115760969945856
Energy: 1.4210128049541042
Energy: 1.0470214890836147
Energy: 0.9829708878499315
Energy: 1.0470214890848089
Energy: 1.4210128049535073
Energy: 1.0470214890842118
Energy: 1.147793691319744
Energy: 1.1219512704487677
Energy: 1.052354803426936
Energy: 1.1219512704487677
Energy: 1.147793691319744
Energy: 1.1219512704487677
Energy: 1.4209341313612058
Energy: 0.88086724266509
Energy: 0.8658689132356984
Energy: 0.8808672426656871
Energy: 1.420934131357027
Energy: 0.8808672426656871
Energy: 0.919363462042564
Energy: 1.1017437591078463
Energy: 1.0277401441219225
Energy: 1.101743759109637
Energy: 0.9193634620431611
Energy: 1.101743759109637
Energy: 1.264540538206561
Energy: 1.0806718339293662
Energy: 0.8671733688406545
Energy: 1.0806718339293662
Energy: 1.264540538207755
Energy: 1.080671833928769
Energy: 0.8986533875750919
Energy: 1.088101672296859
Energy: 1.197275137246081
Energy: 1.0881016722962618
Energy: 0.8986533875744949
Energy: 1.0881016722962618
Energy: 1.2732315966409378
Energy: 1.08849765550399
Energy: 0.8933498550082919
Energy: 1.08849765550399
Energy: 1.273231596639147
Energy: 1.088497655504587
Energy: 0.8670128980164703
Energy: 1.0805784813092472
Energy: 1.1850973412022563
Energy: 1.0805784813074562
Energy: 0.8670128980164703
Energy: 1.0805784813074562
Energy: 1.0546538938726753
Energy: 1.1018192890791492
Energy: 0.9190147768534208
Energy: 1.101819289079746
Energy: 1.0546538938726753
Energy: 1.101819289079746
Energy: 0.8658845924841266
Energy: 0.8805869195875694
Energy: 1.4221183487556912
Energy: 0.8805869195881663
Energy: 0.8658845924841266
Energy: 0.8805869195887633
Energy: 1.0885326847360048
Energy: 1.1222520780939647
Energy: 1.142618570169217
Energy: 1.1222520780933678
Energy: 1.0885326847354078
Energy: 1.1222520780933678
Energy: 0.939371284276469
Energy: 1.0729936858574223
Energy: 1.4257613557935795
Energy: 1.0729936858574223
Energy: 0.939371284276469
Energy: 1.0729936858574223
Energy: 0.9916710858019839
Energy: 1.1116978486299114
Energy: 1.1653095068964834
Energy: 1.1116978486281204
Energy: 0.991671085802581
Energy: 1.1116978486281204
Energy: 0.8534159215783889
Energy: 0.8676186439026403
Energy: 1.635153824473723
Energy: 0.8676186439026403
Energy: 0.8534159215783889
Energy: 0.8676186439020434
Energy: 0.883045299252231
Energy: 1.1222944506159647
Energy: 1.1386967619803678
Energy: 1.1222944506159647
Energy: 0.8830452992528279
Energy: 1.1222944506165615
Energy: 0.9402527641342028
Energy: 1.060948355363695
Energy: 1.4201898102819364
Energy: 1.060948355366083
Energy: 0.9402527641347997
Energy: 1.060948355366083
Energy: 0.8703206738945416
Energy: 1.115495276436507
Energy: 0.9189994744598156
Energy: 1.115495276437104
Energy: 0.8703206738945416
Energy: 1.115495276437104
Energy: 0.8963058341086844
Energy: 1.1025405745050747
Energy: 1.42358747778421
Energy: 1.1025405745044776
Energy: 0.8963058341092813
Energy: 1.1025405745044776
Energy: 0.8923467425650087
Energy: 1.1135066786159702
Energy: 0.8945915200468352
Energy: 1.1135066786153731
Energy: 0.8923467425656055
Energy: 1.1135066786153731

minimum gb energy = 0.8486338193686191 eV
minimum distance =  2.28413914231666 Angstroms
sigma value = 67


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

Energy: 0.2571822575396553
Energy: 0.2580979268791414
Energy: 0.25767449025700007
Energy: 0.2580979268791414
Energy: 0.2571822575396553
Energy: 0.2580979268787334
Energy: 0.26361193954143575
Energy: 0.7997162866596994
Energy: 0.6291211284035473
Energy: 0.7997162866596994
Energy: 0.26361193954143575
Energy: 0.7997162866596994
Energy: 0.25718225754001794
Energy: 0.2580979268787334
Energy: 0.25767449025740813
Energy: 0.2580979268787334
Energy: 0.25718225754001794
Energy: 0.2580979268787334
Energy: 0.26361193954143575
Energy: 0.7997162866601074
Energy: 0.6291211798266246
Energy: 0.7997162866596994
Energy: 0.26361193954143575
Energy: 0.7997162866601074
Energy: 0.2571822575396553
Energy: 0.2580979268795495
Energy: 0.25767449025700007
Energy: 0.2580979268795495
Energy: 0.25718225754001794
Energy: 0.2580979268791414
Energy: 0.26361193954143575
Energy: 0.7997162866593367
Energy: 0.629121219719356
Energy: 0.7997162866593367
Energy: 0.26361193954143575
Energy: 0.7997162866593367
Energy: 0.2571822575396553
Energy: 0.2580979268787334
Energy: 0.25767449025700007
Energy: 0.2580979268787334
Energy: 0.25718225754001794
Energy: 0.2580979268787334

minimum gb energy = 0.2571822575396553 eV
minimum distance =  2.4340441245878 Angstroms
sigma value = 3


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

Energy: 1.3996753848124421
Energy: 1.0876288771139364
Energy: 0.9673122428529782
Energy: 1.0876288771139364
Energy: 1.3996753848118995
Energy: 1.0876288771133935
Energy: 1.59296845089712
Energy: 0.8541867502779055
Energy: 0.8384258362586507
Energy: 0.8541867502779055
Energy: 1.5929684508954913
Energy: 0.8541867502779055
Energy: 1.251117160247455
Energy: 1.1000919821361288
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Energy: 0.8320419457255047
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Energy: 0.8344988188826908
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Energy: 1.0951290640448592
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Energy: 0.8460407726776155
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Energy: 1.0992927953214442
Energy: 0.8462396713387079
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Energy: 0.9352125416647764
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Energy: 0.8391054235837654
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Energy: 1.323911473261032
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Energy: 1.3239114732604886
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Energy: 1.3323679720811261
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Energy: 1.3474018920482767
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Energy: 0.8425951452651872
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Energy: 1.3474018920477338
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Energy: 1.4650360183179139
Energy: 1.0956614203744715
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Energy: 1.3323319891432712
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Energy: 0.834954366124601
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Energy: 1.0693200520189912
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Energy: 0.842190216608722
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Energy: 1.0693200520189912
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Energy: 1.3085369425944176
Energy: 1.0948534568578956
Energy: 0.8413925387759981
Energy: 1.0948534568584385
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Energy: 1.0625401101938932
Energy: 1.0482559799390352
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Energy: 1.0457456648351704
Energy: 1.0698234122024484
Energy: 0.8565740852596171
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Energy: 1.0457456648357135
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Energy: 1.06801968742057
Energy: 1.0311132988652372
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Energy: 0.8417109769884721
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Energy: 1.0371213990544583
Energy: 1.0973635271909177
Energy: 1.1189482230045313
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Energy: 1.0371213990544583
Energy: 1.097363527190375
Energy: 0.832774637615876
Energy: 1.0123365964025937
Energy: 1.299096238100027
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Energy: 0.832774637615876
Energy: 1.0123365964025937
Energy: 0.8324143678878672
Energy: 1.0697434481422634
Energy: 1.0633199906658244
Energy: 1.0697434481428065
Energy: 0.8324143678873241
Energy: 1.0697434481422634
Energy: 0.8468086107343682
Energy: 1.030132365763608
Energy: 1.3077249820142616
Energy: 1.030132365763608
Energy: 0.8468086107343682
Energy: 1.030132365763608
Energy: 0.8358372433533308
Energy: 1.0973133622171178
Energy: 1.3249199660554543
Energy: 1.0973133622165752
Energy: 0.8358372433533308
Energy: 1.0973133622165752
Energy: 0.8328424378708115
Energy: 0.8521697296202867
Energy: 1.4567130306214668
Energy: 0.8521697296202867
Energy: 0.8328424378708115
Energy: 0.8521697296213726
Energy: 0.8470876000603533
Energy: 1.115899527337113
Energy: 1.3478786637904594
Energy: 1.115899527337113
Energy: 0.8470876000608963
Energy: 1.115899527337113
Energy: 0.8468682881484711
Energy: 0.8642918643219304
Energy: 1.4665643352917457
Energy: 0.8642918643213875
Energy: 0.8468682881490142
Energy: 0.8642918643213875
Energy: 0.8613899060874418
Energy: 1.0974513224631544
Energy: 1.3202143211424562
Energy: 1.097451322463697
Energy: 0.8613899060874418
Energy: 1.097451322463697
Energy: 0.8326190675265378
Energy: 0.8471289323956126
Energy: 1.4562008655959746
Energy: 0.8471289323950697
Energy: 0.8326190675265378
Energy: 0.8471289323956126
Energy: 0.8468821931220367
Energy: 1.0695095868361708
Energy: 1.110886575930379
Energy: 1.0695095868367137
Energy: 0.8468821931214937
Energy: 1.0695095868372568
Energy: 0.8507916245663955
Energy: 0.8397756113209618
Energy: 1.181224724511066
Energy: 0.8397756113220476
Energy: 0.8507916245669384
Energy: 0.8397756113215048
Energy: 1.0434371276766088
Energy: 1.0637279036456913
Energy: 1.0935258046827894
Energy: 1.0637279036456913
Energy: 1.0434371276766088
Energy: 1.0637279036462346

minimum gb energy = 0.8320419457255047 eV
minimum distance =  2.2759391354255 Angstroms
sigma value = 81


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

Energy: 1.362773830432098
Energy: 0.9613422253336574
Energy: 1.0950047150917663
Energy: 0.9613422253336574
Energy: 1.3627738304313528
Energy: 0.9613422253336574
Energy: 1.2315775399782098
Energy: 0.9636384071051437
Energy: 0.9271799660019021
Energy: 0.9636384071058889
Energy: 1.231577539978955
Energy: 0.9636384071058889
Energy: 1.374818139793434
Energy: 1.2324576399952885
Energy: 1.0728770627866113
Energy: 1.2324576399960334
Energy: 1.374818139793434
Energy: 1.2324576399960334
Energy: 1.2187460333371702
Energy: 0.929238165195414
Energy: 0.927034548473502
Energy: 0.929238165195414
Energy: 1.2187460333371702
Energy: 0.9292381651946687
Energy: 0.9686935869574841
Energy: 0.9225216969029176
Energy: 1.0147219928066507
Energy: 0.922521696903663
Energy: 0.9686935869574841
Energy: 0.922521696903663
Energy: 1.0764510831761271
Energy: 0.9354780223388178
Energy: 0.9271820304016369
Energy: 0.935478022339563
Energy: 1.0764510831761271
Energy: 0.9354780223388178
Energy: 0.9441078590510841
Energy: 0.9265966771641244
Energy: 1.0836199574608882
Energy: 0.9265966771641244
Energy: 0.9441078590510841
Energy: 0.9265966771633793
Energy: 0.941322309513167
Energy: 0.9308239706530312
Energy: 0.9538693894055011
Energy: 0.9308239706522861
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Energy: 0.9222728996504713
Energy: 0.9238057860563663
Energy: 1.3239679530603177
Energy: 0.9238057860556212
Energy: 0.9222728996504713
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Energy: 0.9760297594874624
Energy: 1.2229781520837655
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Energy: 0.9257085261039608
Energy: 0.9272214891948338
Energy: 0.9409470705526572
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Energy: 1.3245111123366802
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Energy: 0.9409470705526572
Energy: 1.243545310472128
Energy: 0.9222185170824007
Energy: 1.2079605808117921
Energy: 1.3240174626639845
Energy: 1.2079605808117921
Energy: 0.9222185170824007
Energy: 1.2079605808125378
Energy: 0.9256406607935167
Energy: 1.2230782287764468
Energy: 1.2414495567403643
Energy: 1.2230782287764468
Energy: 0.9256406607935167
Energy: 1.2230782287764468
Energy: 0.9256640061805772
Energy: 0.9741644465617654
Energy: 1.2156249728280104
Energy: 0.9741644465610202
Energy: 0.9256640061805772
Energy: 0.9741644465617654
Energy: 0.9227646146877155
Energy: 1.244017307288003
Energy: 0.9541413375664038
Energy: 1.244017307288003
Energy: 0.9227646146877155
Energy: 1.244017307288003
Energy: 0.9222601437363226
Energy: 0.9381007458056825
Energy: 1.1485299198449666
Energy: 0.9381007458049373
Energy: 0.9222601437363226
Energy: 0.9381007458049373
Energy: 1.2244686031472864
Energy: 1.2231551033716086
Energy: 0.9274649822010639
Energy: 1.2231551033708634
Energy: 1.2244686031472864
Energy: 1.2231551033708634
Energy: 1.2132748993952684
Energy: 1.2327870880895886
Energy: 0.9313013936056116
Energy: 1.2327870880895886
Energy: 1.2132748993952684
Energy: 1.2327870880895886
Energy: 1.2451251126626302
Energy: 1.2445568206824795
Energy: 0.9272412293164984
Energy: 1.2445568206824795
Energy: 1.2451251126618852
Energy: 1.2445568206824795
Energy: 1.245989941237973
Energy: 1.2240177611572511
Energy: 1.1591145533717613
Energy: 1.224017761156506
Energy: 1.2459899412372275
Energy: 1.224017761156506
Energy: 1.2398315273711322
Energy: 1.223472940649705
Energy: 0.9312730674117363
Energy: 1.2234729406504503
Energy: 1.2398315273711322
Energy: 1.2234729406504503
Energy: 1.6092604885782038
Energy: 1.2234773472844187
Energy: 0.9312616838056883
Energy: 1.2234773472851639
Energy: 1.6092604885774588
Energy: 1.2234773472851639
Energy: 1.2452210997340105
Energy: 1.2241712096324817
Energy: 1.0950957222291542
Energy: 1.2241712096317363
Energy: 1.2452210997340105
Energy: 1.2241712096317363
Energy: 1.2405339968365605
Energy: 1.2445081767371504
Energy: 0.9271701984751435
Energy: 1.2445081767371504
Energy: 1.2405339968380509
Energy: 1.2445081767378956
Energy: 1.2133758868773838
Energy: 1.232782744973604
Energy: 0.9313092348863516
Energy: 1.232782744973604
Energy: 1.2133758868773838
Energy: 1.232782744973604
Energy: 1.2246146512031606
Energy: 1.2231550616169742
Energy: 0.9275102097583698
Energy: 1.2231550616169742
Energy: 1.2246146512031606
Energy: 1.2231550616169742
Energy: 0.9223569418834098
Energy: 0.9384960630107478
Energy: 1.0685657096020174
Energy: 0.9384960630107478
Energy: 0.9223569418834098
Energy: 0.9384960630100025
Energy: 0.9227665249787791
Energy: 1.2438822316885574
Energy: 0.9539746291000688
Energy: 1.2438822316885574
Energy: 0.9227665249780338
Energy: 1.2438822316885574
Energy: 0.9256427910426347
Energy: 0.9741644465617654
Energy: 1.2157246622967308
Energy: 0.9741644465617654
Energy: 0.9256427910426347
Energy: 0.9741644465617654
Energy: 0.9256765657881671
Energy: 1.222913382271649
Energy: 1.2423358868398635
Energy: 1.222913382271649
Energy: 0.9256765657881671
Energy: 1.222913382271649
Energy: 0.9222346535008614
Energy: 1.2079857296799006
Energy: 1.2328067903461455
Energy: 1.2079857296806458
Energy: 0.9222346535008614
Energy: 1.2079857296806458
Energy: 0.9409811550000213
Energy: 1.243539804643668
Energy: 1.2912311779173435
Energy: 1.243539804642923
Energy: 0.9409811550000213
Energy: 1.243539804642923
Energy: 0.9257142393716313
Energy: 0.9272803484338932
Energy: 1.240679067358236
Energy: 0.9272803484338932
Energy: 0.9257142393716313
Energy: 0.927280348433148
Energy: 0.9760297594867171
Energy: 1.2229739621073983
Energy: 1.2419237854289424
Energy: 1.2229739621081435
Energy: 0.9760297594867171
Energy: 1.2229739621073983
Energy: 0.9222757907061726
Energy: 0.9239361264459388
Energy: 1.080269686113019
Energy: 0.9239361264459388
Energy: 0.9222757907054273
Energy: 0.9239361264459388
Energy: 0.9413042191227902
Energy: 0.9309169516093235
Energy: 0.9539540479077936
Energy: 0.9309169516093235
Energy: 0.9413042191227902
Energy: 0.9309169516093235
Energy: 0.9441142008313669
Energy: 0.9271672982808888
Energy: 1.083775363242021
Energy: 0.9271672982823791
Energy: 0.9441142008313669
Energy: 0.9271672982823791

