Model name: model_name=MEAM_LAMMPS_ShimParkCho_2003_NiW__MO_500937681860_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391771733761
cohesive_energy=4.450349977833565
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.018146766741690364
Energy: 1.2209109677823198
Energy: 0.018146766741690364
Energy: 1.2209109677816954
Energy: 0.01814676674202087
Energy: 1.220910967782026
Energy: 1.220910967782026
Energy: 1.4668545366484669
Energy: 1.220910967782026
Energy: 1.4668545366487975
Energy: 1.220910967782026
Energy: 1.4668545366487975
Energy: 0.018146766741690364
Energy: 1.220910967782026
Energy: 0.018146766741690364
Energy: 1.2209109677823198
Energy: 0.01814676674202087
Energy: 1.220910967782026
Energy: 1.220910967782026
Energy: 1.466854536649128
Energy: 1.220910967782026
Energy: 1.6259067962420992
Energy: 1.220910967782026
Energy: 1.4668545366504129
Energy: 0.018146766741690364
Energy: 1.220910967782026
Energy: 0.018146766741690364
Energy: 1.220910967782026
Energy: 0.01814676674202087
Energy: 1.220910967782026
Energy: 1.2209109677816954
Energy: 1.4668545366504129
Energy: 1.220910967782026
Energy: 1.4668545366504129
Energy: 1.2209109677816954
Energy: 1.4668545366484669

minimum gb energy = 0.018146766741690364 eV
minimum distance =  2.36838715264217 Angstroms
sigma value = 1


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

Energy: 1.5748694097341456
Energy: 1.5089380701204524
Energy: 1.5748694097349412
Energy: 1.5089380701204524
Energy: 1.5748694097341456
Energy: 1.5089380701204524
Energy: 1.7444385290186473
Energy: 1.4074959645731209
Energy: 1.7444385290186473
Energy: 1.4074959645731209
Energy: 1.7444385290186473
Energy: 1.4074959645731209
Energy: 1.4930573110062588
Energy: 1.5820067915873115
Energy: 1.5543949136971462
Energy: 1.5820067915881073
Energy: 1.4930573110062588
Energy: 1.5820067915881073
Energy: 1.6507304642223595
Energy: 1.4858718355909892
Energy: 1.6507304642223595
Energy: 1.4858718355917848
Energy: 1.6507304642223595
Energy: 1.4858718355917848
Energy: 1.5051829188423442
Energy: 1.653133821766357
Energy: 1.5051829188430677
Energy: 1.653133821766357
Energy: 1.5051829188423442
Energy: 1.653133821766357
Energy: 1.6236000800426325
Energy: 1.4412773324293615
Energy: 1.6236000800434283
Energy: 1.441277332430157
Energy: 1.6236000800434283
Energy: 1.4412773324293615
Energy: 1.5049926324828582
Energy: 1.5467402652913702
Energy: 1.5049926324821352
Energy: 1.5467402652905746
Energy: 1.5049926324828582
Energy: 1.5467402652913702
Energy: 1.4538043184895646
Energy: 1.6776796323804177
Energy: 1.4538043184895646
Energy: 1.677679632381213
Energy: 1.4538043184887688
Energy: 1.677679632381213
Energy: 1.6106130619273216
Energy: 1.5461134283740228
Energy: 1.6106130619273216
Energy: 1.5461134283740228
Energy: 1.6106130619273216
Energy: 1.5461134283740228
Energy: 1.388694103519931
Energy: 1.6561001766423864
Energy: 1.388694103519931
Energy: 1.6561001766439054
Energy: 1.388694103519931
Energy: 1.6561001766431098
Energy: 1.8077355026149076
Energy: 1.4391439911770463
Energy: 1.8077355026141122
Energy: 1.4391439911770463
Energy: 1.8077355026141122
Energy: 1.4391439911770463
Energy: 1.3677392104128239
Energy: 1.8966945929219259
Energy: 1.3677392104128239
Energy: 1.8966945929227215
Energy: 1.3677392104136195
Energy: 1.8966945929219259
Energy: 1.6952929928759313
Energy: 1.3535398246326311
Energy: 1.6952929928767266
Energy: 1.3535398246318358
Energy: 1.6952929928759313
Energy: 1.3535398246318358
Energy: 1.4608744888447442
Energy: 1.489192515471486
Energy: 1.4608744888447442
Energy: 1.489192515471486
Energy: 1.4608744888447442
Energy: 1.489192515471486
Energy: 1.7711582561607515
Energy: 1.4012535353396438
Energy: 1.771158256159956
Energy: 1.4012535353396438
Energy: 1.7711582561607515
Energy: 1.4012535353396438
Energy: 1.7652795504439875
Energy: 1.5997806340157061
Energy: 1.7652795504439875
Energy: 1.5997806340157061
Energy: 1.7652795504439875
Energy: 1.5997806340149106
Energy: 1.5319949878406325
Energy: 1.5455679354386025
Energy: 1.5319949878422237
Energy: 1.5455679354386025
Energy: 1.531994987841428
Energy: 1.5455679354386025
Energy: 1.534940210464107
Energy: 1.471847347810995
Energy: 1.534940210464107
Energy: 1.471847347810995
Energy: 1.534940210464107
Energy: 1.471847347810995
Energy: 1.4186592938753153
Energy: 1.4815159004018232
Energy: 1.4186592938753153
Energy: 1.4815159004018232
Energy: 1.4186592938753153
Energy: 1.4815159004010277
Energy: 1.6017149689061512
Energy: 1.4401903295550857
Energy: 1.6017149689061512
Energy: 1.4401903295550857
Energy: 1.6017149689061512
Energy: 1.4401903295550857
Energy: 1.4201837122599386
Energy: 1.9102587713667374
Energy: 1.4201837122599386
Energy: 1.9102587713667374
Energy: 1.420183712259143
Energy: 1.9102587713667374
Energy: 1.59677658079517
Energy: 1.5494440638447202
Energy: 1.59677658079517
Energy: 1.5494440638447202
Energy: 1.59677658079517
Energy: 1.5494440638447202
Energy: 1.3711002574055828
Energy: 1.695097055595407
Energy: 1.371100257404787
Energy: 1.695097055595407
Energy: 1.3711002574055828
Energy: 1.695097055595407

minimum gb energy = 1.3535398246318358 eV
minimum distance =  2.25204332087293 Angstroms
sigma value = 33


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

Energy: 1.5593876306819499
Energy: 1.64082540272681
Energy: 1.5593876306819499
Energy: 1.6408254027254527
Energy: 1.5593876306814973
Energy: 1.6408254027250002
Energy: 1.589872226576612
Energy: 1.4952194068558249
Energy: 1.589872226576612
Energy: 1.4952194068562774
Energy: 1.589872226576612
Energy: 1.4952194068558249
Energy: 1.3825519906150825
Energy: 1.484058909347112
Energy: 1.3825519906150825
Energy: 1.4840589093498269
Energy: 1.3825519906159873
Energy: 1.4840589093484693
Energy: 1.5948888396683265
Energy: 1.662669563850271
Energy: 1.594888839666064
Energy: 1.662669563849819
Energy: 1.5948888396665164
Energy: 1.662669563850271
Energy: 1.4701937250581179
Energy: 1.543838537238324
Energy: 1.4701937250572128
Energy: 1.5438385372274637
Energy: 1.4701937250581179
Energy: 1.543838537236514
Energy: 1.4840697877104716
Energy: 1.365860025220906
Energy: 1.484069787709114
Energy: 1.3658600252204536
Energy: 1.484069787710019
Energy: 1.3658600252204536
Energy: 1.6517857999731174
Energy: 1.560217708888981
Energy: 1.6517857999726646
Energy: 1.560217708888981
Energy: 1.6517857999731174
Energy: 1.560217708888981
Energy: 1.3542102326937688
Energy: 1.5620860146512694
Energy: 1.3542102326933165
Energy: 1.5620860146508166
Energy: 1.3542102326933165
Energy: 1.5620860146512694
Energy: 1.4169849126158178
Energy: 1.3832607071377152
Energy: 1.4169849126153653
Energy: 1.3832607071381677
Energy: 1.4169849126153653
Energy: 1.3832607071377152
Energy: 1.3703798932024553
Energy: 1.5774135405075473
Energy: 1.3703798932033602
Energy: 1.5774135405075473
Energy: 1.3703798932042655
Energy: 1.577413540508
Energy: 1.5789638731013045
Energy: 1.3706490667438127
Energy: 1.578963873099947
Energy: 1.3706490667429074
Energy: 1.5789638730994946
Energy: 1.3706490667429074
Energy: 1.3686913172159179
Energy: 1.4159812728015522
Energy: 1.368691317215465
Energy: 1.415981272802005
Energy: 1.368691317215465
Energy: 1.4159812728010999
Energy: 1.5600153139920792
Energy: 1.353847651913907
Energy: 1.560015313992984
Energy: 1.3538476519143594
Energy: 1.5600153139934365
Energy: 1.3538476519143594
Energy: 1.559449159068449
Energy: 1.6457257482144119
Energy: 1.559449159068449
Energy: 1.645725748213507
Energy: 1.559449159068449
Energy: 1.6457257482139596
Energy: 1.4901935056255469
Energy: 1.4857517361844017
Energy: 1.4901935056246416
Energy: 1.4857517361848545
Energy: 1.490193505625999
Energy: 1.4857517361844017
Energy: 1.3642910948753921
Energy: 1.4941160331637822
Energy: 1.3642910948749396
Energy: 1.4941160331633299
Energy: 1.3642910948749396
Energy: 1.4941160331637822
Energy: 1.6642861210255862
Energy: 1.591070342395263
Energy: 1.6642861210246809
Energy: 1.5910703423957155
Energy: 1.6642861210255862
Energy: 1.591070342395263
Energy: 1.492443369092885
Energy: 1.3661097361558625
Energy: 1.4924433690924328
Energy: 1.3661097361558625
Energy: 1.492443369092885
Energy: 1.366109736156315
Energy: 1.4882535208995977
Energy: 1.4915223795134926
Energy: 1.4882535209005026
Energy: 1.4915223795130401
Energy: 1.48825352090005
Energy: 1.4915223795130401
Energy: 1.6436904597128763
Energy: 1.5640403616970449
Energy: 1.6436904597124236
Energy: 1.5640403616970449
Energy: 1.6436904597128763
Energy: 1.5640403616970449
Energy: 1.3749597244238982
Energy: 1.5621929188525032
Energy: 1.3749597244238982
Energy: 1.5621929188525032
Energy: 1.3749597244238982
Energy: 1.5621929188525032
Energy: 1.4840600053252548
Energy: 1.3832140726270885
Energy: 1.48406000533159
Energy: 1.3832140726270885
Energy: 1.4840600053329476
Energy: 1.3832140726270885
Energy: 1.370362944245191
Energy: 1.5789864237299722
Energy: 1.370362944245191
Energy: 1.5789864237304247
Energy: 1.370362944245191
Energy: 1.5789864237299722
Energy: 1.5779969716398299
Energy: 1.4709373147849347
Energy: 1.5779969716411877
Energy: 1.4709373147849347
Energy: 1.5779969716402824
Energy: 1.4709373147840294
Energy: 1.3829066367501863
Energy: 1.483910336653073
Energy: 1.3829066367492813
Energy: 1.4839103366526207
Energy: 1.382906636749734
Energy: 1.4839103366521684
Energy: 1.5603324981168754
Energy: 1.5958882816529123
Energy: 1.5603324981164226
Energy: 1.5958882816533648
Energy: 1.5603324981168754
Energy: 1.5958882816533648
Energy: 1.5610059400550977
Energy: 1.5958601044246785
Energy: 1.561005940052835
Energy: 1.5958601044233212
Energy: 1.5610059400537404
Energy: 1.595860104424226
Energy: 1.3828710649261562
Energy: 1.4839371786481006
Energy: 1.3828710649261562
Energy: 1.4839371786481006
Energy: 1.3828710649266087
Energy: 1.483937178647648
Energy: 1.5780272713764223
Energy: 1.4707223840399284
Energy: 1.5780272713768748
Energy: 1.4707223840394759
Energy: 1.5780272713768748
Energy: 1.4707223840394759
Energy: 1.37056659080401
Energy: 1.5801363142664833
Energy: 1.3705665908035574
Energy: 1.580136314265126
Energy: 1.37056659080401
Energy: 1.5801363142646732
Energy: 1.483989419592905
Energy: 1.3834145877589892
Energy: 1.4839894195906427
Energy: 1.3834145877589892
Energy: 1.4839894195924526
Energy: 1.3834145877594417
Energy: 1.3750321820583133
Energy: 1.56313854952451
Energy: 1.3750321820583133
Energy: 1.5631385495249626
Energy: 1.375032182057861
Energy: 1.5631385495240575
Energy: 1.6439261967679029
Energy: 1.5640582962928797
Energy: 1.6439261967683554
Energy: 1.5640582962924272
Energy: 1.6439261967679029
Energy: 1.5640582962919747
Energy: 1.4882588181816867
Energy: 1.4913182074692446
Energy: 1.4882588181821392
Energy: 1.491318207468792
Energy: 1.4882588181816867
Energy: 1.4913182074701499
Energy: 1.4927081657208428
Energy: 1.3665865347947996
Energy: 1.4927081657226526
Energy: 1.3665865347947996
Energy: 1.4927081657208428
Energy: 1.3665865347947996
Energy: 1.6643148499927374
Energy: 1.5910542205771405
Energy: 1.6643148499931897
Energy: 1.5910542205753302
Energy: 1.6643148499931897
Energy: 1.5910542205775928
Energy: 1.3642759502597765
Energy: 1.4937637887298079
Energy: 1.364275950259324
Energy: 1.4937637887298079
Energy: 1.3642759502602293
Energy: 1.4937637887298079
Energy: 1.490355354375268
Energy: 1.4855737368703434
Energy: 1.490355354375268
Energy: 1.485573736870796
Energy: 1.490355354375268
Energy: 1.4855737368703434
Energy: 1.5593672708955242
Energy: 1.6457333979255813
Energy: 1.5593672708955242
Energy: 1.6457333979255813
Energy: 1.5593672708955242
Energy: 1.6457333979255813
Energy: 1.5599684563738796
Energy: 1.3538019108463355
Energy: 1.5599684563743323
Energy: 1.3538019108463355
Energy: 1.5599684563747847
Energy: 1.3538019108458827
Energy: 1.3686589828310856
Energy: 1.4159993146100995
Energy: 1.368658982831538
Energy: 1.4159993146100995
Energy: 1.3686589828310856
Energy: 1.4159993146096475

minimum gb energy = 1.3538019108458827 eV
minimum distance =  2.34014817562818 Angstroms
sigma value = 51


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

Energy: 1.5495078944703926
Energy: 1.5768008465103323
Energy: 1.5495078944703926
Energy: 1.5768008465103323
Energy: 1.5495078944703926
Energy: 1.5768008465103323
Energy: 1.6678397319507976
Energy: 1.5164555228946202
Energy: 1.6678397319507976
Energy: 1.5164555228956684
Energy: 1.6678397319507976
Energy: 1.5164555228946202
Energy: 1.4828988687582818
Energy: 1.5559866882966154
Energy: 1.4828988687572333
Energy: 1.5559866882955669
Energy: 1.4828988687582818
Energy: 1.5559866882966154
Energy: 1.539333645934339
Energy: 1.4030821271661729
Energy: 1.539333645934339
Energy: 1.4030821271661729
Energy: 1.5393336459332903
Energy: 1.4030821271661729
Energy: 1.6036009413672656
Energy: 1.5000211528627683
Energy: 1.603600941368314
Energy: 1.5000211528627683
Energy: 1.6036009413672656
Energy: 1.5000211528627683
Energy: 1.6023136831830604
Energy: 1.5001128326302802
Energy: 1.6023136831841087
Energy: 1.5001128326313284
Energy: 1.6023136831830604
Energy: 1.5001128326313284
Energy: 1.54903833478298
Energy: 1.4994332002548272
Energy: 1.54903833478298
Energy: 1.4994332002537785
Energy: 1.54903833478298
Energy: 1.4994332002537785
Energy: 1.4420129133452688
Energy: 1.5005023570773843
Energy: 1.4420129133452688
Energy: 1.5005023570763356
Energy: 1.4420129133452688
Energy: 1.5005023570773843
Energy: 1.776379157148397
Energy: 1.4028919838787923
Energy: 1.776379157148397
Energy: 1.4028919838787923
Energy: 1.776379157148397
Energy: 1.4028919838787923
Energy: 1.4318879842035912
Energy: 1.766427218313759
Energy: 1.4318879842046395
Energy: 1.766427218313759
Energy: 1.4318879842046395
Energy: 1.766427218313759
Energy: 1.6619701598277434
Energy: 1.4010924241364056
Energy: 1.6619701598277434
Energy: 1.4010924241364056
Energy: 1.6619701598277434
Energy: 1.4010924241364056
Energy: 1.5468535819733162
Energy: 1.579754967551
Energy: 1.5468535819733162
Energy: 1.579754967551
Energy: 1.5468535819733162
Energy: 1.5797549675499518
Energy: 1.6706699179759616
Energy: 1.5134522454776773
Energy: 1.6706699179759616
Energy: 1.5134522454776773
Energy: 1.6706699179749132
Energy: 1.5134522454776773
Energy: 1.4832609422746257
Energy: 1.470905764249537
Energy: 1.4832609422746257
Energy: 1.4709057642484884
Energy: 1.4832609422746257
Energy: 1.470905764249537
Energy: 1.578268361286885
Energy: 1.5488411221138567
Energy: 1.578268361286885
Energy: 1.5488411221138567
Energy: 1.578268361286885
Energy: 1.5488411221138567
Energy: 1.5877088601642038
Energy: 1.4998833090397534
Energy: 1.5877088601631555
Energy: 1.4998833090408021
Energy: 1.587708860162107
Energy: 1.4998833090397534
Energy: 1.6021628140480506
Energy: 1.6194113115445707
Energy: 1.6021628140470021
Energy: 1.6194113115445707
Energy: 1.6021628140480506
Energy: 1.6194113115445707
Energy: 1.5475074349279145
Energy: 1.4995556024681642
Energy: 1.5475074349279145
Energy: 1.4995556024681642
Energy: 1.5475074349279145
Energy: 1.4995556024671157

minimum gb energy = 1.4010924241364056 eV
minimum distance =  2.25585416297917 Angstroms
sigma value = 19


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

Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.5026740640861074
Energy: 1.578713302390563
Energy: 1.5026740640855136
Energy: 1.5787133023911848
Energy: 1.5026740640861074
Energy: 1.578713302390563
Energy: 1.2596260795421714
Energy: 1.578059334788258
Energy: 1.2596260795421714
Energy: 1.578059334788258
Energy: 1.2596260795421714
Energy: 1.578059334788258
Energy: 1.3871187645062473
Energy: 1.2598472435417494
Energy: 1.3871187645062473
Energy: 1.2598472435411274
Energy: 1.3871187645062473
Energy: 1.2598472435423715
Energy: 1.2890343975256762
Energy: 1.3069957031356936
Energy: 1.2890343975250542
Energy: 1.3069957031350716
Energy: 1.2890343975256762
Energy: 1.3069957031350716
Energy: 1.2889416476937074
Energy: 1.3069624041195074
Energy: 1.2889416476930855
Energy: 1.3069624041195074
Energy: 1.2889416476930855
Energy: 1.306962404120129
Energy: 1.387148108822683
Energy: 1.2597816386349485
Energy: 1.387148108822683
Energy: 1.2597816386355705
Energy: 1.387148108822683
Energy: 1.2597816386349485
Energy: 1.2597048505941462
Energy: 1.5779604643954226
Energy: 1.259704850594768
Energy: 1.5779604643960445
Energy: 1.2597048505941462
Energy: 1.5779604643979106
Energy: 1.5013360192447405
Energy: 1.5783570606930983
Energy: 1.5013360192447405
Energy: 1.5783570606937203
Energy: 1.5013360192447405
Energy: 1.5783570606930983
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961357485
Energy: 1.3337752191580994
Energy: 1.5026740640867293
Energy: 1.578713302390563
Energy: 1.5026740640867293
Energy: 1.578713302390563
Energy: 1.5026740640867293
Energy: 1.5787133023911848
Energy: 1.2596260795421714
Energy: 1.5780593347876362
Energy: 1.2596260795427932
Energy: 1.578059334788258
Energy: 1.2596260795427932
Energy: 1.578059334788258
Energy: 1.3871187645062473
Energy: 1.2598472435417494
Energy: 1.387118764506869
Energy: 1.2598472435423715
Energy: 1.387118764506869
Energy: 1.2598472435423715
Energy: 1.2890343975250542
Energy: 1.3069957031356936
Energy: 1.2890343975256762
Energy: 1.3069957031356936
Energy: 1.2890343975250542
Energy: 1.3069957031356936
Energy: 1.2889416476937074
Energy: 1.3069624041195074
Energy: 1.2889416476937074
Energy: 1.306962404120129
Energy: 1.2889416476937074
Energy: 1.3069624041195074
Energy: 1.387148108822683
Energy: 1.2597816386355705
Energy: 1.387148108822683
Energy: 1.2597816386355705
Energy: 1.387148108822683
Energy: 1.2597816386349485
Energy: 1.259704850594768
Energy: 1.5779604643948009
Energy: 1.259704850594768
Energy: 1.5779604643972884
Energy: 1.259704850594768
Energy: 1.5779604643966665
Energy: 1.5013360192441183
Energy: 1.5783570606937203
Energy: 1.5013360192447405
Energy: 1.5783570606937203
Energy: 1.5013360192447405
Energy: 1.5783570606937203
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961357485
Energy: 1.3337752191580994
Energy: 1.5026740640867293
Energy: 1.578713302390563
Energy: 1.5026740640867293
Energy: 1.578713302390563
Energy: 1.5026740640861074
Energy: 1.5787133023899413
Energy: 1.2596260795421714
Energy: 1.578059334788258
Energy: 1.2596260795421714
Energy: 1.578059334788258
Energy: 1.2596260795421714
Energy: 1.578059334788258
Energy: 1.3871187645062473
Energy: 1.2598472435417494
Energy: 1.387118764506869
Energy: 1.2598472435423715
Energy: 1.3871187645062473
Energy: 1.2598472435423715
Energy: 1.2890343975256762
Energy: 1.3069957031356936
Energy: 1.2890343975250542
Energy: 1.3069957031356936
Energy: 1.2890343975256762
Energy: 1.3069957031356936
Energy: 1.2889416476937074
Energy: 1.3069624041195074
Energy: 1.2889416476937074
Energy: 1.306962404120129
Energy: 1.2889416476943292
Energy: 1.3069624041195074
Energy: 1.387148108822683
Energy: 1.2597816386355705
Energy: 1.387148108822683
Energy: 1.2597816386355705
Energy: 1.387148108822683
Energy: 1.2597816386355705
Energy: 1.2597048505941462
Energy: 1.5779604643966665
Energy: 1.259704850594768
Energy: 1.5779604643960445
Energy: 1.2597048505941462
Energy: 1.5779604643948009
Energy: 1.5013360192447405
Energy: 1.5783570606937203
Energy: 1.5013360192447405
Energy: 1.5783570606930983
Energy: 1.5013360192447405
Energy: 1.5783570606930983
Energy: 1.3093713961357485
Energy: 1.3337752191580994
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.3093713961351265
Energy: 1.3337752191580994
Energy: 1.5026740640867293
Energy: 1.578713302390563
Energy: 1.5026740640861074
Energy: 1.578713302390563
Energy: 1.5026740640861074
Energy: 1.578713302390563
Energy: 1.2596260795427932
Energy: 1.578059334788258
Energy: 1.2596260795421714
Energy: 1.5780593347888798
Energy: 1.2596260795421714
Energy: 1.578059334788258

minimum gb energy = 1.2596260795421714 eV
minimum distance =  2.26691607930399 Angstroms
sigma value = 27


