Model name: model_name=EAM_Dynamo_MendelevSordeletKramer_2007_CuZr__MO_120596890176_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.639085099101067
cohesive_energy=3.2833744382854766
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.012534983049974743
Energy: 1.0453901568894883
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 1.0453901568901072
Energy: 1.2275501139670284
Energy: 1.0453901568894883
Energy: 1.2275501139603577
Energy: 1.0453901568901072
Energy: 1.2275501139600482
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 1.0453901568897979
Energy: 1.2275501139640026
Energy: 1.0453901568894883
Energy: 1.227550113959154
Energy: 1.0453901568894883
Energy: 1.227550113972771
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 0.012534983049974743
Energy: 1.0453901568897979
Energy: 0.012534983049974743
Energy: 1.0453901568894883
Energy: 1.0453901568891788
Energy: 1.2275501139657905
Energy: 1.0453901568897979
Energy: 1.2275501139630742
Energy: 1.0453901568901072
Energy: 1.2275501139588445

minimum gb energy = 0.012534983049974743 eV
minimum distance =  2.5088745560271 Angstroms
sigma value = 1


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

Energy: 0.9842890600588573
Energy: 0.9621884474617126
Energy: 0.9842890600588573
Energy: 0.9621884474617126
Energy: 0.9842890600581123
Energy: 0.9621884474624578
Energy: 1.1406023974686565
Energy: 0.9133168852359637
Energy: 1.1406023974478323
Energy: 0.9133168852352187
Energy: 1.1406023973874926
Energy: 0.9133168852352187
Energy: 0.9401945820679624
Energy: 1.0191048739695028
Energy: 0.9401945820679624
Energy: 1.0191048739709925
Energy: 0.9401945820687072
Energy: 1.0191048739695028
Energy: 1.1065047686576817
Energy: 0.9409563378238273
Energy: 1.1065047686576817
Energy: 0.9409563378238273
Energy: 1.1065047686636413
Energy: 0.9409563378238273
Energy: 0.9591959174342609
Energy: 1.0591998082176073
Energy: 0.959195917433516
Energy: 1.059199808218352
Energy: 0.9591959174342609
Energy: 1.059199808219808
Energy: 1.0301266814084662
Energy: 0.9069582853538406
Energy: 1.0301266814077212
Energy: 0.9069582853545856
Energy: 1.0301266814069765
Energy: 0.9069582853545856
Energy: 0.9451083682886892
Energy: 0.9702119993842556
Energy: 0.9451083682894342
Energy: 0.9702119993842556
Energy: 0.9451083682886892
Energy: 0.9702119993842556
Energy: 0.9338017037595759
Energy: 1.0474405462103058
Energy: 0.9338017037595759
Energy: 1.0474405462125407
Energy: 0.9338017037603209
Energy: 1.0474405462103058
Energy: 1.040677143470833
Energy: 0.9707054606959269
Energy: 1.040677143471578
Energy: 0.9707054606959269
Energy: 1.040677143470833
Energy: 0.9707054606959269
Energy: 0.8976524855858353
Energy: 1.0399536115103574
Energy: 0.8976524855858353
Energy: 1.039953611501418
Energy: 0.8976524855858353
Energy: 1.0399536115058876
Energy: 1.1424511528548411
Energy: 0.9072031294520084
Energy: 1.1424511528548411
Energy: 0.9072031294527534
Energy: 1.142451152855586
Energy: 0.9072031294520084
Energy: 0.8928296732385971
Energy: 1.3017959665147936
Energy: 0.892829673237852
Energy: 1.3017959665147936
Energy: 0.8928296732385971
Energy: 1.3017959665147936
Energy: 1.1339560122757757
Energy: 0.8826811807279882
Energy: 1.1339560122750307
Energy: 0.8826811807272432
Energy: 1.1339560122757757
Energy: 0.8826811807257534
Energy: 0.9199371365244292
Energy: 1.0317925330981903
Energy: 0.9199371365251741
Energy: 1.0317925330981903
Energy: 0.9199371365244292
Energy: 1.0317925330981903
Energy: 1.115977274354737
Energy: 0.9024921988142324
Energy: 1.115977274353992
Energy: 0.9024921988142324
Energy: 1.1159772743554817
Energy: 0.9024921988149772
Energy: 1.1343390422051312
Energy: 1.018322445139575
Energy: 1.1343390422043862
Energy: 1.0183224451455344
Energy: 1.1343390422051312
Energy: 1.0183224451418096
Energy: 0.9633651087163893
Energy: 0.9767944160826101
Energy: 0.9633651087171341
Energy: 0.976794416083355
Energy: 0.9633651087163893
Energy: 0.9767944160826101
Energy: 0.9634038183646537
Energy: 0.9429171121888966
Energy: 0.9634038183646537
Energy: 0.9429171121874068
Energy: 0.9634038183668887
Energy: 0.9429171121866617
Energy: 0.8959318315773452
Energy: 0.9397377259719869
Energy: 0.8959318315803252
Energy: 0.9397377259690072
Energy: 0.8959318315803252
Energy: 0.9397377259697521
Energy: 1.0270123875953203
Energy: 0.9071429340405823
Energy: 1.0270123875953203
Energy: 0.9071429340405823
Energy: 1.0270123875968102
Energy: 0.9071429340376364
Energy: 0.9223042845439031
Energy: 1.224160188964241
Energy: 0.9223042845461379
Energy: 1.2241601889620064
Energy: 0.9223042845446481
Energy: 1.2241601889709457
Energy: 1.0087372598893416
Energy: 0.9728950112647939
Energy: 1.0087372598878517
Energy: 0.9728950112655389
Energy: 1.0087372598885969
Energy: 0.9728950112655389
Energy: 0.892555689198046
Energy: 1.1900976119267357
Energy: 0.892555689197301
Energy: 1.1900976119267357
Energy: 0.892555689198046
Energy: 1.1900976119282256

minimum gb energy = 0.8826811807257534 eV
minimum distance =  2.33157190526804 Angstroms
sigma value = 33


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

Energy: 1.1041637494570546
Energy: 1.0682837405286052
Energy: 0.9893128512920428
Energy: 1.0682837405336898
Energy: 1.1041637494545122
Energy: 1.0682837405324188
Energy: 1.2096299884507682
Energy: 0.9453340978042196
Energy: 1.2096299884533104
Energy: 0.9453340978071855
Energy: 1.209629988448226
Energy: 0.9453340978105753
Energy: 0.9543023612670802
Energy: 0.8644478812040125
Energy: 0.9543023612759781
Energy: 0.864447881215029
Energy: 0.9543023612755545
Energy: 0.8644478812069784
Energy: 1.0102923233612746
Energy: 1.0677990362997856
Energy: 1.0102923233566137
Energy: 1.067799036294277
Energy: 1.0102923233663592
Energy: 1.0677990362972432
Energy: 1.0099335042793216
Energy: 0.9792070026859118
Energy: 1.009933504277627
Energy: 0.9792070026820984
Energy: 1.0099335042759319
Energy: 0.9792070026795561
Energy: 0.9581058672881406
Energy: 0.9542990380867611
Energy: 0.9581058672817847
Energy: 0.9542538324231454
Energy: 0.9581058672839035
Energy: 0.9542990380880321
Energy: 1.1961593627205798
Energy: 1.0651014340009377
Energy: 1.1961593627176137
Energy: 0.9888155346803787
Energy: 1.1961593627129528
Energy: 1.0651014340047509
Energy: 0.8803033361005439
Energy: 0.9558311672239486
Energy: 0.8803033361009677
Energy: 0.9558311671845431
Energy: 0.8803033361043574
Energy: 0.9558311671743739
Energy: 0.9371456815845405
Energy: 0.958016607627974
Energy: 0.9371456815858117
Energy: 0.9580166076250081
Energy: 0.9371456815883539
Energy: 0.9580166076313638
Energy: 0.939296891899694
Energy: 0.9680178765801639
Energy: 0.9392967024587079
Energy: 0.9680178765949553
Energy: 0.9392968918992702
Energy: 0.9680178766017348
Energy: 0.9524420454770931
Energy: 0.9414106115373782
Energy: 0.9524420454669624
Energy: 0.9414106115310225
Energy: 0.9524420454644201
Energy: 0.9414106115424627
Energy: 0.955339549786752
Energy: 1.0174594780824118
Energy: 0.9553466436552213
Energy: 1.0174594780811406
Energy: 0.9553395497863283
Energy: 1.0174594780730901
Energy: 0.9481877290881191
Energy: 0.9452362646696669
Energy: 0.9226557194903044
Energy: 0.9452362646696669
Energy: 0.9481877290864243
Energy: 0.9452362646688195
Energy: 0.98879183043395
Energy: 0.9469942611770243
Energy: 1.065478150063872
Energy: 0.9469942611795666
Energy: 0.9887918304314077
Energy: 0.946994261173211
Energy: 1.022494032259201
Energy: 0.9437282657174089
Energy: 1.0224940322608576
Energy: 0.9437282657161379
Energy: 1.0224940322570826
Energy: 0.9437282657115155
Energy: 0.9544679437767029
Energy: 0.8904918852367297
Energy: 0.9544679437694997
Energy: 0.8904918852384246
Energy: 0.954467943772042
Energy: 0.8904918852396959
Energy: 1.0033362367160676
Energy: 1.0666273947843814
Energy: 1.003336236715644
Energy: 1.0666273947822629
Energy: 1.0033362367215761
Energy: 1.0666273947792968
Energy: 1.009919880646942
Energy: 0.9546111424086385
Energy: 1.0099198806452472
Energy: 0.954434991170524
Energy: 1.0099198806448233
Energy: 0.9546111424103333
Energy: 0.9582784724089829
Energy: 0.9730606229981683
Energy: 0.9582784724077118
Energy: 0.9338646997518385
Energy: 0.9582784724115252
Energy: 0.9730606229990159
Energy: 1.0684601066100459
Energy: 0.9925758696267382
Energy: 1.0684601066117407
Energy: 1.0691503183479372
Energy: 1.068460106617249
Energy: 0.992575869628433
Energy: 0.8796556334685424
Energy: 0.9475234440383165
Energy: 0.8796556334719319
Energy: 0.9475234440421298
Energy: 0.8796556334761307
Energy: 0.9475234440332319
Energy: 0.9817845469812737
Energy: 0.958075048087873
Energy: 0.9817845469846636
Energy: 0.9580750480870256
Energy: 0.9817845469842399
Energy: 0.9580750480840596
Energy: 0.9395272502601649
Energy: 1.0031271618425723
Energy: 0.9395168272730766
Energy: 1.0031271783627123
Energy: 0.939527250261436
Energy: 1.003127181206269
Energy: 0.9524707886141416
Energy: 1.0110542241646312
Energy: 0.9524707886145654
Energy: 1.011054224157428
Energy: 0.9524707886226159
Energy: 1.0110542241536147
Energy: 0.9543147000625625
Energy: 0.9598725216345511
Energy: 0.9543884161347408
Energy: 0.9598725216307377
Energy: 0.9543147000604437
Energy: 0.9598725216277717
Energy: 1.058649560108692
Energy: 1.0228340539106637
Energy: 0.9889633771180312
Energy: 1.0228340539102403
Energy: 1.0586495601002563
Energy: 1.0228340539170195
Energy: 1.0683647318284761
Energy: 0.8682382342169177
Energy: 0.9481654072906521
Energy: 0.8682382341161118
Energy: 1.0683647318289
Energy: 0.8682382341004344
Energy: 0.9544850609720744
Energy: 0.9435917282488929
Energy: 0.9544850609665662
Energy: 0.9435917282501642
Energy: 0.9544850609720744
Energy: 0.9435917282565198
Energy: 1.0926553393850884
Energy: 0.9449137402259443
Energy: 1.0926553393867833
Energy: 0.944913740222131
Energy: 1.0926553393876306
Energy: 0.9449137402225548
Energy: 0.9392943727134091
Energy: 0.9509468049938719
Energy: 0.9392943727146803
Energy: 0.9509468049841264
Energy: 0.939294372710443
Energy: 0.9509468049811605
Energy: 1.2885490714462624
Energy: 0.9581175328114219
Energy: 1.288549071451347
Energy: 0.9580847833049392
Energy: 1.2885490714504995
Energy: 0.9581175328194725
Energy: 0.943825975052951
Energy: 0.9225608393035253
Energy: 0.9438259750631199
Energy: 0.8864944046751666
Energy: 0.9438259750546457
Energy: 0.9225608392522943
Energy: 1.0532330755226422
Energy: 1.069132340668432
Energy: 1.0532330755196762
Energy: 0.9925454466332188
Energy: 1.0532330755285741
Energy: 1.0691323406722455
Energy: 0.9442062216503921
Energy: 1.0223676086453162
Energy: 0.9442062216499684
Energy: 1.0223676086478202
Energy: 0.9442062216436127
Energy: 1.0223676086495148
Energy: 0.8651384600169194
Energy: 0.9543354269894699
Energy: 0.8651384600080212
Energy: 0.9543354269886225
Energy: 0.8651384600097163
Energy: 0.954335426986504
Energy: 1.0697833963839565
Energy: 1.0034254387417174
Energy: 1.0697833963754821
Energy: 1.0034254387531576
Energy: 1.0697833963822618
Energy: 1.0034254387590897
Energy: 0.9546212891052889
Energy: 1.0099499856058891
Energy: 0.9545460178335593
Energy: 1.0099499856024996
Energy: 0.9546212891002043
Energy: 1.0099499855999574
Energy: 0.9729647275943333
Energy: 0.9582145217764018
Energy: 0.9309499776124558
Energy: 0.958214521786571
Energy: 0.9729647275879777
Energy: 0.9582145217797915
Energy: 0.9888143878885494
Energy: 0.968249836307451
Energy: 1.0654425182630316
Energy: 0.9682498360228295
Energy: 0.9888143878872783
Energy: 0.9682498359944405
Energy: 0.9482136852437157
Energy: 0.8803122064173564
Energy: 0.948213685246258
Energy: 0.8803122064182037
Energy: 0.948213685242021
Energy: 0.880312206423712
Energy: 0.9554144307599495
Energy: 0.9361022328399087
Energy: 0.9554144307574073
Energy: 0.9361022328331293
Energy: 0.9554144307586783
Energy: 0.9361022328250787

minimum gb energy = 0.8644478812040125 eV
minimum distance =  2.38461100330412 Angstroms
sigma value = 51


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

Energy: 0.9709630255967326
Energy: 0.9971807183339948
Energy: 0.9709630255967326
Energy: 0.9971807183320537
Energy: 0.9709630255977144
Energy: 0.9971807183320537
Energy: 1.059307576860279
Energy: 0.9618772581920848
Energy: 1.059307576860279
Energy: 0.9618772581920848
Energy: 1.0593075768583156
Energy: 0.9618772581920848
Energy: 0.9168710877882734
Energy: 1.1563524802745928
Energy: 0.9168710877892552
Energy: 1.1563524802745928
Energy: 0.9168710877892552
Energy: 1.1563524802755742
Energy: 0.9859783760838043
Energy: 0.885842359453464
Energy: 0.9859783760779139
Energy: 0.885842359453464
Energy: 0.9859783760838043
Energy: 0.885842359453464
Energy: 1.0103388674255303
Energy: 0.9464648096318783
Energy: 1.0103388674255303
Energy: 0.9464648096308965
Energy: 1.0103388674255303
Energy: 0.9464648096318783
Energy: 1.0106659540610714
Energy: 0.9462700512931161
Energy: 1.0106659540600897
Energy: 0.9462700512921344
Energy: 1.0106659540600897
Energy: 0.9462700512931161
Energy: 1.0337911433237448
Energy: 0.9463720119666157
Energy: 1.0337911433247267
Energy: 0.9463720119666157
Energy: 1.0337911433237448
Energy: 0.9463720119666157
Energy: 0.9289615327241271
Energy: 0.9469113430160883
Energy: 0.9289615327231454
Energy: 0.9469113430151065
Energy: 0.9289615327241271
Energy: 0.9469113430151065
Energy: 1.1636899440960435
Energy: 0.885777332325395
Energy: 1.1636899440930983
Energy: 0.885777332325395
Energy: 1.1636899440950619
Energy: 0.885777332325395
Energy: 0.9022145995421528
Energy: 1.1400246754485694
Energy: 0.9022145995401891
Energy: 1.1400246754475876
Energy: 0.902214599541171
Energy: 1.140024675445624
Energy: 1.0483674699233985
Energy: 0.9000471199185398
Energy: 1.0483674699243803
Energy: 0.9000471199185398
Energy: 1.0483674699233985
Energy: 0.9000471199185398
Energy: 0.9673761553997707
Energy: 0.9964674770567423
Energy: 0.9673761553997707
Energy: 0.996467477057724
Energy: 0.9673761553997707
Energy: 0.9964674770567423
Energy: 1.1612606228609659
Energy: 0.9633120194810291
Energy: 1.1612606228590023
Energy: 0.9633120194810291
Energy: 1.1612606228590023
Energy: 0.9633120194800473
Energy: 0.9384443661313683
Energy: 0.940274549015055
Energy: 0.9384443661303866
Energy: 0.9402745490130916
Energy: 0.9384443661303866
Energy: 0.9402745490130916
Energy: 0.9853037534795999
Energy: 0.9947308763620206
Energy: 0.9853037534776363
Energy: 0.9947308763620206
Energy: 0.9853037534795999
Energy: 0.9947308763620206
Energy: 1.010696589645072
Energy: 0.946321284970566
Energy: 1.0106965896470355
Energy: 0.9463212849715479
Energy: 1.0106965896460536
Energy: 0.9463212849715479
Energy: 1.0104261758267987
Energy: 1.028274654766659
Energy: 1.010426175825817
Energy: 1.028274654766659
Energy: 1.010426175825817
Energy: 1.028274654766659
Energy: 0.9823818873635686
Energy: 0.9468578094061912
Energy: 0.9823818873635686
Energy: 0.9468578094061912
Energy: 0.9823818873635686
Energy: 0.9468578094061912

minimum gb energy = 0.885777332325395 eV
minimum distance =  2.24705140565989 Angstroms
sigma value = 19