minimum gb energy = 0.9222185170824007 eV
minimum distance =  2.29508418675889 Angstroms
sigma value = 43


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

Energy: 1.560473527545946
Energy: 1.3452448663331744
Energy: 1.1458934832922478
Energy: 1.3452448663331744
Energy: 1.560473527545946
Energy: 1.3452448663331744
Energy: 1.365744465330049
Energy: 1.0488172264108826
Energy: 0.9869067673049833
Energy: 1.0488172264108826
Energy: 1.3657444653309643
Energy: 1.0488172264108826
Energy: 1.0544321053000778
Energy: 0.9847995269037717
Energy: 1.145851511313507
Energy: 0.9847995269037717
Energy: 1.0544321053000778
Energy: 0.9847995269037717
Energy: 1.3698996771246985
Energy: 0.9890411331252577
Energy: 0.9878351091948397
Energy: 0.9890411331252577
Energy: 1.3698996771246985
Energy: 0.9890411331252577
Energy: 1.005945441736377
Energy: 0.9869092410419442
Energy: 0.9984720170234216
Energy: 0.9869092410419442
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Energy: 0.9869092410410288
Energy: 1.0059584303718643
Energy: 0.9925504186667302
Energy: 0.9868732290486929
Energy: 0.9925504186658147
Energy: 1.0059584303718643
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Energy: 0.9844999082705208
Energy: 0.9855556165763862
Energy: 1.189944698096303
Energy: 0.9855556165763862
Energy: 0.9844999082705208
Energy: 0.9855556165763862
Energy: 1.066522140197347
Energy: 0.989651248378265
Energy: 1.0372473579144028
Energy: 0.989651248378265
Energy: 1.066522140197347
Energy: 0.989651248378265
Energy: 0.9863092470085193
Energy: 0.9877966297205414
Energy: 1.3876384183173627
Energy: 0.9877966297205414
Energy: 0.9863092470085193
Energy: 0.9877966297205414
Energy: 1.0102616764605834
Energy: 1.331804472159715
Energy: 1.4516178581718668
Energy: 1.33180447216063
Energy: 1.0102616764605834
Energy: 1.33180447216063
Energy: 0.9845812485989306
Energy: 1.3247443724831731
Energy: 1.1769439555903425
Energy: 1.3247443724831731
Energy: 0.9845812485989306
Energy: 1.3247443724831731
Energy: 0.9865534719439418
Energy: 0.9849400920508484
Energy: 1.037183097421321
Energy: 0.9849400920508484
Energy: 0.9865534719439418
Energy: 0.9849400920508484
Energy: 0.986204031047921
Energy: 0.98686773550343
Energy: 1.1717628523637098
Energy: 0.98686773550343
Energy: 0.986204031047921
Energy: 0.98686773550343
Energy: 0.9859194055173859
Energy: 1.330506900622298
Energy: 0.9869911249205114
Energy: 1.330506900622298
Energy: 0.9859194055173859
Energy: 1.330506900622298
Energy: 0.9847521724554804
Energy: 0.9870309410369044
Energy: 0.9944642788837496
Energy: 0.9870309410378199
Energy: 0.9847521724554804
Energy: 0.9870309410378199
Energy: 1.365480803844518
Energy: 0.9870219673806566
Energy: 0.9876946501217573
Energy: 0.9870219673806566
Energy: 1.365480803844518
Energy: 0.9870219673806566
Energy: 1.3658744563397762
Energy: 0.9936943979964596
Energy: 1.1717052804223866
Energy: 0.9936943979973749
Energy: 1.3658744563397762
Energy: 0.9936943979964596
Energy: 1.4334499663168523
Energy: 1.3319139922020315
Energy: 0.9909290398222877
Energy: 1.3319139922020315
Energy: 1.4334499663168523
Energy: 1.3319139922020315
Energy: 1.4519416481282348
Energy: 1.3298642857625793
Energy: 0.9940439893506933
Energy: 1.3298642857634946
Energy: 1.4519416481282348
Energy: 1.3298642857634946
Energy: 1.3655587278217884
Energy: 1.346836764939847
Energy: 0.9875934216358359
Energy: 1.346836764939847
Energy: 1.365558727820873
Energy: 1.346836764939847
Energy: 1.3659419506925232
Energy: 1.373928863516237
Energy: 0.9869525467381205
Energy: 1.373928863516237
Energy: 1.3659419506925232
Energy: 1.373928863516237
Energy: 0.9852697493079492
Energy: 0.9865513365254776
Energy: 0.9912686837580859
Energy: 0.9865513365254776
Energy: 0.9852697493079492
Energy: 0.9865513365254776
Energy: 0.9851501827515439
Energy: 1.3301378174327323
Energy: 0.9863099218059611
Energy: 1.3301378174327323
Energy: 0.9851501827515439
Energy: 1.3301378174327323
Energy: 0.9867406057289182
Energy: 1.3235366773953363
Energy: 0.9889178149605719
Energy: 1.3235366773953363
Energy: 0.9867406057280029
Energy: 1.3235366773953363
Energy: 0.9862064898604214
Energy: 1.373825373521081
Energy: 1.0382916367334707
Energy: 1.373825373521081
Energy: 0.9862064898604214
Energy: 1.373825373521081
Energy: 0.9849881831065568
Energy: 1.3244728299418698
Energy: 1.371472900404553
Energy: 1.3244728299418698
Energy: 0.9849881831065568
Energy: 1.3244728299418698
Energy: 0.986487232954386
Energy: 1.3300262812300232
Energy: 1.4511077623221311
Energy: 1.3300262812300232
Energy: 0.9864872329534706
Energy: 1.3300262812300232
Energy: 0.9868937524059387
Energy: 1.3137468995409662
Energy: 1.2245535019391363
Energy: 1.3137468995409662
Energy: 0.9868937524050234
Energy: 1.3137468995418817
Energy: 1.0633504590201326
Energy: 0.9924275493948584
Energy: 1.0383384910365197
Energy: 0.9924275493948584
Energy: 1.063350459019217
Energy: 0.9924275493948584
Energy: 0.9850688269114452
Energy: 0.9859170251316078
Energy: 1.176207592187021
Energy: 0.9859170251316078
Energy: 0.9850688269114452
Energy: 0.9859170251316078
Energy: 0.9969110638878682
Energy: 0.9866763224815661
Energy: 0.9860655093579361
Energy: 0.9866763224815661
Energy: 0.9969110638878682
Energy: 0.9866763224815661

minimum gb energy = 0.9844999082705208 eV
minimum distance =  2.30116928788252 Angstroms
sigma value = 57


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

Energy: 1.3608849872262403
Energy: 1.4815266412430546
Energy: 1.2397876777758359
Energy: 1.4815266412430546
Energy: 1.3608849872262403
Energy: 1.4815266412430546
Energy: 1.2443563247608973
Energy: 1.1363663015113958
Energy: 1.0721693192195776
Energy: 1.1363663015102106
Energy: 1.2443563247608973
Energy: 1.1363663015102106
Energy: 1.2735696955346842
Energy: 1.464962366507604
Energy: 1.3937845810399951
Energy: 1.4649623665064189
Energy: 1.2735696955346842
Energy: 1.4649623665064189
Energy: 1.2241637602288973
Energy: 1.0681189496181678
Energy: 1.0923293713796831
Energy: 1.0681189496181678
Energy: 1.2241637602288973
Energy: 1.0681189496181678
Energy: 1.0898565326122673
Energy: 1.0777066202570673
Energy: 1.236355675491727
Energy: 1.0777066202558823
Energy: 1.0898565326122673
Energy: 1.0777066202558823
Energy: 1.0819610090680778
Energy: 1.4527036949960097
Energy: 1.2393555084980261
Energy: 1.4527036949948242
Energy: 1.0819610090680778
Energy: 1.4527036949948242
Energy: 1.068128790630929
Energy: 1.0653339294823458
Energy: 1.0811764487631708
Energy: 1.0653339294835313
Energy: 1.068128790630929
Energy: 1.0653339294835313
Energy: 1.070809298670707
Energy: 1.0712575898321648
Energy: 1.157423561504897
Energy: 1.07125758983335
Energy: 1.070809298670707
Energy: 1.07125758983335
Energy: 1.0678977170403048
Energy: 1.1009338608340118
Energy: 1.2086103259418344
Energy: 1.1009338608351973
Energy: 1.0678977170403048
Energy: 1.1009338608351973
Energy: 1.2087020845472245
Energy: 1.4388622040579495
Energy: 1.2318989019394657
Energy: 1.4388622040579495
Energy: 1.2087020845484093
Energy: 1.4388622040579495
Energy: 1.2180924943705151
Energy: 1.069599119683642
Energy: 1.2134850509965518
Energy: 1.0695991196848271
Energy: 1.2180924943705151
Energy: 1.0695991196848271
Energy: 1.2341330117106253
Energy: 1.0680619616116176
Energy: 1.0926038369023887
Energy: 1.0680619616116176
Energy: 1.2341330117106253
Energy: 1.0680619616116176
Energy: 1.2332462423692945
Energy: 1.4198754053279232
Energy: 1.0947975001324328
Energy: 1.4198754053279232
Energy: 1.2332462423692945
Energy: 1.4198754053279232
Energy: 1.242700846101876
Energy: 1.067816236644117
Energy: 1.0690030117118616
Energy: 1.067816236642932
Energy: 1.242700846101876
Energy: 1.067816236642932
Energy: 1.242780176450312
Energy: 1.4683334624831557
Energy: 1.0731603115919102
Energy: 1.4683334624831557
Energy: 1.242780176450312
Energy: 1.4683334624831557
Energy: 1.2336757972123649
Energy: 1.3073466480039564
Energy: 1.0723761349217567
Energy: 1.3073466480039564
Energy: 1.2336757972123649
Energy: 1.3073466480039564
Energy: 1.2335573354610498
Energy: 1.0682329426935842
Energy: 1.2184696018104808
Energy: 1.0682329426923989
Energy: 1.2335573354610498
Energy: 1.0682329426923989
Energy: 1.2190683129181799
Energy: 1.0934689722826743
Energy: 1.2189590439897025
Energy: 1.0934689722826743
Energy: 1.2190683129181799
Energy: 1.0934689722826743
Energy: 1.2182855959354029
Energy: 1.0688494781453366
Energy: 1.2337028327257213
Energy: 1.0688494781453366
Energy: 1.2182855959354029
Energy: 1.0688494781453366
Energy: 1.0699340777151456
Energy: 1.4641915892154471
Energy: 1.2341303927195317
Energy: 1.4641915892154471
Energy: 1.0699340777151456
Energy: 1.4641915892154471
Energy: 1.078162196744341
Energy: 1.4342170220072494
Energy: 1.070073322018465
Energy: 1.4342170220084345
Energy: 1.078162196744341
Energy: 1.4342170220084345
Energy: 1.0688812811233739
Energy: 1.065680470670217
Energy: 1.0691184405134584
Energy: 1.065680470669032
Energy: 1.0688812811233739
Energy: 1.069381463460881
Energy: 1.2450457725537871
Energy: 1.307894025242291
Energy: 1.2335159443954293
Energy: 1.3078940252434763
Energy: 1.2450457725537871
Energy: 1.307894025242291
Energy: 1.0907164340981772
Energy: 1.0683897184445565
Energy: 1.2265900384380595
Energy: 1.0683897184457418
Energy: 1.0907164340981772
Energy: 1.0683897184457418

minimum gb energy = 1.0653339294823458 eV
minimum distance =  2.29647050912723 Angstroms
sigma value = 17