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

Energy: 1.2812464595361486
Energy: 1.2424518751927756
Energy: 1.2812464595361486
Energy: 1.2424518751927756
Energy: 1.2812464595361486
Energy: 1.2424518751927756
Energy: 1.6545523025807531
Energy: 1.2861799544822863
Energy: 1.6545523025807531
Energy: 1.2861799544822863
Energy: 1.6545523025822764
Energy: 1.2861799544822863
Energy: 1.2056024126090596
Energy: 1.4336820917736819
Energy: 1.205602412610583
Energy: 1.4336820917736819
Energy: 1.205602412610583
Energy: 1.4336820917736819
Energy: 1.4029812018818808
Energy: 1.2062024965576719
Energy: 1.4029812018834042
Energy: 1.2062024965576719
Energy: 1.4029812018818808
Energy: 1.2062024965576719
Energy: 1.6451066489442936
Energy: 1.206617088609
Energy: 1.6451066489442936
Energy: 1.206617088609
Energy: 1.6451066489442936
Energy: 1.206617088609
Energy: 1.4408088872506635
Energy: 1.4977698917749884
Energy: 1.4408088872506635
Energy: 1.4977698917749884
Energy: 1.4408088872506635
Energy: 1.4977698917749884
Energy: 1.2076077157977423
Energy: 1.2884572804982615
Energy: 1.4016591173601969
Energy: 1.288457280499785
Energy: 1.4016591173586737
Energy: 1.2884572804982615
Energy: 1.2770706679836892
Energy: 1.2487154818804533
Energy: 1.2770706679852124
Energy: 1.2487154818804533
Energy: 1.2770706679836892
Energy: 1.2487154818804533
Energy: 1.6196170487754982
Energy: 1.326370145637939
Energy: 1.6196170487739747
Energy: 1.3263701528936416
Energy: 1.6196170487739747
Energy: 1.3263701533778351
Energy: 1.3840896792427078
Energy: 1.4435641568918376
Energy: 1.3840896792427078
Energy: 1.4435641568918376
Energy: 1.3840896792427078
Energy: 1.4435641568918376
Energy: 1.341048116745556
Energy: 1.2068511808037332
Energy: 1.341048116745556
Energy: 1.2068511808037332
Energy: 1.341048116745556
Energy: 1.2068511808037332
Energy: 1.4963496370289062
Energy: 1.3663460740987556
Energy: 1.4963496370289062
Energy: 1.3663460740987556
Energy: 1.4963496370289062
Energy: 1.3663460740987556

minimum gb energy = 1.2056024126090596 eV
minimum distance =  2.24682134623469 Angstroms
sigma value = 9


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

Energy: 1.24236733638052
Energy: 1.2659184717913892
Energy: 1.2423673363809484
Energy: 1.2659184717905334
Energy: 1.24236733638052
Energy: 1.2659184717905334
Energy: 1.298737901261162
Energy: 1.1412618578322857
Energy: 1.2987379012620182
Energy: 1.256976062588668
Energy: 1.2987379012598779
Energy: 1.203447833635482
Energy: 1.1342950001188894
Energy: 1.3483078870469842
Energy: 1.1342950001180336
Energy: 1.3483078870495133
Energy: 1.1342950001180336
Energy: 1.3483078870474121
Energy: 1.125121512240568
Energy: 1.0949358992656435
Energy: 1.12512151224014
Energy: 1.0949358992652154
Energy: 1.1251215122397118
Energy: 1.0949358992656435
Energy: 1.2230622226262695
Energy: 1.1708830961374346
Energy: 1.2230622226271257
Energy: 1.1708830961391468
Energy: 1.2230622226271257
Energy: 1.1708830961382908
Energy: 1.2190449865312636
Energy: 1.226097709122635
Energy: 1.2190449865334037
Energy: 1.2457630688124195
Energy: 1.2190449865286954
Energy: 1.226024853935604
Energy: 1.1515287841458877
Energy: 1.2731960349695397
Energy: 1.1515287841467439
Energy: 1.2731960349699678
Energy: 1.1515287841467439
Energy: 1.2731960349695397
Energy: 1.0672375243674599
Energy: 1.314914559374122
Energy: 1.067237524366604
Energy: 1.3149145593736937
Energy: 1.0672375243670318
Energy: 1.314914559374122
Energy: 1.2450770257351393
Energy: 1.1709938569566973
Energy: 1.2450770257577861
Energy: 1.170993856954557
Energy: 1.245077025758214
Energy: 1.1709938569571252
Energy: 1.2265850857738725
Energy: 1.5657880721280113
Energy: 1.2265850857730165
Energy: 1.5657880721280113
Energy: 1.2265850857734444
Energy: 1.5657880721280113
Energy: 1.128853516235528
Energy: 1.1000232968667347
Energy: 1.128853516235528
Energy: 1.1000232968667347
Energy: 1.1288535162363837
Energy: 1.1000232968667347
Energy: 1.1612450276112607
Energy: 1.257228632857284
Energy: 1.1612450276108326
Energy: 1.257228632857284
Energy: 1.1612450276112607
Energy: 1.2572286328577116
Energy: 1.1903237227845525
Energy: 1.2084490580472598
Energy: 1.1903237227845525
Energy: 1.2084490580468314
Energy: 1.1903237227849808
Energy: 1.2084490580472598
Energy: 1.2388363768525148
Energy: 1.5951445219079619
Energy: 1.238836376852943
Energy: 1.59514452190839
Energy: 1.238836376853371
Energy: 1.5951445219079619
Energy: 1.1123490854213285
Energy: 1.233313272728032
Energy: 1.1123490854213285
Energy: 1.2333132727284601
Energy: 1.1123490854217564
Energy: 1.233313272728032
Energy: 1.136073992923597
Energy: 1.185133431636285
Energy: 1.1360739929240251
Energy: 1.185133431636285
Energy: 1.1360739929240251
Energy: 1.185133431635857
Energy: 1.4510192924750163
Energy: 1.0945955850861986
Energy: 1.4510192924758727
Energy: 1.0945955850866265
Energy: 1.4510192924758727
Energy: 1.0945955850857705
Energy: 1.1241517757421078
Energy: 1.1721071547806268
Energy: 1.1241517757416797
Energy: 1.1721071547819109
Energy: 1.1241517757416797
Energy: 1.1721071547797708
Energy: 1.0633648034861682
Energy: 1.5187184501738051
Energy: 1.0633648034865961
Energy: 1.5187184501738051
Energy: 1.0633648034857401
Energy: 1.518718450173377
Energy: 1.5630965149481044
Energy: 1.3771615984831604
Energy: 1.5630965149481044
Energy: 1.3771615984831604
Energy: 1.5630965149481044
Energy: 1.3472295931442935
Energy: 1.063334029857632
Energy: 1.5265949070406881
Energy: 1.0633340298580598
Energy: 1.52659490704026
Energy: 1.0633340298567757
Energy: 1.52659490704026
Energy: 1.1243400207856709
Energy: 1.172280844545447
Energy: 1.1243400207856709
Energy: 1.1722808445445907
Energy: 1.124340020785243
Energy: 1.1722808445437347
Energy: 1.4507540081654773
Energy: 1.0945066781622277
Energy: 1.4507540081650492
Energy: 1.0945066781626556
Energy: 1.4507540081654773
Energy: 1.0945066781626556
Energy: 1.1360493305211257
Energy: 1.2150241915640907
Energy: 1.1360493305206978
Energy: 1.2150241915640907
Energy: 1.1360493305211257
Energy: 1.2150241915636628
Energy: 1.1122969296221399
Energy: 1.2333371562349629
Energy: 1.1122969296221399
Energy: 1.2333371562349629
Energy: 1.1122969296221399
Energy: 1.233337156236675
Energy: 1.2391560351389654
Energy: 1.3503510156936493
Energy: 1.2391560351389654
Energy: 1.3503510156940772
Energy: 1.2391560351389654
Energy: 1.3503510156932212
Energy: 1.1887939419752647
Energy: 1.2079909055809923
Energy: 1.1887939419756925
Energy: 1.2079909055809923
Energy: 1.1887939419726963
Energy: 1.2079909055814202
Energy: 1.1613212114947815
Energy: 1.178646717996187
Energy: 1.1613212114952094
Energy: 1.1786467179966151
Energy: 1.1613212114952094
Energy: 1.178646717996187
Energy: 1.1288307222438625
Energy: 1.0999401743295807
Energy: 1.1288307222447185
Energy: 1.0999401743287245
Energy: 1.1288307222442906
Energy: 1.0999401743291526
Energy: 1.2257378377403658
Energy: 1.3210173923244488
Energy: 1.2257378377399375
Energy: 1.3210173923184565
Energy: 1.2257378377399375
Energy: 1.3210173923235926
Energy: 1.2452957006180858
Energy: 1.1715562762547271
Energy: 1.2452957006176577
Energy: 1.1715562762547271
Energy: 1.2452957006172296
Energy: 1.171556276256011
Energy: 1.0673946585158296
Energy: 1.3149868508177314
Energy: 1.0673946585158296
Energy: 1.314986850817303
Energy: 1.0673946585154013
Energy: 1.3149868508177314
Energy: 1.1517232559200843
Energy: 1.2724618720370307
Energy: 1.1517232559205122
Energy: 1.2724618720370307
Energy: 1.1517232559209403
Energy: 1.2724618720366028
Energy: 1.2191844608745686
Energy: 1.2197119063205386
Energy: 1.2191844608749967
Energy: 1.2197119063205386
Energy: 1.2191844608741405
Energy: 1.2197119063205386
Energy: 1.2230376956817066
Energy: 1.1712507953784
Energy: 1.2230376956821345
Energy: 1.171250795378828
Energy: 1.2230376956821345
Energy: 1.1712507953784
Energy: 1.1251780264301317
Energy: 1.0947480237742755
Energy: 1.1251780264305598
Energy: 1.0947480237738476
Energy: 1.1251780264301317
Energy: 1.0947480237734195
Energy: 1.134359918663721
Energy: 1.3482608091849972
Energy: 1.1343599186632929
Energy: 1.3482608091841415
Energy: 1.134359918662437
Energy: 1.3482608091858532
Energy: 1.2990177882840317
Energy: 1.1851374280527642
Energy: 1.2990177882831757
Energy: 1.1851374280531919
Energy: 1.2990177882844598
Energy: 1.1851374280531919
Energy: 1.242367336379236
Energy: 1.2659184717896772
Energy: 1.242367336379236
Energy: 1.265918471790105
Energy: 1.2423673363788081
Energy: 1.2659184717892493
Energy: 1.2987379012581655
Energy: 1.2034478336333418
Energy: 1.2987379012585938
Energy: 1.20344783363377
Energy: 1.2987379012581655
Energy: 1.20344783363377
Energy: 1.1342950001171774
Energy: 1.3483078870469842
Energy: 1.1342950001176055
Energy: 1.3483078870439877
Energy: 1.1342950001176055
Energy: 1.348307887046556
Energy: 1.1251215122388556
Energy: 1.094935899262647
Energy: 1.125121512239284
Energy: 1.094935899261363
Energy: 1.125121512239284
Energy: 1.094935899262647
Energy: 1.2230622226262695
Energy: 1.1708830961387187
Energy: 1.2230622226271257
Energy: 1.1708830961387187
Energy: 1.2230622226262695
Energy: 1.1708830961374346

minimum gb energy = 1.0633340298567757 eV
minimum distance =  2.31332296331298 Angstroms
sigma value = 57


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

Energy: 0.8341316420307642
Energy: 0.7973818861032705
Energy: 0.5358191236385914
Energy: 0.7973818861042449
Energy: 0.8341316420297898
Energy: 0.7973818861052193
Energy: 0.9527772414679465
Energy: 0.7833676553091391
Energy: 0.9527772414679465
Energy: 0.7838470848874088
Energy: 0.9527772414659978
Energy: 0.7833676553071904
Energy: 0.8559834123552378
Energy: 0.9745529774810756
Energy: 0.8559834123562122
Energy: 1.2574428872712373
Energy: 0.8559834123552378
Energy: 0.9745529774781526
Energy: 0.7989063806431663
Energy: 0.6836849188044624
Energy: 0.7989063806421919
Energy: 0.5354771391671117
Energy: 0.7989063806431663
Energy: 0.6836849188054365
Energy: 0.6940789369237003
Energy: 0.9577679782664316
Energy: 0.6940789369227258
Energy: 0.9577679782664316
Energy: 0.6940789369237003
Energy: 0.9577679782664316
Energy: 0.5356357781932466
Energy: 0.8560075081769044
Energy: 0.535635778194221
Energy: 0.8560075081759744
Energy: 0.5356357781932466
Energy: 0.8560075081769044
Energy: 0.5356244991069629
Energy: 0.6047141970156044
Energy: 0.5356244991069629
Energy: 0.6047141970146299
Energy: 0.5356244991059885
Energy: 0.6047141970146299
Energy: 0.9530058098741956
Energy: 0.7004842198638748
Energy: 0.9530058098741956
Energy: 0.7004842198629004
Energy: 0.9530058098741956
Energy: 0.7004842198638748
Energy: 0.7990904872969808
Energy: 0.5354695724401679
Energy: 0.7990904872960065
Energy: 0.6836792037196635
Energy: 0.7990904872940578
Energy: 0.5354695724382191
Energy: 0.6043717413418349
Energy: 0.9715076922260338
Energy: 0.6043717413428092
Energy: 0.9715076922260338
Energy: 0.6043717413418349
Energy: 0.9715076922270083
Energy: 0.6942841873231128
Energy: 0.9940537377270182
Energy: 0.6942841873240873
Energy: 0.9940537377270182
Energy: 0.6942841873240873
Energy: 0.9940537377279927
Energy: 0.8341316420317386
Energy: 0.7973818861032705
Energy: 0.5358191236395657
Energy: 0.7973818861022962
Energy: 0.8341316420307642
Energy: 0.7973818861042449
Energy: 0.9527772414689208
Energy: 0.7833676553101135
Energy: 0.9527772414679465
Energy: 0.7838470848874088
Energy: 0.9527772414659978
Energy: 0.7833676553071904
Energy: 0.8559834123571866
Energy: 0.9745529774908193
Energy: 0.855983412358161
Energy: 1.2574428872585708
Energy: 0.8559834123562122
Energy: 0.9745529774878963
Energy: 0.7989063806431663
Energy: 0.6836849188054365
Energy: 0.7989063806441407
Energy: 0.5354771391671117
Energy: 0.7989063806441407
Energy: 0.6836849188064109
Energy: 0.6940789369227258
Energy: 0.957767978267406
Energy: 0.6940789369207773
Energy: 0.9577679782683804
Energy: 0.6940789369227258
Energy: 0.9577679782664316
Energy: 0.5356357781922723
Energy: 0.8560075081778787
Energy: 0.535635778194221
Energy: 0.8560075081769044
Energy: 0.5356357781932466
Energy: 0.8560075081778787
Energy: 0.5356244991059885
Energy: 0.6047141970156044
Energy: 0.5356244991059885
Energy: 0.6047141970146299
Energy: 0.5356244991059885
Energy: 0.6047141970146299
Energy: 0.9530058098741956
Energy: 0.7004842198638748
Energy: 0.9530058098741956
Energy: 0.7004842198638748
Energy: 0.9530058098741956
Energy: 0.7004842198638748

minimum gb energy = 0.5354695724382191 eV
minimum distance =  2.40732957576574 Angstroms
sigma value = 11


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

Energy: 1.1103203870415534
Energy: 1.1657789096774278
Energy: 1.1103203870408398
Energy: 1.1657789096781412
Energy: 1.1103203870415534
Energy: 1.1657789096781412
Energy: 1.264575295365981
Energy: 1.1553579715213405
Energy: 1.264575295365981
Energy: 1.1553579715213405
Energy: 1.264575295365981
Energy: 1.1553579715213405
Energy: 1.3426153974508905
Energy: 1.6244360297065783
Energy: 1.3791175272655323
Energy: 1.6244360297065783
Energy: 1.3426153974516042
Energy: 1.6244360297065783
Energy: 1.3635219851921916
Energy: 0.993810573895601
Energy: 1.3635219851921916
Energy: 0.993810573895601
Energy: 1.3635219851921916
Energy: 0.993810573895601
Energy: 1.1335187721190116
Energy: 0.936768784403938
Energy: 1.1335187721190116
Energy: 0.9367687844032241
Energy: 1.1335187721190116
Energy: 0.936768784403938
Energy: 1.1233939370454502
Energy: 1.0663515472829788
Energy: 1.1233939370454502
Energy: 1.0663515472829788
Energy: 1.1233939370461639
Energy: 1.0663515472836924
Energy: 0.9440291249084937
Energy: 1.3350417518365838
Energy: 0.9440291249099212
Energy: 1.3350417518351565
Energy: 0.9440291249092074
Energy: 1.3350417518365838
Energy: 1.173512764685692
Energy: 0.9046755233626123
Energy: 1.173512764685692
Energy: 0.9046755233633261
Energy: 1.173512764685692
Energy: 0.9046755233633261
Energy: 1.1700452567514072
Energy: 0.9207122570972228
Energy: 1.1700452567506934
Energy: 0.9207122570965091
Energy: 1.1700452567514072
Energy: 0.9207122570965091
Energy: 0.9245510007925265
Energy: 1.442364305525914
Energy: 0.9245510007925265
Energy: 1.4423643055252
Energy: 0.9245510007918127
Energy: 1.4423643055252
Energy: 1.3986247506504337
Energy: 1.427122822456829
Energy: 1.3986247506504337
Energy: 1.4271228224575425
Energy: 1.398624750649006
Energy: 1.427122822456829
Energy: 1.1353859773411041
Energy: 0.9369313580057471
Energy: 1.1353859773411041
Energy: 0.9369313580057471
Energy: 1.1353859773411041
Energy: 0.9369313580057471
Energy: 1.2021762250399304
Energy: 0.9995364483253947
Energy: 1.2021762250399304
Energy: 0.9995364483246808
Energy: 1.2021762250392165
Energy: 0.9995364483253947
Energy: 1.2739958191955396
Energy: 1.5921216774407638
Energy: 1.273995819194826
Energy: 1.5921216774407638
Energy: 1.273995819194826
Energy: 1.5921216774400502
Energy: 1.494187739251829
Energy: 1.1546395695120808
Energy: 1.4941877392511151
Energy: 1.1546395695120808
Energy: 1.4941877392511151
Energy: 1.1546395695120808
Energy: 1.0218984234078992
Energy: 1.1659814844885596
Energy: 1.0218984234121815
Energy: 1.1659814844885596
Energy: 1.021898423410754
Energy: 1.1659814844885596
Energy: 1.0475854679341745
Energy: 1.1340577346883152
Energy: 1.0475854679348884
Energy: 1.1340577346876013
Energy: 1.0475854679334609
Energy: 1.1340577346883152
Energy: 1.4557410016951722
Energy: 1.5527342748375228
Energy: 1.4557410016951722
Energy: 1.5527342748382367
Energy: 1.455741001695886
Energy: 1.552734274836809
Energy: 1.3588618983023981
Energy: 0.9894039161095634
Energy: 1.3588618983023981
Energy: 0.9894039161088498
Energy: 1.3588618983023981
Energy: 0.9894039161088498
Energy: 1.1349077411097375
Energy: 1.068412010927326
Energy: 1.1349077411090238
Energy: 1.068412010927326
Energy: 1.1349077411097375
Energy: 1.0684120109266122
Energy: 0.9261768083539846
Energy: 1.0677249684392354
Energy: 0.9261768083539846
Energy: 1.0677249684392354
Energy: 0.926176808353271
Energy: 1.0677249684392354
Energy: 1.2213163332657346
Energy: 1.3354586887144417
Energy: 1.2213163332635935
Energy: 1.3354586887144417
Energy: 1.2213163332628796
Energy: 1.3354586887151556
Energy: 1.1967413964501485
Energy: 1.0929096862207417
Energy: 1.1967413964508624
Energy: 1.0929096862207417
Energy: 1.1967413964508624
Energy: 1.0929096862214556
Energy: 1.170649320721701
Energy: 1.034210370083506
Energy: 1.170649320722415
Energy: 1.0342103700842196
Energy: 1.170649320721701
Energy: 1.0342103700842196
Energy: 0.9260232456270522
Energy: 1.4025053852603835
Energy: 0.9260232456277661
Energy: 1.4025053852603835
Energy: 0.9260232456270522
Energy: 1.4025053852596694
Energy: 1.6402511328181675
Energy: 1.429410869735251
Energy: 1.6402511328181675
Energy: 1.429410869735251
Energy: 1.6402511328181675
Energy: 1.4294108697359649

minimum gb energy = 0.9046755233626123 eV
minimum distance =  2.30017353738675 Angstroms
sigma value = 41