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

Energy: 0.902952914548601
Energy: 0.930762421727202
Energy: 0.8129280654704711
Energy: 0.9307624217277845
Energy: 0.9029529145509304
Energy: 0.930762421723708
Energy: 1.0518513509154226
Energy: 0.9962393513201486
Energy: 1.0518513509165874
Energy: 0.9962393513207309
Energy: 1.051851350914258
Energy: 0.9962393513195662
Energy: 0.8776684795987547
Energy: 0.9134829517355741
Energy: 0.8776684795987547
Energy: 0.913482951736739
Energy: 0.877668479599337
Energy: 0.913482951736739
Energy: 0.9495593403365828
Energy: 0.8775621891471761
Energy: 0.9495593403360005
Energy: 0.877563190530981
Energy: 0.9495593403354181
Energy: 0.8775621891442642
Energy: 0.8949359266528948
Energy: 0.8575108813207115
Energy: 0.8949359266511479
Energy: 0.8119987743777554
Energy: 0.8949359266534772
Energy: 0.8575108813189646
Energy: 0.809601483588033
Energy: 0.8576032835791578
Energy: 0.8096014835903622
Energy: 0.8122397519075917
Energy: 0.809601483591527
Energy: 0.8576032835785754
Energy: 0.8548660297190916
Energy: 0.8776283701935472
Energy: 0.854866029721421
Energy: 0.8776283701906356
Energy: 0.8548660297225856
Energy: 0.8776283701906356
Energy: 0.8776560056475956
Energy: 1.0833730025607546
Energy: 0.877652987038993
Energy: 1.0833730025613368
Energy: 0.8776560056470134
Energy: 1.083373002557843
Energy: 0.9284552455832729
Energy: 0.9365590776677167
Energy: 0.9284552455844375
Energy: 0.9365590776688815
Energy: 0.928455245582108
Energy: 0.9365590776671343
Energy: 0.8129280654687241
Energy: 0.9307624217283668
Energy: 0.8129280654698887
Energy: 0.9307624217277845
Energy: 0.8129280654716358
Energy: 0.9307624217248727
Energy: 1.051851350914258
Energy: 0.9962393513213131
Energy: 1.0518513509160052
Energy: 0.9962393513207309
Energy: 1.0518513509154226
Energy: 0.9962393513218956
Energy: 0.8776684795964254
Energy: 0.9134829517361566
Energy: 0.8776684795981725
Energy: 0.913482951736739
Energy: 0.8776684795999194
Energy: 0.913482951736739
Energy: 0.9495593403360005
Energy: 0.8775631682074955
Energy: 0.9495593403365828
Energy: 0.8775693150547823
Energy: 0.9495593403354181
Energy: 0.877563168205166
Energy: 0.8949359266534772
Energy: 0.8119987743742613
Energy: 0.8949359266511479
Energy: 0.8575908213016729
Energy: 0.8949359266528948
Energy: 0.8119987743806668
Energy: 0.8096014835891975
Energy: 0.8122397519081741
Energy: 0.8096014835909446
Energy: 0.8576256520802286
Energy: 0.8096014835921094
Energy: 0.8122397519070095
Energy: 0.8548660297190916
Energy: 0.8776283701923825
Energy: 0.8548660297225856
Energy: 0.8776283701894708
Energy: 0.8548660297220033
Energy: 0.8776283701906356
Energy: 0.8776651021947047
Energy: 1.0833730025625017
Energy: 0.8776634984450928
Energy: 1.0833730025619195
Energy: 0.8776651021976162
Energy: 1.0833730025584252
Energy: 0.9085558635086346
Energy: 0.9365590776665521
Energy: 0.9284552455838551
Energy: 0.936559077668299
Energy: 0.908555863503976
Energy: 0.9365590776665521
Energy: 0.9029529145497657
Energy: 0.930762421727202
Energy: 0.8129280654681417
Energy: 0.930762421727202
Energy: 0.9029529145497657
Energy: 0.930762421723708
Energy: 1.0518513509171696
Energy: 0.9962393513207309
Energy: 1.051851350917752
Energy: 0.9962393513213131
Energy: 1.0518513509154226
Energy: 0.9962393513207309
Energy: 0.8776684795975901
Energy: 0.9134829517349919
Energy: 0.877668479599337
Energy: 0.9134829517361566
Energy: 0.8776684796005018
Energy: 0.913482951736739
Energy: 0.9495593403365828
Energy: 0.8775621891460111
Energy: 0.9495593403360005
Energy: 0.8775631905321457
Energy: 0.9495593403348359
Energy: 0.8775621891465937
Energy: 0.8949359266528948
Energy: 0.8575108813218763
Energy: 0.8949359266505656
Energy: 0.8119987743765904
Energy: 0.8949359266528948
Energy: 0.8575108813212938
Energy: 0.8096014835862858
Energy: 0.8576032835791578
Energy: 0.80960148358978
Energy: 0.8122397519058447
Energy: 0.809601483591527
Energy: 0.8576032835768284
Energy: 0.8548660297173446
Energy: 0.8776283701935472
Energy: 0.8548660297208386
Energy: 0.8776283701906356
Energy: 0.854866029721421
Energy: 0.8776283701906356
Energy: 0.8776560056481781
Energy: 1.0833730025619195
Energy: 0.877652987038993
Energy: 1.0833730025601724
Energy: 0.8776560056487605
Energy: 1.083373002557843
Energy: 0.9284552455844375
Energy: 0.9365590776665521
Energy: 0.9284552455850199
Energy: 0.9365590776694637
Energy: 0.928455245582108
Energy: 0.9365590776671343
Energy: 0.8129280654698887
Energy: 0.9307624217277845
Energy: 0.8129280654693064
Energy: 0.930762421727202
Energy: 0.8129280654733827
Energy: 0.930762421723708
Energy: 1.0518513509154226
Energy: 0.9962393513201486
Energy: 1.0518513509165874
Energy: 0.9962393513207309
Energy: 1.0518513509165874
Energy: 0.9962393513213131
Energy: 0.8776684795975901
Energy: 0.9134829517355741
Energy: 0.8776684795975901
Energy: 0.9134829517349919
Energy: 0.8776684796005018
Energy: 0.9134829517361566

minimum gb energy = 0.8096014835862858 eV
minimum distance =  2.33580525841176 Angstroms
sigma value = 27


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

Energy: 0.8198341011018839
Energy: 0.8090952334045927
Energy: 0.8198341011018839
Energy: 0.8090952334045927
Energy: 0.8198341011018839
Energy: 0.8090952334045927
Energy: 0.9472075199973381
Energy: 0.8502852222418386
Energy: 0.9472075199973381
Energy: 0.8502852222418386
Energy: 0.9472075199973381
Energy: 0.8502852222418386
Energy: 0.8316222584703249
Energy: 0.8971507533916991
Energy: 0.8316222584703249
Energy: 0.8971507533902727
Energy: 0.8316222584703249
Energy: 0.8971507533888463
Energy: 0.9306413092951116
Energy: 0.7859017252609682
Energy: 0.930641309296538
Energy: 0.7859017252609682
Energy: 0.9306413092951116
Energy: 0.7859017252623948
Energy: 0.930443216422841
Energy: 0.7858634832660335
Energy: 0.9304432164242674
Energy: 0.7858634832660335
Energy: 0.930443216422841
Energy: 0.7858634832660335
Energy: 0.9273814889301705
Energy: 0.95249709253294
Energy: 0.9273814889301705
Energy: 0.95249709253294
Energy: 0.9273814889301705
Energy: 0.9524970925343664
Energy: 0.7863744776380259
Energy: 0.8524249887723305
Energy: 0.7863744776380259
Energy: 0.8524249887723305
Energy: 0.7863744776394525
Energy: 0.8524249887723305
Energy: 0.8191519593547232
Energy: 0.8089469198780164
Energy: 0.8191519593547232
Energy: 0.8089469198780164
Energy: 0.8191519593547232
Energy: 0.8089469198780164
Energy: 0.9484765259001872
Energy: 0.8317270216924607
Energy: 0.9484765259016135
Energy: 0.8317270216924607
Energy: 0.9484765259001872
Energy: 0.8317270216924607
Energy: 0.8989453117659042
Energy: 0.9487441661759316
Energy: 0.8989453117659042
Energy: 0.9487441661759316
Energy: 0.8989453117659042
Energy: 0.9487441661759316
Energy: 0.8096846572910148
Energy: 0.7871145382960395
Energy: 0.8096846572924411
Energy: 0.787114538297466
Energy: 0.8096846572910148
Energy: 0.7871145382960395
Energy: 0.9735080473713654
Energy: 0.8861106441791137
Energy: 0.9735080473713654
Energy: 0.8861106441791137
Energy: 0.9735080473713654
Energy: 0.8861106441776873

minimum gb energy = 0.7858634832660335 eV
minimum distance =  2.21946382036538 Angstroms
sigma value = 9


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

Energy: 0.809837994664709
Energy: 0.8091497237674364
Energy: 0.8098379946655104
Energy: 0.8091497237670358
Energy: 0.8098379946651098
Energy: 0.8091497237670358
Energy: 1.0377321290187178
Energy: 0.7814655350358644
Energy: 1.0377321290219244
Energy: 0.7814655350358644
Energy: 1.0377321290215233
Energy: 0.7814655350358644
Energy: 0.7334315479434569
Energy: 0.9162012561268142
Energy: 0.7334315479422545
Energy: 0.9162012561240086
Energy: 0.7334315479438577
Energy: 0.9162012561220045
Energy: 0.7606279224766612
Energy: 0.712079653459919
Energy: 0.7606279224746573
Energy: 0.7120796534603199
Energy: 0.7606279224782644
Energy: 0.7120796534591175
Energy: 0.8101834917665486
Energy: 0.7792003578036228
Energy: 0.8101834917685524
Energy: 0.7792003578028212
Energy: 0.8101834917665486
Energy: 0.7792003578024204
Energy: 0.7955619120654559
Energy: 0.7970359262291968
Energy: 0.7955619120646543
Energy: 0.7970359262279947
Energy: 0.7955619120654559
Energy: 0.7970359262283955
Energy: 0.752111635049886
Energy: 0.8412709786831408
Energy: 0.7521116350490843
Energy: 0.8412709786839424
Energy: 0.7521116350502868
Energy: 0.8412709786839424
Energy: 0.7029767778420158
Energy: 0.8428217310753698
Energy: 0.7029767778428174
Energy: 0.8428217310757706
Energy: 0.7029767778428174
Energy: 0.8428217310757706
Energy: 0.9377572923414719
Energy: 0.779631934793351
Energy: 0.937757292339468
Energy: 0.779631934793351
Energy: 0.9377572923402697
Energy: 0.7796319347941526
Energy: 0.8081100114232163
Energy: 0.8605617051067561
Energy: 0.8081100114232163
Energy: 0.8605617051075578
Energy: 0.8081100114248194
Energy: 0.8605617051019466
Energy: 0.7591955686160348
Energy: 0.718839468202479
Energy: 0.7591955686176379
Energy: 0.7188394682020783
Energy: 0.7591955686164357
Energy: 0.7188394682028799
Energy: 0.7698321049472309
Energy: 0.8802096745908295
Energy: 0.7698321049472309
Energy: 0.8802096745904288
Energy: 0.7698321049472309
Energy: 0.8802096745904288
Energy: 0.7672031824289819
Energy: 0.7865605263760266
Energy: 0.767203182432589
Energy: 0.7865605263760266
Energy: 0.7672031824382002
Energy: 0.7865605263760266
Energy: 0.8043921618926373
Energy: 1.027341699554356
Energy: 0.8043921618930381
Energy: 1.027341699554356
Energy: 0.8043921618942405
Energy: 1.027341699553955
Energy: 0.7324069072022356
Energy: 0.8234250885598875
Energy: 0.7324069072018349
Energy: 0.8234250885598875
Energy: 0.7324069072018349
Energy: 0.8234250885602883
Energy: 0.7424529775031962
Energy: 0.753117790882568
Energy: 0.7424529775052
Energy: 0.7531177908829688
Energy: 0.7424529775007912
Energy: 0.753117790884572
Energy: 0.9280636094743386
Energy: 0.7121058431759105
Energy: 0.9280636094739377
Energy: 0.7121058431767121
Energy: 0.9280636094751402
Energy: 0.7121058431811209
Energy: 0.7467157504332849
Energy: 0.7825502360531319
Energy: 0.7467157504392968
Energy: 0.7825502360535327
Energy: 0.7467157504328841
Energy: 0.7825502360531319
Energy: 0.6994244269646546
Energy: 0.9639266122919636
Energy: 0.699424426965857
Energy: 0.9639266122907613
Energy: 0.6994244269654563
Energy: 0.9639266122907613
Energy: 0.8594340267296511
Energy: 0.8539592631758807
Energy: 0.8594340267300519
Energy: 0.8539592631758807
Energy: 0.8594340267288495
Energy: 0.8539592631758807
Energy: 0.6994345565559585
Energy: 0.9639673445006
Energy: 0.6994345565559585
Energy: 0.9639673445001989
Energy: 0.6994345565567601
Energy: 0.9639673445010006
Energy: 0.7467296496049886
Energy: 0.7824958859156165
Energy: 0.7467296496045878
Energy: 0.782495885914815
Energy: 0.7467296496053893
Energy: 0.7824958859156165
Energy: 0.9280059600151294
Energy: 0.7120904590152428
Energy: 0.9280059600167326
Energy: 0.7120904590140404
Energy: 0.9280059600151294
Energy: 0.712090459016846
Energy: 0.7427213023107258
Energy: 0.7970242942229078
Energy: 0.7427213023099242
Energy: 0.7970242942209038
Energy: 0.7427213023143329
Energy: 0.7970242942197016
Energy: 0.7321950950448444
Energy: 0.8234315502333971
Energy: 0.7321950950444435
Energy: 0.8234315502341987
Energy: 0.7321950950444435
Energy: 0.8234315502337979
Energy: 0.8043883368680391
Energy: 0.8084291010796082
Energy: 0.8043883368672375
Energy: 0.8084291010808107
Energy: 0.8043883368676383
Energy: 0.808429101080009
Energy: 0.7671504680522684
Energy: 0.786518503368717
Energy: 0.7671504680550739
Energy: 0.7865185033679156
Energy: 0.767150468057078
Energy: 0.7865185033663123
Energy: 0.7699582674975932
Energy: 0.7797813927780385
Energy: 0.7699582674991963
Energy: 0.7797813927772369
Energy: 0.7699582674979939
Energy: 0.7797813927772369
Energy: 0.7591953216912842
Energy: 0.7191280329906362
Energy: 0.7591953216884787
Energy: 0.7191280329906362
Energy: 0.7591953216908834
Energy: 0.7191280329906362
Energy: 0.8081257894073348
Energy: 0.934933899346094
Energy: 0.808125789405331
Energy: 0.934933899346094
Energy: 0.8081257894061323
Energy: 0.9349338993464947
Energy: 0.9377591771551
Energy: 0.7799314980884111
Energy: 0.9377591771551
Energy: 0.7799314980884111
Energy: 0.9377591771563025
Energy: 0.7799314980884111
Energy: 0.7029600608018571
Energy: 0.8427771514660771
Energy: 0.7029600608034603
Energy: 0.8427771514656763
Energy: 0.7029600608014563
Energy: 0.8427771514656763
Energy: 0.7521160452778876
Energy: 0.841311065193174
Energy: 0.7521160452790899
Energy: 0.841311065193174
Energy: 0.7521160452782883
Energy: 0.8413110651927732
Energy: 0.7956631795151253
Energy: 0.7850916128865981
Energy: 0.7956631795163277
Energy: 0.7850916128873998
Energy: 0.7956631795147245
Energy: 0.7850916128865981
Energy: 0.8101607442979432
Energy: 0.7792137619944903
Energy: 0.810160744298344
Energy: 0.7792137619936886
Energy: 0.8101607442975424
Energy: 0.7792137619936886
Energy: 0.7606639747154302
Energy: 0.7119319129804378
Energy: 0.7606639747170334
Energy: 0.7119319129804378
Energy: 0.7606639747154302
Energy: 0.711931912980037
Energy: 0.7334080146748495
Energy: 0.9169866321164905
Energy: 0.733408014676052
Energy: 0.9169866321164905
Energy: 0.7334080146772542
Energy: 0.9169866321148873
Energy: 1.0376973572959705
Energy: 0.7840521018700629
Energy: 1.0376973572983754
Energy: 0.7840521018700629
Energy: 1.0376973572979744
Energy: 0.784052101869662
Energy: 0.8098379946627049
Energy: 0.8091497237702421
Energy: 0.8098379946615024
Energy: 0.8091497237706429
Energy: 0.8098379946611016
Energy: 0.8091497237706429
Energy: 1.0377321290159123
Energy: 0.7814655350334594
Energy: 1.0377321290167139
Energy: 0.7814655350342611
Energy: 1.0377321290159123
Energy: 0.7814655350338603
Energy: 0.7334315479462624
Energy: 0.9162012561276157
Energy: 0.7334315479458615
Energy: 0.9162012561276157
Energy: 0.7334315479458615
Energy: 0.9162012561252111
Energy: 0.7606279224798675
Energy: 0.7120796534579151
Energy: 0.760627922477062
Energy: 0.7120796534575143
Energy: 0.7606279224802684
Energy: 0.7120796534587166
Energy: 0.8101834917705565
Energy: 0.7792003578008172
Energy: 0.8101834917733621
Energy: 0.7792003578020196
Energy: 0.8101834917705565
Energy: 0.7792003578016189

minimum gb energy = 0.6994244269646546 eV
minimum distance =  2.31914610955154 Angstroms
sigma value = 57