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

Energy: 1.1602901559404892
Energy: 1.1590713500253202
Energy: 1.1769700223127666
Energy: 1.1590713500253202
Energy: 1.1602901559404892
Energy: 1.1590713500253202
Energy: 1.1771064093710473
Energy: 1.1484152826610083
Energy: 1.1489616416462114
Energy: 1.1484152826610083
Energy: 1.1771064093710473
Energy: 1.1484152826610083
Energy: 1.1506023895384432
Energy: 1.1507379937347069
Energy: 1.1546825959411549
Energy: 1.1507379937347069
Energy: 1.1506023895384432
Energy: 1.1507379937347069
Energy: 1.1745423693119632
Energy: 1.1487922446350187
Energy: 1.1489531591590019
Energy: 1.1487922446333427
Energy: 1.174542369310287
Energy: 1.1487922446333427
Energy: 1.1472495600575778
Energy: 1.1480259439676326
Energy: 1.1508012866656132
Energy: 1.1480259439676326
Energy: 1.1472495600575778
Energy: 1.1480259439676326
Energy: 1.1486996748854674
Energy: 1.159212711290794
Energy: 1.160517028990985
Energy: 1.159212711289118
Energy: 1.1486996748854674
Energy: 1.159212711289118
Energy: 1.153115653287547
Energy: 1.3242883285951224
Energy: 1.1810608636869677
Energy: 1.3242883285951224
Energy: 1.153115653287547
Energy: 1.3242883285951224
Energy: 1.1479848439447167
Energy: 1.4367786222746322
Energy: 1.149048393353003
Energy: 1.4367786222746322
Energy: 1.1479848439447167
Energy: 1.4367786222746322
Energy: 1.1472934817947225
Energy: 1.14761160138743
Energy: 1.2143047468728045
Energy: 1.147611601385754
Energy: 1.1472934817930465
Energy: 1.147611601385754
Energy: 1.159625535273568
Energy: 1.1314745992167552
Energy: 1.149068032805447
Energy: 1.1314745992167552
Energy: 1.159625535273568
Energy: 1.1314745992167552
Energy: 1.1621203487010408
Energy: 1.1480381682991974
Energy: 1.1570099323650327
Energy: 1.1480381682991974
Energy: 1.1621203487010408
Energy: 1.1480381682991974
Energy: 1.1474649236589203
Energy: 1.150929377076097
Energy: 1.154407749425501
Energy: 1.1509293770777733
Energy: 1.147464923657244
Energy: 1.1509293770777733
Energy: 1.1474946832297457
Energy: 1.297394713749844
Energy: 1.1477945698059318
Energy: 1.297394713749844
Energy: 1.1474946832297457
Energy: 1.297394713749844
Energy: 1.1479662006487874
Energy: 1.1480304854207433
Energy: 1.1492845404545475
Energy: 1.1480304854207433
Energy: 1.1479662006487874
Energy: 1.1480304854207433
Energy: 1.1527820830926239
Energy: 1.4162182553016696
Energy: 1.1597826703538388
Energy: 1.4162182552999936
Energy: 1.1527820830926239
Energy: 1.4162182552999936
Energy: 1.1539496547015933
Energy: 1.1486320795370208
Energy: 1.1604119569512257
Energy: 1.1486320795386968
Energy: 1.1539496547015933
Energy: 1.1486320795386968
Energy: 1.1575899918596244
Energy: 1.1491992252441026
Energy: 1.147857526162003
Energy: 1.1491992252441026
Energy: 1.1575899918596244
Energy: 1.1491992252441026

minimum gb energy = 1.1314745992167552 eV
minimum distance =  2.27471979453222 Angstroms
sigma value = 17


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

Energy: 1.7127462729548582
Energy: 1.5594795039232214
Energy: 1.2737227887467946
Energy: 1.5594795039225742
Energy: 1.7127462729548582
Energy: 1.5594795039225742
Energy: 1.4172223581717858
Energy: 1.1486252382034021
Energy: 1.1353900560462833
Energy: 1.1486252382034021
Energy: 1.4172223581717858
Energy: 1.1486252382034021
Energy: 1.1414534107444665
Energy: 1.2384171628074667
Energy: 1.131373095035246
Energy: 1.2384171628074667
Energy: 1.1414534107444665
Energy: 1.2384171628074667
Energy: 1.1461472510862691
Energy: 1.131413336975329
Energy: 1.2495172209486558
Energy: 1.131413336975329
Energy: 1.1461472510862691
Energy: 1.1314133369759762
Energy: 1.1350427089374597
Energy: 1.1866446422406032
Energy: 1.4536202128843487
Energy: 1.1866446422399561
Energy: 1.1350427089374597
Energy: 1.1866446422399561
Energy: 1.2618259968138459
Energy: 1.139199169909581
Energy: 1.2786760342118748
Energy: 1.139199169909581
Energy: 1.2618259968151404
Energy: 1.139199169909581
Energy: 1.1362977405648345
Energy: 1.2600761762873167
Energy: 1.414991028645057
Energy: 1.2600761762873167
Energy: 1.1362977405648345
Energy: 1.2600761762873167
Energy: 1.398444659488634
Energy: 1.1333969822284626
Energy: 1.1341092020733372
Energy: 1.13339698222911
Energy: 1.398444659488634
Energy: 1.1333969822284626
Energy: 1.2803614229432563
Energy: 1.1388410581205812
Energy: 1.1528964211037502
Energy: 1.1388410581192865
Energy: 1.2803614229432563
Energy: 1.138841058119934
Energy: 1.394197970966812
Energy: 1.2221622903013682
Energy: 1.1364755577727852
Energy: 1.2221622903020155
Energy: 1.394197970966165
Energy: 1.2221622903020155
Energy: 1.251083126660983
Energy: 1.3786057780130887
Energy: 1.2448358087028788
Energy: 1.3786057780130887
Energy: 1.251083126660983
Energy: 1.3786057780130887
Energy: 1.146665852921289
Energy: 1.1469309602527695
Energy: 1.1484122977795566
Energy: 1.1469309602521223
Energy: 1.146665852921289
Energy: 1.1469309602534168
Energy: 1.1378728528681854
Energy: 1.135377574725856
Energy: 1.4279457201054737
Energy: 1.1353775747265031
Energy: 1.1378728528681854
Energy: 1.135377574725856
Energy: 1.1588425959579347
Energy: 1.4134496624494375
Energy: 1.6297885420467941
Energy: 1.4134496624494375
Energy: 1.1588425959579347
Energy: 1.4134496624494375
Energy: 1.1516085117246808
Energy: 1.38658628901947
Energy: 1.2439910847151356
Energy: 1.38658628901947
Energy: 1.1516085117246808
Energy: 1.386586289018823
Energy: 1.2506940578027996
Energy: 1.5448275652919468
Energy: 1.1488858048517232
Energy: 1.5448275652919468
Energy: 1.2506940578027996
Energy: 1.5448275652919468
Energy: 1.259003096666732
Energy: 1.132965817534744
Energy: 1.1448601840177517
Energy: 1.1329658175340966
Energy: 1.259003096666732
Energy: 1.132965817534744
Energy: 1.6092373796808253
Energy: 1.421250270020929
Energy: 1.1562812982621657
Energy: 1.421250270020929
Energy: 1.6092373796808253
Energy: 1.421250270020929
Energy: 1.5279919826021433
Energy: 1.3748874477911768
Energy: 1.1398091659927558
Energy: 1.3748874477905295
Energy: 1.5279919826021433
Energy: 1.3748874477911768
Energy: 1.1459908777697654
Energy: 1.2177366669541545
Energy: 1.1459570574875364
Energy: 1.217736666952213
Energy: 1.1459908777697654
Energy: 1.217736666952213
Energy: 1.1397788457607598
Energy: 1.3756564545495993
Energy: 1.442060717838986
Energy: 1.3756564545489518
Energy: 1.139778845761407
Energy: 1.3756564545495993
Energy: 1.1562926355191152
Energy: 1.4212349726651459
Energy: 1.6092135112080321
Energy: 1.4212349726644986
Energy: 1.1562926355191152
Energy: 1.4212349726651459
Energy: 1.1536482943351352
Energy: 1.1324724859665514
Energy: 1.2586244427635649
Energy: 1.1324724859671988
Energy: 1.1536482943351352
Energy: 1.1324724859671988
Energy: 1.1488870036743832
Energy: 1.370766500403334
Energy: 1.2509223590177012
Energy: 1.3707665004026868
Energy: 1.1488870036743832
Energy: 1.3707665004026868
Energy: 1.2439739066205466
Energy: 1.3861815601166765
Energy: 1.1427365911342608
Energy: 1.3861815601160292
Energy: 1.2439739066205466
Energy: 1.3861815601160292
Energy: 1.6712598886331371
Energy: 1.4135733642011037
Energy: 1.1588457148462876
Energy: 1.413573364202398
Energy: 1.6712598886331371
Energy: 1.4135733642017507
Energy: 1.4275208751540083
Energy: 1.1353713787202178
Energy: 1.1376733003938972
Energy: 1.135371378718923
Energy: 1.4275208751533612
Energy: 1.135371378718923
Energy: 1.1484321826672732
Energy: 1.146816573493445
Energy: 1.1465592205284483
Energy: 1.146816573493445
Energy: 1.1484321826672732
Energy: 1.146816573496034
Energy: 1.24465283433313
Energy: 1.3784002934033974
Energy: 1.2509485601392243
Energy: 1.37840029340275
Energy: 1.24465283433313
Energy: 1.37840029340275
Energy: 1.1364947542657882
Energy: 1.187679732577895
Energy: 1.3941814399771804
Energy: 1.187679732577895
Energy: 1.136494754265141
Energy: 1.187679732577895
Energy: 1.1529039192826076
Energy: 1.1387774648251894
Energy: 1.2803706376373591
Energy: 1.1387774648251894
Energy: 1.1529039192826076
Energy: 1.1387774648251894
Energy: 1.1341121334615336
Energy: 1.1330821704997205
Energy: 1.3984169410081186
Energy: 1.1330821704997205
Energy: 1.1341121334615336
Energy: 1.1330821704990732
Energy: 1.4147701006742404
Energy: 1.260037983899024
Energy: 1.1363131229002987
Energy: 1.260037983899024
Energy: 1.4147701006742404
Energy: 1.260037983899024
Energy: 1.2787054984589539
Energy: 1.1386931699394505
Energy: 1.262354288658348
Energy: 1.1386931699394505
Energy: 1.2787054984583068
Energy: 1.1386931699400977
Energy: 1.45375958360405
Energy: 1.1866446422399561
Energy: 1.1350392447969273
Energy: 1.1866446422399561
Energy: 1.4537595836034025
Energy: 1.1866446422399561
Energy: 1.2496867572827899
Energy: 1.131319639706396
Energy: 1.1462885433550756
Energy: 1.131319639706396
Energy: 1.2496867572827899
Energy: 1.1313196397070433
Energy: 1.1314165393346785
Energy: 1.2384047536571556
Energy: 1.1414615877702918
Energy: 1.2384047536571556
Energy: 1.1314165393346785
Energy: 1.2384047536571556
Energy: 1.1353904732356026
Energy: 1.1486250070255892
Energy: 1.4170926465379308
Energy: 1.1486250070255892
Energy: 1.1353904732356026
Energy: 1.1486250070255892
Energy: 1.4087376995380587
Energy: 1.5594795039225742
Energy: 1.7127462729548582
Energy: 1.5594795039219271
Energy: 1.4087376995380587
Energy: 1.5594795039232214
Energy: 1.1353900560469306
Energy: 1.1486252382034021
Energy: 1.4172223581717858
Energy: 1.1486252382034021
Energy: 1.1353900560469306
Energy: 1.1486252382034021
Energy: 1.1313730950481908
Energy: 1.2384171628068197
Energy: 1.141453410743819
Energy: 1.2384171628061724
Energy: 1.131373095046249
Energy: 1.2384171628061724
Energy: 1.2495172209486558
Energy: 1.131413336975329
Energy: 1.1461472510862691
Energy: 1.131413336975329
Energy: 1.2495172209486558
Energy: 1.1314133369746817
Energy: 1.4536202128837015
Energy: 1.1866446422399561
Energy: 1.1350427089368127
Energy: 1.1866446422406032
Energy: 1.4536202128837015
Energy: 1.1866446422406032

minimum gb energy = 1.131319639706396 eV
minimum distance =  2.25883831936198 Angstroms
sigma value = 57