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

Energy: 1.2608392818351053
Energy: 1.0945719095796818
Energy: 1.2608392818351053
Energy: 1.0945719095796818
Energy: 1.2608392818351053
Energy: 1.0945719095796818
Energy: 1.3201179652480284
Energy: 1.3516587067820114
Energy: 1.3201179652480284
Energy: 1.3516587067820114
Energy: 1.3201179652480284
Energy: 1.3516587067820114
Energy: 1.609694152505847
Energy: 1.8453661021599013
Energy: 1.609694152505847
Energy: 1.8453661021599013
Energy: 1.609694152505847
Energy: 1.845366102160464
Energy: 1.2771036114274448
Energy: 1.0434929396161388
Energy: 1.2771036114280072
Energy: 1.0434929396167014
Energy: 1.2771036114285697
Energy: 1.0434929396161388
Energy: 1.0112211781483473
Energy: 1.093835731356255
Energy: 1.0112211781483473
Energy: 1.09383573135738
Energy: 1.0112211781483473
Energy: 1.09383573135738
Energy: 1.2930280820686768
Energy: 1.2763448731877742
Energy: 1.2930280820692392
Energy: 1.2763448731883367
Energy: 1.2930280820692392
Energy: 1.2763448731883367
Energy: 1.0516685849125915
Energy: 1.4399461077498827
Energy: 1.0516685849125915
Energy: 1.4399461077504454
Energy: 1.0516685849125915
Energy: 1.4399461077498827
Energy: 1.0302579371992406
Energy: 1.0437866019890008
Energy: 1.030257937199803
Energy: 1.0437866019890008
Energy: 1.030257937199803
Energy: 1.0437866019901259
Energy: 1.0228079469600704
Energy: 1.0699077751419501
Energy: 1.0228079469600704
Energy: 1.0699077751419501
Energy: 1.0228079469600704
Energy: 1.0699077751419501
Energy: 1.1313850539192338
Energy: 1.5633881625368948
Energy: 1.1313850539169836
Energy: 1.5633881625368948
Energy: 1.1313850539175463
Energy: 1.5633881625368948
Energy: 1.1342234418492692
Energy: 1.5582726979831307
Energy: 1.1342234418498318
Energy: 1.5582726979831307
Energy: 1.1342234418498318
Energy: 1.5582726979825683
Energy: 1.0329129977272862
Energy: 1.3273770043428066
Energy: 1.0329129977284113
Energy: 1.3273770043433695
Energy: 1.0329129977278486
Energy: 1.2167306800749342
Energy: 1.0213724794991013
Energy: 1.0659611477901505
Energy: 1.0213724794985386
Energy: 1.0659611477907132
Energy: 1.0213724794991013
Energy: 1.0659611477901505
Energy: 0.9795514853823628
Energy: 1.4507942644345435
Energy: 0.9795514853823628
Energy: 1.4507942644345435
Energy: 0.9795514853818003
Energy: 1.4507942644345435
Energy: 1.288297092923299
Energy: 1.2759606830342451
Energy: 1.288297092923299
Energy: 1.2759606830336825
Energy: 1.288297092923299
Energy: 1.2759606830342451
Energy: 1.0197454339800849
Energy: 1.2145676302337371
Energy: 1.0197454339800849
Energy: 1.2145676302337371
Energy: 1.0197454339800849
Energy: 1.2145676302337371
Energy: 1.0432805466363584
Energy: 1.0662445567832795
Energy: 1.0432805466363584
Energy: 1.0662445567832795
Energy: 1.0432805466363584
Energy: 1.0662445567832795
Energy: 1.3717734786767648
Energy: 1.8446749463793477
Energy: 1.3717734786773275
Energy: 1.8446749463793477
Energy: 1.3717734786773275
Energy: 1.8446749463793477
Energy: 1.3547630234850923
Energy: 1.3472480989862825
Energy: 1.3547630234850923
Energy: 1.3472480989862825
Energy: 1.3547630234856547
Energy: 1.3472480989857198
Energy: 1.1315197223876274
Energy: 1.3880051726147924
Energy: 1.13151972238819
Energy: 1.388005172615355
Energy: 1.13151972238819
Energy: 1.388005172615355
Energy: 1.023679217575971
Energy: 1.3534466215469867
Energy: 1.023679217575971
Energy: 1.3534466215469867
Energy: 1.023679217575971
Energy: 1.3534466215464243
Energy: 1.6086426853506361
Energy: 1.6756013934924807
Energy: 1.6086426853500735
Energy: 1.6756013934952934
Energy: 1.6086426853511986
Energy: 1.6756013934919183
Energy: 1.221071076209729
Energy: 1.0406926232660667
Energy: 1.221071076209729
Energy: 1.0406926232660667
Energy: 1.221071076209729
Energy: 1.0406926232660667
Energy: 1.0196261842784375
Energy: 1.3819018885256211
Energy: 1.0196261842784375
Energy: 1.3819018885256211
Energy: 1.0196261842784375
Energy: 1.3819018885250587
Energy: 0.9797290073212694
Energy: 1.426262965940263
Energy: 0.979729007321832
Energy: 1.4262629659408255
Energy: 0.979729007321832
Energy: 1.426262965940263
Energy: 1.0516966900192137
Energy: 1.051646274277352
Energy: 1.0516966900203388
Energy: 1.0516462742784771
Energy: 1.051696690020901
Energy: 1.0516462742779145
Energy: 1.0213283997733233
Energy: 1.041118966162462
Energy: 1.0213283997733233
Energy: 1.041118966162462
Energy: 1.021328399773886
Energy: 1.041118966162462
Energy: 1.022602095512039
Energy: 1.3529741085373
Energy: 1.022602095512039
Energy: 1.3529741085373
Energy: 1.022602095512039
Energy: 1.3529741085367375
Energy: 1.131543710736772
Energy: 1.3860948786732925
Energy: 1.1315437107362092
Energy: 1.3860948786732925
Energy: 1.131543710736772
Energy: 1.3860948786732925
Energy: 1.2424263034322027
Energy: 0.9786521971498507
Energy: 1.2424263034310776
Energy: 0.9786521971504133
Energy: 1.2424263034327654
Energy: 0.9786521971504133
Energy: 1.0070346184342762
Energy: 1.2122531674058459
Energy: 1.0070346184342762
Energy: 1.2122531674058459
Energy: 1.0070346184342762
Energy: 1.2122531674058459
Energy: 1.0547723616399647
Energy: 1.0651530043618287
Energy: 1.0547723616399647
Energy: 1.0651530043623911
Energy: 1.0547723616399647
Energy: 1.0651530043623911
Energy: 0.988060965931331
Energy: 1.2413182121581117
Energy: 0.988060965931331
Energy: 1.2413182121581117
Energy: 0.988060965931331
Energy: 1.2413182121581117

minimum gb energy = 0.9786521971498507 eV
minimum distance =  2.34074867085957 Angstroms
sigma value = 33


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

Energy: 1.1953401290946881
Energy: 1.1190347705587753
Energy: 1.1953401290950472
Energy: 1.1190347705583448
Energy: 1.1953401290946881
Energy: 1.1190347705583448
Energy: 1.2336120138182334
Energy: 1.0588737454359893
Energy: 1.2336120138198126
Energy: 1.0588737454359893
Energy: 1.2336120138193818
Energy: 1.0588737454359893
Energy: 1.4657725961319674
Energy: 1.297968327529293
Energy: 1.4657725961295989
Energy: 1.2979683275269245
Energy: 1.4657725961303882
Energy: 1.297968327527714
Energy: 1.1452566275118974
Energy: 1.0755213022759562
Energy: 1.1452566275142662
Energy: 1.0755213022759562
Energy: 1.1452566275099592
Energy: 1.0755213022763868
Energy: 1.107901788091612
Energy: 1.074764533639687
Energy: 1.107901788091612
Energy: 1.0747645336401175
Energy: 1.1079017880920425
Energy: 1.0747645336266942
Energy: 1.4559116644810806
Energy: 1.1079562708244686
Energy: 1.4559116644818701
Energy: 1.1079562708244686
Energy: 1.4559116644814394
Energy: 1.1079562708241097
Energy: 1.1265959532569103
Energy: 1.248389788155186
Energy: 1.1265959532569103
Energy: 1.2483897881536066
Energy: 1.1265959532565513
Energy: 1.2483897881559756
Energy: 1.1804169455759046
Energy: 1.2146627007014232
Energy: 1.1804169455766942
Energy: 1.2146627007014232
Energy: 1.180416945577053
Energy: 1.2146627007009925
Energy: 1.1378019002551008
Energy: 1.122115409444793
Energy: 1.1378019002570388
Energy: 1.1221154094451518
Energy: 1.1378019002598383
Energy: 1.1221154094451518
Energy: 1.5098366722541345
Energy: 1.0977753834998272
Energy: 1.5098366722560725
Energy: 1.0977753834998272
Energy: 1.5098366722568624
Energy: 1.0977753834990374
Energy: 1.1791413023095398
Energy: 1.1801875969251476
Energy: 1.179141302311119
Energy: 1.1801875969251476
Energy: 1.1791413023098984
Energy: 1.180187596924717
Energy: 1.6969508767395105
Energy: 1.075192524178776
Energy: 1.6969508767395105
Energy: 1.0751925241784173
Energy: 1.6969508767395105
Energy: 1.0751925241784173
Energy: 1.128356268577124
Energy: 1.140525227860192
Energy: 1.128356268577124
Energy: 1.1405252278633504
Energy: 1.1283562685767654
Energy: 1.1405252278637812
Energy: 1.2250566118884707
Energy: 1.182227521319493
Energy: 1.2250566118892605
Energy: 1.182227521319493
Energy: 1.2250566118889015
Energy: 1.1822275213202826
Energy: 1.214046177613902
Energy: 1.1271113663885557
Energy: 1.2140461776142606
Energy: 1.1271113663893453
Energy: 1.214046177613471
Energy: 1.1271113663881251
Energy: 1.1325730665587248
Energy: 1.4579872281224275
Energy: 1.1325730665579352
Energy: 1.4579872281224275
Energy: 1.1325730665587248
Energy: 1.4579872281224275
Energy: 1.4029993717767992
Energy: 1.1033651721557862
Energy: 1.4029993717866336
Energy: 1.1033651721557862
Energy: 1.4029993717882125
Energy: 1.1033651721553555
Energy: 1.071118242547039
Energy: 1.1491796314523548
Energy: 1.0711182425462493
Energy: 1.1491796314527136
Energy: 1.0711182425473977
Energy: 1.1491796314523548
Energy: 1.5074351710753682
Energy: 1.4614737345683604
Energy: 1.5074351710753682
Energy: 1.4614737345683604
Energy: 1.5074351710750094
Energy: 1.4614737345683604
Energy: 1.679441771746243
Energy: 1.126107195547649
Energy: 1.679441771746602
Energy: 1.1261071955472897
Energy: 1.679441771746602
Energy: 1.126107195547649
Energy: 1.1151633352702357
Energy: 1.1958726909113042
Energy: 1.115163335269805
Energy: 1.1958726909113042
Energy: 1.1151633352702357
Energy: 1.1958726909113042
Energy: 1.0559610120545464
Energy: 1.239112223676134
Energy: 1.0559610120541156
Energy: 1.2391122236765648
Energy: 1.0559610120537568
Energy: 1.2391122236757752
Energy: 1.2147191981473202
Energy: 1.3904652755650577
Energy: 1.2147191981461716
Energy: 1.3904652755650577
Energy: 1.2147191981477508
Energy: 1.3904652755654168
Energy: 1.104461154169326
Energy: 1.437628537137631
Energy: 1.104461154169326
Energy: 1.437628537137631
Energy: 1.104461154169757
Energy: 1.43762853713799
Energy: 1.0811759980502977
Energy: 1.1035922521929111
Energy: 1.0811759980490774
Energy: 1.1035922521921215
Energy: 1.0811759980569735
Energy: 1.1035922521921215
Energy: 1.1065291171979046
Energy: 1.4552278497113342
Energy: 1.1065291172014218
Energy: 1.4552278497129134
Energy: 1.1065291172014218
Energy: 1.4552278497125546
Energy: 1.234969050057589
Energy: 1.129571198993679
Energy: 1.2349690500567994
Energy: 1.129571198993679
Energy: 1.2349690500567994
Energy: 1.1295711989941097
Energy: 1.1906200053402272
Energy: 1.082075728425772
Energy: 1.1906200053414477
Energy: 1.0820757284253415
Energy: 1.1906200053402272
Energy: 1.0820757284249825
Energy: 1.1237040880092748
Energy: 1.139291714590518
Energy: 1.123704088009634
Energy: 1.1392917145881492
Energy: 1.123704088009634
Energy: 1.139291714588939
Energy: 1.090843273221776
Energy: 1.5077902239042622
Energy: 1.0908432732206277
Energy: 1.5077902239042622
Energy: 1.0908432732206277
Energy: 1.5077902239039034
Energy: 1.1465379206365187
Energy: 1.070545896294122
Energy: 1.1465379206357291
Energy: 1.0705458962937628
Energy: 1.1465379206361594
Energy: 1.0705458962937628
Energy: 1.104328804242829
Energy: 1.6989981507652618
Energy: 1.10432880424247
Energy: 1.6989981507644725
Energy: 1.104328804242829
Energy: 1.6989981507652618
Energy: 1.6804904144668402
Energy: 1.1307335428045875
Energy: 1.6804904144672708
Energy: 1.130733542804157
Energy: 1.6804904144672708
Energy: 1.130733542804157
Energy: 1.1786668229575756
Energy: 1.2166135042534192
Energy: 1.1786668229579347
Energy: 1.216613504253778
Energy: 1.1786668229587243
Energy: 1.216613504253778
Energy: 1.1784586301122677
Energy: 1.2166624965563562
Energy: 1.1784586301134161
Energy: 1.2166624965559254
Energy: 1.1784586301130573
Energy: 1.2166624965563562
Energy: 1.6801021043063193
Energy: 1.130720214732368
Energy: 1.6801021043067499
Energy: 1.1307202147315782
Energy: 1.6801021043071087
Energy: 1.130720214732368
Energy: 1.1044343853806668
Energy: 1.698918085457004
Energy: 1.1044343853810976
Energy: 1.6989180854577934
Energy: 1.1044343853810976
Energy: 1.6989180854574344
Energy: 1.1469807381276402
Energy: 1.0708106259157466
Energy: 1.1469807381276402
Energy: 1.0708106259165362
Energy: 1.1469807381272814
Energy: 1.0708106259165362
Energy: 1.0907819467928672
Energy: 1.508143427176798
Energy: 1.0907819467920776
Energy: 1.5081434271779464
Energy: 1.0907819467920776
Energy: 1.5081434271783771
Energy: 1.1237738398247479
Energy: 1.1397368316469407
Energy: 1.1237738398243173
Energy: 1.1397368316513192
Energy: 1.1237738398235275
Energy: 1.1397368316528986
Energy: 1.190637904638596
Energy: 1.072730710584071
Energy: 1.1906379046350786
Energy: 1.07273071058443
Energy: 1.1906379046378064
Energy: 1.0727307105848607
Energy: 1.2345936519688498
Energy: 1.1294849579673591
Energy: 1.2345936519684189
Energy: 1.1294849579669288
Energy: 1.2345936519688498
Energy: 1.1294849579677184
Energy: 1.1064004294965164
Energy: 1.4551173404313689
Energy: 1.1064004294965164
Energy: 1.4551173404313689
Energy: 1.1064004294965164
Energy: 1.4551173404313689
Energy: 1.0743724533113406
Energy: 1.1035390671306178
Energy: 1.0743724533077514
Energy: 1.1035390671317662
Energy: 1.0743724533066026
Energy: 1.1035390671314074
Energy: 1.1045152712666335
Energy: 1.4377276338066307
Energy: 1.1045152712634752
Energy: 1.4377276338069898
Energy: 1.1045152712658437
Energy: 1.4377276338066307
Energy: 1.215056250532523
Energy: 1.3901835119712955
Energy: 1.2150562505333127
Energy: 1.390183511971726
Energy: 1.2150562505321643
Energy: 1.3901835119720851
Energy: 1.0562495889782888
Energy: 1.2384479476601602
Energy: 1.0562495889771404
Energy: 1.2384479476574326
Energy: 1.0562495889767098
Energy: 1.2384479476598014

minimum gb energy = 1.0559610120537568 eV
minimum distance =  2.32304652232416 Angstroms
sigma value = 67


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

Energy: 1.1841330871262106
Energy: 1.1175784490185603
Energy: 1.1841330871262106
Energy: 1.1175784490185603
Energy: 1.1841330871288491
Energy: 1.1175784490185603
Energy: 1.1047578693867859
Energy: 1.0850239812211318
Energy: 1.1047578693867859
Energy: 1.0850239812211318
Energy: 1.1047578693867859
Energy: 1.0850239812211318
Energy: 1.6841086118160276
Energy: 1.4351986790053715
Energy: 1.6841086118160276
Energy: 1.43519867900801
Energy: 1.6841086118186663
Energy: 1.4351986790053715
Energy: 1.1047966191900218
Energy: 1.085028803628382
Energy: 1.1047966191900218
Energy: 1.085028803628382
Energy: 1.1047966191900218
Energy: 1.085028803628382
Energy: 1.1841330871288491
Energy: 1.1175784490185603
Energy: 1.1841330871288491
Energy: 1.1175784490185603
Energy: 1.1841330871288491
Energy: 1.1175784490185603
Energy: 1.1047578693867859
Energy: 1.0850239812184932
Energy: 1.1047578693867859
Energy: 1.0850239812184932
Energy: 1.1047578693867859
Energy: 1.0850239812184932
Energy: 1.0605112240089152
Energy: 1.43519867900801
Energy: 1.0595800468926693
Energy: 1.43519867900801
Energy: 1.4292623882334872
Energy: 1.43519867900801

minimum gb energy = 1.0595800468926693 eV
minimum distance =  2.34067825537462 Angstroms
sigma value = 3