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

Energy: 0.381389424039574
Energy: 0.38986598170269054
Energy: 0.38138942404139864
Energy: 0.38986598170633996
Energy: 0.381389424039574
Energy: 0.38986598170360287
Energy: 0.4302926267716881
Energy: 0.38178267748943784
Energy: 0.43029262677077573
Energy: 0.3817826774930873
Energy: 0.4302926267716881
Energy: 0.3817826774949119
Energy: 0.4074246736498854
Energy: 0.44412424524500277
Energy: 0.40742467364806073
Energy: 0.4441242464159677
Energy: 0.4074246736498854
Energy: 0.44412427446749586
Energy: 0.3917262764234528
Energy: 0.38093728711644753
Energy: 0.3917262764261899
Energy: 0.3809372871210093
Energy: 0.3917262764280146
Energy: 0.38093728711097347
Energy: 0.42991744537402166
Energy: 0.42885378388388296
Energy: 0.4299174453731093
Energy: 0.4288588251953824
Energy: 0.4299174453731093
Energy: 0.42885848962915485
Energy: 0.38109071952996515
Energy: 0.40695432326772807
Energy: 0.3810907195263158
Energy: 0.40695540670600333
Energy: 0.38109071953087753
Energy: 0.40695739815457666
Energy: 0.38109269803799894
Energy: 0.406820121740959
Energy: 0.3810926980316124
Energy: 0.406820121740959
Energy: 0.38109269803070006
Energy: 0.406820121740959
Energy: 0.4298035710334826
Energy: 0.4290757881407988
Energy: 0.4298035710334826
Energy: 0.42907169521433325
Energy: 0.4298035710334826
Energy: 0.42907487600214
Energy: 0.39172070593532016
Energy: 0.38093193794098307
Energy: 0.391720705929846
Energy: 0.3809319379455448
Energy: 0.3917207059316708
Energy: 0.3809319379373336
Energy: 0.40761597258688104
Energy: 0.4442667896696996
Energy: 0.40761597258596877
Energy: 0.44426678991226143
Energy: 0.40761597258688104
Energy: 0.4442667896687873
Energy: 0.42978171159145256
Energy: 0.3820687833780937
Energy: 0.42978171161057055
Energy: 0.382068783379006
Energy: 0.4297817116224312
Energy: 0.38206878338174305
Energy: 0.381389424039574
Energy: 0.38986598170269054
Energy: 0.381389424039574
Energy: 0.38986598170360287
Energy: 0.381389424039574
Energy: 0.38986598170269054
Energy: 0.4302926267716881
Energy: 0.38178267749399963
Energy: 0.430292626768951
Energy: 0.38178267749126255
Energy: 0.430292626768951
Energy: 0.381782677488567
Energy: 0.40742467364806073
Energy: 0.44412425948054607
Energy: 0.40742467364806073
Energy: 0.4441242597523032
Energy: 0.4074246736498854
Energy: 0.4441242435423842
Energy: 0.39172627642892693
Energy: 0.38093728710641167
Energy: 0.39172627643440106
Energy: 0.38093728711644753
Energy: 0.39172627642710217
Energy: 0.3809372871173599
Energy: 0.4299174453721969
Energy: 0.42885101391268576
Energy: 0.4299174453731093
Energy: 0.4288529765527674
Energy: 0.4299174453731093
Energy: 0.42885622733542367
Energy: 0.3810907195336146
Energy: 0.40694407726633647
Energy: 0.38109071953452694
Energy: 0.40694214906874016
Energy: 0.3810907195354393
Energy: 0.40687685840054383
Energy: 0.38109269802522594
Energy: 0.406820121740959
Energy: 0.3810926980270507
Energy: 0.406820121740959
Energy: 0.381092698040736
Energy: 0.406820121740959
Energy: 0.42980357103257033
Energy: 0.4290789338240414
Energy: 0.4298035710334826
Energy: 0.42907906238057547
Energy: 0.4298035710334826
Energy: 0.4290747150978441

minimum gb energy = 0.3809319379373336 eV
minimum distance =  2.46972015102127 Angstroms
sigma value = 11


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

Energy: 0.6428137353845805
Energy: 0.7717402988117106
Energy: 0.6428137353819073
Energy: 0.7717402988117106
Energy: 0.6428137353859171
Energy: 0.7717402988117106
Energy: 0.8099520427917103
Energy: 0.7664426436063323
Energy: 0.8099520427950518
Energy: 0.7664426436063323
Energy: 0.8099520427923785
Energy: 0.7664426436063323
Energy: 0.8268568358707831
Energy: 0.9841492733658715
Energy: 0.8268568358687781
Energy: 0.9841492733658715
Energy: 0.8268568358721197
Energy: 0.9841492733665399
Energy: 0.8900796343957602
Energy: 0.6177402239830948
Energy: 0.8900796343950919
Energy: 0.6177402239837633
Energy: 0.8900796343957602
Energy: 0.6177402239824266
Energy: 0.7516712077214208
Energy: 0.6008397824993917
Energy: 0.7516712077240941
Energy: 0.60083978250006
Energy: 0.7516712077207526
Energy: 0.6008397824993917
Energy: 0.7000170166602138
Energy: 0.7737014978752915
Energy: 0.7000170166595453
Energy: 0.7737014978752915
Energy: 0.7000170166608821
Energy: 0.7737014978759599
Energy: 0.5956864720197356
Energy: 0.8211023951193869
Energy: 0.5956864720150573
Energy: 0.8211023951193869
Energy: 0.5956864720197356
Energy: 0.8211023951193869
Energy: 0.7651197890820765
Energy: 0.5806129286241309
Energy: 0.7651197890860862
Energy: 0.5806129286234626
Energy: 0.7651197890814081
Energy: 0.5806129286241309
Energy: 0.7599186025363773
Energy: 0.583655672340012
Energy: 0.7599186025363773
Energy: 0.5836556723406803
Energy: 0.7599186025363773
Energy: 0.583655672340012
Energy: 0.5876767046613384
Energy: 0.9775787233272285
Energy: 0.58767670466067
Energy: 0.9775787233272285
Energy: 0.5876767046626751
Energy: 0.9775787233278969
Energy: 0.7088385667315048
Energy: 0.875032951460477
Energy: 0.7088385667321732
Energy: 0.8750329514624818
Energy: 0.7088385667335099
Energy: 0.8750329514618136
Energy: 0.7526124070014161
Energy: 0.6022253604843922
Energy: 0.7526124070014161
Energy: 0.6022253604850606
Energy: 0.7526124070007477
Energy: 0.6022253604843922
Energy: 0.7763218408385592
Energy: 0.6210705254196571
Energy: 0.7763218408392275
Energy: 0.6210705254189888
Energy: 0.7763218408392275
Energy: 0.6210705254203256
Energy: 0.860279010582625
Energy: 0.9730175318248588
Energy: 0.86027901058463
Energy: 0.9730175318235222
Energy: 0.8602790105852983
Energy: 0.9730175318235222
Energy: 0.8015583911501897
Energy: 0.7665617874969344
Energy: 0.8015583911481847
Energy: 0.7665617874969344
Energy: 0.8015583911481847
Energy: 0.7665617874976027
Energy: 0.6298170888221611
Energy: 0.761983927993932
Energy: 0.6298170888221611
Energy: 0.7619839279932636
Energy: 0.6298170888201563
Energy: 0.761983927993932
Energy: 0.6945567231972524
Energy: 0.7576753000758819
Energy: 0.6945567231972524
Energy: 0.7576753000758819
Energy: 0.6945567231965841
Energy: 0.7576753000752136
Energy: 0.9880605354084345
Energy: 0.8310923248741875
Energy: 0.9880605354091029
Energy: 0.8310923248748557
Energy: 0.9880605354091029
Energy: 0.8310923248741875
Energy: 0.835515281872737
Energy: 0.6151771707576307
Energy: 0.835515281872737
Energy: 0.6151771707596357
Energy: 0.835515281872737
Energy: 0.615177170760304
Energy: 0.7571758624186744
Energy: 0.6803616609781918
Energy: 0.7571758624193428
Energy: 0.6803616609781918
Energy: 0.7571758624180062
Energy: 0.6803616609781918
Energy: 0.5882496117556766
Energy: 0.7619295117750439
Energy: 0.5882496117550081
Energy: 0.7619295117750439
Energy: 0.5882496117570132
Energy: 0.7619295117757122
Energy: 0.7178479503485854
Energy: 0.8205377852818778
Energy: 0.7178479503472488
Energy: 0.8205377852818778
Energy: 0.717847950349922
Energy: 0.8205377852818778
Energy: 0.7632288266609598
Energy: 0.6876047606273897
Energy: 0.7632288266643014
Energy: 0.6876047606267214
Energy: 0.7632288266609598
Energy: 0.6876047606273897
Energy: 0.7612266282121061
Energy: 0.6734129499119963
Energy: 0.7612266282107695
Energy: 0.6734129499119963
Energy: 0.761226628210101
Energy: 0.6734129499119963
Energy: 0.588344750915355
Energy: 0.9397850235454357
Energy: 0.5883447509120133
Energy: 0.9397850235440991
Energy: 0.5883447509160232
Energy: 0.9397850235440991
Energy: 1.0730758201173232
Energy: 0.8753940426181325
Energy: 1.0730758201166548
Energy: 0.8753940426167959
Energy: 1.073075820115318
Energy: 0.8753940426174641

minimum gb energy = 0.5806129286234626 eV
minimum distance =  2.35943788899788 Angstroms
sigma value = 41


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

Energy: 0.7178805976551983
Energy: 0.6745476621485837
Energy: 0.7178805976546715
Energy: 0.6745476621485837
Energy: 0.717880597655725
Energy: 0.6745476621485837
Energy: 0.819838768551253
Energy: 0.8925425054338947
Energy: 0.8198387685523065
Energy: 0.8925425054338947
Energy: 0.8198387685523065
Energy: 0.8925425054344215
Energy: 1.0431655217660298
Energy: 1.0438614628450011
Energy: 1.0431655217660298
Energy: 1.0438614628444745
Energy: 1.0431655217655031
Energy: 1.0438614628444745
Energy: 0.7872281887088906
Energy: 0.6436767589155267
Energy: 0.7872281887088906
Energy: 0.6436767589149999
Energy: 0.7872281887078371
Energy: 0.6436767589149999
Energy: 0.6418841150135381
Energy: 0.6807460376787267
Energy: 0.6418841150130113
Energy: 0.6807460376787267
Energy: 0.6418841150135381
Energy: 0.6807460376787267
Energy: 0.7942248040754187
Energy: 0.9028987244024214
Energy: 0.794224804074892
Energy: 0.9028987244024214
Energy: 0.7942248040743654
Energy: 0.9028987244024214
Energy: 0.6474651315152292
Energy: 0.9115925444203293
Energy: 0.6474651315168094
Energy: 0.9115925444203293
Energy: 0.647465131515756
Energy: 0.9115925444208561
Energy: 0.6396858607787654
Energy: 0.6438450323437852
Energy: 0.6396858607782385
Energy: 0.6438450323437852
Energy: 0.6396858607777118
Energy: 0.6438450323437852
Energy: 0.6508771109244508
Energy: 0.6737398271558704
Energy: 0.6508771109233973
Energy: 0.6737398271553436
Energy: 0.6508771109239241
Energy: 0.6737398271553436
Energy: 0.6801553897079858
Energy: 0.9638360949869251
Energy: 0.6801553897079858
Energy: 0.9638360949874518
Energy: 0.6801553897079858
Energy: 0.9638360949869251
Energy: 0.6807471464882405
Energy: 0.9606189315950062
Energy: 0.6807471464882405
Energy: 0.9606189315955329
Energy: 0.6807471464882405
Energy: 0.9606189315955329
Energy: 0.6331200010082277
Energy: 0.7653560108552848
Energy: 0.6331200010092812
Energy: 0.7653560108552848
Energy: 0.6331200010087544
Energy: 0.7653560108552848
Energy: 0.6400418686109097
Energy: 0.66465755944612
Energy: 0.6400418686109097
Energy: 0.66465755944612
Energy: 0.6400418686103829
Energy: 0.66465755944612
Energy: 0.6202445449196283
Energy: 0.8431154968077842
Energy: 0.6202445449206819
Energy: 0.8431154968072575
Energy: 0.6202445449196283
Energy: 0.8431154968072575
Energy: 0.7920388896207237
Energy: 1.0012157609520156
Energy: 0.7920388896207237
Energy: 1.0012157609520156
Energy: 0.7920388896212505
Energy: 1.0012157609525423
Energy: 0.619461008784316
Energy: 0.7760530068385861
Energy: 0.619461008784316
Energy: 0.7760530068385861
Energy: 0.619461008784316
Energy: 0.7760530068380594
Energy: 0.6479397336217337
Energy: 0.6648273979814772
Energy: 0.6479397336217337
Energy: 0.6648273979814772
Energy: 0.6479397336227872
Energy: 0.6648273979814772
Energy: 0.9072028003576686
Energy: 1.0440467997263343
Energy: 0.9072028003587221
Energy: 1.044046799726861
Energy: 0.9072028003571418
Energy: 1.044046799726861
Energy: 0.8169989973953943
Energy: 0.8900101785271792
Energy: 0.816998997395921
Energy: 0.8900101785271792
Energy: 0.816998997395921
Energy: 0.890010178527706
Energy: 0.6796052518969395
Energy: 0.8942253364170918
Energy: 0.6796052518964129
Energy: 0.8942253364170918
Energy: 0.679605251897993
Energy: 0.8942253364170918
Energy: 0.6531592293886599
Energy: 0.8963959599596455
Energy: 0.6531592293881331
Energy: 0.8963959599591187
Energy: 0.6531592293886599
Energy: 0.8963959599596455
Energy: 0.7953090629966836
Energy: 0.9844718483240035
Energy: 0.7953090629945766
Energy: 0.9844718483240035
Energy: 0.7953090629861725
Energy: 0.9844718483245302
Energy: 0.789183806603817
Energy: 0.6458013728670541
Energy: 0.7891838066022369
Energy: 0.6458013728665274
Energy: 0.7891838066032903
Energy: 0.6458013728670541
Energy: 0.6194026816094574
Energy: 0.898698459906548
Energy: 0.6194026816094574
Energy: 0.9335735255249414
Energy: 0.6194026816099842
Energy: 0.8986984599070748
Energy: 0.625625993288479
Energy: 0.9069812734759476
Energy: 0.6256259932874255
Energy: 0.9069812734759476
Energy: 0.6256259932890058
Energy: 0.9069812734759476
Energy: 0.6474631907298803
Energy: 0.6486511182878647
Energy: 0.6474631907293537
Energy: 0.6486511182883914
Energy: 0.6474631907298803
Energy: 0.6486511182883914
Energy: 0.6436050922701999
Energy: 0.6456736088576673
Energy: 0.6436050922701999
Energy: 0.6456736088576673
Energy: 0.6436050922696732
Energy: 0.6456736088587208
Energy: 0.6517136327927636
Energy: 0.8906238464149157
Energy: 0.6517136327922367
Energy: 0.8906238464149157
Energy: 0.6517136327911832
Energy: 0.8906238464149157
Energy: 0.6798809916344668
Energy: 0.8932666515826605
Energy: 0.679880991636047
Energy: 0.8932666515821338
Energy: 0.6798809916349935
Energy: 0.8932666515821338
Energy: 0.8735234985601649
Energy: 0.6197727336607224
Energy: 0.8735234985606916
Energy: 0.6197727336612491
Energy: 0.8735234985601649
Energy: 0.6197727336601956
Energy: 0.6361546359013214
Energy: 0.7622757407995144
Energy: 0.6361546359007946
Energy: 0.7622757407989876
Energy: 0.6361546359013214
Energy: 0.7622757407995144
Energy: 0.6580874416849732
Energy: 0.6643495725653457
Energy: 0.6580874416849732
Energy: 0.6643495725653457
Energy: 0.6580874416844466
Energy: 0.6643495725653457
Energy: 0.6251332043608654
Energy: 0.7755945163048437
Energy: 0.6251332043613921
Energy: 0.7755945163053705
Energy: 0.6251332043603386
Energy: 0.7755945163048437

minimum gb energy = 0.6194026816094574 eV
minimum distance =  2.41807228736286 Angstroms
sigma value = 33