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

Energy: 1.3037098304021653
Energy: 1.106051224031803
Energy: 1.4660031278732581
Energy: 1.1060512240339107
Energy: 1.3037098304021653
Energy: 1.1060512240286415
Energy: 1.235844410687273
Energy: 1.1147878100773034
Energy: 1.115176381818444
Energy: 1.114787810080465
Energy: 1.235844410687273
Energy: 1.114787810080465
Energy: 1.1053425188524204
Energy: 1.2713136164421373
Energy: 1.2172510297602401
Energy: 1.2713136164400294
Energy: 1.1053425188513666
Energy: 1.2713136164400294
Energy: 1.3191018053563548
Energy: 1.2666111629822252
Energy: 1.266711929811264
Energy: 1.2666111629822252
Energy: 1.3191018053563548
Energy: 1.2666111629822252
Energy: 1.1082322342945492
Energy: 1.1747553815310514
Energy: 1.3188893715564554
Energy: 1.1747553815310514
Energy: 1.1082322342945492
Energy: 1.1747553815299978
Energy: 1.2812981183055379
Energy: 1.2666402466493607
Energy: 1.266829823275359
Energy: 1.266640246648307
Energy: 1.281298118304484
Energy: 1.266640246648307
Energy: 1.1082671759469604
Energy: 1.2803855455782092
Energy: 1.1194643176475358
Energy: 1.2803855455792628
Energy: 1.1082671759469604
Energy: 1.2803855455792628
Energy: 1.1067850868717668
Energy: 1.186162297578487
Energy: 1.1151394894147624
Energy: 1.186162297577433
Energy: 1.1067850868707128
Energy: 1.186162297578487
Energy: 1.3055077573107743
Energy: 1.1055618253003587
Energy: 1.120270238890759
Energy: 1.1055618253014126
Energy: 1.3055077573107743
Energy: 1.1055618253003587
Energy: 1.2169589107656995
Energy: 1.1166729414620897
Energy: 1.120453352507389
Energy: 1.1166729414631438
Energy: 1.2169589107656995
Energy: 1.1166729414620897
Energy: 1.1083869830092161
Energy: 1.1065936610224927
Energy: 1.2680049341523152
Energy: 1.1065936610214386
Energy: 1.1083869830092161
Energy: 1.1065936610224927
Energy: 1.1908245090749296
Energy: 1.2681479505013895
Energy: 1.2703460814402379
Energy: 1.2681479505003357
Energy: 1.1908245090759835
Energy: 1.2681479504992819
Energy: 1.1141724252611502
Energy: 1.2708850275744994
Energy: 1.267951570201137
Energy: 1.2708850275744994
Energy: 1.1141724252611502
Energy: 1.2708850275744994
Energy: 1.2807245775348373
Energy: 1.3058947053914325
Energy: 1.2704026167269309
Energy: 1.3058947053914325
Energy: 1.2807245775348373
Energy: 1.305894705394594
Energy: 1.116854009415587
Energy: 1.2822047673801953
Energy: 1.1219040342129056
Energy: 1.2822047673801953
Energy: 1.116854009415587
Energy: 1.2822047673801953
Energy: 1.1076432866658896
Energy: 1.1875198611663442
Energy: 1.120610083898477
Energy: 1.1875198611631823
Energy: 1.1076432866658896
Energy: 1.1875198611621287
Energy: 1.3123600546533325
Energy: 1.2566936174561445
Energy: 1.127251257230975
Energy: 1.2566936174624677
Energy: 1.3123600546533325
Energy: 1.2566936174571983
Energy: 1.2803912210296444
Energy: 1.2623181276281459
Energy: 1.1231132888073656
Energy: 1.2623181276291997
Energy: 1.2803912210285904
Energy: 1.2623181276291997
Energy: 1.117284437568794
Energy: 1.1098554873101536
Energy: 1.2795422782657708
Energy: 1.1098554873090998
Energy: 1.117284437568794
Energy: 1.1098554873112074
Energy: 1.2693774021453545
Energy: 1.2598884182451617
Energy: 1.2784348310893099
Energy: 1.259888418244108
Energy: 1.2693774021453545
Energy: 1.2598884182472694
Energy: 1.1141177631655237
Energy: 1.2607640074135738
Energy: 1.2673706069800335
Energy: 1.2607640074125197
Energy: 1.1141177631655237
Energy: 1.2607640074114659
Energy: 1.123133724963871
Energy: 1.1065297307884552
Energy: 1.2788758167569272
Energy: 1.1065297307895092
Energy: 1.123133724963871
Energy: 1.1065297307895092
Energy: 1.1179512672591392
Energy: 1.2729924480295913
Energy: 1.1278928278054132
Energy: 1.2729924480295913
Energy: 1.1179512672580856
Energy: 1.2729924480295913
Energy: 1.3178068734877024
Energy: 1.2639794543409557
Energy: 1.1216961720647283
Energy: 1.2639794543388478
Energy: 1.3178068734877024
Energy: 1.263979454337794
Energy: 1.304134985870436
Energy: 1.2549389442071612
Energy: 1.125553593922843
Energy: 1.2549389442071612
Energy: 1.304134985870436
Energy: 1.2549389442061074
Energy: 1.1228833843345492
Energy: 1.2836250363044928
Energy: 1.1270380155270374
Energy: 1.2836250363044928
Energy: 1.1228833843345492
Energy: 1.2836250363044928
Energy: 1.1180327537900496
Energy: 1.107242383638445
Energy: 1.2740783602423509
Energy: 1.1072423836363372
Energy: 1.1180327537900496
Energy: 1.107242383638445

minimum gb energy = 1.1053425188513666 eV
minimum distance =  2.30269000743476 Angstroms
sigma value = 43


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

Energy: 1.3628685160936618
Energy: 1.1789409668820146
Energy: 1.3494156724657604
Energy: 1.1789409668820146
Energy: 1.3628685160936618
Energy: 1.1789409668804787
Energy: 1.2330441617781491
Energy: 1.1753270539875083
Energy: 1.158072103984248
Energy: 1.1753270539875083
Energy: 1.2330441617781491
Energy: 1.1753270539875083
Energy: 1.1574218888731953
Energy: 1.3105030771013042
Energy: 1.1580693287558874
Energy: 1.3105030771020718
Energy: 1.1574218888731953
Energy: 1.3105030771020718
Energy: 1.3680981438371944
Energy: 1.1574468859150064
Energy: 1.3080593834949907
Energy: 1.1574468859150064
Energy: 1.3680981438371944
Energy: 1.1574468859150064
Energy: 1.1568940429481551
Energy: 1.2329316027045594
Energy: 1.2782574708376508
Energy: 1.2329316027045594
Energy: 1.1568940429481551
Energy: 1.2329316027045594
Energy: 1.2905006911174597
Energy: 1.2896487642834893
Energy: 1.178727806953089
Energy: 1.2896487642834893
Energy: 1.2905006911174597
Energy: 1.2896487642842573
Energy: 1.1803759551961222
Energy: 1.290121775266499
Energy: 1.1759636377496978
Energy: 1.290121775266499
Energy: 1.1803759551961222
Energy: 1.290121775266499
Energy: 1.3006326857856265
Energy: 1.2330764284986901
Energy: 1.1563087523423783
Energy: 1.2330764284986901
Energy: 1.3006326857856265
Energy: 1.233076428497922
Energy: 1.309132283269749
Energy: 1.1573337207853927
Energy: 1.312808341041687
Energy: 1.157333720784625
Energy: 1.309132283269749
Energy: 1.1573337207853927
Energy: 1.3994703474650945
Energy: 1.3115863409163326
Energy: 1.1619171475353323
Energy: 1.3115863409163326
Energy: 1.3994703474650945
Energy: 1.3115863409163326
Energy: 1.159660305715267
Energy: 1.2285103527539982
Energy: 1.5313996595438488
Energy: 1.2285103527539982
Energy: 1.159660305715267
Energy: 1.2285103527539982
Energy: 1.175721039461112
Energy: 1.178841152423562
Energy: 1.3663809042882689
Energy: 1.178841152423562
Energy: 1.175721039461112
Energy: 1.1788411524243299
Energy: 1.157886868467425
Energy: 1.1759838938102125
Energy: 1.306268316796958
Energy: 1.1759838938102125
Energy: 1.157886868467425
Energy: 1.1759838938102125
Energy: 1.308227734572402
Energy: 1.1574088226258514
Energy: 1.1615081502153681
Energy: 1.1574088226250836
Energy: 1.308227734572402
Energy: 1.1574088226258514
Energy: 1.313742259065848
Energy: 1.1581032205454125
Energy: 1.1733233107707453
Energy: 1.1581032205454125
Energy: 1.313742259065848
Energy: 1.1581032205454125
Energy: 1.291100010729166
Energy: 1.3069587590433687
Energy: 1.155135442616691
Energy: 1.3069587590433687
Energy: 1.291100010729166
Energy: 1.3069587590433687
Energy: 1.1780205284712566
Energy: 1.1784729862131722
Energy: 1.2913931244059944
Energy: 1.1784729862131722
Energy: 1.1780205284712566
Energy: 1.1784729862131722
Energy: 1.1780927528749199
Energy: 1.2922317924384605
Energy: 1.1778664462261783
Energy: 1.2922317924376927
Energy: 1.1780927528749199
Energy: 1.2922317924376927
Energy: 1.1731267841111142
Energy: 1.1765215233813928
Energy: 1.3079772728736665
Energy: 1.1765215233813928
Energy: 1.1731267841111142
Energy: 1.1765215233813928
Energy: 1.1573807026072238
Energy: 1.2894467571189911
Energy: 1.308160886060345
Energy: 1.2894467571189911
Energy: 1.1573807026072238
Energy: 1.2894467571189911
Energy: 1.1574032995115604
Energy: 1.3132295722411602
Energy: 1.1751192647078201
Energy: 1.3132295722411602
Energy: 1.1574032995115604
Energy: 1.3132295722411602
Energy: 1.690353347041408
Energy: 1.1637451482521362
Energy: 1.1578062487063212
Energy: 1.1637451482521362
Energy: 1.690353347041408
Energy: 1.1637451482513683
Energy: 1.8030955218692666
Energy: 1.1560725172178765
Energy: 1.1748402720854514
Energy: 1.1560725172178765
Energy: 1.8030955218700344
Energy: 1.1560725172171087
Energy: 1.1570751504384251
Energy: 1.3023029016942493
Energy: 1.1746843920108179
Energy: 1.3023029016950172
Energy: 1.1570751504384251
Energy: 1.3023029016950172
Energy: 1.1576163840130809
Energy: 1.3006524627697431
Energy: 1.3085228390205337
Energy: 1.3006524627697431
Energy: 1.1576163840130809
Energy: 1.3006524627697431
Energy: 1.1727996293549274
Energy: 1.332219207767664
Energy: 1.3079242036503267
Energy: 1.332219207767664
Energy: 1.1727996293541596
Energy: 1.332219207767664
Energy: 1.1753401746709315
Energy: 1.4975884077853459
Energy: 1.2903076891065377
Energy: 1.4975884077853459
Energy: 1.1753401746709315
Energy: 1.4975884077853459
Energy: 1.2905303396256167
Energy: 1.277044756721436
Energy: 1.2904971638991165
Energy: 1.277044756721436
Energy: 1.2905303396256167
Energy: 1.277044756721436
Energy: 1.290300969507347
Energy: 1.497591029557816
Energy: 1.1566797490370586
Energy: 1.497591029557816
Energy: 1.290300969507347
Energy: 1.497591029557816
Energy: 1.3079746285756777
Energy: 1.3321385630634064
Energy: 1.1727580294646902
Energy: 1.3321385630626383
Energy: 1.3079746285756777
Energy: 1.3321385630626383
Energy: 1.3082988529952069
Energy: 1.2943221199967987
Energy: 1.157463919665786
Energy: 1.294322119996031
Energy: 1.3082988529959747
Energy: 1.294322119996031
Energy: 1.174667363287201
Energy: 1.302276462339261
Energy: 1.1570722716650874
Energy: 1.302276462339261
Energy: 1.174667363287201
Energy: 1.302276462339261
Energy: 1.1748350989054666
Energy: 1.1560567358033567
Energy: 1.5753444917063069
Energy: 1.1560567358033567
Energy: 1.1748350989062344
Energy: 1.1560567358033567
Energy: 1.1580648817692345
Energy: 1.1639054900771968
Energy: 1.6904301910956854
Energy: 1.163905490076429
Energy: 1.1580648817684667
Energy: 1.1639054900771968
Energy: 1.1751270989059368
Energy: 1.3135564831538138
Energy: 1.1573577757873934
Energy: 1.3135564831538138
Energy: 1.1751270989059368
Energy: 1.3135564831538138
Energy: 1.3081775034913683
Energy: 1.2892317785265588
Energy: 1.1573552402826144
Energy: 1.2892317785265588
Energy: 1.3081775034913683
Energy: 1.2892317785265588

minimum gb energy = 1.155135442616691 eV
minimum distance =  2.28488264653305 Angstroms
sigma value = 81


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

Energy: 1.1970242449141992
Energy: 1.1980049366308285
Energy: 1.1973602786268678
Energy: 1.1980049366305399
Energy: 1.1970242449139425
Energy: 1.1980049366305399
Energy: 1.1984611827582299
Energy: 1.197943368020951
Energy: 1.1970477525678167
Energy: 1.1979433680212397
Energy: 1.1984611827582299
Energy: 1.1979433680212397
Energy: 1.1970458587598611
Energy: 1.197946513199073
Energy: 1.6137059683568449
Energy: 1.197946513199073
Energy: 1.1970458587598611
Energy: 1.1979465131987843
Energy: 1.1973602786262907
Energy: 1.1980049366305399
Energy: 1.1970242449141992
Energy: 1.1980049366302512
Energy: 1.1973602786268678
Energy: 1.1980049366302512
Energy: 1.1970477525678167
Energy: 1.197943368020951
Energy: 1.1984611827576848
Energy: 1.1979433680206626
Energy: 1.1970477525678167
Energy: 1.197943368020951
Energy: 1.6137059683568449
Energy: 1.1979465131987843
Energy: 1.1970458587598611
Energy: 1.197946513199073
Energy: 1.6137059683568449
Energy: 1.1979465131987843
Energy: 1.1970242449141992
Energy: 1.1980049366305399
Energy: 1.1973602786257136
Energy: 1.1980049366305399
Energy: 1.1970242449141992
Energy: 1.1980049366305399
Energy: 1.1984611827579414
Energy: 1.1979433680212397
Energy: 1.1970477525678167
Energy: 1.197943368020951
Energy: 1.1984611827579414
Energy: 1.197943368020951
Energy: 1.1970458587601176
Energy: 1.197946513199073
Energy: 1.1797562822180052
Energy: 1.1979465131987843
Energy: 1.1970458587601176
Energy: 1.1979465131987843
Energy: 1.1973602786251687
Energy: 1.1980049366305399
Energy: 1.1970242449141992
Energy: 1.1980049366305399
Energy: 1.197360278626002
Energy: 1.1980049366305399

minimum gb energy = 1.1797562822180052 eV
minimum distance =  2.25712762239815 Angstroms
sigma value = 3