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

Energy: 1.6823445259912513
Energy: 1.2684346052045508
Energy: 1.6823445259912513
Energy: 1.2684346052045508
Energy: 1.6823445259912513
Energy: 1.2684346052045508
Energy: 1.3901414324040544
Energy: 1.2371428775159674
Energy: 1.3901414324040544
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Energy: 1.3678551040389832
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Energy: 1.5462508393961765
Energy: 1.3732125297816478
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Energy: 1.5462508393925858
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Energy: 1.368712232232001
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Energy: 1.368712232232001
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Energy: 1.3687122322284102
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Energy: 1.5265487840671912
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Energy: 1.5265487840671912
Energy: 1.538571186930582
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Energy: 1.3749572598961382
Energy: 1.538571186930582
Energy: 1.3749572598961382
Energy: 1.261620813532357
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Energy: 1.318179837713433
Energy: 1.261620813532357
Energy: 1.318179837713433
Energy: 1.34051748123867
Energy: 1.6480589138891144
Energy: 1.3405174812351446
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Energy: 1.1926450686041818
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Energy: 1.2811350935180468
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Energy: 1.2811350935216375
Energy: 1.4283685315214372
Energy: 1.5186487838672842
Energy: 1.3626709120183897
Energy: 1.5186487838672842
Energy: 1.3626709120183897
Energy: 1.5186487838672842
Energy: 1.3626709120183897
Energy: 1.2285809132968881
Energy: 1.1885476585478973
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Energy: 1.2285809132754093
Energy: 1.1885476585478973
Energy: 1.3656030701578734
Energy: 1.3266353347247775
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Energy: 1.3266353347247775
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Energy: 1.3266353347247775
Energy: 1.4349699022497404
Energy: 1.270210625956743
Energy: 1.4349699022533309
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Energy: 1.4349699022533309
Energy: 1.270210625956743
Energy: 1.6238050023413684
Energy: 1.3469338459636864
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Energy: 1.235255487672562
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Energy: 1.235255487672562
Energy: 1.4210506638789375
Energy: 1.3170293007678044
Energy: 1.4210506638789375
Energy: 1.3170293007713951
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Energy: 1.3170293007678044
Energy: 1.500800918006516
Energy: 1.3418529719765433
Energy: 1.500800918006516
Energy: 1.3418529719765433
Energy: 1.500800918006516
Energy: 1.3418529719729526
Energy: 1.447422051868024
Energy: 1.3488505971782225
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Energy: 1.3488505971782225
Energy: 1.4474220518716148
Energy: 1.3488505971782225
Energy: 1.3730346498830044
Energy: 1.635473574638071
Energy: 1.3730346498830044
Energy: 1.635473574638071
Energy: 1.3730346498830044
Energy: 1.635473574638071
Energy: 1.194649201750307
Energy: 1.3785352453596196
Energy: 1.1946492017431256
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Energy: 1.1946492017467163
Energy: 1.3785352453596196
Energy: 1.6226708513710801
Energy: 1.262493136770062
Energy: 1.6226708513710801
Energy: 1.262493136770062
Energy: 1.6226708513710801
Energy: 1.262493136770062
Energy: 1.2344979385801338
Energy: 1.5562314560369561
Energy: 1.2344979385801338
Energy: 1.5562314560369561
Energy: 1.2344979385801338
Energy: 1.5562314560369561
Energy: 1.3604500902177794
Energy: 1.6361701384850735
Energy: 1.3604500902177794
Energy: 1.6361701384850735
Energy: 1.3604500902177794
Energy: 1.6361701384850735
Energy: 1.2638153933758418
Energy: 1.4004348238118913
Energy: 1.2638153933758418
Energy: 1.4004348238118913
Energy: 1.2638153933758418
Energy: 1.4004348238118913
Energy: 1.7115636980149151
Energy: 1.1899926431794527
Energy: 1.7115636980149151
Energy: 1.1899926431794527
Energy: 1.7115636980149151
Energy: 1.1899926431794527
Energy: 1.2443602994987026
Energy: 1.6688117615587594
Energy: 1.2443602994987026
Energy: 1.6688117615587594
Energy: 1.2443602994987026
Energy: 1.6688117615587594
Energy: 1.5054638825060318
Energy: 1.2356627759000824
Energy: 1.5054638825060318
Energy: 1.2356627759000824
Energy: 1.5054638825060318
Energy: 1.2356627759000824
Energy: 1.6255547493947042
Energy: 1.318605637680096
Energy: 1.6255547493947042
Energy: 1.3186056376836865
Energy: 1.6255547493947042
Energy: 1.318605637680096
Energy: 1.6341324987133097
Energy: 1.2654574191770358
Energy: 1.6341324987133097
Energy: 1.2654574191770358
Energy: 1.6341324987133097
Energy: 1.2654574191770358
Energy: 1.3284064928877277
Energy: 1.3954113571388227
Energy: 1.3284064928877277
Energy: 1.3954113571388227
Energy: 1.3284064928877277
Energy: 1.3954113571388227
Energy: 1.3218814204310234
Energy: 1.244311459068588
Energy: 1.3218814204310234
Energy: 1.244311459068588
Energy: 1.3218814204310234
Energy: 1.244311459068588
Energy: 1.2638857774830563
Energy: 1.4297884871063193
Energy: 1.2638857774794656
Energy: 1.4297884871063193
Energy: 1.2638857774794656
Energy: 1.4297884871063193
Energy: 1.4705165035863739
Energy: 1.4016439305139712
Energy: 1.4705165035863739
Energy: 1.4016439305139712
Energy: 1.4705165035899643
Energy: 1.4016439305139712
Energy: 1.3611511777360432
Energy: 1.4628166975910557
Energy: 1.3611511777360432
Energy: 1.4628166975910557
Energy: 1.3611511777360432
Energy: 1.4628166975910557

minimum gb energy = 1.1885476585478973 eV
minimum distance =  2.2745746959529 Angstroms
sigma value = 81


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

Energy: 1.3212048292836025
Energy: 1.2860389636655285
Energy: 1.3212048292831098
Energy: 1.2860389636655285
Energy: 1.3212048292836025
Energy: 1.2860389636655285
Energy: 1.1950701671623374
Energy: 1.2981328021590077
Energy: 1.1950701671638158
Energy: 1.2981328021599934
Energy: 1.1950701671638158
Energy: 1.2981328021599934
Energy: 1.5678543318816012
Energy: 1.596350401924855
Energy: 1.5678543318816012
Energy: 1.596350401924855
Energy: 1.5678543318820939
Energy: 1.596350401924855
Energy: 1.2737718684985972
Energy: 1.4049110737155135
Energy: 1.2737718684990902
Energy: 1.4049110737174848
Energy: 1.2737718684990902
Energy: 1.4049110737155135
Energy: 1.265414036017655
Energy: 1.1953224688240371
Energy: 1.2654140360181476
Energy: 1.19532246882453
Energy: 1.265414036017655
Energy: 1.1953224688250228
Energy: 1.1947734535717294
Energy: 1.1921753426290536
Energy: 1.1947734535712364
Energy: 1.1921753426295465
Energy: 1.1947734535717294
Energy: 1.1921753426285608
Energy: 1.1718506000103295
Energy: 1.1925082467871124
Energy: 1.1718506000093438
Energy: 1.192508246788098
Energy: 1.1718506000093438
Energy: 1.1925082467871124
Energy: 1.2671476500905692
Energy: 1.19731045420369
Energy: 1.2671476500915548
Energy: 1.1973104542046757
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Energy: 1.19731045420369
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Energy: 1.4661965744874812
Energy: 1.4024900480495508
Energy: 1.4661965744869883
Energy: 1.4024900480485651
Energy: 1.3457784731861664
Energy: 1.7510345276003683
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Energy: 1.3457784731861664
Energy: 1.7510345276003683
Energy: 1.1946838962249298
Energy: 1.1700444708093558
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Energy: 1.170044470808863
Energy: 1.194683896224437
Energy: 1.170044470808863
Energy: 1.1924793862899763
Energy: 1.1950738533790015
Energy: 1.192479386290962
Energy: 1.1950738533794942
Energy: 1.1924793862963827
Energy: 1.1950738533794942
Energy: 1.1953666635932412
Energy: 1.2839520379635603
Energy: 1.1953666635937341
Energy: 1.2839520379635603
Energy: 1.1953666635932412
Energy: 1.2839520379635603
Energy: 1.4042072155488972
Energy: 1.5977781361893493
Energy: 1.4042072155484042
Energy: 1.5977781361889014
Energy: 1.4042072155479115
Energy: 1.5977781361889014
Energy: 1.5979137478707823
Energy: 1.1713034331104104
Energy: 1.5979137478702896
Energy: 1.1713034331104104
Energy: 1.5979137478712753
Energy: 1.1713034331109033
Energy: 1.2668547025501946
Energy: 1.1951009328266768
Energy: 1.2668547025511803
Energy: 1.195100932826184
Energy: 1.266854702552166
Energy: 1.1951009328266768
Energy: 1.2887152349605564
Energy: 1.192022549733412
Energy: 1.2887152349600635
Energy: 1.192022549733412
Energy: 1.2887152349600635
Energy: 1.192022549733412
Energy: 1.168580756637731
Energy: 1.274025647121112
Energy: 1.168580756637731
Energy: 1.274025647121112
Energy: 1.1685807566392097
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Energy: 1.1942877970648513
Energy: 1.572080024074342
Energy: 1.1942877970623873
Energy: 1.572080024074835
Energy: 1.1942877970643584
Energy: 1.572080024074835
Energy: 1.4026121615714235
Energy: 1.469074363443159
Energy: 1.4026121615694522
Energy: 1.469074363442666
Energy: 1.4026121615704379
Energy: 1.469074363442666
Energy: 1.1956142531189213
Energy: 1.2836744174462582
Energy: 1.1956142531189213
Energy: 1.2836744174462582
Energy: 1.1956142531194143
Energy: 1.2836744174462582
Energy: 1.1917990996071068
Energy: 1.17475145463193
Energy: 1.1917990996071068
Energy: 1.1747514546314373
Energy: 1.1917990996056285
Energy: 1.1747514546314373
Energy: 1.1917483193891945
Energy: 1.1748594700112942
Energy: 1.1917483193891945
Energy: 1.1748594700112942
Energy: 1.1917483193896874
Energy: 1.1748594700112942
Energy: 1.195614417857812
Energy: 1.2703321506987064
Energy: 1.1956144178573194
Energy: 1.2703321506982135
Energy: 1.195614417857812
Energy: 1.2703321506987064
Energy: 1.4027079866408791
Energy: 1.4689560886320312
Energy: 1.4027079866403864
Energy: 1.468956088632524
Energy: 1.4027079866408791
Energy: 1.468956088632524
Energy: 1.1941818601735437
Energy: 1.5720653527671755
Energy: 1.1941818601745293
Energy: 1.5720653527666828
Energy: 1.1941818601760077
Energy: 1.5720653527671755
Energy: 1.1687304453210248
Energy: 1.273827572791249
Energy: 1.1687304453215177
Energy: 1.2738275727917419
Energy: 1.1687304453210248
Energy: 1.273827572791249
Energy: 1.2972264915785254
Energy: 1.1919046544381777
Energy: 1.2972264915790181
Energy: 1.1919046544381777
Energy: 1.2972264915780325
Energy: 1.1919046544386704
Energy: 1.2669964365604585
Energy: 1.1951307730507819
Energy: 1.2669964365609514
Energy: 1.1951307730507819
Energy: 1.2669964365614441
Energy: 1.1951307730512746
Energy: 1.5979841016640293
Energy: 1.1714422396472783
Energy: 1.597984101664522
Energy: 1.1714422396472783
Energy: 1.5979841016640293
Energy: 1.1714422396472783
Energy: 1.4041737818052997
Energy: 1.5976166345161602
Energy: 1.4041737818057924
Energy: 1.5976166345161602
Energy: 1.4041737818052997
Energy: 1.5976166345161602
Energy: 1.1951066676028814
Energy: 1.28397161800069
Energy: 1.19510666760436
Energy: 1.28397161800069
Energy: 1.19510666760436
Energy: 1.283971618000197
Energy: 1.192328007460872
Energy: 1.1951067026942752
Energy: 1.192328007460872
Energy: 1.1951067026942752
Energy: 1.1923280074618576
Energy: 1.195106702694768
Energy: 1.194563809562428
Energy: 1.1698762271497205
Energy: 1.1945638095639066
Energy: 1.1698762271492278
Energy: 1.194563809562428
Energy: 1.1698762271497205
Energy: 1.345787104016226
Energy: 1.7508007192842128
Energy: 1.3457871040147475
Energy: 1.7508007192847055
Energy: 1.345787104015733
Energy: 1.75080071928372
Energy: 1.4662044236938638
Energy: 1.4025633388946663
Energy: 1.4662044236938638
Energy: 1.4025633388946663
Energy: 1.4662044236948495
Energy: 1.4025633388941734
Energy: 1.2668448851661167
Energy: 1.1973028371722307
Energy: 1.2668448851656238
Energy: 1.1973028371727237
Energy: 1.2668448851661167
Energy: 1.1973028371727237
Energy: 1.1719038415390497
Energy: 1.1923148945589126
Energy: 1.171903841538557
Energy: 1.1923148945594055
Energy: 1.171903841538557
Energy: 1.1923148945589126

minimum gb energy = 1.168580756637731 eV
minimum distance =  2.37399758301551 Angstroms
sigma value = 43


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

Energy: 1.5389347835730653
Energy: 1.29158796901337
Energy: 1.5389347835730653
Energy: 1.29158796901337
Energy: 1.5389347835730653
Energy: 1.29158796901337
Energy: 1.427533319014627
Energy: 1.224832196613459
Energy: 1.427533319014627
Energy: 1.224832196613459
Energy: 1.427533319014627
Energy: 1.224832196613459
Energy: 1.4605494370767753
Energy: 1.5916676367688876
Energy: 1.381649092925224
Energy: 1.5916676367688876
Energy: 1.4605494370773804
Energy: 1.5916676367688876
Energy: 1.517075360285241
Energy: 1.2762939717991548
Energy: 1.517075360285241
Energy: 1.2762939717991548
Energy: 1.517075360285241
Energy: 1.2762939717991548
Energy: 1.3388825386136203
Energy: 1.3159705067983969
Energy: 1.3388825386136203
Energy: 1.3159705067983969
Energy: 1.3388825386136203
Energy: 1.3159705067983969
Energy: 1.3815849432417435
Energy: 1.312822488341423
Energy: 1.3815849432423488
Energy: 1.3128224883408175
Energy: 1.3815849432423488
Energy: 1.312822488341423
Energy: 1.395632490578213
Energy: 1.4724681595373526
Energy: 1.395632490578213
Energy: 1.4724681595373526
Energy: 1.3956324905770021
Energy: 1.4724681595373526
Energy: 1.2701897573205168
Energy: 1.3738704747672108
Energy: 1.2701897573205168
Energy: 1.3738704747672108
Energy: 1.2701897573187007
Energy: 1.3738704747672108
Energy: 1.435829656070557
Energy: 1.3976063043966833
Energy: 1.435829656070557
Energy: 1.3976063043966833
Energy: 1.435829656070557
Energy: 1.3976063043966833
Energy: 1.2694950509784249
Energy: 1.5048206930687056
Energy: 1.2694950509802407
Energy: 1.5048206930687056
Energy: 1.2694950509796354
Energy: 1.5048206930687056
Energy: 1.5807666044473507
Energy: 1.320630786287493
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Energy: 1.3206307862868878
Energy: 1.5807666044473507
Energy: 1.320630786287493
Energy: 1.2696589663558757
Energy: 1.3371017594364936
Energy: 1.2696589663564812
Energy: 1.3371017593983852
Energy: 1.2696589663558757
Energy: 1.337101759235606
Energy: 1.3751030882549593
Energy: 1.3127037081053896
Energy: 1.3751030882549593
Energy: 1.3127037081053896
Energy: 1.3751030882555646
Energy: 1.3127037081053896
Energy: 1.2027021056541896
Energy: 1.5338705465051965
Energy: 1.2027021056523735
Energy: 1.5338705465051965
Energy: 1.202702105653584
Energy: 1.5338705465051965
Energy: 1.452423027868934
Energy: 1.3203643327894719
Energy: 1.452423027868934
Energy: 1.3203643327894719
Energy: 1.452423027868934
Energy: 1.3203643327894719
Energy: 1.4726276590550147
Energy: 1.3758719883382982
Energy: 1.4726276590544094
Energy: 1.3758719883382982
Energy: 1.4726276590544094
Energy: 1.3758719883382982
Energy: 1.3886431236805434
Energy: 1.2261914403147052
Energy: 1.388643123681754
Energy: 1.2261914403147052
Energy: 1.3886431236811487
Energy: 1.2261914403147052
Energy: 1.5037934549948504
Energy: 1.2962424009273195
Energy: 1.5037934549948504
Energy: 1.2962424009273195
Energy: 1.5037934549948504
Energy: 1.2962424009267142
Energy: 1.4569440456900185
Energy: 1.4098130889426381
Energy: 1.4569440456900185
Energy: 1.4098130889426381
Energy: 1.4569440456900185
Energy: 1.4098130889426381
Energy: 1.3886155351494436
Energy: 1.4244616605984621
Energy: 1.3886155351494436
Energy: 1.4244616605978568
Energy: 1.3886155351494436
Energy: 1.4244616605984621
Energy: 1.29649814760366
Energy: 1.4214295118599363
Energy: 1.2964981476030544
Energy: 1.4214295118599363
Energy: 1.29649814760366
Energy: 1.4214295118599363
Energy: 1.4636485201915654
Energy: 1.3522424715256882
Energy: 1.4636485201915654
Energy: 1.3522424715256882
Energy: 1.4636485201915654
Energy: 1.3522424715256882
Energy: 1.2032415152159333
Energy: 1.452275111066689
Energy: 1.2032415152159333
Energy: 1.452275111066689
Energy: 1.2032415152159333
Energy: 1.452275111066689
Energy: 1.3797337063644228
Energy: 1.4865694776848284
Energy: 1.3797337063638173
Energy: 1.4865694776854337
Energy: 1.3797337063638173
Energy: 1.4865694776854337
Energy: 1.2692613952621288
Energy: 1.2721377148409332
Energy: 1.2692613952615235
Energy: 1.2721377148403281
Energy: 1.2692613952615235
Energy: 1.2721377148409332
Energy: 1.5446059353545551
Energy: 1.3688250573621545
Energy: 1.5446059353545551
Energy: 1.3688250573615492
Energy: 1.54460593535395
Energy: 1.3688250573615492
Energy: 1.2690623515845765
Energy: 1.4301074740298458
Energy: 1.2690623515845765
Energy: 1.4301074740298458
Energy: 1.2690623515839712
Energy: 1.4301074740298458
Energy: 1.435244306024872
Energy: 1.3204748829601451
Energy: 1.4352443060242668
Energy: 1.3204748829601451
Energy: 1.435244306024872
Energy: 1.3204748829601451
Energy: 1.2690122660040581
Energy: 1.3729470856438193
Energy: 1.2690122660040581
Energy: 1.3729470856432138
Energy: 1.269012266005269
Energy: 1.3729470856432138
Energy: 1.3577244931918822
Energy: 1.3897756869000661
Energy: 1.3577244931924877
Energy: 1.3897756869000661
Energy: 1.3577244931912769
Energy: 1.3897756869006714
Energy: 1.4001202641315857
Energy: 1.3127229770358226
Energy: 1.4001202641315857
Energy: 1.3127229770352171
Energy: 1.4001202641315857
Energy: 1.3127229770352171

minimum gb energy = 1.2027021056523735 eV
minimum distance =  2.32100874883908 Angstroms
sigma value = 57