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

Energy: 0.7368727421985273
Energy: 0.7003354309359897
Energy: 0.736872742200006
Energy: 0.7003354309411651
Energy: 0.736872742196309
Energy: 0.7003354309415348
Energy: 0.9264933523478408
Energy: 0.6741376170613316
Energy: 0.9264933523530163
Energy: 0.6741376170664735
Energy: 0.9264933523533859
Energy: 0.6741376170624407
Energy: 0.9068249374299613
Energy: 1.0113746065108857
Energy: 0.9068249374329187
Energy: 1.011374606504971
Energy: 0.9068249374321794
Energy: 1.0113746065071891
Energy: 0.8986999954817688
Energy: 0.6791238963511388
Energy: 0.8986999954732663
Energy: 0.679123896344888
Energy: 0.8986999954825081
Energy: 0.6791238963434093
Energy: 0.6929274230939515
Energy: 1.0596474720230102
Energy: 0.6929274230891457
Energy: 1.0596474720281857
Energy: 0.6929274230928424
Energy: 1.0596474720163895
Energy: 0.8967814684407653
Energy: 0.6965773359075261
Energy: 0.8967814684448318
Energy: 0.6965773359127015
Energy: 0.8967814684503435
Energy: 0.6965773359104834
Energy: 0.693483768371583
Energy: 0.743741370186784
Energy: 0.693483768365668
Energy: 0.7437413701923291
Energy: 0.6934837683701043
Energy: 0.7437413702034195
Energy: 0.7199265289775376
Energy: 0.728549074975436
Energy: 0.7199265289797557
Energy: 0.7285490749880049
Energy: 0.7199265289779072
Energy: 0.7285490749798721
Energy: 1.0612162415678337
Energy: 0.7111012233028797
Energy: 1.06121624156044
Energy: 0.7111012233065764
Energy: 1.0612162415663549
Energy: 0.7111012233058371
Energy: 0.9291071328632805
Energy: 0.6921482240497179
Energy: 0.9291071328643895
Energy: 0.6921482240504574
Energy: 0.9291071328599535
Energy: 0.6921482240519361
Energy: 0.7186839299460744
Energy: 0.7173519788471021
Energy: 0.7186839299394202
Energy: 0.7173519788474719
Energy: 0.7186839299372021
Energy: 0.7173519788522777
Energy: 1.0631423968858351
Energy: 0.6789240830206501
Energy: 1.0631423968843565
Energy: 0.6789240830213895
Energy: 1.0631423968876836
Energy: 0.6789240830169535
Energy: 0.7101935308529709
Energy: 1.0673365502304097
Energy: 0.7101935308518618
Energy: 1.067336550223756
Energy: 0.7101935308577766
Energy: 1.067336550223386
Energy: 0.7368600036284993
Energy: 0.7239219400385126
Energy: 0.7368600036273905
Energy: 0.7239219400418396
Energy: 0.7368600036373382
Energy: 0.7239219400429487
Energy: 0.7298062634328673
Energy: 0.6922063398677242
Energy: 0.729806263431019
Energy: 0.6922063398703119
Energy: 0.7298062634273221
Energy: 0.6922063398603308
Energy: 0.7004970065429067
Energy: 0.9006234997730068
Energy: 0.7004970065488215
Energy: 0.9006234997737461
Energy: 0.7004970065480821
Energy: 0.9006234997770732
Energy: 1.075515044234154
Energy: 0.6933617407121343
Energy: 1.075515044236372
Energy: 0.6933617407191582
Energy: 1.0755150442348933
Energy: 0.6933617407080679
Energy: 0.6762545114539465
Energy: 0.7042437742262193
Energy: 0.6762545114506194
Energy: 0.7042437742262193
Energy: 0.6762545114539465
Energy: 0.7042437742210438
Energy: 0.9246093802293182
Energy: 0.9083542762369828
Energy: 0.9246093802378207
Energy: 0.9083542762384615
Energy: 0.9246093802341239
Energy: 0.908354276235874
Energy: 1.0645410587686506
Energy: 0.7101217498627215
Energy: 1.0645410587708688
Energy: 0.7101217498660487
Energy: 1.064541058771608
Energy: 0.7101217498601338
Energy: 0.6754486547570608
Energy: 0.737208565833273
Energy: 0.6754486547578002
Energy: 0.7372085658391877
Energy: 0.6754486547526246
Energy: 0.7372085658366001
Energy: 0.6722311430568192
Energy: 0.9236844995717738
Energy: 0.6722311430579282
Energy: 0.9236844995654894
Energy: 0.6722311430564495
Energy: 0.9236844995654894
Energy: 0.893133904650352
Energy: 0.8722516402819771
Energy: 0.8931339046507217
Energy: 0.8722516402816074
Energy: 0.8931339046496127
Energy: 0.8722516402786501
Energy: 0.6829472889484636
Energy: 0.8892899586727022
Energy: 0.6829472889521603
Energy: 0.8892899585895919
Energy: 0.6829472889477243
Energy: 0.8892899585585391
Energy: 1.0593633284400028
Energy: 0.6934393372925509
Energy: 1.0593633284392634
Energy: 0.6934393372840483
Energy: 1.0593633284263584
Energy: 0.6934393372866361
Energy: 0.6933496411602371
Energy: 0.8943192672679257
Energy: 0.6933496411598674
Energy: 0.8943192672719922
Energy: 0.6933496411613461
Energy: 0.8943192672682954
Energy: 0.7469019401335093
Energy: 0.6959206361009824
Energy: 0.7469019401372061
Energy: 0.6959206360995037
Energy: 0.7469019401335093
Energy: 0.6959206360946979
Energy: 0.7181881903917072
Energy: 0.6834618457370932
Energy: 0.7181881904312291
Energy: 0.6834618457385719
Energy: 0.7181881904308594
Energy: 0.6834618457370932
Energy: 0.712227242145883
Energy: 1.0672051966835614
Energy: 0.7122272421451435
Energy: 1.0672051966828222
Energy: 0.7122272421388591
Energy: 1.0672051966809737
Energy: 0.6897001745340137
Energy: 0.926735894989304
Energy: 0.6897001745258807
Energy: 0.9267358949963279
Energy: 0.6897001745336439
Energy: 0.9267358949944794
Energy: 0.7014498635805103
Energy: 0.6749511059081527
Energy: 0.7014498635838375
Energy: 0.6749511059074134
Energy: 0.7014498635871647
Energy: 0.6749511059066741
Energy: 0.6830179643334837
Energy: 1.066444213110056
Energy: 0.6830179643290475
Energy: 1.0664442131133829
Energy: 0.6830179643286779
Energy: 1.0664442131126435
Energy: 1.0648398107365746
Energy: 0.7104034092300004
Energy: 1.064839810737684
Energy: 0.7104034092329579
Energy: 1.0648398107373138
Energy: 0.7104034092336973
Energy: 0.7208281967192737
Energy: 0.732616367205277
Energy: 0.7208281967163163
Energy: 0.7326163672026894
Energy: 0.7208281967226008
Energy: 0.732616367207495
Energy: 0.7206969180992846
Energy: 0.7326194079135672
Energy: 0.7206969180963272
Energy: 0.7326194079168943
Energy: 0.7206969180900428
Energy: 0.7326194079146763
Energy: 1.0648125375567783
Energy: 0.7105376637742125
Energy: 1.0648125375575175
Energy: 0.710537663780833
Energy: 1.0648125375575175
Energy: 0.7105376637934021
Energy: 0.6829410513369614
Energy: 1.0662172327548536
Energy: 0.6829410513410278
Energy: 1.0662172327544839
Energy: 0.6829410513380704
Energy: 1.0662172327555928
Energy: 0.7014549499257341
Energy: 0.6748818516608627
Energy: 0.7014549499297669
Energy: 0.674881851662711
Energy: 0.7014549499257341
Energy: 0.6748818516656685
Energy: 0.6896539134333609
Energy: 0.9268342562733087
Energy: 0.6896539134304035
Energy: 0.9268342562725693
Energy: 0.6896539134355789
Energy: 0.9268342562770054
Energy: 0.7122346036002559
Energy: 1.0672058019588586
Energy: 0.7122346035921231
Energy: 1.0672058019544226
Energy: 0.712234603591014
Energy: 1.0672058019570105
Energy: 0.7183880620346651
Energy: 0.6832663359134088
Energy: 0.7183880591421111
Energy: 0.6832663359137784
Energy: 0.7183880588442859
Energy: 0.6832663359122997
Energy: 0.7470139552917242
Energy: 0.696017509778572
Energy: 0.7470139552883973
Energy: 0.6960175097748753
Energy: 0.7470139552980087
Energy: 0.6960175097789417
Energy: 0.6934700747734692
Energy: 0.8943907502535023
Energy: 0.6934700747734692
Energy: 0.8943907502549812
Energy: 0.6934700747786446
Energy: 0.8943907502553509
Energy: 1.0593955300965738
Energy: 0.6933263073435044
Energy: 1.0593955300973132
Energy: 0.6933263073375896
Energy: 1.059395530095095
Energy: 0.6933263073420257
Energy: 0.683031099687372
Energy: 0.8882320899409902
Energy: 0.6830310996821966
Energy: 0.8882320899358148
Energy: 0.6830310996844147
Energy: 0.8882320899406206
Energy: 0.893148223530477
Energy: 0.8722582262405882
Energy: 0.8931482235308466
Energy: 0.872258226246503
Energy: 0.89314822352715
Energy: 0.8722582262435455
Energy: 0.6722379590788938
Energy: 0.9238433952822762
Energy: 0.6722379590781544
Energy: 0.9238433953014995
Energy: 0.672237959078524
Energy: 0.9238433952918877

minimum gb energy = 0.6722311430564495 eV
minimum distance =  2.34438036796047 Angstroms
sigma value = 67


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

Energy: 0.792977922722619
Energy: 0.7402824470826593
Energy: 0.7929779227231243
Energy: 0.7402824470824066
Energy: 0.7929779227223944
Energy: 0.740282447082154
Energy: 0.777907590478811
Energy: 0.6964702474781587
Energy: 0.7779075904795411
Energy: 0.6964702474783833
Energy: 0.7779075904790357
Energy: 0.6964702474781587
Energy: 0.81729548674812
Energy: 0.8581393862984373
Energy: 0.81729548674812
Energy: 0.8581393862981848
Energy: 0.8172954867478673
Energy: 0.8581393862981848
Energy: 0.7779145089487706
Energy: 0.696307974779835
Energy: 0.7779145089487706
Energy: 0.6963079747793577
Energy: 0.7779145089480124
Energy: 0.696307974779105
Energy: 0.7929779227233771
Energy: 0.7402824470848773
Energy: 0.7929779227233771
Energy: 0.7402824470853827
Energy: 0.7929779227228716
Energy: 0.7402824470844002
Energy: 0.777907590480271
Energy: 0.6964702474769232
Energy: 0.7779075904797936
Energy: 0.6964702474766706
Energy: 0.7779075904805236
Energy: 0.6964702474766706
Energy: 0.6957769588490323
Energy: 0.858139386297932
Energy: 0.695776958849285
Energy: 0.858139386297932
Energy: 0.6957769588482743
Energy: 0.858139386297932

minimum gb energy = 0.6957769588482743 eV
minimum distance =  2.350805922046 Angstroms
sigma value = 3


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

Energy: 0.9185939612837667
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Energy: 0.8668391549141132
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Energy: 0.9079400578417343
Energy: 0.8167241600450812
Energy: 0.9079400578464414
Energy: 0.8167241600457538
Energy: 0.9079400578433848
Energy: 0.8167241600457538
Energy: 0.8974383738637607
Energy: 0.9596023873800956
Energy: 0.8974383738644331
Energy: 0.9596023873804013
Energy: 0.8974383738660837
Energy: 0.9596023873810737
Energy: 0.9215113155536051
Energy: 0.8528148874877087
Energy: 0.9215113155515878
Energy: 0.852814887487403
Energy: 0.9215113155532993
Energy: 0.8528148874877087
Energy: 0.8279181742202412
Energy: 0.9093845996850053
Energy: 0.8279181742202412
Energy: 0.9093845996846385
Energy: 0.8279181742205467
Energy: 0.9093845996832937
Energy: 0.8487378883737703
Energy: 0.8500512271021127
Energy: 0.8487378883690633
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Energy: 0.8487378883757876
Energy: 0.8500512271024793
Energy: 0.8885646111678952
Energy: 0.8398400282534727
Energy: 0.8885646111712574
Energy: 0.8398400282551842
Energy: 0.88856461116924
Energy: 0.8398400282528002

minimum gb energy = 0.807390205426719 eV
minimum distance =  2.29805684708109 Angstroms
sigma value = 81


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

Energy: 0.9345487772466311
Energy: 0.8849394870214217
Energy: 0.854037983898804
Energy: 0.8849394870227641
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Energy: 0.8305894873973575
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Energy: 0.8211136221600817
Energy: 0.8854510636310353
Energy: 0.780308021688289
Energy: 0.8854510636328812
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Energy: 0.8400676579949686
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Energy: 0.8400821562088723
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Energy: 0.8051467931018214
Energy: 0.9146843068185588
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Energy: 0.8867205903710959
Energy: 0.9156010242050916
Energy: 0.7816351864133093
Energy: 0.9268784193810271
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Energy: 0.926878419377797
Energy: 0.7816351864096178
Energy: 0.9268784193782584
Energy: 0.7802318675234028
Energy: 0.8415071420528795
Energy: 0.7802318675234028
Energy: 0.8415071420542639
Energy: 0.7802318675284788
Energy: 0.8415071420505721
Energy: 0.9169900572761327
Energy: 0.893677557674554
Energy: 0.916990057273364
Energy: 0.8936775576680939
Energy: 0.9169900572756713
Energy: 0.8936775576690167
Energy: 0.9010615793698226
Energy: 1.1218934734518629
Energy: 0.9012107204420153
Energy: 1.1218934734527857
Energy: 0.9010615793610969
Energy: 1.1218934734518629
Energy: 0.9702374089201274
Energy: 0.8758957572314069
Energy: 0.9702374089219732
Energy: 0.8758957572267922
Energy: 0.9702374089233576
Energy: 0.8758957572277152
Energy: 0.8403388669230175
Energy: 0.8543165110725356
Energy: 0.8403388669184029
Energy: 0.8543165110729972
Energy: 0.8403388669220947
Energy: 0.8543165110674596
Energy: 0.8425740149786204
Energy: 0.7801739556620741
Energy: 0.8425740149753903
Energy: 0.821099067022892
Energy: 0.8425740149758517
Energy: 0.7801739556625357

minimum gb energy = 0.7625755094209402 eV
minimum distance =  2.37377491434016 Angstroms
sigma value = 43


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

Energy: 1.0038924500176254
Energy: 0.8903047263728135
Energy: 1.0038924500176254
Energy: 0.8903047263733803
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Energy: 1.0187889873821705
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Energy: 0.9399869952990784
Energy: 0.858590052865956
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Energy: 0.8966808097862444
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Energy: 0.9441106493137975
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Energy: 0.9715254745182396
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Energy: 0.9715254745182396
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Energy: 0.8034600474954676
Energy: 0.9985179151301474
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Energy: 0.9079822595202728
Energy: 0.9013104413261942
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Energy: 0.9013104413261942
Energy: 0.9079822595214064
Energy: 0.9013104413261942
Energy: 0.8728214716428971
Energy: 0.9222040937681557
Energy: 0.8728214716423304
Energy: 0.9222040937687225
Energy: 0.8728214716423304
Energy: 0.9222040937687225
Energy: 0.9089577004948668
Energy: 0.8202717092790801
Energy: 0.9089577004948668
Energy: 0.8202717092790801
Energy: 0.9089577004977009
Energy: 0.8202717092790801
Energy: 0.9285598829485904
Energy: 0.8822382199504707
Energy: 0.928559882949157
Energy: 0.8822382199504707
Energy: 0.9285598829485904
Energy: 0.8822382199504707
Energy: 0.9244506230632059
Energy: 0.8458805699548342
Energy: 0.9244506230615055
Energy: 0.8458805699548342
Energy: 0.9244506230654732
Energy: 0.8458805699548342
Energy: 0.9091126444025873
Energy: 0.8938960933487418
Energy: 0.9091126444020207
Energy: 0.8938960933487418
Energy: 0.9091126444014538
Energy: 0.8938960933487418
Energy: 0.8736203939451357
Energy: 0.885029381458531
Energy: 0.873620393944569
Energy: 0.885029381458531
Energy: 0.8736203939457026
Energy: 0.885029381458531
Energy: 0.92872893846875
Energy: 0.9136514560225388
Energy: 0.92872893846875
Energy: 0.9136514560225388
Energy: 0.92872893846875
Energy: 0.9136514560225388
Energy: 0.8033629505142295
Energy: 0.9538106105275105
Energy: 0.8033629505136626
Energy: 0.9538106105275105
Energy: 0.8033629505142295
Energy: 0.9538106105275105
Energy: 0.9271425174611367
Energy: 0.8714588103804494
Energy: 0.9271425174617036
Energy: 0.8714588103804494
Energy: 0.9271425174594362
Energy: 0.8714588103798825
Energy: 0.850844889071858
Energy: 0.8735685763844658
Energy: 0.850844889071858
Energy: 0.8735685763844658
Energy: 0.8508448890724247
Energy: 0.8735685763844658
Energy: 0.9977156820209371
Energy: 0.8854862024375503
Energy: 0.9977156820198034
Energy: 0.8854862024386838
Energy: 0.9977156820209371
Energy: 0.8854862024375503
Energy: 0.8563246734153422
Energy: 0.9166205488222651
Energy: 0.8563246734159091
Energy: 0.9166205488222651
Energy: 0.8563246734153422
Energy: 0.916620548822832
Energy: 0.9123641650307652
Energy: 0.8172008173834427
Energy: 0.9123641650307652
Energy: 0.8172008173834427
Energy: 0.9123641650307652
Energy: 0.8172008173834427
Energy: 0.8500970872926883
Energy: 0.8934989851234861
Energy: 0.8500970872932552
Energy: 0.8934989851246197
Energy: 0.8500970872921216
Energy: 0.8934989851223526
Energy: 0.9049547840965942
Energy: 0.8979125991615632
Energy: 0.9049547840982948
Energy: 0.8979125991604294
Energy: 0.9049547840960276
Energy: 0.8979125991604294
Energy: 0.8486692266998518
Energy: 0.8697468089792942
Energy: 0.8486692267004187
Energy: 0.8697468089792942
Energy: 0.8486692266998518
Energy: 0.8697468089792942

minimum gb energy = 0.8033629505136626 eV
minimum distance =  2.29637788557201 Angstroms
sigma value = 57


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

Energy: 0.8993363279087634
Energy: 0.8064987617480731
Energy: 0.8993363279087634
Energy: 0.8064987617473394
Energy: 0.8993363279072957
Energy: 0.8064987617480731
Energy: 0.8625512211641169
Energy: 0.7718826097922667
Energy: 0.8625512211655847
Energy: 0.7718826097922667
Energy: 0.8625512211648508
Energy: 0.7718826097922667
Energy: 0.8870608700908971
Energy: 0.9645547863892702
Energy: 0.8870608700930988
Energy: 0.9645547863885362
Energy: 0.8870608700953004
Energy: 0.9645547863878025
Energy: 1.045181843817522
Energy: 0.9040650651020481
Energy: 1.0451818438182559
Energy: 0.9040650651020481
Energy: 1.045181843817522
Energy: 0.9040650651020481
Energy: 0.9447735348943503
Energy: 0.9307170032533515
Energy: 0.9447735348943503
Energy: 0.9307170032540852
Energy: 0.9447735348936166
Energy: 0.9307170032526175
Energy: 0.8861537556391931
Energy: 0.8652521611289028
Energy: 0.8861537556369914
Energy: 0.8652521611274684
Energy: 0.8861537556377251
Energy: 0.8652521611281689
Energy: 0.8776808745944633
Energy: 0.9248589612228851
Energy: 0.8776808745951971
Energy: 0.9248589612228851
Energy: 0.8776808745937293
Energy: 0.9248589612228851
Energy: 0.8970743371738452
Energy: 0.8091434227165595
Energy: 0.8970743371731114
Energy: 0.8091434227158255
Energy: 0.8970743371738452
Energy: 0.8091434227165595
Energy: 0.8972331636370526
Energy: 0.7727048866714624
Energy: 0.8972331636370526
Energy: 0.7727048866721964
Energy: 0.897233163634851
Energy: 0.7727048866721964
Energy: 0.7731703044292334
Energy: 0.866045059263829
Energy: 0.7731703044277656
Energy: 0.866045059263829
Energy: 0.7731703044292334
Energy: 0.866045059263829
Energy: 0.8777289120613296
Energy: 0.9036839644202078
Energy: 0.8777289120598617
Energy: 0.9036839644202078
Energy: 0.8777289120598617
Energy: 0.9036839644209416
Energy: 0.8579818505621032
Energy: 0.93218047341466
Energy: 0.857981850562837
Energy: 0.9321804734109905
Energy: 0.857981850562837
Energy: 0.9321804734095227
Energy: 0.8736640465669031
Energy: 0.7725412793773081
Energy: 0.8736640465647014
Energy: 0.7725412793773081
Energy: 0.8736640465647014
Energy: 0.7725412793773081
Energy: 0.9553968653995331
Energy: 0.7777229734551936
Energy: 0.9553968653987993
Energy: 0.7777229734544596
Energy: 0.9553968653987993
Energy: 0.7777229734544596
Energy: 0.8365128049757671
Energy: 0.7758143237300277
Energy: 0.8365128049720976
Energy: 0.7758143237292938
Energy: 0.8365128049764676
Energy: 0.7758143237292938
Energy: 0.9156648146708162
Energy: 0.8333856058749289
Energy: 0.9156648146686145
Energy: 0.8333856058749289
Energy: 0.9156648146693485
Energy: 0.8333856058749289
Energy: 0.772761638752706
Energy: 0.8639393127351734
Energy: 0.7727616387519721
Energy: 0.8639393127351734
Energy: 0.7727616387534398
Energy: 0.8639393127351734
Energy: 0.8998244375137338
Energy: 0.8744230476979532
Energy: 0.899824437513
Energy: 0.8744230476972193
Energy: 0.899824437513
Energy: 0.8744230476979532
Energy: 0.7728037694507609
Energy: 0.8639157803024231
Energy: 0.7728037694507609
Energy: 0.8639157803024231
Energy: 0.7728037694507609
Energy: 0.8639157803024231
Energy: 0.9159263020376356
Energy: 0.8333085584866495
Energy: 0.9159263020376356
Energy: 0.8333085584873835
Energy: 0.9159263020383696
Energy: 0.8333085584866495
Energy: 0.8366298155682164
Energy: 0.7757650690377468
Energy: 0.8366298155696841
Energy: 0.775765069036279
Energy: 0.8366298155696841
Energy: 0.7757650690370129
Energy: 0.9555398356682568
Energy: 0.8322838233987393
Energy: 0.9555398356697247
Energy: 0.8322838233987393
Energy: 0.9555398356689908
Energy: 0.8322838233987393
Energy: 0.8727977699016114
Energy: 0.7726143719453582
Energy: 0.8727977699023453
Energy: 0.7726143719453582
Energy: 0.8727977699023453
Energy: 0.7726143719460922
Energy: 0.8579379641663759
Energy: 0.9321593691416045
Energy: 0.8579379641671098
Energy: 0.9321593691394028
Energy: 0.8579379641663759
Energy: 0.9321593691401368

minimum gb energy = 0.7718826097922667 eV
minimum distance =  2.2822885558699 Angstroms
sigma value = 17