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

Energy: 1.6347993085650219
Energy: 1.15907257300347
Energy: 1.1517228426305093
Energy: 1.159072573002626
Energy: 1.6347993085650219
Energy: 1.159072573002626
Energy: 1.1587269840214962
Energy: 1.1814635880980784
Energy: 1.1270136556071753
Energy: 1.1814635880989228
Energy: 1.1587269840223402
Energy: 1.1814635880989228
Energy: 1.1474746512979175
Energy: 1.1478731282372139
Energy: 1.2392674359716132
Energy: 1.1478731282380583
Energy: 1.1474746512979175
Energy: 1.1478731282372139
Energy: 1.1496916422651846
Energy: 1.3888626130625086
Energy: 1.1865597268375978
Energy: 1.3888626130625086
Energy: 1.1496916422643404
Energy: 1.3888626130625086
Energy: 1.160233407663621
Energy: 1.158616526708044
Energy: 1.1294959572244179
Energy: 1.158616526708044
Energy: 1.160233407663621
Energy: 1.158616526708044
Energy: 1.1577362521266976
Energy: 1.2213279519318172
Energy: 1.1296452422119951
Energy: 1.2213279519318172
Energy: 1.1577362521250094
Energy: 1.2213279519318172
Energy: 1.1604829745143255
Energy: 1.1587441709003812
Energy: 1.1804700933832484
Energy: 1.158744170899537
Energy: 1.1604829745143255
Energy: 1.158744170899537
Energy: 1.1590830501722766
Energy: 1.1275403705728526
Energy: 1.1902426146378946
Energy: 1.1275403705736968
Energy: 1.1590830501722766
Energy: 1.1275403705728526
Energy: 1.1479845493249716
Energy: 1.147591632978497
Energy: 1.3701527869837509
Energy: 1.147591632978497
Energy: 1.1479845493249716
Energy: 1.147591632978497
Energy: 1.148404867962295
Energy: 1.1824155292515073
Energy: 1.1267765368768354
Energy: 1.1824155292515073
Energy: 1.1484048679631393
Energy: 1.1824155292515073
Energy: 1.6162591075860278
Energy: 1.1270309704074377
Energy: 1.1821129806661688
Energy: 1.1270309704065933
Energy: 1.6162591075860278
Energy: 1.1270309704074377
Energy: 1.6180862844513226
Energy: 1.2431586922899351
Energy: 1.1265050423245313
Energy: 1.2431586922907791
Energy: 1.6180862844513226
Energy: 1.2431586922916233
Energy: 1.1486368496213482
Energy: 1.2584496440793198
Energy: 1.1269514193674468
Energy: 1.258449644075943
Energy: 1.1486368496213482
Energy: 1.258449644075943
Energy: 1.147058334911629
Energy: 1.2557769659309328
Energy: 1.1855964403651253
Energy: 1.2557769659300884
Energy: 1.147058334911629
Energy: 1.2557769659292441
Energy: 1.158475478042179
Energy: 1.248336669735927
Energy: 1.1851737631444492
Energy: 1.2483366697350828
Energy: 1.1584754780413349
Energy: 1.2483366697350828
Energy: 1.1590233532741767
Energy: 1.1825619384225075
Energy: 1.1273732479560659
Energy: 1.1825619384233519
Energy: 1.1590233532741767
Energy: 1.1825619384225075
Energy: 1.158782816494684
Energy: 1.1826534790668557
Energy: 1.1276056940704664
Energy: 1.1826534790651675
Energy: 1.158782816494684
Energy: 1.1826534790651675
Energy: 1.1585078586142044
Energy: 1.2792092394790244
Energy: 1.1857625883086984
Energy: 1.2792092394798689
Energy: 1.1585078586150488
Energy: 1.2792092394798689
Energy: 1.1482230733522236
Energy: 1.2567128262169682
Energy: 1.1855707493461567
Energy: 1.256712826216124
Energy: 1.1482230733522236
Energy: 1.2567128262152796
Energy: 1.1479802735044593
Energy: 1.1837067224989593
Energy: 1.1267139200097716
Energy: 1.1837067224989593
Energy: 1.1479802735044593
Energy: 1.1837067224989593
Energy: 1.6157534640745683
Energy: 1.2420992052788162
Energy: 1.126621942608357
Energy: 1.2420992052788162
Energy: 1.6157534640754125
Energy: 1.2420992052788162
Energy: 1.6145292091118504
Energy: 1.126129905209106
Energy: 1.1821209216644895
Energy: 1.1261299052082618
Energy: 1.6145292091118504
Energy: 1.1261299052074176
Energy: 1.1481780767101586
Energy: 1.1826752059255339
Energy: 1.126969628045018
Energy: 1.1826752059255339
Energy: 1.1481780767101586
Energy: 1.1826752059255339
Energy: 1.1479644061450627
Energy: 1.1473966380129605
Energy: 1.6025125988464564
Energy: 1.1473966380129605
Energy: 1.1479644061450627
Energy: 1.1473966380129605
Energy: 1.1588974104531573
Energy: 1.2816427857647195
Energy: 1.1853854151310963
Energy: 1.2816427857647195
Energy: 1.1588974104531573
Energy: 1.2816427857647195
Energy: 1.1627388312920135
Energy: 1.2745421920450042
Energy: 1.2214503316572385
Energy: 1.2745421920458486
Energy: 1.1627388312920135
Energy: 1.2745421920441597
Energy: 1.1587360639034094
Energy: 1.1820354894447926
Energy: 1.129572325305013
Energy: 1.182035489443104
Energy: 1.1587360639034094
Energy: 1.182035489443104
Energy: 1.162756659901768
Energy: 1.2437778023068784
Energy: 1.1295421402932688
Energy: 1.2437778023060342
Energy: 1.162756659901768
Energy: 1.2437778023060342
Energy: 1.2580760996436602
Energy: 1.1268381208168181
Energy: 1.1879078040543138
Energy: 1.1268381208176623
Energy: 1.2580760996428155
Energy: 1.1268381208176623
Energy: 1.148200325183498
Energy: 1.1478661713138611
Energy: 1.3568553877844425
Energy: 1.1478661713147058
Energy: 1.148200325183498
Energy: 1.1478661713147058
Energy: 1.2200493605884917
Energy: 1.1817513793853445
Energy: 1.1289393585543974
Energy: 1.1817513793861887
Energy: 1.2200493605884917
Energy: 1.1817513793861887
Energy: 1.6134532541806341
Energy: 1.1591791284906872
Energy: 1.1806904536693332
Energy: 1.1591791284898427
Energy: 1.6134532541806341
Energy: 1.1591791284898427
Energy: 1.155800130572886
Energy: 1.1813322222588833
Energy: 1.1263892918915157
Energy: 1.1813322222597278
Energy: 1.155800130572886
Energy: 1.1813322222597278

minimum gb energy = 1.1261299052074176 eV
minimum distance =  2.24384089043276 Angstroms
sigma value = 67


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

Energy: 1.1484887639680437
Energy: 1.0900069314893739
Energy: 1.5388704935739446
Energy: 1.0900069314893739
Energy: 1.1484887639680437
Energy: 1.0900069314893739
Energy: 1.5236268705500575
Energy: 1.1002216181124218
Energy: 1.0910959496187578
Energy: 1.1002216181124218
Energy: 1.5236268705500575
Energy: 1.1002216181124218
Energy: 1.0903027538285683
Energy: 1.1888334320839107
Energy: 1.317168944512768
Energy: 1.1888334320839107
Energy: 1.0903027538285683
Energy: 1.1888334320839107
Energy: 1.5396570148373498
Energy: 1.1762546326266954
Energy: 1.0883100237133232
Energy: 1.1762546326254926
Energy: 1.539657014836147
Energy: 1.1762546326266954
Energy: 1.0902993252281241
Energy: 1.1726175256187594
Energy: 1.1021418282332944
Energy: 1.1726175256187594
Energy: 1.0902993252281241
Energy: 1.1726175256187594
Energy: 1.0890401671834768
Energy: 1.1010915021692598
Energy: 1.091334914519
Energy: 1.1010915021680572
Energy: 1.0890401671834768
Energy: 1.1010915021692598
Energy: 1.0903816295103275
Energy: 1.1007902225741542
Energy: 1.103544085271951
Energy: 1.1007902225741542
Energy: 1.0903816295103275
Energy: 1.1007902225741542
Energy: 1.1008830052178136
Energy: 1.4411183045006388
Energy: 1.6649218093059703
Energy: 1.441118304499436
Energy: 1.1008830052166108
Energy: 1.441118304499436
Energy: 1.111467007490499
Energy: 1.1551532827883118
Energy: 1.655415712811424
Energy: 1.1551532827883118
Energy: 1.1114670074917021
Energy: 1.1551532827895148
Energy: 1.1008941191334305
Energy: 1.1017316156973753
Energy: 1.1079675815887733
Energy: 1.1017316156973753
Energy: 1.1008941191334305
Energy: 1.1017316156973753
Energy: 1.0995556877359285
Energy: 1.1014443927608544
Energy: 1.1045946437227772
Energy: 1.1014443927608544
Energy: 1.0995556877371315
Energy: 1.1014443927608544
Energy: 1.088425391223527
Energy: 1.1647515136961244
Energy: 1.088219502825183
Energy: 1.1647515136961244
Energy: 1.088425391223527
Energy: 1.1647515136961244
Energy: 1.1047095464797938
Energy: 1.1016368552713245
Energy: 1.0995447487792376
Energy: 1.1016368552713245
Energy: 1.1047095464797938
Energy: 1.1016368552713245
Energy: 1.1082518594688229
Energy: 1.1016771234716678
Energy: 1.1006901713076296
Energy: 1.1016771234716678
Energy: 1.1082518594688229
Energy: 1.1016771234704645
Energy: 1.65540483986327
Energy: 1.1552203991342327
Energy: 1.1112143304998507
Energy: 1.1552203991330299
Energy: 1.65540483986327
Energy: 1.1552203991330299
Energy: 1.664729432105763
Energy: 1.441135963834783
Energy: 1.1008197354958016
Energy: 1.441135963834783
Energy: 1.664729432105763
Energy: 1.441135963834783
Energy: 1.1032389030018863
Energy: 1.1009779184789719
Energy: 1.0854565029733194
Energy: 1.100977918477769
Energy: 1.1032389030030894
Energy: 1.100977918477769
Energy: 1.0912884854053784
Energy: 1.10102709808898
Energy: 1.0893159838801882
Energy: 1.1010270980877772
Energy: 1.0912884854053784
Energy: 1.10102709808898
Energy: 1.1024260416895755
Energy: 1.1675337790582792
Energy: 1.0903419918340829
Energy: 1.1675337790582792
Energy: 1.1024260416943872
Energy: 1.167533779055873
Energy: 1.0883134727481578
Energy: 1.1764178163145944
Energy: 1.5396261985421826
Energy: 1.1764178163145944
Energy: 1.0883134727481578
Energy: 1.1764178163145944
Energy: 1.3165727865046373
Energy: 1.1888334320839107
Energy: 1.0853380088931461
Energy: 1.188833432082708
Energy: 1.3165727865034889
Energy: 1.1888334320839107
Energy: 1.091078782652042
Energy: 1.1002405545489773
Energy: 1.5236811596348994
Energy: 1.1002405545489773
Energy: 1.091078782652042
Energy: 1.1002405545489773
Energy: 1.3631271081117955
Energy: 1.090006931490577
Energy: 1.1484887639680437
Energy: 1.090006931490577
Energy: 1.3631271081117955
Energy: 1.0900069314893739

minimum gb energy = 1.0853380088931461 eV
minimum distance =  2.2711513562295 Angstroms
sigma value = 33