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

Energy: 1.462418010959478
Energy: 1.2920601909665403
Energy: 1.3789020188509529
Energy: 1.292060190967324
Energy: 1.4624180109586942
Energy: 1.2920601909665403
Energy: 1.4067352550035692
Energy: 1.2359980940332522
Energy: 1.406735255002002
Energy: 1.235998094034036
Energy: 1.406735255002002
Energy: 1.235998094034036
Energy: 1.4939080659357666
Energy: 1.4566748878347975
Energy: 1.4351721164714697
Energy: 1.4566748878355813
Energy: 1.493908065934983
Energy: 1.4566748878355813
Energy: 1.6801568458469875
Energy: 1.4083007853042369
Energy: 1.6801568458477711
Energy: 1.4083007853050207
Energy: 1.6801568458485547
Energy: 1.4083007853050207
Energy: 1.7046143372512605
Energy: 1.3263615657390682
Energy: 1.7046143372496931
Energy: 1.3263615657398518
Energy: 1.7046143372489095
Energy: 1.3263615657398518
Energy: 1.4846890525951515
Energy: 1.2356261769082841
Energy: 1.4846890525951515
Energy: 1.235626176909068
Energy: 1.4846890525943677
Energy: 1.2356261769082841
Energy: 1.4506744150755224
Energy: 1.494648602902629
Energy: 1.4506744150763062
Energy: 1.494648602902629
Energy: 1.45067441507709
Energy: 1.494648602902629
Energy: 1.3797564143964056
Energy: 1.2933761842132825
Energy: 1.3797564143964056
Energy: 1.2933761842124984
Energy: 1.3797564143964056
Energy: 1.2933761842124984
Energy: 1.457102472790143
Energy: 1.2387201161605497
Energy: 1.4571024727893593
Energy: 1.2387201161589825
Energy: 1.4571024727885755
Energy: 1.2387201161589825
Energy: 1.2280818394555513
Energy: 1.3060754825350878
Energy: 1.2280824924633496
Energy: 1.3060754825350878
Energy: 1.2280818394539836
Energy: 1.306075482534304
Energy: 1.3547462216670636
Energy: 1.409656190358262
Energy: 1.3547462216686312
Energy: 1.4096561903598293
Energy: 1.3547462216694148
Energy: 1.4096561903598293
Energy: 1.5902469418666327
Energy: 1.515751762763046
Energy: 1.5902469418650655
Energy: 1.5157517627646133
Energy: 1.5902469418658491
Energy: 1.5157517627646133
Energy: 1.4077775748713872
Energy: 1.2386573844965438
Energy: 1.4077775748729546
Energy: 1.2386573844957605
Energy: 1.4077775748729546
Energy: 1.2386573844957605
Energy: 1.4475314548909606
Energy: 1.2446686197838503
Energy: 1.4598340828463823
Energy: 1.2446686197845984
Energy: 1.4475314548909606
Energy: 1.2446686197838503
Energy: 1.449650485004335
Energy: 1.40082585732654
Energy: 1.3428946467517837
Energy: 1.40082585732654
Energy: 1.449650485003551
Energy: 1.4008258573257564
Energy: 1.4278969171121463
Energy: 1.3485512545642013
Energy: 1.4278969171121463
Energy: 1.3485512545618499
Energy: 1.4278969171113627
Energy: 1.3485512545634177
Energy: 1.2276284367650279
Energy: 1.3019486208421145
Energy: 1.2276880309217368
Energy: 1.3019486208428983
Energy: 1.2276284367650279
Energy: 1.3019486208428983
Energy: 1.3520117788699626
Energy: 1.1631130281311435
Energy: 1.3520117788699626
Energy: 1.1631130281311435
Energy: 1.3520117788691788
Energy: 1.1631130281319275
Energy: 1.2275871596674517
Energy: 1.3020043716212506
Energy: 1.2275871596682357
Energy: 1.3020043716220346
Energy: 1.2275871596674517
Energy: 1.3020043716220346
Energy: 1.4935626476697539
Energy: 1.3484386789314873
Energy: 1.49356264766897
Energy: 1.3484386789314873
Energy: 1.4935626476681867
Energy: 1.3484386789307037
Energy: 1.34247232837719
Energy: 1.2420085473278777
Energy: 1.3424723283764064
Energy: 1.2420085473278777
Energy: 1.34247232837719
Energy: 1.2420085473278777
Energy: 1.4596075283226582
Energy: 1.4583129754106072
Energy: 1.4596075283218741
Energy: 1.4583129754113913
Energy: 1.4596075283226582
Energy: 1.4583129754113913
Energy: 1.491921749397661
Energy: 1.2353838176185603
Energy: 1.4922411880666684
Energy: 1.235383817616993
Energy: 1.491921749398445
Energy: 1.2353838176177767
Energy: 1.5703622436196674
Energy: 1.4656236390902941
Energy: 1.570409640920487
Energy: 1.465623639091078
Energy: 1.570362243621235
Energy: 1.465623639091078

minimum gb energy = 1.1631130281311435 eV
minimum distance =  2.27138708897292 Angstroms
sigma value = 17


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

Energy: 1.6471131038069806
Energy: 1.1809197340744835
Energy: 1.6471131038069806
Energy: 1.1809197340744835
Energy: 1.6471131038069806
Energy: 1.1809197340744835
Energy: 1.3207298486402912
Energy: 1.2746947153826338
Energy: 1.3207298486402912
Energy: 1.2746947153826338
Energy: 1.3207298486402912
Energy: 1.2746947153826338
Energy: 1.3471507479477074
Energy: 1.3212477242425567
Energy: 1.3471507479477074
Energy: 1.3212477242414482
Energy: 1.3471507479477074
Energy: 1.3212477242414482
Energy: 1.316479391593284
Energy: 1.283843298272915
Energy: 1.316479391593284
Energy: 1.283843298272915
Energy: 1.316479391593284
Energy: 1.283843298272915
Energy: 1.298449934622968
Energy: 1.4715566999820282
Energy: 1.298449934622968
Energy: 1.4715566999820282
Energy: 1.298449934622968
Energy: 1.4715566999820282
Energy: 1.2079856015297787
Energy: 1.2825355680479535
Energy: 1.2079856015297787
Energy: 1.2825355680479535
Energy: 1.2079856015297787
Energy: 1.2825355680479535
Energy: 1.2774127067976122
Energy: 1.3301903627960532
Energy: 1.2774127067976122
Energy: 1.3301903627960532
Energy: 1.2774127067987207
Energy: 1.3301903627971616
Energy: 1.3165202395922
Energy: 1.3047001289809546
Energy: 1.3165202395922
Energy: 1.3047001289809546
Energy: 1.3165202395933084
Energy: 1.3047001289809546
Energy: 1.244779940859035
Energy: 1.1255156852072683
Energy: 1.244779940859035
Energy: 1.1255156852072683
Energy: 1.244779940859035
Energy: 1.1255156852072683
Energy: 1.1824467852647313
Energy: 1.2582788239194225
Energy: 1.1824467852614062
Energy: 1.2582788239205307
Energy: 1.1824467852647313
Energy: 1.2582788239205307
Energy: 1.2018159949928011
Energy: 1.2934267822411634
Energy: 1.2018159949928011
Energy: 1.2934267822411634
Energy: 1.2018159949928011
Energy: 1.2934267822411634
Energy: 1.2623367116911874
Energy: 1.255742008448556
Energy: 1.2623367116911874
Energy: 1.2557420084496644
Energy: 1.2623367116911874
Energy: 1.2557420084496644
Energy: 1.0693492588096087
Energy: 1.2825901373366688
Energy: 1.0693492588096087
Energy: 1.2825901373366688
Energy: 1.0693492588096087
Energy: 1.2825901373366688
Energy: 1.20242499136079
Energy: 1.2827732052556322
Energy: 1.20242499136079
Energy: 1.2827732052556322
Energy: 1.20242499136079
Energy: 1.2827732052556322
Energy: 1.207650434326601
Energy: 1.4526779158874668
Energy: 1.207650434326601
Energy: 1.4526779158874668
Energy: 1.207650434326601
Energy: 1.4526779158874668
Energy: 1.20698336313052
Energy: 1.4992664354471752
Energy: 1.2069833631316285
Energy: 1.4992664354449583
Energy: 1.20698336313052
Energy: 1.4992664354449583
Energy: 1.1996266394313302
Energy: 1.2826695689828083
Energy: 1.1996266394313302
Energy: 1.2826695689828083
Energy: 1.1996266394313302
Energy: 1.2826695689828083

minimum gb energy = 1.0693492588096087 eV
minimum distance =  2.31537487653842 Angstroms
sigma value = 17


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

Energy: 1.2372210713506324
Energy: 1.1053251328173372
Energy: 1.1959302286669506
Energy: 1.1053251328177265
Energy: 1.2372210713540566
Energy: 1.1053251328181546
Energy: 1.3236944709906715
Energy: 1.156554258363073
Energy: 1.2778794890824983
Energy: 1.1565542583592208
Energy: 1.3236944709915275
Energy: 1.156554258360077
Energy: 1.2688083538681656
Energy: 1.2509131667941218
Energy: 1.256834511745735
Energy: 1.2509131667932658
Energy: 1.2688083538681656
Energy: 1.2509131667941218
Energy: 1.1501079954113236
Energy: 1.1669179796321374
Energy: 1.158473908213471
Energy: 1.166946767136373
Energy: 1.1501079954091835
Energy: 1.1669179796338496
Energy: 1.5142913475260766
Energy: 1.17175544430964
Energy: 1.5142913475260766
Energy: 1.17175544430964
Energy: 1.5142913475269324
Energy: 1.171755444308356
Energy: 1.2055390170912599
Energy: 1.120481930946971
Energy: 1.2051317820993108
Energy: 1.1168943938890783
Energy: 1.2055390170916878
Energy: 1.1204819309444027
Energy: 1.0811248500798565
Energy: 1.1264751615355748
Energy: 1.0811248500790003
Energy: 1.1264751615360027
Energy: 1.0811248500790003
Energy: 1.1264751615360027
Energy: 1.43271078484086
Energy: 1.3478305582981593
Energy: 1.432710784841288
Energy: 1.3478305582955914
Energy: 1.432710784840004
Energy: 1.347830558294735
Energy: 1.1210507365138282
Energy: 1.1345144169089145
Energy: 1.1210507365138282
Energy: 1.1345144169127668
Energy: 1.1210507365138282
Energy: 1.134514416913623
Energy: 1.0824692413830126
Energy: 1.0144556879465718
Energy: 1.0824692413847248
Energy: 1.0144556879457156
Energy: 1.0824692413851529
Energy: 1.0144556879465718
Energy: 1.0339117792228667
Energy: 1.3160995622937746
Energy: 1.0339117792228667
Energy: 1.3160995622946305
Energy: 1.0339117792232948
Energy: 1.3160995622946305
Energy: 1.223668300205615
Energy: 1.2930150371098275
Energy: 1.223668300206899
Energy: 1.2930150371076872
Energy: 1.223668300204759
Energy: 1.2930150371076872
Energy: 1.2949187445089114
Energy: 1.2788587733965904
Energy: 1.2949187445071995
Energy: 1.2788587733983023
Energy: 1.2949187445110517
Energy: 1.2788587733978745
Energy: 1.2662095306058525
Energy: 1.2277918582470542
Energy: 1.2662095306062804
Energy: 1.227791858244486
Energy: 1.2662095306067085
Energy: 1.227791858244486
Energy: 1.2297434495531876
Energy: 1.290899577256731
Energy: 1.2300232479743078
Energy: 1.290899577255019
Energy: 1.2297231980867533
Energy: 1.290899577255019
Energy: 1.1388560474239908
Energy: 1.2529198452586638
Energy: 1.139259012796699
Energy: 1.2529198452586638
Energy: 1.1388560474261311
Energy: 1.2529198452582355
Energy: 1.1010548019766346
Energy: 1.2129857912452267
Energy: 1.1010548019753505
Energy: 1.2129857912452267
Energy: 1.1010548019757789
Energy: 1.2129857912452267
Energy: 1.1980661765834433
Energy: 1.39431674966971
Energy: 1.1980661765838714
Energy: 1.3943167496701383
Energy: 1.198066176578735
Energy: 1.39431674966971
Energy: 1.1049454203262241
Energy: 1.5145488354524232
Energy: 1.1049454203266522
Energy: 1.5145488354515673
Energy: 1.1049454203296483
Energy: 1.5145488354511392
Energy: 1.1000222129450927
Energy: 0.9842464907987857
Energy: 1.1000222129446646
Energy: 0.9842464907957894
Energy: 1.1000222129438086
Energy: 0.9842464907957894
Energy: 1.1472225867506767
Energy: 1.4908306283157422
Energy: 1.1472225867532448
Energy: 1.490830628314886
Energy: 1.1472225867523889
Energy: 1.490830628315314
Energy: 1.145565473126262
Energy: 1.394380665656364
Energy: 1.145565473125406
Energy: 1.3943806656585043
Energy: 1.14556547312669
Energy: 1.3943806656580762
Energy: 1.1010986292674432
Energy: 1.15923025172133
Energy: 1.1010986292661589
Energy: 1.159230251720046
Energy: 1.1010986292653027
Energy: 1.159230251719618
Energy: 1.2426903600348276
Energy: 1.204884134609188
Energy: 1.2426903600339714
Energy: 1.2048841346121844
Energy: 1.2426903600331154
Energy: 1.2048841346113284
Energy: 1.196126894308185
Energy: 1.2114199935841738
Energy: 1.1961268943086132
Energy: 1.2114199935841738
Energy: 1.196126894308185
Energy: 1.211419993583746
Energy: 1.2934260467349206
Energy: 1.233187730417748
Energy: 1.2662054114643808
Energy: 1.233187730415608
Energy: 1.2934260467353487
Energy: 1.23318773041518
Energy: 1.3058094902667987
Energy: 1.2687566319815007
Energy: 1.2658321819180407
Energy: 1.2687566319802164
Energy: 1.3058094902667987
Energy: 1.2687566319797887
Energy: 1.2688852695512525
Energy: 1.303582790484739
Energy: 1.2029018470754018
Energy: 1.3035827904855952
Energy: 1.2688852695538206
Energy: 1.3035827904855952
Energy: 1.0337041856792573
Energy: 1.3735807876578712
Energy: 1.033221079547727
Energy: 1.373580787657015
Energy: 1.033704185677545
Energy: 1.373580787657015
Energy: 1.082405016290784
Energy: 1.0143347363562836
Energy: 1.08240501629164
Energy: 1.0143347363558555
Energy: 1.08240501629164
Energy: 1.0143347363562836
Energy: 1.1652225153237772
Energy: 1.1345957442205192
Energy: 1.165222515323349
Energy: 1.1345957442205192
Energy: 1.1652225153259173
Energy: 1.134595744219663
Energy: 1.3794862918417226
Energy: 1.4028841565525487
Energy: 1.3794862918421507
Energy: 1.4028841565534047
Energy: 1.3794862918430066
Energy: 1.4028841565538328
Energy: 1.082266450328222
Energy: 1.085333751987202
Energy: 1.0822664503290778
Energy: 1.085333751988914
Energy: 1.0822664503290778
Energy: 1.0853337519893422
Energy: 1.1718643619255125
Energy: 1.0492185768036748
Energy: 1.1718643619250846
Energy: 1.0492185768019626
Energy: 1.1718643619255125
Energy: 1.0492185768028186
Energy: 1.4917001957038551
Energy: 1.2298898231228048
Energy: 1.4917001957055673
Energy: 1.2298898231232331
Energy: 1.4917001957072795
Energy: 1.2298898231228048
Energy: 1.2436273428331595
Energy: 1.1493712202598378
Energy: 1.2436273428348719
Energy: 1.1493712202585538
Energy: 1.2436273428335878
Energy: 1.1493712202598378
Energy: 1.2215288978751395
Energy: 1.2374746641488208
Energy: 1.2215288978747112
Energy: 1.2374746641471088
Energy: 1.2215288978742833
Energy: 1.2374746641471088
Energy: 1.2933384046069472
Energy: 1.0867070936600889
Energy: 1.2933384046069472
Energy: 1.0867070936630854
Energy: 1.2933384046078034
Energy: 1.0867070936630854
Energy: 1.1959302286690912
Energy: 1.1053251328185825
Energy: 1.1959302286682347
Energy: 1.1053251328185825
Energy: 1.1959302286682347
Energy: 1.1053251328190106
Energy: 1.2778794890820706
Energy: 1.2724840032560771
Energy: 1.2778794890816423
Energy: 1.2724840032612132
Energy: 1.2778794890812144
Energy: 1.2724840032607856
Energy: 1.2671678734345553
Energy: 1.2510691146245825
Energy: 1.267166272089402
Energy: 1.2510691146271506
Energy: 1.2671678734354115
Energy: 1.2510691146275787
Energy: 1.158532497257456
Energy: 1.2127584171435226
Energy: 1.1583968963590514
Energy: 1.2127584171426664
Energy: 1.1585324972570281
Energy: 1.2127584171422383
Energy: 1.5142913475277886
Energy: 1.1721059449637408
Energy: 1.5142913475282167
Energy: 1.1721059449633124
Energy: 1.5142913475282167
Energy: 1.1721059449616005

minimum gb energy = 0.9842464907957894 eV
minimum distance =  2.20811030629186 Angstroms
sigma value = 57


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

Energy: 1.0984395799924775
Energy: 0.9885238952996561
Energy: 1.098439579994568
Energy: 0.988523895300353
Energy: 1.0984395799924775
Energy: 0.988523895300353
Energy: 1.134566576005711
Energy: 1.131049094539094
Energy: 1.134566576005711
Energy: 1.1310490945377
Energy: 1.1345665760050139
Energy: 1.131049094539094
Energy: 1.1443348770071213
Energy: 1.1309499534865013
Energy: 1.1443348770092119
Energy: 1.1309499534858045
Energy: 1.144334877009909
Energy: 1.1309499534865013
Energy: 1.1425802713335158
Energy: 1.0743107244628165
Energy: 1.1425802713321218
Energy: 1.0743107244628165
Energy: 1.1425802713335158
Energy: 1.0743107244621197
Energy: 1.3295908070307034
Energy: 1.1011806071758885
Energy: 1.3295908070334914
Energy: 1.1011806071765855
Energy: 1.3295908070334914
Energy: 1.1011806071758885
Energy: 1.071840081814742
Energy: 0.9745478062088595
Energy: 1.0718400818140452
Energy: 0.9745478062088595
Energy: 1.0718400818140452
Energy: 0.9745478062088595
Energy: 1.3060560173056066
Energy: 1.0437634215567237
Energy: 1.3060560173076974
Energy: 1.0437634215560267
Energy: 1.3060560173070004
Energy: 1.0437634215567237
Energy: 1.2572462775068785
Energy: 1.260939200456561
Energy: 1.2572462775068785
Energy: 1.260939200457258
Energy: 1.2572462775068785
Energy: 1.260939200457258
Energy: 0.9912089944409646
Energy: 0.9763579814700641
Energy: 0.9912089944395707
Energy: 0.9763579814700641
Energy: 0.9912089944395707
Energy: 0.9763579814700641
Energy: 1.12252312956265
Energy: 1.0069815464458356
Energy: 1.12252312956265
Energy: 1.0069815464458356
Energy: 1.1225231295633469
Energy: 1.0069815464465324
Energy: 1.2750672754302674
Energy: 1.272983393108362
Energy: 1.2750672754302674
Energy: 1.272983393108362
Energy: 1.2750672754302674
Energy: 1.272983393108362
Energy: 1.0295290529349856
Energy: 1.2671403928826996
Energy: 1.0295290529349856
Energy: 1.2671403928820026
Energy: 1.0295290529356826
Energy: 1.2671403928820026
Energy: 1.1223898199657087
Energy: 1.1377706611611031
Energy: 1.1223898199664057
Energy: 1.1377706611604061
Energy: 1.1223898199664057
Energy: 1.1377706611604061
Energy: 1.267618984598687
Energy: 1.1494115948588723
Energy: 1.267618984598687
Energy: 1.1494115948561479
Energy: 1.267618984598687
Energy: 1.1494115948574786
Energy: 1.100201013069686
Energy: 1.182565903361186
Energy: 1.100201013070383
Energy: 1.1825659033625797
Energy: 1.100201013070383
Energy: 1.182565903358398
Energy: 1.1571502551558701
Energy: 1.150157005143651
Energy: 1.1571502551551731
Energy: 1.150157005144348
Energy: 1.1571502551558701
Energy: 1.150157005143651
Energy: 1.1747365707327484
Energy: 1.1282064125598281
Energy: 1.1747365707327484
Energy: 1.1282064125598281
Energy: 1.1747365707320516
Energy: 1.1282064125598281
Energy: 1.1892307429564655
Energy: 1.1853734426248685
Energy: 1.1892307429571625
Energy: 1.1853734426248685
Energy: 1.1892307429564655
Energy: 1.1853734426269593
Energy: 1.1279088759851679
Energy: 1.1765160951674047
Energy: 1.1279088759837739
Energy: 1.1765160951667077
Energy: 1.1279088759837739
Energy: 1.1765160951674047
Energy: 1.1297218733741587
Energy: 1.0756139091178296
Energy: 1.1297218733734615
Energy: 1.0756139091185264
Energy: 1.1297218733734615
Energy: 1.0756139091178296
Energy: 1.0797684454831311
Energy: 1.2674096898505745
Energy: 1.0797684454845249
Energy: 1.2674096898505745
Energy: 1.0797684454831311
Energy: 1.2674096898512714
Energy: 0.9284604711996439
Energy: 1.3644847952309838
Energy: 0.928460471200341
Energy: 1.3644847952302868
Energy: 0.928460471200341
Energy: 1.3644847952309838
Energy: 1.017360756943588
Energy: 1.028820458903954
Energy: 1.017360756944982
Energy: 1.028820458903954
Energy: 1.017360756944982
Energy: 1.028820458903954
Energy: 1.0170045564303922
Energy: 1.3843072698142578
Energy: 1.0170045564317862
Energy: 1.3843072698135606
Energy: 1.0170045564303922
Energy: 1.3843072698142578
Energy: 1.2118706181234498
Energy: 1.2744965135840856
Energy: 1.2118706181220558
Energy: 1.2744965135840856
Energy: 1.2118706181227525
Energy: 1.2744965135847826
Energy: 0.990590189412139
Energy: 1.0281216147592454
Energy: 0.9905901894114423
Energy: 1.0281216147592454
Energy: 0.9905901894128362
Energy: 1.0281216147592454
Energy: 0.928120741008227
Energy: 1.1764300462424642
Energy: 0.9281207410054394
Energy: 1.176430046243161
Energy: 0.9281207410061362
Energy: 1.1764300462424642

minimum gb energy = 0.9281207410054394 eV
minimum distance =  2.28416206927707 Angstroms
sigma value = 43