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

Energy: 0.8374310594436836
Energy: 0.7526759627084099
Energy: 0.8374310594436836
Energy: 0.7526759627073719
Energy: 0.8374310594436836
Energy: 0.7526759627073719
Energy: 0.7288185426450221
Energy: 0.7205606982465992
Energy: 0.7288185426450221
Energy: 0.7205606982465992
Energy: 0.7288185426450221
Energy: 0.7205606982465992
Energy: 0.8388434299265297
Energy: 0.8427857782791345
Energy: 0.8388434299265297
Energy: 0.8427857782791345
Energy: 0.8388434299285819
Energy: 0.8427857782791345
Energy: 0.6883255992200796
Energy: 0.8575465367451768
Energy: 0.6883255992221553
Energy: 0.8575465367462148
Energy: 0.6883255992200796
Energy: 0.8575465367462148
Energy: 0.8424298513239918
Energy: 0.8031309371503682
Energy: 0.8424298513239918
Energy: 0.8031309371503682
Energy: 0.8424298513250297
Energy: 0.8031309371503682
Energy: 0.780106608042578
Energy: 0.8243689315310554
Energy: 0.7801066080436158
Energy: 0.8243689315310554
Energy: 0.780106608042578
Energy: 0.8243689315310554
Energy: 0.8252701017622037
Energy: 0.730561663556475
Energy: 0.8252701017611661
Energy: 0.7305616635554371
Energy: 0.8252701017622037
Energy: 0.730561663556475
Energy: 0.6882697682815787
Energy: 0.8255723556806392
Energy: 0.6882697682826167
Energy: 0.8255723556806392
Energy: 0.6882697682815787
Energy: 0.8255723556806392
Energy: 0.8381649226158843
Energy: 0.7206205583388279
Energy: 0.8381649226148463
Energy: 0.7206205583398657
Energy: 0.8381649226158843
Energy: 0.7206205583398657
Energy: 0.7726966718593421
Energy: 0.7304240822077442
Energy: 0.772696671861418
Energy: 0.7304240822077442
Energy: 0.7726966718603799
Energy: 0.7304240822077442
Energy: 0.7614289488288999
Energy: 0.8354061952861106
Energy: 0.7614289488299378
Energy: 0.8354061952861106
Energy: 0.7614289488299378
Energy: 0.8354061952861106
Energy: 0.7880168473376505
Energy: 0.7199490627702753
Energy: 0.7880168473366126
Energy: 0.7199490627702753
Energy: 0.7880168473366126
Energy: 0.7199490627702753
Energy: 0.6883479628265814
Energy: 0.8239836204057223
Energy: 0.6883479628276192
Energy: 0.8239836204057223
Energy: 0.6883479628265814
Energy: 0.8239836204057223
Energy: 0.77233847180227
Energy: 0.8451779304074682
Energy: 0.772338471801232
Energy: 0.8451779304085062
Energy: 0.772338471801232
Energy: 0.8451779304085062
Energy: 0.7794803985125102
Energy: 0.8036410437894512
Energy: 0.7794803985125102
Energy: 0.8036410437894512
Energy: 0.7794803985125102
Energy: 0.8036410437894512
Energy: 0.7796936111197635
Energy: 0.9601363315205963
Energy: 0.7796936111197635
Energy: 0.9601363315205963
Energy: 0.7796936111197635
Energy: 0.9601363315205963
Energy: 0.7709912495700879
Energy: 0.845779082372464
Energy: 0.7709912495711257
Energy: 0.845779082372464
Energy: 0.7709912495700879
Energy: 0.845779082372464

minimum gb energy = 0.6882697682815787 eV
minimum distance =  2.34382226913049 Angstroms
sigma value = 17


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

Energy: 0.7498530271685999
Energy: 0.677998213637407
Energy: 0.749853027166596
Energy: 0.6779982136370062
Energy: 0.7498530271698024
Energy: 0.6779982136382086
Energy: 0.6857444458330807
Energy: 0.6593863562189849
Energy: 0.6857444458322791
Energy: 0.6593863562193856
Energy: 0.6857444458326799
Energy: 0.6593863562197864
Energy: 0.803230695646523
Energy: 0.7315561835327455
Energy: 0.8032306956457216
Energy: 0.7315561835327455
Energy: 0.8032306956461224
Energy: 0.7315561835327455
Energy: 0.6350599342586115
Energy: 0.7549152805104803
Energy: 0.6350599342570448
Energy: 0.7549152805104803
Energy: 0.6350599342598139
Energy: 0.7549152805108812
Energy: 0.7786245244231604
Energy: 0.6582504279984829
Energy: 0.7786245244215573
Energy: 0.6582504279988836
Energy: 0.7786245244231604
Energy: 0.6582504279976813
Energy: 0.7417694575196074
Energy: 0.7099422728247508
Energy: 0.7417694575208098
Energy: 0.7099422728247508
Energy: 0.7417694575192065
Energy: 0.7099422728255523
Energy: 0.6874513657251672
Energy: 0.6930575255154942
Energy: 0.6874513657227624
Energy: 0.6930575255158948
Energy: 0.6874513657247664
Energy: 0.6930575255154942
Energy: 0.752612781059329
Energy: 0.8529433855817471
Energy: 0.7526127810585275
Energy: 0.8529433855821479
Energy: 0.752612781059329
Energy: 0.8529433855817471
Energy: 0.7184412229974253
Energy: 0.7203409426139921
Energy: 0.7184412229986277
Energy: 0.7203409426143927
Energy: 0.7184412229966236
Energy: 0.7203409426135913
Energy: 0.687691196851822
Energy: 0.6255162395983982
Energy: 0.6876911968506196
Energy: 0.6255162395983982
Energy: 0.6876911968530244
Energy: 0.6255162395983982
Energy: 0.6350522015921884
Energy: 0.8294880760302085
Energy: 0.6350522015929901
Energy: 0.8294880760294069
Energy: 0.6350522015925893
Energy: 0.8294880760298077
Energy: 0.7735126687923138
Energy: 0.6687860344396725
Energy: 0.7735126687935162
Energy: 0.6687860344392716
Energy: 0.773512668791913
Energy: 0.6687860344392716
Energy: 0.6898704783580641
Energy: 0.6712977048330823
Energy: 0.6898704783580641
Energy: 0.6712977048326815
Energy: 0.6898704783584649
Energy: 0.6712977048330823
Energy: 0.6983109573728273
Energy: 0.756632071578582
Energy: 0.6983109573764344
Energy: 0.7566320715781811
Energy: 0.6983109573732281
Energy: 0.756632071578582
Energy: 0.735691713570793
Energy: 0.6691216841769847
Energy: 0.7356917135711938
Energy: 0.6691216841769847
Energy: 0.735691713570793
Energy: 0.6691216841769847
Energy: 0.6350769057423261
Energy: 0.7936099166202342
Energy: 0.6350769057407228
Energy: 0.7936099166202342
Energy: 0.6350769057415245
Energy: 0.7936099166202342
Energy: 0.697179800428801
Energy: 0.731533746810944
Energy: 0.697179800427198
Energy: 0.7315337468105431
Energy: 0.6971798004275986
Energy: 0.7315337468105431
Energy: 0.7403117642941273
Energy: 0.8549811800278293
Energy: 0.7403117642969329
Energy: 0.8549811800274286
Energy: 0.740311764294528
Energy: 0.8549811800278293
Energy: 0.7030075607771028
Energy: 0.7954157614313341
Energy: 0.7030075607779045
Energy: 0.7954157614321357
Energy: 0.7030075607779045
Energy: 0.7954157614317349
Energy: 0.6965587378503629
Energy: 0.6283832041733384
Energy: 0.696558737852367
Energy: 0.6283832041733384
Energy: 0.6965587378515653
Energy: 0.6283832041737392
Energy: 0.7030072023562044
Energy: 0.7953838140902889
Energy: 0.7030072023554028
Energy: 0.7953838140882851
Energy: 0.7030072023566053
Energy: 0.7953838140882851
Energy: 0.7403825897126428
Energy: 0.8551151890467186
Energy: 0.7403825897118412
Energy: 0.8551151890463178
Energy: 0.740382589714246
Energy: 0.8551151890463178
Energy: 0.6972679605677005
Energy: 0.7318670414874723
Energy: 0.697267960566498
Energy: 0.7318670414866707
Energy: 0.6972679605677005
Energy: 0.7318670414866707
Energy: 0.6350873629090154
Energy: 0.7681282635636285
Energy: 0.6350873629098169
Energy: 0.7681282635636285
Energy: 0.6350873629082138
Energy: 0.7681282635628269
Energy: 0.735503045697247
Energy: 0.6687912215655448
Energy: 0.7355030457000526
Energy: 0.6687912215651441
Energy: 0.7355030456980487
Energy: 0.6687912215667473
Energy: 0.6983536784614107
Energy: 0.7565840408626205
Energy: 0.6983536784594068
Energy: 0.7565840408630213
Energy: 0.6983536784630138
Energy: 0.7565840408630213
Energy: 0.6899607936257763
Energy: 0.671292259320414
Energy: 0.6899607936253755
Energy: 0.6712922593208148
Energy: 0.6899607936265778
Energy: 0.671292259320414
Energy: 0.7735272554149321
Energy: 0.668854744260663
Energy: 0.7735272554153328
Energy: 0.6688547442602624
Energy: 0.7735272554153328
Energy: 0.6688547442602624
Energy: 0.6350260878976858
Energy: 0.8294685296739415
Energy: 0.6350260878984874
Energy: 0.8294685296739415
Energy: 0.6350260878980866
Energy: 0.8294685296739415
Energy: 0.6878380412890954
Energy: 0.626732989434917
Energy: 0.6878380412882937
Energy: 0.6267329894353177
Energy: 0.6878380412874922
Energy: 0.6267329894353177
Energy: 0.7183585521862885
Energy: 0.7203166812290417
Energy: 0.7183585521894951
Energy: 0.7203166812290417
Energy: 0.7183585521878918
Energy: 0.7203166812290417
Energy: 0.7527671204428971
Energy: 0.8529193491108681
Energy: 0.7527671204440995
Energy: 0.8529193491108681
Energy: 0.7527671204432979
Energy: 0.8529193491100666
Energy: 0.6874793975858934
Energy: 0.6929899242284328
Energy: 0.6874793975870959
Energy: 0.6929899242292342
Energy: 0.6874793975858934
Energy: 0.6929899242284328
Energy: 0.7417784241539731
Energy: 0.6645984939905488
Energy: 0.7417784241535722
Energy: 0.6645984939901479
Energy: 0.7417784241523698
Energy: 0.6645984939909496
Energy: 0.7788892338409826
Energy: 0.6567292563223033
Energy: 0.7788892338429866
Energy: 0.6567292563223033
Energy: 0.7788892338413834
Energy: 0.6567292563231047
Energy: 0.6350891502328607
Energy: 0.7505709533940695
Energy: 0.63508915023246
Energy: 0.7505709533944703
Energy: 0.6350891502320593
Energy: 0.7505709533944703
Energy: 0.803153218333499
Energy: 0.7314984591529587
Energy: 0.8031532183326973
Energy: 0.7314984591529587
Energy: 0.803153218333499
Energy: 0.7314984591525578
Energy: 0.6871532302357504
Energy: 0.6642193262211287
Energy: 0.6871532302349487
Energy: 0.6642193262207279
Energy: 0.6871532302349487
Energy: 0.6642193262207279
Energy: 0.7498530271641912
Energy: 0.6779982136406133
Energy: 0.7498530271629888
Energy: 0.6779982136398118
Energy: 0.7498530271653936
Energy: 0.6779982136410141
Energy: 0.6857444458306761
Energy: 0.6593863562149769
Energy: 0.6857444458310767
Energy: 0.6593863562145761
Energy: 0.6857444458318784
Energy: 0.6593863562141753
Energy: 0.8032306956417136
Energy: 0.7315561835331462
Energy: 0.8032306956425151
Energy: 0.7315561835331462
Energy: 0.8032306956429159
Energy: 0.7315561835327455
Energy: 0.6350599342550409
Energy: 0.7319046570458563
Energy: 0.6350599342554416
Energy: 0.7319046570454556
Energy: 0.6350599342558424
Energy: 0.731904657044654
Energy: 0.7786245244203548
Energy: 0.6582504279988836
Energy: 0.7786245244191525
Energy: 0.6582504279988836
Energy: 0.7786245244199541
Energy: 0.6582504279988836

minimum gb energy = 0.6255162395983982 eV
minimum distance =  2.35211214137977 Angstroms
sigma value = 57


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

Energy: 0.6854100157146613
Energy: 0.6221313869087092
Energy: 0.6854100157127035
Energy: 0.6221313869087092
Energy: 0.6854100157153139
Energy: 0.6221313869087092
Energy: 0.7048417358507996
Energy: 0.6131900342647808
Energy: 0.7048417358488417
Energy: 0.6131900342654334
Energy: 0.7048417358507996
Energy: 0.6131900342647808
Energy: 0.7244356253564229
Energy: 0.6721528426846549
Energy: 0.7244356253564229
Energy: 0.6721528426840023
Energy: 0.7244356253570755
Energy: 0.6721528426840023
Energy: 0.5932280645200227
Energy: 0.6908276859460628
Energy: 0.5932280645213279
Energy: 0.6908276859454102
Energy: 0.5932280645200227
Energy: 0.6908276859454102
Energy: 0.7065407675081086
Energy: 0.6071239005843647
Energy: 0.7065407675041931
Energy: 0.6071239005830595
Energy: 0.7065407675068034
Energy: 0.6071239005830595
Energy: 0.6886097805945265
Energy: 0.6131560064195107
Energy: 0.6886097805932213
Energy: 0.6131560064195107
Energy: 0.6886097805932213
Energy: 0.6131560064201633
Energy: 0.6870791360650667
Energy: 0.6671945849289667
Energy: 0.6870791360650667
Energy: 0.6671945849296192
Energy: 0.6870791360644142
Energy: 0.6671945849296192
Energy: 0.7814622461358344
Energy: 0.7833864048866577
Energy: 0.7814622461364868
Energy: 0.7833864048866577
Energy: 0.7814622461371394
Energy: 0.7833864048866577
Energy: 0.6281289953039617
Energy: 0.6146197400899897
Energy: 0.6281289953039617
Energy: 0.6146197400893372
Energy: 0.6281289953039617
Energy: 0.6146197400893372
Energy: 0.6271976894180237
Energy: 0.6357860401398445
Energy: 0.6271976894180237
Energy: 0.6357860401398445
Energy: 0.6271976894193289
Energy: 0.6357860401398445
Energy: 0.7736165884545034
Energy: 0.788040228739842
Energy: 0.7736165884558086
Energy: 0.788040228739842
Energy: 0.7736165884531981
Energy: 0.7880402287385367
Energy: 0.6602156353721648
Energy: 0.6893358474322722
Energy: 0.6602156353721648
Energy: 0.6893358474348825
Energy: 0.6602156353741225
Energy: 0.6893358474335773
Energy: 0.6257088674030489
Energy: 0.6839569496553112
Energy: 0.625708867401091
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Energy: 0.6257088674017437
Energy: 0.6839569496579215
Energy: 0.6264683783816617
Energy: 0.7272471353411157
Energy: 0.6264683783829669
Energy: 0.7272471353411157
Energy: 0.6264683783810091
Energy: 0.7272471353404631
Energy: 0.7064556240871644
Energy: 0.6560669705539752
Energy: 0.7064556240884696
Energy: 0.6560669705533225
Energy: 0.7064556240865117
Energy: 0.6560669705539752
Energy: 0.642502376789279
Energy: 0.7015074414916551
Energy: 0.642502376789279
Energy: 0.7015074414923076
Energy: 0.6425023767905843
Energy: 0.7015074414923076
Energy: 0.6422791810384164
Energy: 0.7106370058769318
Energy: 0.6422791810377638
Energy: 0.7106370058769318
Energy: 0.6422791810410268
Energy: 0.7106370058775844
Energy: 0.7467642549463964
Energy: 0.6218384022255167
Energy: 0.7467642549437861
Energy: 0.6218384022255167
Energy: 0.746764254947049
Energy: 0.621838402224864
Energy: 0.5945135634787565
Energy: 0.7423570177545217
Energy: 0.5945135634781039
Energy: 0.7423570177590897
Energy: 0.5945135634800617
Energy: 0.7423570177577845
Energy: 0.6239941395371877
Energy: 0.6884764043345478
Energy: 0.623994139539798
Energy: 0.6884764043338953
Energy: 0.6239941395384929
Energy: 0.6884764043338953
Energy: 0.6745906555856477
Energy: 0.7930559687779327
Energy: 0.6745906555863003
Energy: 0.7930559687772801
Energy: 0.674590655584995
Energy: 0.7930559687766277
Energy: 0.5859624917141248
Energy: 0.7434012400557378
Energy: 0.5859624917134723
Energy: 0.7434012400563903
Energy: 0.5859624917147774
Energy: 0.7434012400563903
Energy: 0.6420554624121475
Energy: 0.6622677142683911
Energy: 0.6420554624134527
Energy: 0.6622677142677386
Energy: 0.642055462414758
Energy: 0.6622677142677386
Energy: 0.6454370887888722
Energy: 0.853771267175592
Energy: 0.6454370887882196
Energy: 0.853771267175592
Energy: 0.6454370887882196
Energy: 0.853771267175592
Energy: 0.6464322182256207
Energy: 0.7992327480820514
Energy: 0.6464322182262734
Energy: 0.7992327480820514
Energy: 0.6464322182249682
Energy: 0.7992327480820514
Energy: 0.6245732721524082
Energy: 0.6615062980800995
Energy: 0.6245732721530608
Energy: 0.6615062980807521
Energy: 0.6245732721530608
Energy: 0.6615062980807521
Energy: 0.5965669187071375
Energy: 0.742342679599498
Energy: 0.596566918706485
Energy: 0.7423426796001505
Energy: 0.5965669187077901
Energy: 0.7423426796001505

minimum gb energy = 0.5859624917134723 eV
minimum distance =  2.3152803917768 Angstroms
sigma value = 43