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

Energy: 1.4442296668247905
Energy: 1.067116930705167
Energy: 1.5387610680204997
Energy: 1.067116930705167
Energy: 1.4442296668247905
Energy: 1.067116930705167
Energy: 1.4921451624392001
Energy: 1.0476602828728807
Energy: 1.0264812930301581
Energy: 1.0476602828728807
Energy: 1.4921451624392001
Energy: 1.0476602828728807
Energy: 1.0304435587944303
Energy: 1.1075849370483268
Energy: 1.491931142359507
Energy: 1.1075849370483268
Energy: 1.0304435587944303
Energy: 1.1075849370483268
Energy: 1.1076908957034897
Energy: 1.0265390297246368
Energy: 1.0429636468187102
Energy: 1.0265390297246368
Energy: 1.1076908957042528
Energy: 1.0265390297261632
Energy: 1.3790114419012676
Energy: 1.0273244646777975
Energy: 1.3567920570341814
Energy: 1.0273244646762711
Energy: 1.3790114419005044
Energy: 1.0273244646762711
Energy: 1.378972396228643
Energy: 1.2597621922092115
Energy: 1.0341613715359486
Energy: 1.2597621922092115
Energy: 1.3789723962294063
Energy: 1.2597621922092115
Energy: 1.0311590413261096
Energy: 1.0477388716795775
Energy: 1.0549513527787608
Energy: 1.0477388716803406
Energy: 1.0311590413261096
Energy: 1.0477388716795775
Energy: 1.04947082628297
Energy: 1.0263586397386097
Energy: 1.3808466265513917
Energy: 1.0263586397386097
Energy: 1.04947082628297
Energy: 1.026358639739373
Energy: 1.3580859578788875
Energy: 1.2870507241911908
Energy: 1.3809693843595483
Energy: 1.2870507241911908
Energy: 1.3580859578788875
Energy: 1.2870507241911908
Energy: 1.045437783351838
Energy: 1.0459805151513226
Energy: 1.0335384602233435
Energy: 1.0459805151520858
Energy: 1.045437783351838
Energy: 1.0459805151505595
Energy: 1.0290570223600206
Energy: 1.0490718526965808
Energy: 1.0521123229416278
Energy: 1.0490718526965808
Energy: 1.0290570223592574
Energy: 1.0490718526965808
Energy: 1.0298603274055824
Energy: 1.1084193703880216
Energy: 1.4943381716446738
Energy: 1.1084193703887848
Energy: 1.0298603274055824
Energy: 1.1084193703887848
Energy: 1.3787229652044146
Energy: 1.4905420527174271
Energy: 1.4265349661886702
Energy: 1.4905420527174271
Energy: 1.3787229652028883
Energy: 1.4905420527174271
Energy: 1.0268322893619914
Energy: 1.048672037059267
Energy: 1.0350560627102456
Energy: 1.048672037059267
Energy: 1.0268322893619914
Energy: 1.048672037059267
Energy: 1.3569267581356677
Energy: 1.107393876148629
Energy: 1.027351741477725
Energy: 1.1073938761493922
Energy: 1.3569267581356677
Energy: 1.1073938761493922
Energy: 1.0427375203456628
Energy: 1.0265032602867172
Energy: 1.4993404667320385
Energy: 1.0265032602874804
Energy: 1.0427375203456628
Energy: 1.0265032602867172
Energy: 1.541671743107553
Energy: 1.050620275957928
Energy: 1.390726394948449
Energy: 1.050620275957928
Energy: 1.5416717431083165
Energy: 1.050620275957928
Energy: 1.028161171189609
Energy: 1.047353221328796
Energy: 1.2889476641517563
Energy: 1.047353221328796
Energy: 1.028161171189609
Energy: 1.047353221328796
Energy: 1.2949652360001767
Energy: 1.0474244117965266
Energy: 1.0274807419469507
Energy: 1.0474244117965266
Energy: 1.2949652359994137
Energy: 1.0474244117965266
Energy: 1.374306556512771
Energy: 1.027580473847181
Energy: 1.0478327136871075
Energy: 1.027580473846418
Energy: 1.374306556512771
Energy: 1.027580473847181
Energy: 1.5143269432350952
Energy: 1.2806411144205514
Energy: 1.043613370504843
Energy: 1.2806411144198229
Energy: 1.5143269432350952
Energy: 1.2806411144205514
Energy: 1.0285503591524534
Energy: 1.0480346649804586
Energy: 1.356601293129078
Energy: 1.0480346649804586
Energy: 1.0285503591524534
Energy: 1.0480346649804586
Energy: 1.0557890246515516
Energy: 1.049108880594399
Energy: 1.0280188243906645
Energy: 1.049108880594399
Energy: 1.0557890246515516
Energy: 1.049108880594399
Energy: 1.4230708210473388
Energy: 1.1094861880329854
Energy: 1.027117027895531
Energy: 1.1094861880322222
Energy: 1.4230708210473388
Energy: 1.109486188029933
Energy: 1.6896129267718905
Energy: 1.1074627017321887
Energy: 1.0338936792888005
Energy: 1.1074627017321887
Energy: 1.6896129267718905
Energy: 1.1074627017321887
Energy: 1.0540423639098746
Energy: 1.383701340913136
Energy: 1.0304125656342928
Energy: 1.383701340913136
Energy: 1.0540423639098746
Energy: 1.383701340913136
Energy: 1.0304170877882541
Energy: 1.0485227594921094
Energy: 1.3585233152920126
Energy: 1.0485227594921094
Energy: 1.0304170877874907
Energy: 1.0485227594921094
Energy: 1.3790500628373161
Energy: 1.2707205394735894
Energy: 1.045402424137975
Energy: 1.2707205394743526
Energy: 1.379050062838079
Energy: 1.2707205394735894
Energy: 1.3847590560946113
Energy: 1.026900894126482
Energy: 1.048941325544604
Energy: 1.026900894126482
Energy: 1.3847590560946113
Energy: 1.026900894127245
Energy: 1.049677991698031
Energy: 1.0473493820964064
Energy: 1.0285004475221133
Energy: 1.0473493820964064
Energy: 1.049677991698031
Energy: 1.0473493820964064
Energy: 1.0304090312138294
Energy: 1.2614105972626983
Energy: 1.4911057328664576
Energy: 1.2614105972626983
Energy: 1.0304090312138294
Energy: 1.2614105972619352
Energy: 1.358717575363346
Energy: 1.050717033205657
Energy: 1.4121007519499205
Energy: 1.0507170332048938
Energy: 1.3587175753625826
Energy: 1.0507170332048938
Energy: 1.042467440125158
Energy: 1.0280850986321788
Energy: 1.0580874878703623
Energy: 1.0280850986337051
Energy: 1.042467440125158
Energy: 1.028085098632942
Energy: 1.288288649532319
Energy: 1.1072982469322152
Energy: 1.028125754870899
Energy: 1.1072982469329786
Energy: 1.288288649532319
Energy: 1.1072982469329786
Energy: 1.026439246567269
Energy: 1.0476305846136655
Energy: 1.2827000124159564
Energy: 1.0476305846144285
Energy: 1.026439246567269
Energy: 1.0476305846136655
Energy: 1.378984321378106
Energy: 1.0669420075771248
Energy: 1.4202518262641906
Energy: 1.0669420075778877
Energy: 1.3789843213773425
Energy: 1.0669420075778877
Energy: 1.0274077122320797
Energy: 1.1090039547080621
Energy: 1.4926393327697522
Energy: 1.1090039547088253
Energy: 1.0274077122320797
Energy: 1.1090039547095885

minimum gb energy = 1.0263586397386097 eV
minimum distance =  2.26581192892376 Angstroms
sigma value = 41


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

Energy: 0.8889132275028346
Energy: 0.86263595791102
Energy: 1.514854243151126
Energy: 0.86263595791102
Energy: 0.8889132275028346
Energy: 0.86263595791102
Energy: 1.522339980485949
Energy: 0.8612730061383332
Energy: 0.8627674121969967
Energy: 0.8612730061383332
Energy: 1.522339980485949
Energy: 0.8612730061383332
Energy: 0.889187163001095
Energy: 1.0948593663380917
Energy: 1.1638773435656806
Energy: 1.0948593663380917
Energy: 0.889187163001095
Energy: 1.0948593663380917
Energy: 1.5901721796968913
Energy: 0.8614622772078395
Energy: 0.8628608947449254
Energy: 0.8614622772078395
Energy: 1.5901721796948078
Energy: 0.8614622772078395
Energy: 0.8892539663093161
Energy: 0.8613544149692028
Energy: 0.8642420877194162
Energy: 0.8613544149671193
Energy: 0.8892539663093161
Energy: 0.8613544149671193
Energy: 0.8884045439279643
Energy: 0.9051037979287069
Energy: 0.8632961118408056
Energy: 0.9051037979287069
Energy: 0.8884045439279643
Energy: 0.9051037979287069
Energy: 1.6037124587176652
Energy: 0.8616120672650333
Energy: 0.8635587592373282
Energy: 0.8616120672650333
Energy: 1.6037124587176652
Energy: 0.8616120672650333
Energy: 0.8875012738417537
Energy: 0.8618321187547695
Energy: 0.8640918531524872
Energy: 0.8618321187568533
Energy: 0.8875012738417537
Energy: 0.8618321187568533
Energy: 1.5083662145477137
Energy: 0.9048388553698319
Energy: 0.8631169707242071
Energy: 0.9048388553719154
Energy: 1.5083662145477137
Energy: 0.9048388553719154
Energy: 0.889178344679903
Energy: 0.8615847205952395
Energy: 0.8652006625234575
Energy: 0.8615847205952395
Energy: 0.889178344679903
Energy: 0.8615847205952395
Energy: 1.515100247764032
Energy: 0.8615640974489084
Energy: 0.863015873729759
Energy: 0.8615640974509919
Energy: 1.515100247764032
Energy: 0.8615640974509919
Energy: 0.8893292952185984
Energy: 1.0946053123534898
Energy: 1.4908064447445495
Energy: 1.0946053123514066
Energy: 0.8893292952185984
Energy: 1.0946053123514066
Energy: 1.5152042671630814
Energy: 0.8615774705034572
Energy: 0.8630103701927854
Energy: 0.8615774705034572
Energy: 1.515204267160998
Energy: 0.8615774705034572
Energy: 0.889160689622249
Energy: 0.861644450641693
Energy: 0.8651807794019463
Energy: 0.8616444506437766
Energy: 0.889160689622249
Energy: 0.8616444506437766

minimum gb energy = 0.8612730061383332 eV
minimum distance =  2.3553148472658 Angstroms
sigma value = 11


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

Energy: 1.5151390747504563
Energy: 1.1874230222182993
Energy: 1.3219873077087962
Energy: 1.1874230222192148
Energy: 1.5151390747513718
Energy: 1.1874230222192148
Energy: 1.1248081774219802
Energy: 1.149936687167497
Energy: 1.1238019833409933
Energy: 1.149936687167497
Energy: 1.1248081774219802
Energy: 1.149936687167497
Energy: 1.1243280843235886
Energy: 1.22686490090888
Energy: 1.1239655365744732
Energy: 1.22686490090888
Energy: 1.1243280843235886
Energy: 1.22686490090888
Energy: 1.1496897554458034
Energy: 1.1501551226267397
Energy: 1.1236803804436575
Energy: 1.1501551226267397
Energy: 1.1496897554448882
Energy: 1.1501551226267397
Energy: 1.1239264132589166
Energy: 1.2222799509228932
Energy: 1.1497682139595409
Energy: 1.2222799509228932
Energy: 1.1239264132580018
Energy: 1.2222799509228932
Energy: 1.1584428222769645
Energy: 1.211448246388792
Energy: 1.1240441844489557
Energy: 1.211448246388792
Energy: 1.1584428222769645
Energy: 1.211448246388792
Energy: 1.149848562814609
Energy: 1.347559840846555
Energy: 1.1545820654163004
Energy: 1.3475598408456397
Energy: 1.149848562814609
Energy: 1.347559840846555
Energy: 1.1253623673320452
Energy: 1.150601928982479
Energy: 1.1237657283760647
Energy: 1.150601928982479
Energy: 1.1253623673320452
Energy: 1.150601928982479
Energy: 1.124973950693756
Energy: 1.2350563474755087
Energy: 1.123548926157981
Energy: 1.2350563474755087
Energy: 1.124973950694671
Energy: 1.2350563474755087
Energy: 1.1235864988951831
Energy: 1.150116731997226
Energy: 1.1501723683210685
Energy: 1.150116731997226
Energy: 1.1235864988951831
Energy: 1.150116731997226
Energy: 1.1519331527152927
Energy: 1.123859852759166
Energy: 1.1556046237392517
Energy: 1.1238598527582713
Energy: 1.1519331527152927
Energy: 1.1238598527582713
Energy: 1.1253329644978831
Energy: 1.2120168491609753
Energy: 1.1553718398169093
Energy: 1.2120168491609753
Energy: 1.1253329644978831
Energy: 1.2120168491600598
Energy: 1.123996134705896
Energy: 1.1501326028305576
Energy: 1.139314791031318
Energy: 1.1501326028305576
Energy: 1.123996134705896
Energy: 1.1501326028305576
Energy: 1.1508928792911675
Energy: 1.2366294137053508
Energy: 1.1508353117973282
Energy: 1.2366294137044358
Energy: 1.1508928792911675
Energy: 1.2366294137044358
Energy: 1.1236411488912554
Energy: 1.4664638200912499
Energy: 1.1260634050442258
Energy: 1.4664638200912499
Energy: 1.1236411488921707
Energy: 1.4664638200912499
Energy: 1.1526638281057906
Energy: 1.128162583655735
Energy: 1.1544817061739543
Energy: 1.1281625836566505
Energy: 1.1526638281057906
Energy: 1.1281625836566505
Energy: 1.1546283619217668
Energy: 1.3474601770215489
Energy: 1.1244839469343337
Energy: 1.3474601767772587
Energy: 1.1546283619217668
Energy: 1.347460176726957
Energy: 1.1242169173143446
Energy: 1.467690670672524
Energy: 1.1234889052177044
Energy: 1.467690670672524
Energy: 1.1242169173143446
Energy: 1.467690670672524
Energy: 1.150049309663904
Energy: 1.1502726646237296
Energy: 1.1501415008367493
Energy: 1.1502726646237296
Energy: 1.150049309663904
Energy: 1.1502726646228145
Energy: 1.1236693336546446
Energy: 1.1503038165078527
Energy: 1.1264649281815418
Energy: 1.1503038165078527
Energy: 1.1236693336555599
Energy: 1.1503038165078527
Energy: 1.1550619754532139
Energy: 1.2126131936556308
Energy: 1.124427071114867
Energy: 1.2126131936556308
Energy: 1.1550619754522984
Energy: 1.2126131936556308
Energy: 1.1556345012415792
Energy: 1.1242073547055569
Energy: 1.1508230852007555
Energy: 1.1242073547064724
Energy: 1.1556345012415792
Energy: 1.1242073547046416
Energy: 1.1519056808595105
Energy: 1.1502091340389426
Energy: 1.159536590071856
Energy: 1.1502091340389426
Energy: 1.1519056808595105
Energy: 1.150209134039858
Energy: 1.123561937126664
Energy: 1.23467415877321
Energy: 1.1244061075915404
Energy: 1.23467415877321
Energy: 1.123561937126664
Energy: 1.23467415877321
Energy: 1.126724314885886
Energy: 1.1522560059938398
Energy: 1.1241949741348898
Energy: 1.1522560059938398
Energy: 1.126724314885886
Energy: 1.1522560059938398
Energy: 1.1548021310626697
Energy: 1.3494780633365362
Energy: 1.1497688165199578
Energy: 1.349478063335621
Energy: 1.1548021310626697
Energy: 1.3494780633365362
Energy: 1.1242162586596938
Energy: 1.212556590350146
Energy: 1.123999979802243
Energy: 1.212556590350146
Energy: 1.1242162586596938
Energy: 1.212556590350146
Energy: 1.1498247677518774
Energy: 1.3499577071111788
Energy: 1.1584098210054936
Energy: 1.3499577071102633
Energy: 1.1498247677518774
Energy: 1.3499577071102633
Energy: 1.12421656464447
Energy: 1.1509657901405743
Energy: 1.149789811824226
Energy: 1.1509657901396588
Energy: 1.12421656464447
Energy: 1.1509657901396588
Energy: 1.1237513896239943
Energy: 1.1508944474553577
Energy: 1.1255674958855557
Energy: 1.150894447456273
Energy: 1.1237513896239943
Energy: 1.1508944474553577
Energy: 1.1235833946039129
Energy: 1.1528565433195892
Energy: 1.1259134832157387
Energy: 1.1528565433195892
Energy: 1.1235833946039129
Energy: 1.1528565433205047

minimum gb energy = 1.1234889052177044 eV
minimum distance =  2.23982185189158 Angstroms
sigma value = 57