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

Energy: 1.2068138661645926
Energy: 0.8942642267243488
Energy: 1.2068138661640846
Energy: 0.8942642267243488
Energy: 1.2068138661651002
Energy: 0.8942642267243488
Energy: 0.980672999329831
Energy: 1.0266987234193108
Energy: 0.9806729993288154
Energy: 1.0266987234198186
Energy: 0.9806729993303387
Energy: 1.0266987234198186
Energy: 0.9993788340294801
Energy: 1.0267403052490365
Energy: 0.9993788340304958
Energy: 1.0267403052495445
Energy: 0.9993788340299881
Energy: 1.0267403052495445
Energy: 1.1486541688688447
Energy: 0.9415281517644306
Energy: 1.148654168867829
Energy: 0.9415281517644306
Energy: 1.1486541688673213
Energy: 0.9415281517649383
Energy: 1.123430488471671
Energy: 0.9819108574102633
Energy: 1.1234304884721786
Energy: 0.9819108574102633
Energy: 1.1234304884726867
Energy: 0.9819108574097555
Energy: 0.9304725925684857
Energy: 0.9792780530770318
Energy: 0.9304725925684857
Energy: 0.9792780530770318
Energy: 0.9304725925689934
Energy: 0.9792780530770318
Energy: 1.1111561805701713
Energy: 1.021914432994531
Energy: 1.1111561805706789
Energy: 1.0219144329950387
Energy: 1.1111561805706789
Energy: 1.0219144329950387
Energy: 1.1685613327319484
Energy: 1.0755036342415838
Energy: 1.1685613327319484
Energy: 1.0755036342415838
Energy: 1.1685613327319484
Energy: 1.0755036342410758
Energy: 0.880605559499559
Energy: 0.9685257527092743
Energy: 0.8806055595000668
Energy: 0.9685257527087665
Energy: 0.8806055595000668
Energy: 0.9685257527087665
Energy: 0.9864099719188715
Energy: 0.8673564280010744
Energy: 0.9864099719188715
Energy: 0.8673564280000586
Energy: 0.9864099719188715
Energy: 0.8673564280000586
Energy: 1.1007929626737771
Energy: 1.0670589108151733
Energy: 1.1007929626732693
Energy: 1.0670589108151733
Energy: 1.1007929626737771
Energy: 1.0670589108151733
Energy: 0.8426822927054297
Energy: 0.967037159065108
Energy: 0.842682292707461
Energy: 0.967037159065108
Energy: 0.8426822927059376
Energy: 0.9670371590646003
Energy: 0.9859956139878363
Energy: 0.8317821737459041
Energy: 0.9859956139878363
Energy: 0.8317821737459041
Energy: 0.9859956139878363
Energy: 0.8317821737453963
Energy: 1.071545072215492
Energy: 1.0689899065511363
Energy: 1.071545072215492
Energy: 1.0689899065511363
Energy: 1.071545072215492
Energy: 1.0689899065511363
Energy: 0.8626898030991755
Energy: 0.9669062497648554
Energy: 0.8626898030996833
Energy: 0.9669062497648554
Energy: 0.8626898030996833
Energy: 0.9669062497648554
Energy: 1.008589772275589
Energy: 0.9202933349138275
Energy: 1.0085897722750812
Energy: 0.9202933349138275
Energy: 1.0085897722750812
Energy: 0.9202933349138275
Energy: 1.1075136968375443
Energy: 1.1193180027371297
Energy: 1.1075136968380521
Energy: 1.119318002736622
Energy: 1.1075136968380521
Energy: 1.1193180027371297
Energy: 0.8937569184548391
Energy: 1.0963824400507587
Energy: 0.8937569184553468
Energy: 1.0963824400507587
Energy: 0.8937569184548391
Energy: 1.0963824400507587
Energy: 0.9797645528099638
Energy: 0.9656256466298575
Energy: 0.9797645528099638
Energy: 0.9656256466298575
Energy: 0.9797645528099638
Energy: 0.9656256466298575
Energy: 1.1398752736688271
Energy: 1.1107184719086411
Energy: 1.1398752736688271
Energy: 1.1107184719086411
Energy: 1.1398752736688271
Energy: 1.1107184719091492
Energy: 0.9594485458561433
Energy: 1.1590379325983606
Energy: 0.9594485458561433
Energy: 1.1590379325978528
Energy: 0.959448545857159
Energy: 1.159037932599376
Energy: 1.0377056881649676
Energy: 1.0166481770652087
Energy: 1.0377056881654754
Energy: 1.0166481770652087
Energy: 1.0377056881649676
Energy: 1.016648177064701
Energy: 1.0375082099584476
Energy: 0.9738210446240817
Energy: 1.0375082099589552
Energy: 0.9738210446235739
Energy: 1.0375082099589552
Energy: 0.9738210446240817
Energy: 1.0236500711727232
Energy: 1.1595229685536128
Energy: 1.0236500711727232
Energy: 1.1595229685541206
Energy: 1.0236500711727232
Energy: 1.1595229685531052
Energy: 0.9809917569128583
Energy: 1.0252803657898915
Energy: 0.9809917569128583
Energy: 1.0252803657898915
Energy: 0.9809917569128583
Energy: 1.0252803657903995
Energy: 0.980737672645092
Energy: 0.9429924859360791
Energy: 0.9807376726440764
Energy: 0.9429924859360791
Energy: 0.9807376726445843
Energy: 0.9429924859360791
Energy: 0.9245377391963733
Energy: 1.109925764472042
Energy: 0.9233767850411566
Energy: 1.10992576447255
Energy: 0.9233767850416643
Energy: 1.1099257644730576
Energy: 0.9489148646490732
Energy: 0.9512287558290075
Energy: 0.9489148646480576
Energy: 0.9512287558300231
Energy: 0.9489148646480576
Energy: 0.9512287558295152
Energy: 0.8599330073872463
Energy: 0.8844156910476334
Energy: 0.859933007387754
Energy: 0.8844156910471256
Energy: 0.8599330073882621
Energy: 0.8844156910471256
Energy: 0.8627199138541031
Energy: 1.082006673027789
Energy: 0.8627199138551187
Energy: 1.0820066730267737
Energy: 0.8627199138546109
Energy: 1.082006673027789
Energy: 0.9574745013195782
Energy: 1.1673930720001333
Energy: 0.9816438093894042
Energy: 1.1673930720001333
Energy: 0.981643809389912
Energy: 1.1673930720001333
Energy: 0.9598325221815097
Energy: 0.8570821363771789
Energy: 0.9598325221820174
Energy: 0.8570821363771789
Energy: 0.9598325221820174
Energy: 0.8570821363771789
Energy: 0.8391902819151927
Energy: 1.1981900855766328
Energy: 0.8391902819151927
Energy: 1.1981900855766328
Energy: 0.8391902819151927
Energy: 1.1981900855771406
Energy: 1.0786196632397302
Energy: 1.0687837049826086
Energy: 1.0786196632397302
Energy: 1.0687837049831164
Energy: 1.0786196632397302
Energy: 1.0687837049831164
Energy: 0.9881009002972703
Energy: 0.9517630715683286
Energy: 0.9881009002972703
Energy: 0.9517630715683286
Energy: 0.9881009002972703
Energy: 0.9517630715688363
Energy: 0.7756117936299601
Energy: 0.9562038900982041
Energy: 0.7756117936294523
Energy: 0.9562038900997274
Energy: 0.7756117936294523
Energy: 0.9562038900992196

minimum gb energy = 0.7756117936294523 eV
minimum distance =  2.28606588259714 Angstroms
sigma value = 81


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

Energy: 0.08155698589363009
Energy: 0.13860806092336264
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.696398831924471
Energy: 0.08267551638828516
Energy: 0.696398831924471
Energy: 0.0826755162763822
Energy: 0.696398831924471
Energy: 0.08267551637709063
Energy: 0.6964056230437401
Energy: 0.08255632994687008
Energy: 0.6964056230437401
Energy: 0.08255632995993038
Energy: 0.6964056230418743
Energy: 0.08255632997299066
Energy: 0.08155698589363009
Energy: 0.13860806092336264
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.08155698589363009
Energy: 0.13860806092336264
Energy: 0.696398831924471
Energy: 0.08267551585120185
Energy: 0.696398831924471
Energy: 0.08267551589780334
Energy: 0.696398831924471
Energy: 0.08267551585866487
Energy: 0.6964056230418743
Energy: 0.08255632945269917
Energy: 0.6964056230418743
Energy: 0.08255632949556914
Energy: 0.6964056230437401
Energy: 0.08255632948064309
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.08155698589363009
Energy: 0.13860806092709416
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.696398831924471
Energy: 0.08267551553601629
Energy: 0.696398831924471
Energy: 0.08267551550802994
Energy: 0.6963988319263368
Energy: 0.08267551552855326
Energy: 0.6964056230437401
Energy: 0.08255632923449051
Energy: 0.6964056230437401
Energy: 0.08255632923075899
Energy: 0.6964056230437401
Energy: 0.08255632921956445
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.08155698589363009
Energy: 0.1386080609252284
Energy: 0.08155698589363009
Energy: 0.1386080609252284

minimum gb energy = 0.08155698589363009 eV
minimum distance =  2.46625252413522 Angstroms
sigma value = 3


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

Energy: 1.0664307155467192
Energy: 0.8845348020381951
Energy: 1.0664307155472774
Energy: 0.8845348020381951
Energy: 1.0664307155472774
Energy: 0.8845348020381951
Energy: 0.8868783341788051
Energy: 1.0229935575052485
Energy: 0.8868783341788051
Energy: 1.0229935575052485
Energy: 0.8868783341788051
Energy: 1.0229935575058067
Energy: 0.923984851368345
Energy: 0.9950244851456365
Energy: 0.9239848513689033
Energy: 0.9950244851456365
Energy: 0.9239848513694616
Energy: 0.9950244851456365
Energy: 0.9983648613994904
Energy: 0.9360873775539552
Energy: 0.9983648613989319
Energy: 0.9360873775539552
Energy: 0.9983648613994904
Energy: 0.9360873775533968
Energy: 0.7760994167489923
Energy: 1.00515006754552
Energy: 0.7760994167489923
Energy: 1.00515006754552
Energy: 0.7760994167489923
Energy: 1.00515006754552
Energy: 0.9249882702565451
Energy: 0.9693833465410853
Energy: 0.9249882702565451
Energy: 0.9693833465416436
Energy: 0.9249882702565451
Energy: 0.9693833465410853
Energy: 0.9545311833821569
Energy: 0.9927707355768796
Energy: 0.9545311833810401
Energy: 0.9927707355768796
Energy: 0.9545311833815986
Energy: 0.9927707355768796
Energy: 0.7695804159617743
Energy: 0.9096693340633477
Energy: 0.7695804159617743
Energy: 0.9096693340611144
Energy: 0.7695804159617743
Energy: 0.909669334058881
Energy: 0.9534455981081829
Energy: 0.9669952455117994
Energy: 0.9534455981081829
Energy: 0.9669952455117994
Energy: 0.9534455981081829
Energy: 0.9669952455123576
Energy: 0.9709956562708549
Energy: 0.9444923925475224
Energy: 0.9709956562714134
Energy: 0.9444923925475224
Energy: 0.9709956562708549
Energy: 0.9444923925475224
Energy: 0.8437336915964974
Energy: 0.9065003262000687
Energy: 0.8437336915964974
Energy: 0.9065003261995105
Energy: 0.8437336915964974
Energy: 0.9065003261995105
Energy: 0.9805900904526256
Energy: 0.9762435380803647
Energy: 0.9805900904526256
Energy: 0.976243538080923
Energy: 0.9805900904526256
Energy: 0.976243538080923
Energy: 0.9614234731750726
Energy: 0.7728442157498994
Energy: 0.9614234731750726
Energy: 0.772844215749341
Energy: 0.961423473175631
Energy: 0.772844215749341
Energy: 0.876800499697719
Energy: 0.9560583928893173
Energy: 0.8768004996982774
Energy: 0.9560583928893173
Energy: 0.8768004996982774
Energy: 0.9560583928893173
Energy: 0.959091726508104
Energy: 0.9439095313304
Energy: 0.959091726508104
Energy: 0.9439095313309582
Energy: 0.959091726508104
Energy: 0.9439095313309582
Energy: 0.9750299193853736
Energy: 0.7736173546181591
Energy: 0.975029919385932
Energy: 0.7736173546192756
Energy: 0.975029919385932
Energy: 0.7736173546187174
Energy: 0.9736933593187942
Energy: 0.985954257021301
Energy: 0.9736933593187942
Energy: 0.985954257021301
Energy: 0.9736933593182359
Energy: 0.9859542570218593
Energy: 0.9870941116600315
Energy: 0.9167272727061473
Energy: 0.9870941116600315
Energy: 0.9167272727067056
Energy: 0.9870941116600315
Energy: 0.9167272727061473
Energy: 0.9870953453433811
Energy: 0.874707174239159
Energy: 0.9870953453439394
Energy: 0.874707174239159
Energy: 0.9870953453433811
Energy: 0.874707174239159
Energy: 0.903534674875657
Energy: 1.0439242776051978
Energy: 0.9035346748750988
Energy: 1.043924277605756
Energy: 0.9035346748750988
Energy: 1.0439242776051978
Energy: 0.9779109375364051
Energy: 0.8942185252544738
Energy: 0.9779109375358468
Energy: 0.8942185252539153
Energy: 0.9779109375369633
Energy: 0.8942185252550321
Energy: 1.0410523109760654
Energy: 0.8893496631727777
Energy: 1.041052310977182
Energy: 0.8893496631722193
Energy: 1.0410523109760654
Energy: 0.8893496631722193
Energy: 0.9560153170555272
Energy: 1.0415400406556126
Energy: 0.9560153170555272
Energy: 1.041540040656171
Energy: 0.9560153170555272
Energy: 1.0415400406556126
Energy: 1.0442354421656295
Energy: 0.8722686088913851
Energy: 1.0442354421650712
Energy: 0.8722686088913851
Energy: 1.0442354421650712
Energy: 0.8722686088908269
Energy: 0.9859453860039035
Energy: 0.9247078273410403
Energy: 0.9859453860050202
Energy: 0.9247078273410403
Energy: 0.9859453860039035
Energy: 0.9247078273410403
Energy: 0.8934610885413506
Energy: 0.9671054153281776
Energy: 0.8934610885407925
Energy: 0.9671054153281776
Energy: 0.8934610885413506
Energy: 0.9671054153281776
Energy: 1.0382812980394447
Energy: 0.8196870872337559
Energy: 1.0382812980400031
Energy: 0.8196870872337559
Energy: 1.0382812980400031
Energy: 0.8196870872343143
Energy: 0.9413127792458925
Energy: 0.9556374397108217
Energy: 0.9413127792458925
Energy: 0.9556374397102634
Energy: 0.9413127792458925
Energy: 0.9556374397102634
Energy: 0.8345652414227372
Energy: 1.0054248955946232
Energy: 0.8345652414232955
Energy: 1.0054248955946232
Energy: 0.8345652414227372
Energy: 1.0054248955946232
Energy: 1.058626761238844
Energy: 0.8808111847553493
Energy: 1.0586267612382858
Energy: 0.8808111847553493
Energy: 1.0586267612382858
Energy: 0.8808111847553493
Energy: 0.9474711343807
Energy: 0.9529752975698152
Energy: 0.9474711343807
Energy: 0.9529752975698152
Energy: 0.9474711343807
Energy: 0.9529752975698152
Energy: 0.810571441506384
Energy: 0.9496617794155627
Energy: 0.8105714415058256
Energy: 0.9496617794155627
Energy: 0.810571441506384
Energy: 0.9496617794161212
Energy: 0.944167275587617
Energy: 0.9883896515843094
Energy: 0.9441672755870587
Energy: 0.9883896515843094
Energy: 0.944167275587617
Energy: 0.9883896515843094

minimum gb energy = 0.7695804159617743 eV
minimum distance =  2.34520067992737 Angstroms
sigma value = 67


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

Energy: 1.223778647889216
Energy: 1.1079165392699726
Energy: 1.223778647889216
Energy: 1.1079165392691768
Energy: 1.223778647890012
Energy: 1.107916539270768
Energy: 1.077330261461461
Energy: 1.1992332963830215
Energy: 1.0773302614622566
Energy: 1.199233296383817
Energy: 1.0773302614622566
Energy: 1.1992332963830215
Energy: 1.164680900844375
Energy: 1.1666948052739534
Energy: 1.2025019788131992
Energy: 1.1666948052731578
Energy: 1.2025019788131992
Energy: 1.1666948052739534
Energy: 1.1671246445080345
Energy: 1.0935974775441737
Energy: 1.1671246445080345
Energy: 1.0935974775441737
Energy: 1.16712464450883
Energy: 1.0935974775449693
Energy: 0.9621558097804107
Energy: 1.0600617919664543
Energy: 0.9621558097820018
Energy: 1.06006179196725
Energy: 0.9621558097827974
Energy: 1.0600617919664543
Energy: 1.1494166636869978
Energy: 1.1483470897828423
Energy: 1.1494166636869978
Energy: 1.1483470897836379
Energy: 1.1494166636869978
Energy: 1.1483470897828423
Energy: 1.0811011951750316
Energy: 1.1899020390444262
Energy: 1.081101195174236
Energy: 1.1899020390444262
Energy: 1.0811011951750316
Energy: 1.1899020390444262
Energy: 1.0813573486371046
Energy: 1.0522666076204312
Energy: 1.0813573486371046
Energy: 1.0522666076204312
Energy: 1.081357348636309
Energy: 1.0522666076196356
Energy: 1.182375444082566
Energy: 1.1992993747973997
Energy: 1.182375444082566
Energy: 1.1992993747973997
Energy: 1.1823754440817702
Energy: 1.1992993747973997
Energy: 1.1643517443103257
Energy: 0.993099926908161
Energy: 1.1643517443095304
Energy: 0.993099926908161
Energy: 1.1643517443095304
Energy: 0.993099926908161
Energy: 1.150849176709408
Energy: 1.1433461693396585
Energy: 1.150849176709408
Energy: 1.1433461693396585
Energy: 1.1508491767086124
Energy: 1.1433461693396585
Energy: 1.166183432485873
Energy: 1.1335846195671695
Energy: 1.1661834324866687
Energy: 1.1335846195671695
Energy: 1.166183432485873
Energy: 1.1335846195671695
Energy: 1.1399361315177776
Energy: 1.2214712940485595
Energy: 1.1399361315169818
Energy: 1.2214712940485595
Energy: 1.1399361315177776
Energy: 1.2214712940485595
Energy: 1.1829187485722379
Energy: 1.178243901803653
Energy: 1.1829187485722379
Energy: 1.178243901803653
Energy: 1.1829187485730335
Energy: 1.178243901803653
Energy: 1.109047965243414
Energy: 1.0775961127787153
Energy: 1.109047965243414
Energy: 1.0775961127787153
Energy: 1.109047965243414
Energy: 1.0775961127787153
Energy: 1.1898877321452968
Energy: 1.1158435878791289
Energy: 1.1898877321452968
Energy: 1.1158435878791289
Energy: 1.1898877321452968
Energy: 1.1158435878791289
Energy: 1.0976496367494322
Energy: 1.187006165910185
Energy: 1.0976496367494322
Energy: 1.187006165910185
Energy: 1.0976496367494322
Energy: 1.1870061659109805
Energy: 1.1210385876681532
Energy: 1.0581324098486895
Energy: 1.1210385876689488
Energy: 1.058132409849485
Energy: 1.1210385876689488
Energy: 1.0581324098486895
Energy: 1.1442061237871524
Energy: 1.2058873376799566
Energy: 1.1442061237863568
Energy: 1.2058873376807522
Energy: 1.1442061237871524
Energy: 1.2058873376807522
Energy: 1.220986938929163
Energy: 1.1965357829074645
Energy: 1.220986938929163
Energy: 1.1965357829074645
Energy: 1.220986938929163
Energy: 1.1965357829082603
Energy: 1.2261625221234802
Energy: 1.0786359572366648
Energy: 1.2261625221234802
Energy: 1.0786359572374606
Energy: 1.2261625221226846
Energy: 1.0786359572374606
Energy: 1.1679117263195467
Energy: 1.2001359007512502
Energy: 1.167911726320342
Energy: 1.2001359007504548
Energy: 1.167911726320342
Energy: 1.2001359007512502
Energy: 0.972210521757978
Energy: 1.1656482775871722
Energy: 0.9722105217571825
Energy: 1.1656482775879677
Energy: 0.9722105217571825
Energy: 1.1656482775879677

minimum gb energy = 0.9621558097804107 eV
minimum distance =  2.32830234458753 Angstroms
sigma value = 33