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

Energy: 0.7541604829532744
Energy: 0.5569223583172498
Energy: 0.754160482951848
Energy: 0.5569223583177252
Energy: 0.7541604829527989
Energy: 0.5569223583172498
Energy: 0.6077006920305108
Energy: 0.6444205082359864
Energy: 0.6077006920309863
Energy: 0.6444205082355109
Energy: 0.6077006920319372
Energy: 0.6444205082350355
Energy: 0.6194058342561679
Energy: 0.6445888658988145
Energy: 0.6194058342552168
Energy: 0.6445888658988145
Energy: 0.6194058342552168
Energy: 0.64458886589929
Energy: 0.6320589230711526
Energy: 0.5873822042117014
Energy: 0.6320589230702016
Energy: 0.5873822042117014
Energy: 0.6320589230730546
Energy: 0.587382204211226
Energy: 0.6069491735138001
Energy: 0.5379578084337585
Energy: 0.6069491735123737
Energy: 0.5379578084337585
Energy: 0.6069491735123737
Energy: 0.5379578084337585
Energy: 0.5783984449776636
Energy: 0.6114606221841458
Energy: 0.5783984449776636
Energy: 0.6114606221841458
Energy: 0.5783984449786145
Energy: 0.6114606221831949
Energy: 0.6148673370759272
Energy: 0.5748961970521685
Energy: 0.6148673370778291
Energy: 0.5748961970521685
Energy: 0.6148673370764028
Energy: 0.5748961970521685
Energy: 0.7313537818240717
Energy: 0.5956644240848981
Energy: 0.7313537818231206
Energy: 0.5956644240863245
Energy: 0.7313537818240717
Energy: 0.5956644240867999
Energy: 0.5558933163095051
Energy: 0.6037828121500598
Energy: 0.5558933163090296
Energy: 0.6037828121491088
Energy: 0.5558933163090296
Energy: 0.6037828121495843
Energy: 0.6147772514063052
Energy: 0.5480628420779383
Energy: 0.6147772514067806
Energy: 0.5480628420779383
Energy: 0.6147772514048788
Energy: 0.548062842077463
Energy: 0.6170534571703485
Energy: 0.6016864693172295
Energy: 0.6170534571703485
Energy: 0.6016864693172295
Energy: 0.6170534571698731
Energy: 0.6016864693177049
Energy: 0.5252590494211923
Energy: 0.6029312795178962
Energy: 0.5252590494188148
Energy: 0.6029312795178962
Energy: 0.525259049419766
Energy: 0.6029312795178962
Energy: 0.6146248894671704
Energy: 0.5235764095589782
Energy: 0.6146248894676029
Energy: 0.5235764095589782
Energy: 0.6146248894662196
Energy: 0.5235764095585027
Energy: 0.6130566280893545
Energy: 0.6019049443612
Energy: 0.6130566280869771
Energy: 0.6019049443602491
Energy: 0.61305662808983
Energy: 0.6019049443612
Energy: 0.5464998239923982
Energy: 0.6028984160743682
Energy: 0.5464998239928734
Energy: 0.6028984160748437
Energy: 0.546499823993349
Energy: 0.6028984160748437
Energy: 0.6306653125781819
Energy: 0.6063510667715613
Energy: 0.6306653125791328
Energy: 0.6063510667715613
Energy: 0.6306653125786574
Energy: 0.6063510667715613
Energy: 0.614994284430317
Energy: 0.5963453447968902
Energy: 0.6149942844307924
Energy: 0.5963453447968902
Energy: 0.614994284429366
Energy: 0.5963453447964147
Energy: 0.5629857453410083
Energy: 0.6029355454962086
Energy: 0.5629857453381555
Energy: 0.6029355454957331
Energy: 0.5629857453410083
Energy: 0.6029355454962086
Energy: 0.6135860345407936
Energy: 0.6117683466697954
Energy: 0.6135860345412691
Energy: 0.6117683466697954
Energy: 0.6135860345403182
Energy: 0.6117683466697954
Energy: 0.6310992024040735
Energy: 0.5976205691101247
Energy: 0.6310992024026469
Energy: 0.5976205691101247
Energy: 0.6310992024031225
Energy: 0.5976205691091738
Energy: 0.6040313169405535
Energy: 0.6247229001293982
Energy: 0.6040313169415044
Energy: 0.6247229001265454
Energy: 0.6040313169410289
Energy: 0.6247229001260699
Energy: 0.6511943826512007
Energy: 0.5551866235723332
Energy: 0.6511943826521516
Energy: 0.5551866235728087
Energy: 0.6511943826512007
Energy: 0.5551866235723332
Energy: 0.6489819781064758
Energy: 0.6051644434852294
Energy: 0.6489819781079023
Energy: 0.6051644434852294
Energy: 0.6489819781069514
Energy: 0.6051644434852294
Energy: 0.6351722042153447
Energy: 0.54800646148392
Energy: 0.6351722042158202
Energy: 0.5480064614867728
Energy: 0.6351722042153447
Energy: 0.548006461482969
Energy: 0.6141202120697327
Energy: 0.5283130422538851
Energy: 0.6141202120687818
Energy: 0.5283130422543606
Energy: 0.6141202120678307
Energy: 0.5283130422557869
Energy: 0.6134728551493949
Energy: 0.5874430285686347
Energy: 0.6134728551489194
Energy: 0.5874430285691102
Energy: 0.6134728551498704
Energy: 0.5874430285686347
Energy: 0.5763200525970386
Energy: 0.6889627280738535
Energy: 0.5763200525979896
Energy: 0.6889627280738535
Energy: 0.576320052596563
Energy: 0.688962728074329
Energy: 0.5925115019164535
Energy: 0.5918164692033469
Energy: 0.5925115019140762
Energy: 0.5918164692033469
Energy: 0.5925115019164535
Energy: 0.5918164692033469
Energy: 0.5338936785890557
Energy: 0.5579096585402241
Energy: 0.5338936785895313
Energy: 0.5579096585406997
Energy: 0.5338936785900066
Energy: 0.5579096585406997
Energy: 0.5451698829137496
Energy: 0.6572252831900168
Energy: 0.5451698829137496
Energy: 0.6572252831900168
Energy: 0.5451698829132741
Energy: 0.6572252831904922
Energy: 0.5288976312114215
Energy: 0.7331828774268195
Energy: 0.5288976312123725
Energy: 0.7331828774268195
Energy: 0.5288976312104706
Energy: 0.7331828774272948
Energy: 0.5349034769756332
Energy: 0.543166980115634
Energy: 0.5349034769732558
Energy: 0.543166980115634
Energy: 0.5349034769742068
Energy: 0.543166980115634
Energy: 0.5244556486982908
Energy: 0.5957098409722041
Energy: 0.5244556486963888
Energy: 0.5957098409755325
Energy: 0.5244556486982908
Energy: 0.5957098409722041
Energy: 0.6182939246487207
Energy: 0.6645457190605162
Energy: 0.6182939246496717
Energy: 0.6645457190586143
Energy: 0.6182939246477698
Energy: 0.6645457190605162
Energy: 0.55568099484336
Energy: 0.5220672373300037
Energy: 0.55568099484336
Energy: 0.5220672373304792
Energy: 0.555680994842409
Energy: 0.5220672373300037
Energy: 0.483195744103293
Energy: 0.5947529292364524
Energy: 0.48319574410281746
Energy: 0.5947529292369279
Energy: 0.48319574410281746
Energy: 0.5947529292369279

minimum gb energy = 0.48319574410281746 eV
minimum distance =  2.31906792862084 Angstroms
sigma value = 81


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

Energy: 0.0320627207077527
Energy: 0.06492258475660767
Energy: 0.0320627207077527
Energy: 0.06492258475660767
Energy: 0.03206272070757403
Energy: 0.06492258475992303
Energy: 0.6258798014789702
Energy: 0.032487155529883134
Energy: 0.6258798014803598
Energy: 0.032487316321221246
Energy: 0.6258798014793077
Energy: 0.03248717470336353
Energy: 0.625879810777749
Energy: 0.03300899108969967
Energy: 0.6258798107765182
Energy: 0.03300900958509613
Energy: 0.6258798107775704
Energy: 0.03300901404642229
Energy: 0.032062720707931376
Energy: 0.0649225847580172
Energy: 0.0320627207077527
Energy: 0.06492258475642898
Energy: 0.0320627207077527
Energy: 0.06492258475678633
Energy: 0.6258798014777393
Energy: 0.032488589614494016
Energy: 0.6258798014786129
Energy: 0.03248791082394643
Energy: 0.625879801477918
Energy: 0.032488418932413485
Energy: 0.6258798107796549
Energy: 0.03300901771984017
Energy: 0.625879810777749
Energy: 0.033009023810227446
Energy: 0.6258798107789599
Energy: 0.03300901044826546
Energy: 0.032062720707931376
Energy: 0.06492258475293494
Energy: 0.032062720707931376
Energy: 0.06492258475660767
Energy: 0.032062720707931376
Energy: 0.06492258475660767
Energy: 0.6258798014782554
Energy: 0.03248808732506949
Energy: 0.6258798014772232
Energy: 0.03248759112813661
Energy: 0.6258798014775607
Energy: 0.0324873392809019
Energy: 0.6258798107782653
Energy: 0.03300904134519691
Energy: 0.6258798107791387
Energy: 0.03300901401936326
Energy: 0.6258798107787814
Energy: 0.033009024512749875
Energy: 0.0320627207077527
Energy: 0.06492258475748117
Energy: 0.03206272070757403
Energy: 0.06492258475714367
Energy: 0.03206272070757403
Energy: 0.06492258475696501

minimum gb energy = 0.03206272070757403 eV
minimum distance =  2.54773364114997 Angstroms
sigma value = 3


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

Energy: 0.5953137297338069
Energy: 0.5169342683509026
Energy: 0.5953137297338069
Energy: 0.5169342683509026
Energy: 0.5953137297338069
Energy: 0.5169342683509026
Energy: 0.5308497024402479
Energy: 0.5325059279403226
Energy: 0.5308497024397251
Energy: 0.5325059279413681
Energy: 0.5308497024392022
Energy: 0.5325059279408454
Energy: 0.5452216306093991
Energy: 0.5405952281342701
Energy: 0.5452216306088763
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Energy: 0.5452216306093991
Energy: 0.5405952281342701
Energy: 0.5351092829707709
Energy: 0.5404049196316894
Energy: 0.5351092829718165
Energy: 0.5404049196311664
Energy: 0.5351092829707709
Energy: 0.5404049196311664
Energy: 0.467919780134878
Energy: 0.6105960900008621
Energy: 0.4679197801333096
Energy: 0.6105960900019077
Energy: 0.46791978013435526
Energy: 0.6105960900019077
Energy: 0.5474232002333898
Energy: 0.5359835537496597
Energy: 0.5474232002333898
Energy: 0.535983553749137
Energy: 0.5474232002344352
Energy: 0.535983553749137
Energy: 0.5539651385734646
Energy: 0.5989196825137298
Energy: 0.5539651385734646
Energy: 0.5989196825126842
Energy: 0.5539651385739874
Energy: 0.5989196825121614
Energy: 0.4682168878480356
Energy: 0.6047936676103189
Energy: 0.46821688784699
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Energy: 0.4682168878480356
Energy: 0.6047936676103189
Energy: 0.5479823307727576
Energy: 0.5573074251492804
Energy: 0.5479823307732804
Energy: 0.5573074251492804
Energy: 0.5479823307732804
Energy: 0.5573074251492804
Energy: 0.5142980600082835
Energy: 0.5673639028139793
Energy: 0.5142980600077608
Energy: 0.5673639028145021
Energy: 0.5142980600093292
Energy: 0.5673639028118881
Energy: 0.5034555346953391
Energy: 0.603562666939526
Energy: 0.5034555346984759
Energy: 0.6035626669390032
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Energy: 0.5802056750985415
Energy: 0.5646726567969693
Energy: 0.5802056750974959
Energy: 0.5646726567980149
Energy: 0.5802056750974959
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Energy: 0.5785456994271122
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Energy: 0.5382575519490482
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Energy: 0.5556462226222322
Energy: 0.5792901504729144
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Energy: 0.5792901504750058
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Energy: 0.6168114146994342
Energy: 0.46779345143828654
Energy: 0.6168114147004798
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Energy: 0.6168114147004798
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Energy: 0.5843640039279278
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Energy: 0.5843640039263592
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Energy: 0.584364003926882
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Energy: 0.5383852284838975
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Energy: 0.618906911932233
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Energy: 0.5388450092187387
Energy: 0.6189069119327558
Energy: 0.52485518686123
Energy: 0.5319194866746875
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Energy: 0.5248551868622756
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Energy: 0.550457947955549
Energy: 0.5329602303181871
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Energy: 0.5334755914504947
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Energy: 0.5219340154992695
Energy: 0.5388637686097092
Energy: 0.5219340154997923
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Energy: 0.5481088726596921
Energy: 0.5387641139707158
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Energy: 0.46775648734973596
Energy: 0.6252446194068773
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Energy: 0.5519707112148822
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Energy: 0.6370061030774836
Energy: 0.5101874120945717
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Energy: 0.5101874120950944
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Energy: 0.5477123005136726
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Energy: 0.5358089503394973
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Energy: 0.5493815982961784
Energy: 0.5553809083716053
Energy: 0.5493815982956556
Energy: 0.5553809083716053
Energy: 0.5493815982961784

minimum gb energy = 0.46775648734973596 eV
minimum distance =  2.36759129793257 Angstroms
sigma value = 67


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

Energy: 0.7358529780562408
Energy: 0.6902369621940645
Energy: 0.7358529780554959
Energy: 0.6902369621948093
Energy: 0.7358529780554959
Energy: 0.6902369621940645
Energy: 0.6611411057955601
Energy: 0.6722195133313186
Energy: 0.6611411057970499
Energy: 0.6722195133313186
Energy: 0.6611411057963049
Energy: 0.6722195133313186
Energy: 0.6933411761239214
Energy: 0.6805101753203265
Energy: 0.6933411761254112
Energy: 0.6805101753203265
Energy: 0.6933411761246664
Energy: 0.6805101753203265
Energy: 0.694960135003977
Energy: 0.6697743302199508
Energy: 0.6949601350032321
Energy: 0.669774330218461
Energy: 0.6949601350017423
Energy: 0.6697743302214407
Energy: 0.5993175970719159
Energy: 0.6463191076096774
Energy: 0.5993175970711709
Energy: 0.6463191076096774
Energy: 0.5993175970719159
Energy: 0.6463191076096774
Energy: 0.6928499708007204
Energy: 0.6798429865324075
Energy: 0.6928499708007204
Energy: 0.6798429865331524
Energy: 0.6928499708007204
Energy: 0.6798429865331524
Energy: 0.6545940296020017
Energy: 0.7229916239914771
Energy: 0.6545940296020017
Energy: 0.7229916239914771
Energy: 0.6545940296034917
Energy: 0.7229916239914771
Energy: 0.6554036552156478
Energy: 0.6444807464744359
Energy: 0.6554036552163928
Energy: 0.6444807464744359
Energy: 0.6554036552156478
Energy: 0.6444807464744359
Energy: 0.7114726309877574
Energy: 0.7228485313915741
Energy: 0.7114726309855227
Energy: 0.7228485313900842
Energy: 0.7114726309877574
Energy: 0.7228485313908292
Energy: 0.6678235047173559
Energy: 0.7412701783773216
Energy: 0.6678235047173559
Energy: 0.7412701783765766
Energy: 0.6678235047173559
Energy: 0.7412701783765766
Energy: 0.7375439219356328
Energy: 0.6818557329823867
Energy: 0.7375439219371227
Energy: 0.6818557329823867
Energy: 0.7375439219356328
Energy: 0.6818557329831316
Energy: 0.6680126295588906
Energy: 0.6823777249962923
Energy: 0.6680126295574007
Energy: 0.6823777249962923
Energy: 0.6680126295581456
Energy: 0.6823777249962923
Energy: 0.6669811580306105
Energy: 0.7812185374231596
Energy: 0.6669811580291207
Energy: 0.7812185374231596
Energy: 0.6669811580298656
Energy: 0.7812185374231596
Energy: 0.6735609398363328
Energy: 0.7001408995282307
Energy: 0.673560939835588
Energy: 0.7001408995282307
Energy: 0.673560939834098
Energy: 0.7001408995274858
Energy: 0.6645361878254342
Energy: 0.6547865108126403
Energy: 0.6645361878261792
Energy: 0.6547865108126403
Energy: 0.6645361878246893
Energy: 0.6547865108133852
Energy: 0.7184324318555619
Energy: 0.6772552828691029
Energy: 0.718432431854072
Energy: 0.677255282868358
Energy: 0.7184324318548171
Energy: 0.6772552828676129
Energy: 0.6942772058926191
Energy: 0.696454484440997
Energy: 0.694277205893364
Energy: 0.696454484440997
Energy: 0.694277205893364
Energy: 0.696454484440252
Energy: 0.6795334005362987
Energy: 0.6434934689389858
Energy: 0.6795334005370437
Energy: 0.643493468938241
Energy: 0.6795334005370437
Energy: 0.6434934689389858
Energy: 0.6787376759334566
Energy: 0.6961647074572419
Energy: 0.6787376759342014
Energy: 0.6961647074579868
Energy: 0.6787376759342014
Energy: 0.6961647074579868
Energy: 0.7650220137387548
Energy: 0.681536007482842
Energy: 0.7650220137387548
Energy: 0.6815360074820971
Energy: 0.7650220137380098
Energy: 0.681536007482842
Energy: 0.7105780485007752
Energy: 0.6529673720442972
Energy: 0.7105780485015202
Energy: 0.6529673720442972
Energy: 0.7105780485007752
Energy: 0.6529673720450421
Energy: 0.702715541993858
Energy: 0.7282193390809764
Energy: 0.702715541993858
Energy: 0.7282193390809764
Energy: 0.7027155419931131
Energy: 0.7282193390809764
Energy: 0.693753378572672
Energy: 0.6804861857230347
Energy: 0.693753378574162
Energy: 0.6804861857230347
Energy: 0.693753378573417
Energy: 0.6804861857237796

minimum gb energy = 0.5993175970711709 eV
minimum distance =  2.36827981319025 Angstroms
sigma value = 33