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

Energy: 1.26325459095472
Energy: 1.267718726006851
Energy: 1.432499649701709
Energy: 1.267718726005222
Energy: 1.26325459095472
Energy: 1.267718726005222
Energy: 1.20971089755738
Energy: 1.258913263528373
Energy: 1.2084754634603139
Energy: 1.258913263528373
Energy: 1.20971089755738
Energy: 1.258913263528373
Energy: 1.202597502704859
Energy: 1.3308696388879309
Energy: 1.2085285737588476
Energy: 1.3308696388879309
Energy: 1.202597502704859
Energy: 1.3308696388879309
Energy: 1.208765154660323
Energy: 1.3282054256925764
Energy: 1.2087734357821394
Energy: 1.3282054256925764
Energy: 1.208765154660323
Energy: 1.3282054256925764
Energy: 1.2085312875597112
Energy: 1.330842997176112
Energy: 1.2024490684501135
Energy: 1.330842997176112
Energy: 1.2085312875597112
Energy: 1.330842997176112
Energy: 1.2084420802199076
Energy: 1.2096337043815288
Energy: 1.209726325065683
Energy: 1.2096337043815288
Energy: 1.2084420802199076
Energy: 1.2096337043815288
Energy: 1.3640419667035133
Energy: 1.267718726005222
Energy: 1.26325459095472
Energy: 1.267718726006851
Energy: 1.3640419667035133
Energy: 1.267718726005222
Energy: 1.2084754634603139
Energy: 1.258913263528373
Energy: 1.20971089755738
Energy: 1.258913263528373
Energy: 1.2084754634603139
Energy: 1.258913263528373
Energy: 1.2085285737588476
Energy: 1.3308696388895596
Energy: 1.202597502704859
Energy: 1.3308696388879309
Energy: 1.2085285737588476
Energy: 1.3308696388879309
Energy: 1.2087734357821394
Energy: 1.3525929860010868
Energy: 1.208765154660323
Energy: 1.3282054256925764
Energy: 1.2087734357821394
Energy: 1.3525929860010868
Energy: 1.2024490684501135
Energy: 1.330842997176112
Energy: 1.2085312875597112
Energy: 1.330842997176112
Energy: 1.2024490684501135
Energy: 1.330842997176112
Energy: 1.209726325065683
Energy: 1.2096337043815288
Energy: 1.2084420802199076
Energy: 1.2096337043815288
Energy: 1.209726325065683
Energy: 1.2096337043815288
Energy: 1.26325459095472
Energy: 1.267718726005222
Energy: 1.3640419667035133
Energy: 1.267718726005222
Energy: 1.26325459095472
Energy: 1.267718726005222
Energy: 1.20971089755738
Energy: 1.258913263528373
Energy: 1.2084754634603139
Energy: 1.258913263528373
Energy: 1.20971089755738
Energy: 1.258913263528373
Energy: 1.202597502704859
Energy: 1.3308696388879309
Energy: 1.2085285737588476
Energy: 1.3308696388879309
Energy: 1.202597502704859
Energy: 1.3308696388879309
Energy: 1.208765154660323
Energy: 1.3525929860010868
Energy: 1.2087734357821394
Energy: 1.342040418586559
Energy: 1.208765154660323
Energy: 1.3282054256909475
Energy: 1.2085312875597112
Energy: 1.330842997176112
Energy: 1.2024490684501135
Energy: 1.330842997176112
Energy: 1.2085312875597112
Energy: 1.330842997176112

minimum gb energy = 1.2024490684501135 eV
minimum distance =  2.2587657681862 Angstroms
sigma value = 9


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

Energy: 1.3152730315647687
Energy: 1.3058855414658779
Energy: 1.4225828107739449
Energy: 1.3058855414658779
Energy: 1.3152730315647687
Energy: 1.3058855414658779
Energy: 1.2779242807550018
Energy: 1.3499582442280593
Energy: 1.3039949626203309
Energy: 1.3499582442280593
Energy: 1.2779242807563318
Energy: 1.3499582442280593
Energy: 1.3165152781047917
Energy: 1.3166997730820158
Energy: 1.3065276762553182
Energy: 1.3166997730833458
Energy: 1.3165152781047917
Energy: 1.3166997730833458
Energy: 1.3163782372038428
Energy: 1.317532065215545
Energy: 1.2836933976842366
Energy: 1.317532065215545
Energy: 1.3163782372038428
Energy: 1.3175320652142148
Energy: 1.2776992450579057
Energy: 1.4184548849652423
Energy: 1.3069626830920251
Energy: 1.4184548849625824
Energy: 1.2776992450592355
Energy: 1.4184548849625824
Energy: 1.3164140619794864
Energy: 1.317640463062926
Energy: 1.3311996199324174
Energy: 1.317640463062926
Energy: 1.3164140619794864
Energy: 1.317640463062926
Energy: 1.3175578482698276
Energy: 1.4832290628237714
Energy: 1.306598527126262
Energy: 1.4832290628251013
Energy: 1.3175578482698276
Energy: 1.4832290628237714
Energy: 1.2943160056073963
Energy: 1.3482099731407413
Energy: 1.3038707123069573
Energy: 1.3482099731407413
Energy: 1.2943160056073963
Energy: 1.3482099731407413
Energy: 1.2917224681639705
Energy: 1.3508653323729771
Energy: 1.284169977077473
Energy: 1.350865332374307
Energy: 1.2917224681639705
Energy: 1.350865332374307
Energy: 1.3523220695002853
Energy: 1.5718730268048184
Energy: 1.304170438881865
Energy: 1.5718730268048184
Energy: 1.3523220695002853
Energy: 1.5718730268048184
Energy: 1.318381893707688
Energy: 1.3639729381762535
Energy: 1.2871644583535946
Energy: 1.3639729381775834
Energy: 1.318381893707688
Energy: 1.3639729381775834
Energy: 1.3156636106170367
Energy: 1.317882081009647
Energy: 1.2967161293220317
Energy: 1.317882081009647
Energy: 1.3156636106170367
Energy: 1.317882081008317
Energy: 1.3181083217735132
Energy: 1.3171798053461408
Energy: 1.2987045597378157
Energy: 1.317179805344811
Energy: 1.3181083217735132
Energy: 1.317179805344811
Energy: 1.3158748548852532
Energy: 1.3167797210662797
Energy: 1.2836053585180975
Energy: 1.3167797210676095
Energy: 1.3158748548852532
Energy: 1.3167797210676095
Energy: 1.3474516658013964
Energy: 1.463439926496528
Energy: 1.3222615372340663
Energy: 1.463439926496528
Energy: 1.3474516658013964
Energy: 1.463439926496528
Energy: 1.2916430344077297
Energy: 1.349940447084908
Energy: 1.283547229880365
Energy: 1.349940447086238
Energy: 1.2916430344077297
Energy: 1.349940447086238
Energy: 1.2918731142917803
Energy: 1.3481674738931313
Energy: 1.3130815848650421
Energy: 1.3481674738931313
Energy: 1.2918731142917803
Energy: 1.3481674738944613
Energy: 1.368873388951746
Energy: 1.46278524657774
Energy: 1.3042295652262712
Energy: 1.4627852465790698
Energy: 1.368873388951746
Energy: 1.46278524657774
Energy: 1.3188853130422828
Energy: 1.3179317447201528
Energy: 1.2735008920464745
Energy: 1.3179317447201528
Energy: 1.3188853130422828
Energy: 1.317931744718823
Energy: 1.3158106332227695
Energy: 1.4666896172210306
Energy: 1.30447750928759
Energy: 1.4666896172197004
Energy: 1.3158106332214698
Energy: 1.4666896172197004
Energy: 1.3185292837536322
Energy: 1.3195267374833097
Energy: 1.2937263453178272
Energy: 1.31952673748198
Energy: 1.3185292837536322
Energy: 1.3195267374833097

minimum gb energy = 1.2735008920464745 eV
minimum distance =  2.25137863512754 Angstroms
sigma value = 27


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

Energy: 1.4545798928053175
Energy: 1.3127858168645847
Energy: 1.367781494613805
Energy: 1.3127858168634639
Energy: 1.4545798928053175
Energy: 1.3127858168634639
Energy: 1.3058140605243398
Energy: 1.2655209608917002
Energy: 1.300134946899312
Energy: 1.2655209608917002
Energy: 1.3058140605232187
Energy: 1.2655209608905789
Energy: 1.2838606311797014
Energy: 1.2841052050580557
Energy: 1.2998588578148176
Energy: 1.2841052050580557
Energy: 1.2838606311797014
Energy: 1.284105205059177
Energy: 1.3184813982997612
Energy: 1.4886827661938407
Energy: 1.3002391810774465
Energy: 1.4886827661927193
Energy: 1.3184813982997612
Energy: 1.4886827661938407
Energy: 1.2678771985242978
Energy: 1.4994460791111721
Energy: 1.2674499942961
Energy: 1.4994460791122932
Energy: 1.2678771985242978
Energy: 1.4994460791111721
Energy: 1.3156098327685062
Energy: 1.317968166613075
Energy: 1.3267128896011144
Energy: 1.317968166613075
Energy: 1.3156098327685062
Energy: 1.317968166613075
Energy: 1.288247594476566
Energy: 1.442810380718869
Energy: 1.3341703282900228
Energy: 1.442810380718869
Energy: 1.288247594476566
Energy: 1.442810380718869
Energy: 1.2859603568742093
Energy: 1.3492234403136218
Energy: 1.3149246596186965
Energy: 1.3492234403136218
Energy: 1.2859603568742093
Energy: 1.349223440312501
Energy: 1.3890247786100003
Energy: 1.4481470882568928
Energy: 1.3678407456057053
Energy: 1.4481470882580139
Energy: 1.3890247786100003
Energy: 1.4481470882580139
Energy: 1.2857461820045317
Energy: 1.2871271630345642
Energy: 1.3146303680343443
Energy: 1.2871271630345642
Energy: 1.2857461820045317
Energy: 1.287127163033443
Energy: 1.2859092746008796
Energy: 1.2658954212265408
Energy: 1.314548401430732
Energy: 1.2658954212265408
Energy: 1.2859092746008796
Energy: 1.2658954212265408
Energy: 1.3891163368306405
Energy: 1.4968766763336967
Energy: 1.323340113340256
Energy: 1.4968766763336967
Energy: 1.3891163368306405
Energy: 1.4968766763336967
Energy: 1.2861756947826983
Energy: 1.410002460215654
Energy: 1.3343104702946715
Energy: 1.410002460215654
Energy: 1.2861756947826983
Energy: 1.410002460215654
Energy: 1.2691161160129625
Energy: 1.430061732709355
Energy: 1.3339138030723987
Energy: 1.430061732709355
Energy: 1.2691161160129625
Energy: 1.430061732709355
Energy: 1.325615092787951
Energy: 1.356545295434965
Energy: 1.327100706395065
Energy: 1.356545295434965
Energy: 1.325615092787951
Energy: 1.356545295434965
Energy: 1.2661569192558058
Energy: 1.4994460791122932
Energy: 1.2671869113431393
Energy: 1.4994460791122932
Energy: 1.2661569192558058
Energy: 1.4994460791122932
Energy: 1.3184181042896923
Energy: 1.441659729128121
Energy: 1.2650210031137412
Energy: 1.441659729128121
Energy: 1.3184181042896923
Energy: 1.441659729128121
Energy: 1.2837562984973834
Energy: 1.2841105314971877
Energy: 1.3000870670332743
Energy: 1.2841105314983088
Energy: 1.2837562984973834
Energy: 1.2841105314971877
Energy: 1.311135434191631
Energy: 1.2776217258528337
Energy: 1.299923538899249
Energy: 1.2776217258528337
Energy: 1.3111354341905102
Energy: 1.2776217258528337
Energy: 1.4545798928053175
Energy: 1.3127858168645847
Energy: 1.3677814946126838
Energy: 1.3127858168657058
Energy: 1.4545798928053175
Energy: 1.3127858168645847
Energy: 1.3058140605243398
Energy: 1.2655209608917002
Energy: 1.300134946899312
Energy: 1.2655209608917002
Energy: 1.3058140605243398
Energy: 1.2655209608917002
Energy: 1.2838606311797014
Energy: 1.284105205059177
Energy: 1.2998588578148176
Energy: 1.2841052050580557
Energy: 1.2838606311797014
Energy: 1.2841052050580557
Energy: 1.3184813982997612
Energy: 1.4886827661927193
Energy: 1.3002391810774465
Energy: 1.4886827661927193
Energy: 1.3184813982997612
Energy: 1.4886827661927193
Energy: 1.2678771985242978
Energy: 1.4994460791111721
Energy: 1.2674499942949788
Energy: 1.4994460791122932
Energy: 1.2678771985242978
Energy: 1.4994460791111721
Energy: 1.3156098327685062
Energy: 1.317968166613075
Energy: 1.3267128896011144
Energy: 1.317968166613075
Energy: 1.3156098327685062
Energy: 1.317968166613075

minimum gb energy = 1.2650210031137412 eV
minimum distance =  2.25197076341684 Angstroms
sigma value = 19