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

Energy: 1.3443004017868443
Energy: 1.1810896568259652
Energy: 1.3443004017863398
Energy: 1.1810896568259652
Energy: 1.3443004017863398
Energy: 1.1810896568259652
Energy: 1.201256405022816
Energy: 1.297472118891057
Energy: 1.2012564050218066
Energy: 1.297472118891057
Energy: 1.2012564050223113
Energy: 1.297472118891057
Energy: 1.3136285087241493
Energy: 1.2987448924095069
Energy: 1.313628508724654
Energy: 1.2987448924095069
Energy: 1.3136285087241493
Energy: 1.2987448924100116
Energy: 1.2860744299454132
Energy: 1.1916048728920836
Energy: 1.2860744299454132
Energy: 1.1916048728920836
Energy: 1.286074429945918
Energy: 1.1916048728925883
Energy: 1.2101119688208515
Energy: 1.3131447643431424
Energy: 1.2101119688203468
Energy: 1.3131447643426377
Energy: 1.2101119688208515
Energy: 1.3131447643431424
Energy: 1.4293936577253288
Energy: 1.33020188070599
Energy: 1.429393657724824
Energy: 1.33020188070599
Energy: 1.429393657724824
Energy: 1.3136064616477394
Energy: 1.1991294833925767
Energy: 1.1508023286336793
Energy: 1.1991294833925767
Energy: 1.1508023286331746
Energy: 1.1991294833925767
Energy: 1.1508023286341837
Energy: 1.295324639945895
Energy: 1.2796008845432645
Energy: 1.2953246399453904
Energy: 1.2796008845432645
Energy: 1.2953246399453904
Energy: 1.2796008845437692
Energy: 1.2762989725295792
Energy: 1.2863117892391964
Energy: 1.276298972530084
Energy: 1.2863117892386917
Energy: 1.276298972530084
Energy: 1.2863117892391964
Energy: 1.406145029300548
Energy: 1.3073406275197434
Energy: 1.4061450293010527
Energy: 1.2174006070169547
Energy: 1.406145029300548
Energy: 1.3895380747708002
Energy: 1.310178443256208
Energy: 1.2945125256362198
Energy: 1.310178443256208
Energy: 1.2945125256362198
Energy: 1.310178443256208
Energy: 1.2945125256362198
Energy: 1.2041102212891597
Energy: 1.2038037361599943
Energy: 1.2041102212891597
Energy: 1.203803736160499
Energy: 1.2041102212891597
Energy: 1.2038037361599943
Energy: 1.327790745240067
Energy: 1.244100806495815
Energy: 1.3277907452395625
Energy: 1.244100806495815
Energy: 1.3277907452395625
Energy: 1.244100806495815
Energy: 1.26149649706708
Energy: 1.2759945676795774
Energy: 1.261496497066575
Energy: 1.2759945676795774
Energy: 1.261496497066575
Energy: 1.2759945676790727
Energy: 1.2403655680107728
Energy: 1.231399714279532
Energy: 1.2403655680107728
Energy: 1.231399714279532
Energy: 1.2403655680107728
Energy: 1.231399714279532
Energy: 1.2858634466909284
Energy: 1.3163515947871922
Energy: 1.2858634466909284
Energy: 1.3163515947871922
Energy: 1.2858634466914332
Energy: 1.3163515947871922
Energy: 1.1923211174861637
Energy: 1.3247533720666322
Energy: 1.1923211174861637
Energy: 1.3247533720666322
Energy: 1.1923211174861637
Energy: 1.3247533720666322
Energy: 1.3171004660158043
Energy: 1.364778970362834
Energy: 1.3171004660158043
Energy: 1.3647789703633386
Energy: 1.317100466016309
Energy: 1.3647789703633386
Energy: 1.1954681225418187
Energy: 1.3667550578165404
Energy: 1.1954681225418187
Energy: 1.3667550578160357
Energy: 1.195468122541314
Energy: 1.3667550578165404
Energy: 1.3392772312971544
Energy: 1.3008681817690095
Energy: 1.3392772312976589
Energy: 1.3008681817690095
Energy: 1.3392772312966499
Energy: 1.3008681817690095
Energy: 1.3586561357203086
Energy: 1.315445960175265
Energy: 1.3586561357203086
Energy: 1.315445960175265
Energy: 1.3586561357203086
Energy: 1.3154459601757698
Energy: 1.2386364870137683
Energy: 1.182411598043101
Energy: 1.2386364870132636
Energy: 1.182411598043101
Energy: 1.2386364870137683
Energy: 1.1824115980436054
Energy: 1.2047694144325227
Energy: 1.2946454556588753
Energy: 1.2047694144330272
Energy: 1.2946454556583709
Energy: 1.2047694144325227
Energy: 1.2946454556588753
Energy: 1.368659340820305
Energy: 1.2079547273066222
Energy: 1.3686593408198005
Energy: 1.2079547273066222
Energy: 1.3686593408208096
Energy: 1.2079547273076316
Energy: 1.216187164277276
Energy: 1.2117997615966265
Energy: 1.2161871642767712
Energy: 1.2117997615966265
Energy: 1.2161871642762665
Energy: 1.2117997615966265
Energy: 1.2435376590369738
Energy: 1.2899416217160524
Energy: 1.2435376590369738
Energy: 1.2899416217155477
Energy: 1.2435376590364693
Energy: 1.2899416217160524
Energy: 1.199152877243273
Energy: 1.1820796798178337
Energy: 1.1991528772463007
Energy: 1.1820796798173292
Energy: 1.1991528772427682
Energy: 1.1820796798178337
Energy: 1.3595343128869815
Energy: 1.3397041817264856
Energy: 1.3595343128864767
Energy: 1.3397041817264856
Energy: 1.3595343128864767
Energy: 1.3397041817264856
Energy: 1.3364931273692549
Energy: 1.311278898461276
Energy: 1.3364931273697593
Energy: 1.3112788984607713
Energy: 1.3364931273692549
Energy: 1.3112788984607713
Energy: 1.195144415755733
Energy: 1.1457223103986036
Energy: 1.195144415755733
Energy: 1.1457223103991083
Energy: 1.195144415755733
Energy: 1.1457223103991083
Energy: 1.3646847712097252
Energy: 1.3662419945436641
Energy: 1.3646847712097252
Energy: 1.3662419945436641
Energy: 1.3646847712097252
Energy: 1.3662419945431596
Energy: 1.213590475009576
Energy: 1.3003527164299054
Energy: 1.2135904750090714
Energy: 1.3003527164299054
Energy: 1.2135904750090714
Energy: 1.3003527164299054
Energy: 1.284346900842439
Energy: 1.3144651538302712
Energy: 1.2843469008429438
Energy: 1.3144651538297665
Energy: 1.2843469008429438
Energy: 1.3144651538302712
Energy: 1.2485802588346517
Energy: 1.2970904195834525
Energy: 1.2485802588351564
Energy: 1.2970904195829476
Energy: 1.2485802588346517
Energy: 1.2970904195829476
Energy: 1.2072514836472903
Energy: 1.2990439055040872
Energy: 1.207251483647795
Energy: 1.2990439055040872
Energy: 1.207251483647795
Energy: 1.299043905504592
Energy: 1.350010276991084
Energy: 1.2448369693230608
Energy: 1.3500102769905793
Energy: 1.2448369693235657
Energy: 1.3500102769915885
Energy: 1.2448369693230608
Energy: 1.2018202290523303
Energy: 1.2305894328327411
Energy: 1.2018202290523303
Energy: 1.2305894328327411
Energy: 1.2018202290518256
Energy: 1.2305894328327411

minimum gb energy = 1.1457223103986036 eV
minimum distance =  2.31904209891334 Angstroms
sigma value = 41


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

Energy: 1.4888588789305892
Energy: 1.351966141483574
Energy: 1.4888588789319672
Energy: 1.351966141483574
Energy: 1.4888588789319672
Energy: 1.351966141483574
Energy: 1.3531783393258379
Energy: 1.4425633494945544
Energy: 1.3531783393258379
Energy: 1.4425633494945544
Energy: 1.3531783393258379
Energy: 1.4425633494945544
Energy: 1.5826526444341165
Energy: 1.4441399264006352
Energy: 1.6248675157353978
Energy: 1.4441399264006352
Energy: 1.565322138266894
Energy: 1.4441399264006352
Energy: 1.5105589372207886
Energy: 1.567363273560141
Energy: 1.5105589372207886
Energy: 1.567363273560141
Energy: 1.5105589372207886
Energy: 1.567363273560141
Energy: 1.4696429344477906
Energy: 1.449505871052456
Energy: 1.4696429344477906
Energy: 1.4495058710510784
Energy: 1.4696429344477906
Energy: 1.449505871052456
Energy: 1.5758427461185138
Energy: 1.4783499052445153
Energy: 1.5758427461185138
Energy: 1.4783499052445153
Energy: 1.5758427461185138
Energy: 1.4783499052445153
Energy: 1.5066969451211405
Energy: 1.3672207781481438
Energy: 1.5066969451211405
Energy: 1.3672207781481438
Energy: 1.5066969451211405
Energy: 1.3672207781481438
Energy: 1.4388512725906837
Energy: 1.4692149837924688
Energy: 1.4388512725906837
Energy: 1.4692149837924688
Energy: 1.4388512725906837
Energy: 1.4692149837924688
Energy: 1.352803476358886
Energy: 1.3629240834689509
Energy: 1.352803476358886
Energy: 1.3629240834689509
Energy: 1.352803476358886
Energy: 1.3629240834689509
Energy: 1.5017493975336902
Energy: 1.3885284157370605
Energy: 1.5017493975336902
Energy: 1.3885284157370605
Energy: 1.5017493975336902
Energy: 1.3885284157370605
Energy: 1.3540082598401453
Energy: 1.443672011999344
Energy: 1.3540082598401453
Energy: 1.443672012000722
Energy: 1.3540082598401453
Energy: 1.443672011999344
Energy: 1.4340180830622347
Energy: 1.4407587828251303
Energy: 1.4340180830622347
Energy: 1.4407587828251303
Energy: 1.4340180830608564
Energy: 1.4407587828251303
Energy: 1.4789913471484275
Energy: 1.4674773280790663
Energy: 1.4789913471484275
Energy: 1.4674773280790663
Energy: 1.4789913471470497
Energy: 1.4674773280790663
Energy: 1.4715938663274868
Energy: 1.4644483940200692
Energy: 1.4715938663261086
Energy: 1.4644483940200692
Energy: 1.4715938663274868
Energy: 1.4644483940200692

minimum gb energy = 1.351966141483574 eV
minimum distance =  2.2751285656158 Angstroms
sigma value = 11


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

Energy: 1.6537329351860444
Energy: 1.637903066767085
Energy: 1.6537329351860444
Energy: 1.6379030667664796
Energy: 1.6537329351860444
Energy: 1.637903066767085
Energy: 1.44406267351551
Energy: 1.5993489453067904
Energy: 1.44406267351551
Energy: 1.5993489453067904
Energy: 1.44406267351551
Energy: 1.599348945307396
Energy: 1.5541498860755012
Energy: 1.552670516988361
Energy: 1.5541498860761063
Energy: 1.552670516988361
Energy: 1.5541498860755012
Energy: 1.552670516988361
Energy: 1.5590207420715627
Energy: 1.4485327794722302
Energy: 1.5590207420715627
Energy: 1.4485327794728355
Energy: 1.559020742072168
Energy: 1.4485327794728355
Energy: 1.6049061793806119
Energy: 1.5356276665341235
Energy: 1.6049061793806119
Energy: 1.5356276665341235
Energy: 1.6049061793806119
Energy: 1.5356276665341235
Energy: 1.5230020643521573
Energy: 1.5748977910906392
Energy: 1.5230020643521573
Energy: 1.574897791090034
Energy: 1.5230020643527626
Energy: 1.5748977910906392
Energy: 1.5722501304910166
Energy: 1.5373578891089663
Energy: 1.5722501304910166
Energy: 1.5373578891095718
Energy: 1.5722501304910166
Energy: 1.5373578891095718
Energy: 1.5300925367541967
Energy: 1.5709363962175347
Energy: 1.5300925367541967
Energy: 1.5709363962169294
Energy: 1.5300925367541967
Energy: 1.5709363962175347
Energy: 1.5514374333968595
Energy: 1.5457016891526205
Energy: 1.5514374333968595
Energy: 1.5457016891526205
Energy: 1.5514374333968595
Energy: 1.5457016891520152
Energy: 1.5358325024114001
Energy: 1.5397698905112756
Energy: 1.5358325024114001
Energy: 1.5397698905118808
Energy: 1.5358325024114001
Energy: 1.5397698905112756
Energy: 1.463882902479875
Energy: 1.586721350628449
Energy: 1.4638829024792697
Energy: 1.586721350628449
Energy: 1.4638829024792697
Energy: 1.586721350628449
Energy: 1.5657819441383014
Energy: 1.5909199926658069
Energy: 1.5657819441389065
Energy: 1.5909199926664122
Energy: 1.5657819441383014
Energy: 1.5909199926664122
Energy: 1.5606810038685304
Energy: 1.4914650472620417
Energy: 1.5606810038685304
Energy: 1.4914650472620417
Energy: 1.5606810038685304
Energy: 1.4914650472626472
Energy: 1.5347184710408395
Energy: 1.5774951071662564
Energy: 1.534718471040234
Energy: 1.577495107166862
Energy: 1.5347184710408395
Energy: 1.577495107166862
Energy: 1.4937677355243706
Energy: 1.512450943432182
Energy: 1.4937677355243706
Energy: 1.512450943432182
Energy: 1.4937677355243706
Energy: 1.512450943432182
Energy: 1.57747599262238
Energy: 1.5382067176022147
Energy: 1.57747599262238
Energy: 1.53820671760282
Energy: 1.57747599262238
Energy: 1.5382067176022147
Energy: 1.467390455564126
Energy: 1.55436157780861
Energy: 1.4673904555635207
Energy: 1.55436157780861
Energy: 1.4673904555635207
Energy: 1.5543615778092155
Energy: 1.5757163509825582
Energy: 1.5872102227250144
Energy: 1.5757163509825582
Energy: 1.5872102227250144
Energy: 1.5757163509825582
Energy: 1.5872102227250144
Energy: 1.5231709364618147
Energy: 1.4536123827928078
Energy: 1.5231709364618147
Energy: 1.4536123827928078
Energy: 1.5231709364618147
Energy: 1.4536123827928078
Energy: 1.529111992595281
Energy: 1.5597257504582644
Energy: 1.529111992595281
Energy: 1.5597257504582644
Energy: 1.529111992595281
Energy: 1.5597257504582644
Energy: 1.4516325854956522
Energy: 1.4938609281435526
Energy: 1.4516325854956522
Energy: 1.4938609281429471
Energy: 1.4516325854956522
Energy: 1.4938609281435526
Energy: 1.606391888671053
Energy: 1.6460184106265585
Energy: 1.606391888671053
Energy: 1.6460184106265585
Energy: 1.606391888671053
Energy: 1.6460184106271638
Energy: 1.508614215411478
Energy: 1.5525168438487704
Energy: 1.508614215411478
Energy: 1.5525168438487704
Energy: 1.508614215411478
Energy: 1.5525168438487704
Energy: 1.5855511530887856
Energy: 1.5984120048147215
Energy: 1.5855511530887856
Energy: 1.5984120048141162
Energy: 1.5855511530887856
Energy: 1.5984120048141162
Energy: 1.5351026569765647
Energy: 1.5446753245691713
Energy: 1.5351026569765647
Energy: 1.5446753245697766
Energy: 1.5351026569765647
Energy: 1.5446753245697766
Energy: 1.4699177989282863
Energy: 1.57298165143356
Energy: 1.4699177989282863
Energy: 1.57298165143356
Energy: 1.4699177989282863
Energy: 1.57298165143356
Energy: 1.522990877786521
Energy: 1.5936856558286834
Energy: 1.5229908777871266
Energy: 1.593685655829289
Energy: 1.522990877785916
Energy: 1.5936856558286834
Energy: 1.5608788627141985
Energy: 1.4883390726678138
Energy: 1.5608788627141985
Energy: 1.4883390726678138
Energy: 1.5608788627141985
Energy: 1.4883390726678138
Energy: 1.5334603839291832
Energy: 1.6033510420768797
Energy: 1.5334603839291832
Energy: 1.6033510420762744
Energy: 1.5334603839297882
Energy: 1.6033510420762744
Energy: 1.495272843827093
Energy: 1.4319996602777956
Energy: 1.495272843827093
Energy: 1.4319996602771903
Energy: 1.495272843827093
Energy: 1.4319996602777956
Energy: 1.5336795682925024
Energy: 1.6059083988068936
Energy: 1.5336795682925024
Energy: 1.605908398806288
Energy: 1.533679568291897
Energy: 1.605908398807499

minimum gb energy = 1.4319996602771903 eV
minimum distance =  2.25724361719956 Angstroms
sigma value = 57


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

Energy: 1.4550592147174797
Energy: 1.368172564095539
Energy: 1.4550592147174797
Energy: 1.3681725640944618
Energy: 1.4550592147174797
Energy: 1.3681725640944618
Energy: 1.565310454580829
Energy: 1.5214030550286373
Energy: 1.565310454580829
Energy: 1.5214030550286373
Energy: 1.565310454580829
Energy: 1.5214030550286373
Energy: 1.6160033074894022
Energy: 1.4988520521321693
Energy: 1.6160033074883249
Energy: 1.4988520521332467
Energy: 1.6160033074894022
Energy: 1.4988520521321693
Energy: 1.4518464405757214
Energy: 1.4515256759156678
Energy: 1.4518464405735672
Energy: 1.9452955967892414
Energy: 1.4518464405735672
Energy: 1.4317219516700104
Energy: 1.6161659654807161
Energy: 1.4988153862797833
Energy: 1.6161659654796388
Energy: 1.4988153862797833
Energy: 1.6161659654796388
Energy: 1.4988153862797833
Energy: 1.5658198482801302
Energy: 1.408551784508849
Energy: 1.5658198482801302
Energy: 1.4085517845077717
Energy: 1.5658198482801302
Energy: 1.4085517845077717
Energy: 1.4550592147185568
Energy: 1.368172564095539
Energy: 1.4550592147185568
Energy: 1.368172564095539
Energy: 1.4550592147185568
Energy: 1.368172564095539
Energy: 1.5653104545797518
Energy: 1.5214030550275601
Energy: 1.565310454580829
Energy: 1.5214030550275601
Energy: 1.5653104545797518
Energy: 1.5214030550275601
Energy: 1.6160033074894022
Energy: 1.4988520521321693
Energy: 1.6160033074894022
Energy: 1.4988520521332467
Energy: 1.6160033074894022
Energy: 1.4988520521332467
Energy: 1.4518464405757214
Energy: 1.380130527559075
Energy: 1.4518464405767988
Energy: 1.7374528963932452
Energy: 1.4518464405757214
Energy: 1.4370628720351108
Energy: 1.6161659654785614
Energy: 1.4988153862808604
Energy: 1.6161659654785614
Energy: 1.4988153862808604
Energy: 1.6161659654796388
Energy: 1.4988153862808604
Energy: 1.5658198482822845
Energy: 1.4085517845066948
Energy: 1.5658198482822845
Energy: 1.4085517845066948
Energy: 1.5658198482822845
Energy: 1.4085517845066948
Energy: 1.4550592147174797
Energy: 1.368172564095539
Energy: 1.4550592147174797
Energy: 1.368172564095539
Energy: 1.4550592147174797
Energy: 1.368172564095539
Energy: 1.565310454580829
Energy: 1.5214030550275601
Energy: 1.565310454580829
Energy: 1.5214030550275601
Energy: 1.565310454580829
Energy: 1.5214030550275601
Energy: 1.6160033074894022
Energy: 1.4988520521321693
Energy: 1.6160033074894022
Energy: 1.4988520521321693
Energy: 1.6160033074894022
Energy: 1.4988520521321693
Energy: 1.4518464405757214
Energy: 1.3801305275612294
Energy: 1.4518464405757214
Energy: 1.3801305275601523
Energy: 1.4518464405746445
Energy: 1.4370628720351108
Energy: 1.6161659654796388
Energy: 1.4988153862797833
Energy: 1.6161659654796388
Energy: 1.4988153862797833
Energy: 1.6161659654796388
Energy: 1.4988153862797833

minimum gb energy = 1.3681725640944618 eV
minimum distance =  2.29877010181059 Angstroms
sigma value = 9