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

Energy: 0.8169839919557647
Energy: 0.7419287660266211
Energy: 0.8169839919548195
Energy: 0.7419287660266211
Energy: 0.8169839919562372
Energy: 0.7419287660261485
Energy: 0.7410005560318387
Energy: 0.7723368478541861
Energy: 0.741000556031366
Energy: 0.7723368478546587
Energy: 0.741000556031366
Energy: 0.7723368478546587
Energy: 0.7886570249871278
Energy: 0.7736224016567798
Energy: 0.7886570249876005
Energy: 0.7736224016591428
Energy: 0.7886570249838198
Energy: 0.7736224016581976
Energy: 0.7803787608978408
Energy: 0.7540460355648347
Energy: 0.7803787609006761
Energy: 0.7540460355653074
Energy: 0.7803787608978408
Energy: 0.7540460355653074
Energy: 0.744119906059812
Energy: 0.7582223769726044
Energy: 0.7441199060607572
Energy: 0.7582223769730769
Energy: 0.7441199060588669
Energy: 0.7582223769730769
Energy: 0.8384633035181651
Energy: 0.8247062116099242
Energy: 0.8384633035200554
Energy: 0.8247062116099242
Energy: 0.8384633035158022
Energy: 0.8247062116099242
Energy: 0.7374841388552335
Energy: 0.8326312951207363
Energy: 0.7374841388566511
Energy: 0.8326312951202639
Energy: 0.7374841388561785
Energy: 0.8326312951202639
Energy: 0.7942589700850817
Energy: 0.7748217216288865
Energy: 0.794258970091225
Energy: 0.7748217216293591
Energy: 0.7942589700888623
Energy: 0.7748217216293591
Energy: 0.7608577291936442
Energy: 0.7869496156899989
Energy: 0.7608577291950619
Energy: 0.7869496156899989
Energy: 0.7608577291936442
Energy: 0.7869496156899989
Energy: 0.8145893555312018
Energy: 0.8938707463364977
Energy: 0.8145893555316743
Energy: 0.8938707463360251
Energy: 0.8145893555307292
Energy: 0.8938707463364977
Energy: 0.7831695598466024
Energy: 0.7750770623197254
Energy: 0.7831695598484927
Energy: 0.7750770623201979
Energy: 0.7831695598475477
Energy: 0.7750770623197254
Energy: 0.7380274101896465
Energy: 0.7461482166537591
Energy: 0.7380274101877561
Energy: 0.7461482166542316
Energy: 0.7380274101872835
Energy: 0.7461482166542316
Energy: 0.8117512510731695
Energy: 0.750674282314487
Energy: 0.8117512510726967
Energy: 0.750674282314487
Energy: 0.8117512510722242
Energy: 0.750674282314487
Energy: 0.7425236900289329
Energy: 0.7724673598979106
Energy: 0.742523690029878
Energy: 0.7724673598979106
Energy: 0.742523690029878
Energy: 0.7724673598974379
Energy: 0.7714005829996144
Energy: 0.7583138124348112
Energy: 0.7714005830010321
Energy: 0.7583138124343386
Energy: 0.7714005829991418
Energy: 0.7583138124348112
Energy: 0.7805618001739897
Energy: 0.7908306120369263
Energy: 0.7805618001725719
Energy: 0.790830612037399
Energy: 0.78056180017588
Energy: 0.7908306120369263
Energy: 0.8523535664249978
Energy: 0.7749057137001036
Energy: 0.8523535664254703
Energy: 0.7749057137001036
Energy: 0.8523535664249978
Energy: 0.7749057137001036
Energy: 0.8053874665617399
Energy: 0.8269838439513998
Energy: 0.8053874665622123
Energy: 0.8269838439518723
Energy: 0.8053874665617399
Energy: 0.8269838439523449
Energy: 0.734087885330215
Energy: 0.8079587964275506
Energy: 0.734087885330215
Energy: 0.8079587964275506
Energy: 0.7340878853311601
Energy: 0.807958796427078
Energy: 0.8351550983100124
Energy: 0.7718378509483117
Energy: 0.8351550983081222
Energy: 0.7718378509483117
Energy: 0.8351550983085947
Energy: 0.7718378509483117
Energy: 0.7814157780587268
Energy: 0.7903195405127124
Energy: 0.7814157780587268
Energy: 0.7903195405127124
Energy: 0.7814157780591994
Energy: 0.7903195405131849
Energy: 0.7661477429216365
Energy: 0.7267673456745777
Energy: 0.7661477429235266
Energy: 0.7267673456745777
Energy: 0.7661477429230541
Energy: 0.7267673456745777
Energy: 0.7739488595451397
Energy: 0.7750055482142438
Energy: 0.7739488595413592
Energy: 0.7750055482142438
Energy: 0.773948859543722
Energy: 0.7750055482137712
Energy: 0.7976637820404031
Energy: 0.7426099128063085
Energy: 0.797663782037095
Energy: 0.7426099128063085
Energy: 0.7976637820399305
Energy: 0.742609912805836
Energy: 0.7371010092473542
Energy: 0.7425629554225261
Energy: 0.7371010092473542
Energy: 0.7425629554225261
Energy: 0.7371010092468816
Energy: 0.7425629554225261
Energy: 0.7743288310147796
Energy: 0.7799014157245469
Energy: 0.7743288310180876
Energy: 0.7799014157245469
Energy: 0.7743288310157247
Energy: 0.7799014157245469
Energy: 0.7373767135218291
Energy: 0.7266356721711108
Energy: 0.7373767135194662
Energy: 0.7266356721715835
Energy: 0.7373767135218291
Energy: 0.7266356721711108
Energy: 0.7796736865378501
Energy: 0.8359363933334462
Energy: 0.7796736865416305
Energy: 0.8359363933334462
Energy: 0.7796736865392676
Energy: 0.8359363933334462
Energy: 0.8340344453431037
Energy: 0.7597947862985459
Energy: 0.834034445344994
Energy: 0.7597947862990185
Energy: 0.8340344453397956
Energy: 0.7597947862985459
Energy: 0.7341032822519723
Energy: 0.8325617909472433
Energy: 0.7341032822533899
Energy: 0.832561790947716
Energy: 0.7341032822510272
Energy: 0.832561790947716
Energy: 0.8399319973833741
Energy: 0.8264242451897994
Energy: 0.8399319973843192
Energy: 0.8264242451902719
Energy: 0.8399319973847917
Energy: 0.8264242451902719
Energy: 0.8572752436094394
Energy: 0.7719413745899081
Energy: 0.8572752436132198
Energy: 0.7719413745903807
Energy: 0.8572752436103845
Energy: 0.7719413745899081
Energy: 0.7795535986460563
Energy: 0.8514913148487001
Energy: 0.7795535986479467
Energy: 0.8514913148491728
Energy: 0.7795535986465288
Energy: 0.8514913148487001
Energy: 0.7700031880492386
Energy: 0.7588486129763774
Energy: 0.7700031880525466
Energy: 0.7588486129763774
Energy: 0.7700031880506563
Energy: 0.7588486129763774
Energy: 0.7434000344519004
Energy: 0.7738396739351442
Energy: 0.7434000344519004
Energy: 0.7738396739346716
Energy: 0.743400034452373
Energy: 0.7738396739346716
Energy: 0.8116879112031575
Energy: 0.7445710786632467
Energy: 0.8116879112041027
Energy: 0.744571078662774
Energy: 0.8116879112045753
Energy: 0.744571078662774
Energy: 0.738573247934371
Energy: 0.7586709638428671
Energy: 0.738573247935316
Energy: 0.7586709638428671
Energy: 0.7385732479348434
Energy: 0.7586709638423946

minimum gb energy = 0.7266356721711108 eV
minimum distance =  2.34667018105814 Angstroms
sigma value = 41


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

Energy: 0.928496221130571
Energy: 0.8832956783785533
Energy: 0.928496221130571
Energy: 0.8832956783785533
Energy: 0.9284962211292808
Energy: 0.8832956783785533
Energy: 0.857864264313806
Energy: 0.9076443881811375
Energy: 0.857864264313806
Energy: 0.9076443881811375
Energy: 0.857864264313806
Energy: 0.9076443881811375
Energy: 1.0082369496805372
Energy: 0.8956283205054754
Energy: 1.0082369496805372
Energy: 0.8956283205054754
Energy: 1.008236949679247
Energy: 0.8956283205054754
Energy: 0.9461526705032034
Energy: 1.0104384608231538
Energy: 0.9461526705032034
Energy: 1.0104384608244439
Energy: 0.9461526705032034
Energy: 1.0104384608244439
Energy: 0.9383509758869806
Energy: 0.9149763213802447
Energy: 0.9383509758882709
Energy: 0.9149763213789545
Energy: 0.9383509758869806
Energy: 0.9149763213802447
Energy: 1.018923352248328
Energy: 0.954174367622603
Energy: 1.018923352248328
Energy: 0.954174367622603
Energy: 1.0189233522470382
Energy: 0.954174367622603
Energy: 0.9247364306604778
Energy: 0.8431087220004352
Energy: 0.9247364306604778
Energy: 0.8431087220004352
Energy: 0.9247364306604778
Energy: 0.8431087220004352
Energy: 0.920332569002284
Energy: 0.8954040254724617
Energy: 0.920332569002284
Energy: 0.8954040254724617
Energy: 0.920332569002284
Energy: 0.8954040254711714
Energy: 0.8582943528210619
Energy: 0.8598554425391958
Energy: 0.8582943528210619
Energy: 0.8598554425379056
Energy: 0.8582943528210619
Energy: 0.8598554425391958
Energy: 0.9245914926718302
Energy: 0.8974604424370156
Energy: 0.9245914926718302
Energy: 0.8974604424370156
Energy: 0.9245914926718302
Energy: 0.8974604424370156
Energy: 0.8612907545488059
Energy: 0.8955068250984298
Energy: 0.8612907545500961
Energy: 0.89550682509972
Energy: 0.8612907545488059
Energy: 0.8955068250984298
Energy: 0.9121859038266887
Energy: 0.9078704867949416
Energy: 0.9121859038266887
Energy: 0.9078704867949416
Energy: 0.9121859038266887
Energy: 0.9078704867949416
Energy: 0.9231824693089741
Energy: 0.9444783202269638
Energy: 0.9231824693102643
Energy: 0.9444783202269638
Energy: 0.9231824693102643
Energy: 0.9444783202269638
Energy: 0.936093307239536
Energy: 0.9073903979876363
Energy: 0.9360933072382458
Energy: 0.9073903979876363
Energy: 0.9360933072382458
Energy: 0.9073903979876363

minimum gb energy = 0.8431087220004352 eV
minimum distance =  2.2819925993749 Angstroms
sigma value = 11


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

Energy: 1.0523673009206245
Energy: 1.061635221329706
Energy: 1.0523673009206245
Energy: 1.061635221329706
Energy: 1.0523673009206245
Energy: 1.061635221329706
Energy: 1.0232723391004432
Energy: 1.0253521452536738
Energy: 1.0232723390998766
Energy: 1.0253521452531067
Energy: 1.0232723391004432
Energy: 1.0253521452536738
Energy: 1.0251633911697835
Energy: 1.002433080445595
Energy: 1.0251633911692168
Energy: 1.0024330804461619
Energy: 1.0251633911709173
Energy: 1.0024330804461619
Energy: 1.011485487860845
Energy: 0.9793943928821761
Energy: 1.0114854878597115
Energy: 0.9793943928821761
Energy: 1.011485487860278
Energy: 0.979394392882743
Energy: 1.031586544908655
Energy: 0.9794580796686098
Energy: 1.031586544905821
Energy: 0.979458079668043
Energy: 1.031586544908655
Energy: 0.979458079668043
Energy: 0.9893326764660043
Energy: 1.0256311989659814
Energy: 0.9893326764660043
Energy: 1.0256311989654148
Energy: 0.9893326764660043
Energy: 1.0256311989654148
Energy: 1.0048881143379
Energy: 1.006584248338854
Energy: 1.0048881143361998
Energy: 1.0065842483405547
Energy: 1.0048881143373334
Energy: 1.0065842483371539
Energy: 0.995182889483348
Energy: 0.9991212730411874
Energy: 0.9951828894822143
Energy: 0.9991212730406205
Energy: 0.995182889483348
Energy: 0.9991212730406205
Energy: 1.0144477396399538
Energy: 1.0054685393867604
Energy: 1.0144477396410876
Energy: 1.005468539387894
Energy: 1.0144477396405205
Energy: 1.005468539387894
Energy: 0.9832445235843155
Energy: 1.0241615207228358
Energy: 0.9832445235696041
Energy: 1.0241615207228358
Energy: 0.9832445235843155
Energy: 1.0241615207228358
Energy: 0.9830739376129283
Energy: 0.9948168823017766
Energy: 0.9830739376140618
Energy: 0.9948168822995093
Energy: 0.9830739376129283
Energy: 0.9948168823000761
Energy: 1.0059017436685702
Energy: 1.0240993263727038
Energy: 1.0059017436685702
Energy: 1.0240993263727038
Energy: 1.005901743669137
Energy: 1.0240993263727038
Energy: 1.012754288249941
Energy: 1.0019116182643284
Energy: 1.0127542882493743
Energy: 1.0019116182643284
Energy: 1.012754288249941
Energy: 1.0019116182643284
Energy: 1.0178097976673066
Energy: 1.0269940980437957
Energy: 1.0178097976678735
Energy: 1.0269940980437957
Energy: 1.0178097976684402
Energy: 1.0269940980432288
Energy: 0.9841207941352406
Energy: 1.002815557385787
Energy: 0.9841207941346738
Energy: 1.0028155573852204
Energy: 0.9841207941346738
Energy: 1.0028155573852204
Energy: 1.0075731696201327
Energy: 1.0209939129638195
Energy: 1.0075731696201327
Energy: 1.02099391296552
Energy: 1.0075731696195656
Energy: 1.0209939129632524
Energy: 0.9693506518124674
Energy: 0.9964741473560953
Energy: 0.9693506518130341
Energy: 0.996474147354395
Energy: 0.9693506518130341
Energy: 0.996474147354395
Energy: 1.0359894282580795
Energy: 1.0248076632168324
Energy: 1.035989428259213
Energy: 1.0248076632168324
Energy: 1.0359894282586464
Energy: 1.0248076632173992
Energy: 0.9778196586565022
Energy: 0.9609725194822072
Energy: 0.9778196586593364
Energy: 0.9609725194816403
Energy: 0.9778196586565022
Energy: 0.9609725194822072
Energy: 1.0343577458961861
Energy: 0.9940857453501467
Energy: 1.034357745896753
Energy: 0.9940857453501467
Energy: 1.034357745896753
Energy: 0.9940857453501467
Energy: 0.9974897343136793
Energy: 0.9842376946940837
Energy: 0.9974897343142461
Energy: 0.9842376946940837
Energy: 0.9974897343136793
Energy: 0.9842376946940837
Energy: 1.0556250085854515
Energy: 1.0584492101321457
Energy: 1.0556250085865853
Energy: 1.0584492101321457
Energy: 1.0556250085854515
Energy: 1.0584492101321457
Energy: 1.0070684247688604
Energy: 1.0031680431103116
Energy: 1.0070684247688604
Energy: 1.0031680431103116
Energy: 1.007068424769427
Energy: 1.0031680431108783
Energy: 1.0358990585090595
Energy: 1.0257690154270886
Energy: 1.0358990585090595
Energy: 1.0257690154270886
Energy: 1.0358990585096264
Energy: 1.0257690154270886
Energy: 0.9895603788825137
Energy: 1.0090709334278947
Energy: 0.9895603788825137
Energy: 1.0090709334278947
Energy: 0.9895603788830805
Energy: 1.0090709334278947
Energy: 1.0040422213073268
Energy: 0.9925415457763672
Energy: 1.0040422213084603
Energy: 0.9925415457763672
Energy: 1.0040422213078934
Energy: 0.9925415457763672
Energy: 0.9886002644323025
Energy: 1.042061581072384
Energy: 0.9886002644311689
Energy: 1.0420615810712504
Energy: 0.9886002644283349
Energy: 1.0420615810718172
Energy: 1.0107413990265173
Energy: 0.984297456338255
Energy: 1.0107413990259506
Energy: 0.984297456338255
Energy: 1.0107413990270842
Energy: 0.984297456338255
Energy: 1.0149174186258911
Energy: 1.0202442846844075
Energy: 1.0149174186264582
Energy: 1.0202442846844075
Energy: 1.0149174186264582
Energy: 1.0202442846844075
Energy: 0.9891275498899033
Energy: 0.9600663642784769
Energy: 0.98912754989047
Energy: 0.9600663642790438
Energy: 0.9891275498893366
Energy: 0.9600663642784769
Energy: 0.9826508420637489
Energy: 1.0286080669936444
Energy: 0.9826508420637489
Energy: 1.0286080669953446
Energy: 0.9826508420626152
Energy: 1.0286080669959112

minimum gb energy = 0.9600663642784769 eV
minimum distance =  2.28362877631749 Angstroms
sigma value = 57


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

Energy: 0.9485022148586952
Energy: 0.986068581458349
Energy: 0.9485022148586952
Energy: 0.986068581458349
Energy: 0.9485022148597038
Energy: 0.986068581458349
Energy: 1.0100414922049266
Energy: 0.963880496774877
Energy: 1.010041492203918
Energy: 0.963880496774877
Energy: 1.0100414922049266
Energy: 0.9638804967758856
Energy: 1.0325826350695204
Energy: 0.988259239572342
Energy: 1.0325826350695204
Energy: 0.988259239572342
Energy: 1.0325826350685114
Energy: 0.988259239572342
Energy: 0.9600768658277217
Energy: 1.00715220632166
Energy: 0.960076865826713
Energy: 1.00715220632166
Energy: 0.960076865826713
Energy: 1.00715220632166
Energy: 1.032568796503602
Energy: 0.9882692398444979
Energy: 1.0325687965046104
Energy: 0.9882692398455065
Energy: 1.0325687965046104
Energy: 0.9882692398455065
Energy: 1.010114969150241
Energy: 0.963053324425546
Energy: 1.010114969152258
Energy: 0.963053324425546
Energy: 1.010114969150241
Energy: 0.9630533244245373
Energy: 0.9485022148576866
Energy: 0.9860685814573401
Energy: 0.9485022148586952
Energy: 0.9860685814573401
Energy: 0.9485022148576866
Energy: 0.9860685814573401
Energy: 1.0100414922029093
Energy: 0.9638804967768942
Energy: 1.0100414922029093
Energy: 0.9638804967758856
Energy: 1.0100414922029093
Energy: 0.9638804967768942
Energy: 1.0325826350685114
Energy: 0.9882592395693158
Energy: 1.0325826350695204
Energy: 0.9882592395693158
Energy: 1.0325826350685114
Energy: 0.9882592395693158
Energy: 0.9600768658226784
Energy: 1.00715220632166
Energy: 0.9600768658226784
Energy: 1.00715220632166
Energy: 0.9600768658226784
Energy: 1.00715220632166
Energy: 1.0325687965046104
Energy: 0.9882692398475238
Energy: 1.0325687965056192
Energy: 0.9882692398475238
Energy: 1.0325687965046104
Energy: 0.9882692398475238
Energy: 1.0101149691482236
Energy: 0.963053324425546
Energy: 1.010114969150241
Energy: 0.963053324425546
Energy: 1.0101149691492324
Energy: 0.963053324425546
Energy: 0.9485022148586952
Energy: 0.986068581458349
Energy: 0.9485022148576866
Energy: 0.986068581458349
Energy: 0.9485022148586952
Energy: 0.986068581458349
Energy: 1.010041492203918
Energy: 0.9638804967758856
Energy: 1.0100414922029093
Energy: 0.9638804967758856
Energy: 1.0100414922049266
Energy: 0.963880496774877
Energy: 1.0325826350695204
Energy: 0.988259239572342
Energy: 1.0325826350695204
Energy: 0.988259239572342
Energy: 1.0325826350695204
Energy: 0.988259239572342
Energy: 0.960076865826713
Energy: 0.9899820956376222
Energy: 0.960076865826713
Energy: 0.9899820956366135
Energy: 0.9600768658277217
Energy: 0.9899820956376222
Energy: 1.0325687965046104
Energy: 0.9882692398455065
Energy: 1.0325687965046104
Energy: 0.9882692398455065
Energy: 1.032568796503602
Energy: 0.9882692398455065

minimum gb energy = 0.9485022148576866 eV
minimum distance =  2.30274068661712 Angstroms
sigma value = 9