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

Energy: 1.443076567562421
Energy: 1.266143136713697
Energy: 1.4004537904093886
Energy: 1.266143136713697
Energy: 1.443076567562421
Energy: 1.266143136713697
Energy: 1.2764810649593787
Energy: 1.2610341178693443
Energy: 1.2572893596691372
Energy: 1.2610341178693443
Energy: 1.2764810649593787
Energy: 1.2610341178693443
Energy: 1.2478140623626877
Energy: 1.2723202973132284
Energy: 1.2572059848408215
Energy: 1.272320297314196
Energy: 1.2478140623626877
Energy: 1.272320297314196
Energy: 1.2773843778030032
Energy: 1.334542246751905
Energy: 1.283123258425614
Energy: 1.334542246751905
Energy: 1.2773843778030032
Energy: 1.334542246751905
Energy: 1.2589101981760653
Energy: 1.3784602475658974
Energy: 1.2750304636416352
Energy: 1.3784602475649297
Energy: 1.2589101981760653
Energy: 1.3784602475658974
Energy: 1.2630559374965344
Energy: 1.4079888316220053
Energy: 1.2749445665412358
Energy: 1.4079888316220053
Energy: 1.2630559374965344
Energy: 1.4079888316220053
Energy: 1.2516925120314601
Energy: 1.4411635662223559
Energy: 1.2747161642099798
Energy: 1.4411635662213882
Energy: 1.2516925120314601
Energy: 1.4411635662223559
Energy: 1.2625108037644501
Energy: 1.408302496802098
Energy: 1.2749172640144668
Energy: 1.408302496802098
Energy: 1.2625108037644501
Energy: 1.408302496802098
Energy: 1.2719991209773838
Energy: 1.2603359468911062
Energy: 1.281187561121117
Energy: 1.2603359468911062
Energy: 1.2719991209773838
Energy: 1.2603359468911062
Energy: 1.272245821483186
Energy: 1.346271526893629
Energy: 1.2455887111477209
Energy: 1.3462715268926615
Energy: 1.272245821483186
Energy: 1.346271526893629
Energy: 1.2626440235009968
Energy: 1.2589895117094465
Energy: 1.2845360353589015
Energy: 1.2589895117104142
Energy: 1.2626440235009968
Energy: 1.2589895117094465
Energy: 1.2665426175103887
Energy: 1.2260851636469707
Energy: 1.2461004029063947
Energy: 1.2260851636469707
Energy: 1.266542617509421
Energy: 1.2260851636469707
Energy: 1.266349797291223
Energy: 1.2261967822899997
Energy: 1.2456544429001908
Energy: 1.2261967822909676
Energy: 1.266349797291223
Energy: 1.2261967822899997
Energy: 1.2599928291925309
Energy: 1.2831181023030682
Energy: 1.33180256824384
Energy: 1.283118102304036
Energy: 1.2599928291925309
Energy: 1.283118102304036
Energy: 1.2794445742001772
Energy: 1.3333775661039227
Energy: 1.2458462652646585
Energy: 1.3333775661039227
Energy: 1.2794445742001772
Energy: 1.3333775661048906
Energy: 1.2806184412998642
Energy: 1.3466121111833058
Energy: 1.2279716371354445
Energy: 1.346612111182338
Energy: 1.2806184412998642
Energy: 1.346612111182338
Energy: 1.247819051233798
Energy: 1.4082933077417248
Energy: 1.2494038197054966
Energy: 1.4082933077407573
Energy: 1.247819051233798
Energy: 1.4082933077407573
Energy: 1.2717858868708976
Energy: 1.29248087517775
Energy: 1.2261068117160103
Energy: 1.29248087517775
Energy: 1.2717858868699299
Energy: 1.29248087517775
Energy: 1.247784918346931
Energy: 1.4083758224799259
Energy: 1.2493928633239637
Energy: 1.4083758224799259
Energy: 1.247784918346931
Energy: 1.4083758224799259
Energy: 1.2805656894283912
Energy: 1.3352873319975953
Energy: 1.2407802556931715
Energy: 1.3352873319975953
Energy: 1.2805656894283912
Energy: 1.3352873319975953
Energy: 1.279386737976405
Energy: 1.3357255953109473
Energy: 1.2458886587516373
Energy: 1.3357255953099794
Energy: 1.279386737976405
Energy: 1.3357255953099794
Energy: 1.2620868802236274
Energy: 1.2594967038160714
Energy: 1.3315401927826866
Energy: 1.2594967038160714
Energy: 1.2620868802236274
Energy: 1.2594967038160714
Energy: 1.2997976985527586
Energy: 1.2577616477964666
Energy: 1.245767052847666
Energy: 1.2577616477964666
Energy: 1.2997976985527586
Energy: 1.2577616477954987
Energy: 1.3096315536425827
Energy: 1.249663760070968
Energy: 1.2465394351851478
Energy: 1.249663760070968
Energy: 1.3096315536425827
Energy: 1.249663760070968
Energy: 1.288024125669974
Energy: 1.2591300087340396
Energy: 1.2570327068317453
Energy: 1.259130008733072
Energy: 1.288024125669974
Energy: 1.259130008733072
Energy: 1.2794583224952616
Energy: 1.2529658848015048
Energy: 1.2457066739679723
Energy: 1.2529658848015048
Energy: 1.2794583224952616
Energy: 1.2529658848015048
Energy: 1.2722542686998675
Energy: 1.3350066957819033
Energy: 1.2935190760993518
Energy: 1.3350066957819033
Energy: 1.2722542687008351
Energy: 1.3350066957819033
Energy: 1.2625549615973228
Energy: 1.4081893319012004
Energy: 1.2748555511642563
Energy: 1.4081893319012004
Energy: 1.2625549615973228
Energy: 1.4081893319012004
Energy: 1.2518631761717527
Energy: 1.4456153464672417
Energy: 1.274747644875586
Energy: 1.4456153464672417
Energy: 1.2518631761727206
Energy: 1.445615346466274

minimum gb energy = 1.2260851636469707 eV
minimum distance =  2.24000871172024 Angstroms
sigma value = 101


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

Energy: 1.3743808970466396
Energy: 1.2833267934718224
Energy: 1.264557650530263
Energy: 1.2833267934718224
Energy: 1.3743808970466396
Energy: 1.2833267934701211
Energy: 1.2187771973969816
Energy: 1.206575719650801
Energy: 1.218598613814563
Energy: 1.206575719650801
Energy: 1.2187771973969816
Energy: 1.206575719650801
Energy: 1.2062666630231897
Energy: 1.1934499918078343
Energy: 1.219070181679096
Energy: 1.1934499918078343
Energy: 1.2062666630231897
Energy: 1.1934499918069834
Energy: 1.229191069096211
Energy: 1.3713312302049874
Energy: 1.2269059951933126
Energy: 1.371331230204137
Energy: 1.229191069096211
Energy: 1.3713312302049874
Energy: 1.1934793077966535
Energy: 1.2910191833306304
Energy: 1.2031749347495087
Energy: 1.2910191833306304
Energy: 1.1934793077958024
Energy: 1.2910191833306304
Energy: 1.2082795213239794
Energy: 1.3849847990844162
Energy: 1.1940994558638602
Energy: 1.3849847990835653
Energy: 1.2082795213239794
Energy: 1.3849847990835653
Energy: 1.202820140498996
Energy: 1.42883039412379
Energy: 1.1932672649588738
Energy: 1.42883039412379
Energy: 1.202820140498996
Energy: 1.42883039412379
Energy: 1.2055441839244283
Energy: 1.3869552437516948
Energy: 1.2062549767632142
Energy: 1.3869552437508443
Energy: 1.2055441839244283
Energy: 1.3869552437516948
Energy: 1.1932746723943775
Energy: 1.38453007168373
Energy: 1.2065880882072273
Energy: 1.38453007168373
Energy: 1.1932746723943775
Energy: 1.38453007168373
Energy: 1.192645527090674
Energy: 1.325013179581866
Energy: 1.194466255543637
Energy: 1.325013179581866
Energy: 1.1926455270898233
Energy: 1.325013179581866
Energy: 1.2291678081962518
Energy: 1.3720622442252133
Energy: 1.2759297684590152
Energy: 1.3720622442260642
Energy: 1.2291678081962518
Energy: 1.3720622442252133
Energy: 1.2185966701859379
Energy: 1.1933042344359555
Energy: 1.1940059603976187
Energy: 1.1933042344359555
Energy: 1.2185966701859379
Energy: 1.1933042344359555
Energy: 1.2189952670139026
Energy: 1.193961006310894
Energy: 1.212466833192925
Energy: 1.193961006310894
Energy: 1.2189952670139026
Energy: 1.1939610063100434
Energy: 1.2249829978203803
Energy: 1.2375109707113168
Energy: 1.2190405387836183
Energy: 1.2375109707113168
Energy: 1.2249829978195297
Energy: 1.2375109707113168
Energy: 1.2035216278398522
Energy: 1.2946533590306482
Energy: 1.2183604023497396
Energy: 1.2946533590314986
Energy: 1.2035216278398522
Energy: 1.2946533590306482
Energy: 1.251867083597642
Energy: 1.1936577381977649
Energy: 1.2078146850139382
Energy: 1.1936577381977649
Energy: 1.2518670835984929
Energy: 1.1936577381977649
Energy: 1.1933143542150426
Energy: 1.2215116123546987
Energy: 1.1932059133993362
Energy: 1.2215116123538483
Energy: 1.1933143542150426
Energy: 1.2215116123529979
Energy: 1.2075226467143478
Energy: 1.2214129534524107
Energy: 1.1927618271926679
Energy: 1.2214129534524107
Energy: 1.2075226467143478
Energy: 1.2214129534524107
Energy: 1.2068702580417678
Energy: 1.3802173956949353
Energy: 1.205712650907718
Energy: 1.3802173956949353
Energy: 1.2068702580417678
Energy: 1.3802173956949353
Energy: 1.1930567308105986
Energy: 1.2589216424274325
Energy: 1.192598784816662
Energy: 1.2589216424274325
Energy: 1.1930567308105986
Energy: 1.2589216424274325
Energy: 1.2210920357483348
Energy: 1.2243331220169678
Energy: 1.2061049041272052
Energy: 1.2243331220178182
Energy: 1.2210920357483348
Energy: 1.2243331220169678
Energy: 1.1940357434798936
Energy: 1.3805271531215477
Energy: 1.1926763295023703
Energy: 1.3805271531223986
Energy: 1.1940357434798936
Energy: 1.3805271531215477
Energy: 1.2059498152591344
Energy: 1.3793411626770213
Energy: 1.1934293013571209
Energy: 1.3793411626778718
Energy: 1.205949815258284
Energy: 1.3793411626770213
Energy: 1.2290059861459923
Energy: 1.3010482485599975
Energy: 1.259155946140336
Energy: 1.3010482485608479
Energy: 1.2290059861459923
Energy: 1.3010482485625494
Energy: 1.1933601188564311
Energy: 1.286688728391253
Energy: 1.2036309551495579
Energy: 1.286688728391253
Energy: 1.1933601188564311
Energy: 1.286688728391253
Energy: 1.2123233627374275
Energy: 1.2135229121077653
Energy: 1.2519831949212665
Energy: 1.2135229121069147
Energy: 1.2123233627365766
Energy: 1.2135229121077653
Energy: 1.2187743203765216
Energy: 1.1932254646466185
Energy: 1.1929532930300295
Energy: 1.1932254646474691
Energy: 1.2187743203765216
Energy: 1.1932254646466185
Energy: 1.2183911281766984
Energy: 1.1931577511716218
Energy: 1.194922587527946
Energy: 1.1931577511716218
Energy: 1.2183911281766984
Energy: 1.1931577511716218
Energy: 1.2646644507265863
Energy: 1.194777655821554
Energy: 1.2998664469013106
Energy: 1.194777655821554
Energy: 1.2646644507265863
Energy: 1.194777655821554
Energy: 1.1926870391304605
Energy: 1.1981199753974614
Energy: 1.1952392547841597
Energy: 1.1981199753974614
Energy: 1.1926870391313114
Energy: 1.1981199753974614
Energy: 1.1931248247926969
Energy: 1.2214750208296712
Energy: 1.2057075632409946
Energy: 1.2214750208288205
Energy: 1.1931248247926969
Energy: 1.2214750208296712
Energy: 1.2123627416679397
Energy: 1.3813103256667825
Energy: 1.1942466569678465
Energy: 1.381310325667633
Energy: 1.212362741667089
Energy: 1.3813103256667825
Energy: 1.1932213674982244
Energy: 1.2568810432530813
Energy: 1.2060504377584036
Energy: 1.2568810432530813
Energy: 1.1932213674982244
Energy: 1.2568810432530813

minimum gb energy = 1.192598784816662 eV
minimum distance =  2.26454014627246 Angstroms
sigma value = 33


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

Energy: 0.014949791526781766
Energy: 0.015907148469255238
Energy: 1.4711197585763576
Energy: 0.015907148469922743
Energy: 0.014949791526781766
Energy: 0.015907148469922743
Energy: 0.015217212137830612
Energy: 0.6808563705262263
Energy: 0.015217212137830612
Energy: 0.6808563705262263
Energy: 0.015217212137830612
Energy: 0.6808563705262263
Energy: 1.4711197585763576
Energy: 0.015907148469922743
Energy: 0.014949791526781766
Energy: 0.015907148469922743
Energy: 1.4711197585763576
Energy: 0.015907148469922743
Energy: 0.015217212137830612
Energy: 0.6808563705262263
Energy: 0.015217212137830612
Energy: 0.6808563705262263
Energy: 0.015217212137830612
Energy: 0.6808563705262263

minimum gb energy = 0.014949791526781766 eV
minimum distance =  2.45743958701724 Angstroms
sigma value = 1