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

Energy: 1.5576694183376076
Energy: 1.6404916822594706
Energy: 1.5576694183376076
Energy: 1.6404916822594706
Energy: 1.5576694183384874
Energy: 1.6404916822594706
Energy: 1.518604767622973
Energy: 1.5237038405352374
Energy: 1.5186047676238525
Energy: 1.5237038405352374
Energy: 1.518604767622973
Energy: 1.5237038405343577
Energy: 1.509815023884876
Energy: 1.5089431667319475
Energy: 1.5873102108825055
Energy: 1.5089431667310678
Energy: 1.509815023884876
Energy: 1.5089431667310678
Energy: 1.4785664997750798
Energy: 1.6061281025961136
Energy: 1.4785664997759593
Energy: 1.6061281025961136
Energy: 1.4785664997759593
Energy: 1.606128102595234
Energy: 1.5181863647898124
Energy: 1.5293588312468498
Energy: 1.518186364788933
Energy: 1.5293588312468498
Energy: 1.5181863647898124
Energy: 1.5293588312468498
Energy: 1.5282162879716366
Energy: 1.515100773137111
Energy: 1.5282162879725159
Energy: 1.515100773137111
Energy: 1.5282162879725159
Energy: 1.515100773137111
Energy: 1.4965398348675314
Energy: 1.5370453807583648
Energy: 1.4965398348675314
Energy: 1.5370453807583648
Energy: 1.4965398348675314
Energy: 1.5370453807583648
Energy: 1.4933144312517963
Energy: 1.5510950084735906
Energy: 1.4933144312517963
Energy: 1.5510950084727113
Energy: 1.4933144312517963
Energy: 1.5510950084735906
Energy: 1.7089770117663274
Energy: 1.5659013135293383
Energy: 1.708977011767207
Energy: 1.5659013135293383
Energy: 1.708977011767207
Energy: 1.5659013135293383
Energy: 1.4984640272022252
Energy: 1.505579448010595
Energy: 1.4984640272022252
Energy: 1.5055794480114746
Energy: 1.4984640272022252
Energy: 1.5055794480114746
Energy: 1.555453711476772
Energy: 1.5186736383306054
Energy: 1.555453711476772
Energy: 1.5186736383306054
Energy: 1.5554537114776514
Energy: 1.5186736383306054
Energy: 1.5842803971315733
Energy: 1.5458301735205056
Energy: 1.5842803971315733
Energy: 1.5458301735205056
Energy: 1.5842803971315733
Energy: 1.5458301735205056
Energy: 1.4783128307108209
Energy: 1.562851995536748
Energy: 1.4783128307099411
Energy: 1.562851995536748
Energy: 1.4783128307099411
Energy: 1.562851995536748
Energy: 1.5370435118372952
Energy: 1.507923916024203
Energy: 1.5370435118381747
Energy: 1.507923916024203
Energy: 1.5370435118372952
Energy: 1.507923916024203
Energy: 1.6019750094503296
Energy: 1.540507896461655
Energy: 1.6019750094494498
Energy: 1.540507896461655
Energy: 1.6019750094503296
Energy: 1.540507896461655
Energy: 1.5551578831118609
Energy: 1.5173676094116428
Energy: 1.5551578831127406
Energy: 1.5173676094116428
Energy: 1.5551578831127406
Energy: 1.5173676094116428
Energy: 1.550534446731119
Energy: 1.5181692784488987
Energy: 1.550534446731119
Energy: 1.5181692784488987
Energy: 1.550534446731119
Energy: 1.5181692784488987
Energy: 1.7212545144355778
Energy: 1.5291988073836698
Energy: 1.7212545144355778
Energy: 1.5291988073845493
Energy: 1.7212545144355778
Energy: 1.5291988073845493
Energy: 1.4960227598356801
Energy: 1.509368050157899
Energy: 1.4960227598356801
Energy: 1.509368050157899
Energy: 1.4960227598356801
Energy: 1.509368050157899
Energy: 1.5913249835914662
Energy: 1.5553108774782942
Energy: 1.5913249835923458
Energy: 1.5553108774782942
Energy: 1.5913249835914662
Energy: 1.5553108774782942
Energy: 1.586287690016005
Energy: 1.5434936768547547
Energy: 1.5862876900151255
Energy: 1.5434936768547547
Energy: 1.5862876900151255
Energy: 1.5434936768556342

minimum gb energy = 1.4783128307099411 eV
minimum distance =  2.2859253672188 Angstroms
sigma value = 27


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

Energy: 1.5303365300047957
Energy: 1.5863593660012112
Energy: 1.5303365300047957
Energy: 1.58635936600047
Energy: 1.5303365300055372
Energy: 1.58635936600047
Energy: 1.5019614753478707
Energy: 1.5175932096520983
Energy: 1.5019614753471293
Energy: 1.51759320965284
Energy: 1.5019614753471293
Energy: 1.51759320965284
Energy: 1.4856745278753818
Energy: 1.4638047832826875
Energy: 1.4856745278753818
Energy: 1.4638047832826875
Energy: 1.4856745278753818
Energy: 1.4638047832834287
Energy: 1.4536151336748269
Energy: 1.5083706440675446
Energy: 1.4536151336763097
Energy: 1.5083706440668034
Energy: 1.4536151336748269
Energy: 1.5083706440668034
Energy: 1.4520621576963093
Energy: 1.4339921086727216
Energy: 1.4520621576955681
Energy: 1.4339921086727216
Energy: 1.4520621576963093
Energy: 1.4339921086719802
Energy: 1.4250020454224976
Energy: 1.4534770481971022
Energy: 1.4250020454224976
Energy: 1.4534770481985853
Energy: 1.4250020454224976
Energy: 1.4534770481985853
Energy: 1.4976187141228088
Energy: 1.514164261735838
Energy: 1.4976187141228088
Energy: 1.514164261735838
Energy: 1.4976187141228088
Energy: 1.514164261735838
Energy: 1.5113422031594899
Energy: 1.562446666089163
Energy: 1.5113422031602313
Energy: 1.562446666089163
Energy: 1.5113422031594899
Energy: 1.562446666089163
Energy: 1.5063451734989184
Energy: 1.45890121948963
Energy: 1.5063451734989184
Energy: 1.45890121948963
Energy: 1.5063451734989184
Energy: 1.45890121948963
Energy: 1.4538339882540257
Energy: 1.4903687678108044
Energy: 1.4538339882532842
Energy: 1.4903687678108044
Energy: 1.4538339882532842
Energy: 1.4903687678108044
Energy: 1.453807746431228
Energy: 1.572456751243634
Energy: 1.453807746431228
Energy: 1.572456751243634
Energy: 1.4538077464319694
Energy: 1.5724567512428924
Energy: 1.5094832701560297
Energy: 1.4974962627095783
Energy: 1.5094832701560297
Energy: 1.4974962627095783
Energy: 1.509483270156771
Energy: 1.4974962627095783
Energy: 1.5202648000614953
Energy: 1.5101044763729827
Energy: 1.5202648000614953
Energy: 1.5101044763729827
Energy: 1.520264800062237
Energy: 1.510104476372241
Energy: 1.4537727392777995
Energy: 1.5054576970990716
Energy: 1.4537727392777995
Energy: 1.5054576970998128
Energy: 1.453772739278541
Energy: 1.5054576970998128
Energy: 1.4248632392816434
Energy: 1.4535219732287596
Energy: 1.424863239282385
Energy: 1.4535219732287596
Energy: 1.4248632392816434
Energy: 1.4535219732295013
Energy: 1.4525824918982675
Energy: 1.4342457260287231
Energy: 1.4525824918982675
Energy: 1.4342457260294645
Energy: 1.4525824918990087
Energy: 1.4342457260294645
Energy: 1.4958634420050894
Energy: 1.4872991045128854
Energy: 1.4958634420050894
Energy: 1.4872991045128854
Energy: 1.4958634420050894
Energy: 1.4872991045136266
Energy: 1.5081766423946934
Energy: 1.4783377862551643
Energy: 1.5081766423939522
Energy: 1.4783377862551643
Energy: 1.5081766423946934
Energy: 1.4783377862551643
Energy: 1.4441528180630154
Energy: 1.4511482358524141
Energy: 1.444152818062274
Energy: 1.4511482358531556
Energy: 1.444152818062274
Energy: 1.4511482358531556
Energy: 1.5303365300040543
Energy: 1.5863593660012112
Energy: 1.5303365300047957
Energy: 1.5863593660012112
Energy: 1.5303365300047957
Energy: 1.5863593660012112
Energy: 1.5019614753463881
Energy: 1.5175932096520983
Energy: 1.5019614753463881
Energy: 1.51759320965284
Energy: 1.5019614753471293
Energy: 1.5175932096520983
Energy: 1.4856745278753818
Energy: 1.4638047832826875
Energy: 1.4856745278746404
Energy: 1.4638047832819459
Energy: 1.485674527873899
Energy: 1.4638047832834287
Energy: 1.4536151336763097
Energy: 1.5083706440675446
Energy: 1.4536151336763097
Energy: 1.5083706440675446
Energy: 1.453615133675568
Energy: 1.5083706440675446
Energy: 1.4520621576955681
Energy: 1.4339921086727216
Energy: 1.4520621576955681
Energy: 1.4339921086734628
Energy: 1.4520621576963093
Energy: 1.4339921086734628
Energy: 1.4250020454232388
Energy: 1.4534770481971022
Energy: 1.4250020454224976
Energy: 1.453477048196361
Energy: 1.4250020454232388
Energy: 1.4534770481985853

minimum gb energy = 1.4248632392816434 eV
minimum distance =  2.31568192553386 Angstroms
sigma value = 19


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

Energy: 1.4702559025735678
Energy: 1.6991644524404999
Energy: 1.4702559025735678
Energy: 1.6991644524404999
Energy: 1.4702559025735678
Energy: 1.6991644524411105
Energy: 1.52199063208401
Energy: 1.526339353463797
Energy: 1.52199063208401
Energy: 1.526339353462517
Energy: 1.52199063208401
Energy: 1.526339353463157
Energy: 1.6848086970824643
Energy: 1.426926155406931
Energy: 1.5583829849729154
Energy: 1.4269261554062913
Energy: 1.5583829849722755
Energy: 1.426926155406931
Energy: 1.4182422568764232
Energy: 1.5504759790182918
Energy: 1.4182422568764232
Energy: 1.5504759790182918
Energy: 1.4182422568764232
Energy: 1.5504759790189317
Energy: 1.5221883351495766
Energy: 1.5191942367305207
Energy: 1.5221883351495766
Energy: 1.5191942367298807
Energy: 1.5221883351495766
Energy: 1.5191942367305207
Energy: 1.5651876326227672
Energy: 1.4256901625329124
Energy: 1.5651876326227672
Energy: 1.4256901625335523
Energy: 1.565187632622127
Energy: 1.4256901625335523
Energy: 1.4281495326910418
Energy: 1.6390967056878116
Energy: 1.4281495326910418
Energy: 1.6390967056878116
Energy: 1.4281495326910418
Energy: 1.6390967056878116
Energy: 1.449877898688772
Energy: 1.6440424199850074
Energy: 1.449877898688772
Energy: 1.6440424199850074
Energy: 1.449877898688772
Energy: 1.6440424199850074
Energy: 1.5925862952196819
Energy: 1.3966718561872236
Energy: 1.5925862952196819
Energy: 1.3966718561872236
Energy: 1.592586295220322
Energy: 1.3966718561872236
Energy: 1.5219539186866993
Energy: 1.5175598224150446
Energy: 1.5219539186866993
Energy: 1.5175598224156845
Energy: 1.5219539186866993
Energy: 1.5175598224150446
Energy: 1.4076271120149357
Energy: 1.6308334786989531
Energy: 1.4076271120149357
Energy: 1.6308334786989531
Energy: 1.4076271120149357
Energy: 1.6308334786989531
Energy: 1.5942714582633457
Energy: 1.4250571130817864
Energy: 1.5942714582633457
Energy: 1.4250571130811465
Energy: 1.5942714582633457
Energy: 1.4250571130811465
Energy: 1.5427398776399532
Energy: 1.4808303810386558
Energy: 1.5427398776399532
Energy: 1.4808303810386558
Energy: 1.5427398776393133
Energy: 1.4808303810386558
Energy: 1.42406469002829
Energy: 1.5485081591026648
Energy: 1.42406469002893
Energy: 1.5485081591033047
Energy: 1.42406469002893
Energy: 1.5485081591033047
Energy: 1.5628933722918215
Energy: 1.434282396162068
Energy: 1.5628933722918215
Energy: 1.434282396162708
Energy: 1.5628933722918215
Energy: 1.434282396162068
Energy: 1.6226550312364338
Energy: 1.396828880929748
Energy: 1.6226550312364338
Energy: 1.3968288809303877
Energy: 1.6226550312364338
Energy: 1.3968288809303877
Energy: 1.4348503285458825
Energy: 1.5454404286764416
Energy: 1.4348503285458825
Energy: 1.5454404286764416
Energy: 1.4348503285458825
Energy: 1.5454404286764416
Energy: 1.5038961025878972
Energy: 1.541924934223847
Energy: 1.5038961025878972
Energy: 1.541924934223847
Energy: 1.5038961025878972
Energy: 1.541924934223847
Energy: 1.535389928561621
Energy: 1.4246274692414422
Energy: 1.535389928561621
Energy: 1.4246274692408023
Energy: 1.535389928561621
Energy: 1.4246274692414422
Energy: 1.4337409564239325
Energy: 1.5205388774481627
Energy: 1.4337409564245724
Energy: 1.5205388774481627
Energy: 1.4337409564239325
Energy: 1.5205388774481627
Energy: 1.4298534850706486
Energy: 1.6272393955307027
Energy: 1.4298534850700086
Energy: 1.6272393955307027
Energy: 1.4298534850700086
Energy: 1.6272393955307027
Energy: 1.5998164949219276
Energy: 1.4267986716237155
Energy: 1.5998164949219276
Energy: 1.4267986716237155
Energy: 1.5998164949219276
Energy: 1.4267986716237155
Energy: 1.5656929622350888
Energy: 1.5240436160103563
Energy: 1.5656929622350888
Energy: 1.5240436160109965
Energy: 1.5656929622357287
Energy: 1.5240436160103563
Energy: 1.4586676890087646
Energy: 1.5304164200050396
Energy: 1.4586676890081247
Energy: 1.5304164200050396
Energy: 1.4586676890087646
Energy: 1.5304164200050396
Energy: 1.500474141652194
Energy: 1.426964048514579
Energy: 1.500474141652194
Energy: 1.426964048514579
Energy: 1.500474141652194
Energy: 1.426964048514579
Energy: 1.5503822007824437
Energy: 1.4507945178798252
Energy: 1.5503822007824437
Energy: 1.4507945178798252
Energy: 1.5503822007830836
Energy: 1.4507945178798252
Energy: 1.4010892686115486
Energy: 1.5322677704126588
Energy: 1.4010892686121885
Energy: 1.5322677704132988
Energy: 1.4010892686115486
Energy: 1.5322677704132988
Energy: 1.5475872262776178
Energy: 1.4243322592776637
Energy: 1.5475872262776178
Energy: 1.4243322592776637
Energy: 1.5475872262776178
Energy: 1.4243322592783036
Energy: 1.5116714877567738
Energy: 1.4246633347104614
Energy: 1.5116714877567738
Energy: 1.4246633347111013
Energy: 1.5116714877567738
Energy: 1.4246633347104614

minimum gb energy = 1.3966718561872236 eV
minimum distance =  2.27863017344237 Angstroms
sigma value = 101


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

Energy: 1.3820956541653258
Energy: 1.5673826004888058
Energy: 1.3820956541658884
Energy: 1.5673826004882432
Energy: 1.3820956541653258
Energy: 1.5673826004888058
Energy: 1.496501886568814
Energy: 1.4473387510232953
Energy: 1.496501886568814
Energy: 1.4672059960360861
Energy: 1.496501886568814
Energy: 1.3960781353514802
Energy: 1.4772501424794857
Energy: 1.3616889094372144
Energy: 1.4772501424783606
Energy: 1.3616889094372144
Energy: 1.4772501424783606
Energy: 1.3616889094372144
Energy: 1.3235001913209736
Energy: 1.7507876996501675
Energy: 1.3235001913209736
Energy: 1.7911200879262312
Energy: 1.3235001913198485
Energy: 1.7106382057321603
Energy: 1.4377027830895754
Energy: 1.4219664325818209
Energy: 1.437702783090138
Energy: 1.4219664325823835
Energy: 1.4377027830895754
Energy: 1.4219664325801333
Energy: 1.5467671909417273
Energy: 1.342082192310596
Energy: 1.546767190940602
Energy: 1.342082192310596
Energy: 1.5467671909411649
Energy: 1.342082192310596
Energy: 1.3578916922051887
Energy: 1.6555615096470206
Energy: 1.3578916922046262
Energy: 1.6555615096470206
Energy: 1.3578916922040638
Energy: 1.6555615096470206
Energy: 1.3423569987870356
Energy: 1.5862579850564111
Energy: 1.3423569987870356
Energy: 1.638634967038992
Energy: 1.3423569987870356
Energy: 1.4937099574567696
Energy: 1.5423082056138662
Energy: 1.3433745212311268
Energy: 1.5423082056138662
Energy: 1.3433745212316892
Energy: 1.5423082056138662
Energy: 1.3433745212311268
Energy: 1.5152412147813574
Energy: 1.5382740644517012
Energy: 1.5152412147807945
Energy: 1.608808061732629
Energy: 1.5152412147813574
Energy: 1.538274064450576
Energy: 1.322450846194222
Energy: 1.654504986924584
Energy: 1.322450846194222
Energy: 1.654504986924584
Energy: 1.3224508461936595
Energy: 1.654504986924584
Energy: 1.4283303438477664
Energy: 1.3972420886234342
Energy: 1.4283303438477664
Energy: 1.3972420886234342
Energy: 1.4283303438466413
Energy: 1.3972420886234342
Energy: 1.504977749255859
Energy: 1.36223033429597
Energy: 1.504977749255859
Energy: 1.3622303342954074
Energy: 1.504977749255859
Energy: 1.36223033429597
Energy: 1.3822231386509825
Energy: 1.5411971673715883
Energy: 1.3822231386521073
Energy: 1.576413066194921
Energy: 1.3822231386515451
Energy: 1.5411971673715883
Energy: 1.4835708990256333
Energy: 1.4095601598946537
Energy: 1.4835708990273209
Energy: 1.4095601598946537
Energy: 1.483570899026196
Energy: 1.4095601598946537
Energy: 1.558321491542672
Energy: 1.3650387831865913
Energy: 1.558321491542672
Energy: 1.3650387831865913
Energy: 1.558321491542672
Energy: 1.3650387831871535
Energy: 1.3225078038736842
Energy: 1.4547575446985819
Energy: 1.322507803872559
Energy: 1.454757544689581
Energy: 1.322507803872559
Energy: 1.4547575446957692
Energy: 1.316613035686857
Energy: 1.4772684979401702
Energy: 1.3166130356857317
Energy: 1.4772684979401702
Energy: 1.3166130356874195
Energy: 1.4772684979401702
Energy: 1.5437887443976903
Energy: 1.3426344294468655
Energy: 1.5437887443976903
Energy: 1.3426344294468655
Energy: 1.5437887443976903
Energy: 1.3426344294468655
Energy: 1.431105744745694
Energy: 1.4819470721797545
Energy: 1.4311057447468192
Energy: 1.4819470721786294
Energy: 1.431105744745694
Energy: 1.481947072179192
Energy: 1.3423345322454292
Energy: 1.6394276247914776
Energy: 1.3423345322454292
Energy: 1.6394276247920403
Energy: 1.3423345322459916
Energy: 1.6394276247920403
Energy: 1.6584698999650254
Energy: 1.34153588513281
Energy: 1.6584698999650254
Energy: 1.3415358851333727
Energy: 1.6584698999644627
Energy: 1.3415358851333727
Energy: 1.5451619754185344
Energy: 1.3423805880764554
Energy: 1.5451619754185344
Energy: 1.3423805880764554
Energy: 1.5451619754185344
Energy: 1.3423805880770179
Energy: 1.323690074431245
Energy: 1.5474197699042729
Energy: 1.323690074431245
Energy: 1.5474197699042729
Energy: 1.3236900744306825
Energy: 1.5474197699042729
Energy: 1.4297775289004901
Energy: 1.3934737665038701
Energy: 1.4297775288999275
Energy: 1.3934737665033075
Energy: 1.4297775288999275
Energy: 1.3934737665044326
Energy: 1.5056798384584933
Energy: 1.3616301389492502
Energy: 1.5056798384579309
Energy: 1.3616301389492502
Energy: 1.5056798384590557
Energy: 1.3616301389492502
Energy: 1.382205711287267
Energy: 1.5007946474287182
Energy: 1.3822057112867043
Energy: 1.5007946474292806
Energy: 1.3822057112878294
Energy: 1.5007946474287182
Energy: 1.382731087775472
Energy: 1.5184976694638175
Energy: 1.382731087776597
Energy: 1.5184976694643801
Energy: 1.382731087775472
Energy: 1.5184976694638175
Energy: 1.5474493192551708
Energy: 1.3615909779523094
Energy: 1.5474493192546082
Energy: 1.3615909779528719
Energy: 1.547449319256296
Energy: 1.3615909779528719
Energy: 1.3164919716776744
Energy: 1.4968961413742852
Energy: 1.316491971678237
Energy: 1.4968961413748478
Energy: 1.3164919716776744
Energy: 1.4968961413742852
Energy: 1.3223833579024933
Energy: 1.4708176994754267
Energy: 1.3223833579041808
Energy: 1.4708176994754267
Energy: 1.3223833579030557
Energy: 1.4708176994754267
Energy: 1.5267261170719195
Energy: 1.3413163117285534
Energy: 1.5267261170730446
Energy: 1.341316311729116
Energy: 1.5267261170719195
Energy: 1.3413163117285534
Energy: 1.6593934200655922
Energy: 1.34241039468938
Energy: 1.6593934200655922
Energy: 1.34241039468938
Energy: 1.6593934200655922
Energy: 1.3424103946888175

minimum gb energy = 1.3164919716776744 eV
minimum distance =  2.29769317672925 Angstroms
sigma value = 33


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

Energy: 0.02052232806012812
Energy: 1.2229119915255857
Energy: 0.02052232806012812
Energy: 1.2229119915260531
Energy: 0.02052232806012812
Energy: 1.2229119915260531
Energy: 0.021436221011043866
Energy: 0.4553862227257785
Energy: 0.021436221011043866
Energy: 0.4553862227257785
Energy: 0.021436221011043866
Energy: 0.4553862227253631
Energy: 2.5079974866125454
Energy: 0.45468709350358394
Energy: 1.2239735689927438
Energy: 0.45468709409972885
Energy: 1.223575274231678
Energy: 0.4546870937996051
Energy: 0.02143622101151127
Energy: 0.4553862227253631
Energy: 0.02143622101151127
Energy: 0.45538622272442825
Energy: 0.02143622101151127
Energy: 0.4553862227248956

minimum gb energy = 0.02052232806012812 eV
minimum distance =  2.4849283638348 Angstroms
sigma value = 1