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

Energy: 1.0463889293537076
Energy: 1.0340404480293277
Energy: 1.0463889293537076
Energy: 1.034040448026857
Energy: 1.046388929354531
Energy: 1.0340404480293277
Energy: 1.0764625253823874
Energy: 1.0277480609403127
Energy: 1.0764625253815638
Energy: 1.0277480609403127
Energy: 1.0764625253807403
Energy: 1.0277480609403127
Energy: 1.077943774519862
Energy: 1.0361586622824221
Energy: 1.0779437745182148
Energy: 1.0361586622824221
Energy: 1.0779437745190383
Energy: 1.0361586622824221
Energy: 1.0124790089692108
Energy: 1.1642116180250421
Energy: 1.0124790089692108
Energy: 1.1642116180250421
Energy: 1.0124790089700344
Energy: 1.1642116180250421
Energy: 1.0468342154379127
Energy: 1.0266439183359497
Energy: 1.0468342154387362
Energy: 1.0266439183359497
Energy: 1.046834215437089
Energy: 1.0266439183359497
Energy: 1.064566624763093
Energy: 1.0291670195575704
Energy: 1.064566624763093
Energy: 1.0291670195575704
Energy: 1.064566624763093
Energy: 1.0291670195567466
Energy: 1.0136457352751653
Energy: 1.082426633119333
Energy: 1.013645735275989
Energy: 1.0824266331185095
Energy: 1.0136457352743418
Energy: 1.0824266331168624
Energy: 1.0228331976043856
Energy: 1.065507818546594
Energy: 1.0228331976052092
Energy: 1.065507818546594
Energy: 1.0228331976052092
Energy: 1.065507818546594
Energy: 1.15746307485287
Energy: 1.027182168174336
Energy: 1.1574630748536936
Energy: 1.027182168174336
Energy: 1.1574630748536936
Energy: 1.027182168174336
Energy: 1.006290692827343
Energy: 1.0635754523725935
Energy: 1.006290692827343
Energy: 1.0635754523734169
Energy: 1.006290692827343
Energy: 1.0635754523734169
Energy: 1.062150694076449
Energy: 1.0761296264508944
Energy: 1.062150694076449
Energy: 1.0761296264508944
Energy: 1.062150694076449
Energy: 1.0761296264508944
Energy: 1.122961213938786
Energy: 1.0267475276923737
Energy: 1.122961213938786
Energy: 1.0267475276923737
Energy: 1.1229612139379623
Energy: 1.0267475276923737
Energy: 1.0057804578213283
Energy: 1.1356708815879233
Energy: 1.0057804578213283
Energy: 1.1356708815870997
Energy: 1.0057804578229754
Energy: 1.1356708815879233
Energy: 1.0519572336556784
Energy: 1.0808001095179474
Energy: 1.0519572336556784
Energy: 1.0808001095179474
Energy: 1.051957233654855
Energy: 1.0808001095179474
Energy: 1.0749254688342122
Energy: 1.0289977762353244
Energy: 1.0749254688342122
Energy: 1.0289977762353244
Energy: 1.0749254688350356
Energy: 1.0289977762353244
Energy: 1.0564252910898386
Energy: 1.0647613556302322
Energy: 1.0564252910906622
Energy: 1.0647613556252908
Energy: 1.0564252910898386
Energy: 1.0647613556294084
Energy: 1.050549073008686
Energy: 1.070679031460402
Energy: 1.050549073008686
Energy: 1.070679031460402
Energy: 1.0505490730095097
Energy: 1.0706790314612256
Energy: 1.1822565588656735
Energy: 1.030768422332728
Energy: 1.1822565588656735
Energy: 1.030768422332728
Energy: 1.1822565588648501
Energy: 1.0307684223319045
Energy: 1.0209760155409502
Energy: 1.0781702605512664
Energy: 1.0209760155434207
Energy: 1.0781702605504428
Energy: 1.0209760155409502
Energy: 1.0781702605504428
Energy: 1.023199058973794
Energy: 1.0797160641726176
Energy: 1.023199058973794
Energy: 1.079716064171794
Energy: 1.023199058973794
Energy: 1.0797160641726176
Energy: 1.1254185289121748
Energy: 1.0233800353410898
Energy: 1.1254185289138219
Energy: 1.0233800353410898
Energy: 1.1254185289129983
Energy: 1.0233800353410898

minimum gb energy = 1.0057804578213283 eV
minimum distance =  2.26417925155608 Angstroms
sigma value = 27


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

Energy: 0.9792217457503892
Energy: 1.0361594511665981
Energy: 0.9792217457476123
Energy: 1.0361594511665981
Energy: 0.9792217457503892
Energy: 1.0361594511665981
Energy: 0.9909614047879985
Energy: 1.0183014657426108
Energy: 0.9909614047866101
Energy: 1.0183014659535523
Energy: 0.9909614047866101
Energy: 1.018301465866115
Energy: 1.0489821872477803
Energy: 0.964819842194181
Energy: 1.0489822151351709
Energy: 0.9648198421990405
Energy: 1.048982210402165
Energy: 0.9648198421962637
Energy: 0.9792931790839468
Energy: 1.0189699755172394
Energy: 0.9792931789590544
Energy: 1.0189693268752047
Energy: 0.9792939985677278
Energy: 1.0189672891927142
Energy: 1.019563882296989
Energy: 1.0097278358331296
Energy: 1.0195638822956006
Energy: 1.0097278358331296
Energy: 1.0195638822997657
Energy: 1.0097278358338242
Energy: 1.0354248727623738
Energy: 0.9817553369661909
Energy: 1.0354248727616797
Energy: 0.9817553369738271
Energy: 1.0354248727595972
Energy: 0.9817553369738271
Energy: 0.9791567764902724
Energy: 1.0387809972272912
Energy: 0.9791567764875273
Energy: 1.0387809972321504
Energy: 0.9791567764875273
Energy: 1.038780997233539
Energy: 1.0515299228434591
Energy: 1.0497509950187476
Energy: 1.0515299228434591
Energy: 1.0497509950118056
Energy: 1.0515299228469301
Energy: 1.0497509950222186
Energy: 1.0349840310227258
Energy: 0.9823502990902437
Energy: 1.03498403102342
Energy: 0.9823502990902437
Energy: 1.0349840310220317
Energy: 0.982350299094409
Energy: 0.9793208585105275
Energy: 0.983965411893823
Energy: 0.9793208587388239
Energy: 0.9839653795419233
Energy: 0.9793208600128023
Energy: 0.9839659855958028
Energy: 0.9792273737637839
Energy: 0.9839106819672075
Energy: 0.9792273740780973
Energy: 0.983910661949901
Energy: 0.9792273734001822
Energy: 0.9839106933677897
Energy: 1.0349931711247673
Energy: 0.981729584570357
Energy: 1.034993171124073
Energy: 0.9817295845752162
Energy: 1.0349931711261557
Energy: 0.9817295845766046
Energy: 1.0518618559066033
Energy: 1.0498350873855073
Energy: 1.0518618559059092
Energy: 1.0498350873841191
Energy: 1.0518618559107686
Energy: 1.0498350873841191
Energy: 0.9791499168104871
Energy: 1.0387845215304665
Energy: 0.9791499168104871
Energy: 1.0387845215332434
Energy: 0.9791499168077104
Energy: 1.038784521535326
Energy: 1.0354631895198998
Energy: 0.981750891398891
Energy: 1.0354631895178172
Energy: 0.9817508914023304
Energy: 1.0354631895192057
Energy: 0.9817508913968085
Energy: 1.0195680582494935
Energy: 1.009890982621284
Energy: 1.0195680582494935
Energy: 1.009890982621284
Energy: 1.0195680582529647
Energy: 1.00989098262059
Energy: 0.9790330176655998
Energy: 1.0189133817384624
Energy: 0.9790335341869542
Energy: 1.018909397291719
Energy: 0.9790369461925381
Energy: 1.0189123230503052
Energy: 1.0487776504303326
Energy: 0.9648731551637623
Energy: 1.0487775108288555
Energy: 0.9648731551630682
Energy: 1.0487781921808066
Energy: 0.9648731551630682
Energy: 0.9909186787854711
Energy: 1.0181957558210186
Energy: 0.9909186787847768
Energy: 1.0181957558196304
Energy: 0.9909186787833885
Energy: 1.0181957558147707
Energy: 0.9792217457455297
Energy: 1.0361594511665981
Energy: 0.9792217457441413
Energy: 1.0361594511665981
Energy: 0.9792217457441413
Energy: 1.0361594511665981
Energy: 0.990961404785916
Energy: 1.0183014663428076
Energy: 0.9909614047886928
Energy: 1.0183014663414192
Energy: 0.9909614047845275
Energy: 1.0183014659306435
Energy: 1.048982135191499
Energy: 0.964819842197652
Energy: 1.048982152640055
Energy: 0.964819842194181
Energy: 1.0489820884858383
Energy: 0.9648198421962637
Energy: 0.9792920147657429
Energy: 1.0189693245541558
Energy: 0.9792935173701637
Energy: 1.0189692898742653
Energy: 0.9792932210663202
Energy: 1.0189670410468552
Energy: 1.0195638822956006
Energy: 1.0097278358345183
Energy: 1.0195638822983775
Energy: 1.0097278358338242
Energy: 1.0195638822997657
Energy: 1.0097278358338242
Energy: 1.0354248727575144
Energy: 0.9817553369717446
Energy: 1.0354248727561262
Energy: 0.9817553369675793
Energy: 1.0354248727526552
Energy: 0.9817553369731329

minimum gb energy = 0.964819842194181 eV
minimum distance =  2.3452929271209 Angstroms
sigma value = 19


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

Energy: 0.9731208980386422
Energy: 1.1318072994920971
Energy: 0.9731208980392415
Energy: 1.1318072994920971
Energy: 0.9731208980392415
Energy: 1.131807299492696
Energy: 1.0295673453174685
Energy: 0.956775057879294
Energy: 1.0295673453180676
Energy: 0.956775057879294
Energy: 1.0295673453174685
Energy: 0.956775057879294
Energy: 1.0226651965580948
Energy: 0.9235678266642264
Energy: 1.0226651965568962
Energy: 0.9235678266636271
Energy: 1.0226651965568962
Energy: 0.9235678266636271
Energy: 0.9362342265602471
Energy: 1.052866747161289
Energy: 0.9362342265608463
Energy: 1.052866747161289
Energy: 0.9362342265608463
Energy: 1.052866747161289
Energy: 0.9951476700065555
Energy: 1.0287937629373949
Energy: 0.9951476700083531
Energy: 1.0287937629367956
Energy: 0.9951476700071545
Energy: 1.0287937629373949
Energy: 1.0311130151529126
Energy: 0.9456572944622231
Energy: 1.0311130151529126
Energy: 0.9456572944622231
Energy: 1.0311130151529126
Energy: 0.9456572944622231
Energy: 0.9255878228853217
Energy: 1.1111187120925343
Energy: 0.9255878228847225
Energy: 1.1111187120931334
Energy: 0.9255878228853217
Energy: 1.1111187120925343
Energy: 0.9654131165555624
Energy: 1.023724284494397
Energy: 0.9654131165549633
Energy: 1.0237242844949963
Energy: 0.9654131165555624
Energy: 1.023724284494397
Energy: 1.1077780291379358
Energy: 0.9237038477958864
Energy: 1.1077780291379358
Energy: 0.9237038477958864
Energy: 1.1077780291379358
Energy: 0.9237038477958864
Energy: 0.9490515028283496
Energy: 1.010265686787074
Energy: 0.9490515028271511
Energy: 1.0102656867876731
Energy: 0.9490515028283496
Energy: 1.010265686787074
Energy: 0.9277219933411631
Energy: 1.157284052133339
Energy: 0.927721993340564
Energy: 1.157284052133339
Energy: 0.927721993340564
Energy: 1.157284052133339
Energy: 1.0660540647997443
Energy: 0.9359634674968264
Energy: 1.0660540647997443
Energy: 0.9359634674956281
Energy: 1.0660540647997443
Energy: 0.9359634674956281
Energy: 0.9673232927058589
Energy: 0.9639514428262047
Energy: 0.9673232927058589
Energy: 0.9639514428262047
Energy: 0.9673232927058589
Energy: 0.9639514428262047
Energy: 0.9405378500563721
Energy: 1.0310653328409207
Energy: 0.940537850055773
Energy: 1.0310653328409207
Energy: 0.9405378500563721
Energy: 1.0310653328409207
Energy: 1.03056306581947
Energy: 0.9186091375200078
Energy: 1.030563065818871
Energy: 0.9186091375206072
Energy: 1.0305630658200693
Energy: 0.9186091375206072
Energy: 1.0999766794580919
Energy: 0.9256598054914282
Energy: 1.0999766794586914
Energy: 0.9256598054914282
Energy: 1.0999766794580919
Energy: 0.9256598054908288
Energy: 0.9458972052198753
Energy: 1.0504600824205914
Energy: 0.9458972052192762
Energy: 1.0504600824199921
Energy: 0.9458972052204746
Energy: 1.0504600824199921
Energy: 1.0216993001533594
Energy: 0.9882578504952919
Energy: 1.0216993001545578
Energy: 0.9882578504946926
Energy: 1.0216993001533594
Energy: 0.9882578504958911
Energy: 1.0497594474390894
Energy: 0.9440203823267301
Energy: 1.0497594474408871
Energy: 0.9440203823267301
Energy: 1.0497594474408871
Energy: 0.9440203823267301
Energy: 0.9372621449884267
Energy: 1.041527180893458
Energy: 0.9372621449884267
Energy: 1.0415271808946565
Energy: 0.9372621449878273
Energy: 1.0415271808946565
Energy: 0.914050432050001
Energy: 1.0288754769257908
Energy: 0.914050432050001
Energy: 1.0288754769257908
Energy: 0.914050432050001
Energy: 1.0288754769257908
Energy: 1.106225129976512
Energy: 0.9355646773088082
Energy: 1.10622512997831
Energy: 0.9355646773088082
Energy: 1.1062251299771113
Energy: 0.9355646773088082
Energy: 0.9734586627493306
Energy: 0.9963580411876497
Energy: 0.9734586627487314
Energy: 0.9963580411876497
Energy: 0.9734586627487314
Energy: 0.9963580411870504
Energy: 0.9735121261415446
Energy: 1.0690991556490637
Energy: 0.9735121261421437
Energy: 1.0690991556490637
Energy: 0.9735121261415446
Energy: 1.0690991556490637
Energy: 1.0245580581277958
Energy: 0.9369978339898041
Energy: 1.0245580581277958
Energy: 0.9369978339904032
Energy: 1.0245580581277958
Energy: 0.9369978339898041
Energy: 0.9741307869208892
Energy: 0.9555799043929886
Energy: 0.9741307869214885
Energy: 0.9555799043923893
Energy: 0.9741307869220875
Energy: 0.9555799043923893
Energy: 0.9231970177422437
Energy: 1.0221789982394474
Energy: 0.9231970177410455
Energy: 1.0221789982400467
Energy: 0.9231970177410455
Energy: 1.0221789982412453
Energy: 1.011357885587053
Energy: 0.9432856699846731
Energy: 1.0113578855864538
Energy: 0.9432856699846731
Energy: 1.0113578855864538
Energy: 0.9432856699846731
Energy: 1.0433422002390997
Energy: 0.9438370610592626
Energy: 1.0433422002402981
Energy: 0.9438370610592626
Energy: 1.043342200239699
Energy: 0.9438370610592626

minimum gb energy = 0.914050432050001 eV
minimum distance =  2.3108167478477 Angstroms
sigma value = 101


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

Energy: 0.9127730865432914
Energy: 1.017771229377366
Energy: 0.9127730865427646
Energy: 1.017771229377366
Energy: 0.9127730865427646
Energy: 1.0177712293778927
Energy: 0.9484462544275948
Energy: 0.9037952682872178
Energy: 0.9484462544270681
Energy: 0.9037952682872178
Energy: 0.9484462544265413
Energy: 0.9037952682866911
Energy: 1.0169796418386337
Energy: 0.8916408612903605
Energy: 1.0169796418386337
Energy: 0.8916408612903605
Energy: 1.0169796418375803
Energy: 0.8916408612903605
Energy: 0.8706703493425897
Energy: 1.0987961507700046
Energy: 0.8706703493410094
Energy: 1.098796150769478
Energy: 0.8706703493431164
Energy: 1.0987961507700046
Energy: 0.9026210779248877
Energy: 0.9568267886201215
Energy: 0.9026210779248877
Energy: 0.9568267886201215
Energy: 0.902621077924361
Energy: 0.9568267886195948
Energy: 1.0044561153248117
Energy: 0.880857635148521
Energy: 1.0044561153258653
Energy: 0.880857635148521
Energy: 1.0044561153248117
Energy: 0.880857635148521
Energy: 0.9043450386731232
Energy: 0.9039264413453086
Energy: 0.9043450386720697
Energy: 0.9039264413453086
Energy: 0.9043450386731232
Energy: 0.9039264413453086
Energy: 0.8698218554615585
Energy: 1.017750813257529
Energy: 0.8698218554636654
Energy: 1.017750813257529
Energy: 0.8698218554615585
Energy: 1.0177508132564754
Energy: 1.0144914956497275
Energy: 0.8815834936629752
Energy: 1.0144914956497275
Energy: 0.8815834936624484
Energy: 1.0144914956497275
Energy: 0.8815834936629752
Energy: 0.9595505531259673
Energy: 0.9326658618382327
Energy: 0.9595505531249138
Energy: 0.9326658618377061
Energy: 0.9595505531254406
Energy: 0.9326658618377061
Energy: 0.8689591360968851
Energy: 1.1250333124331082
Energy: 0.8689591360968851
Energy: 1.1250333124331082
Energy: 0.8689591360963583
Energy: 1.1250333124325815
Energy: 0.9832410178593637
Energy: 0.9042200298820138
Energy: 0.9832410178593637
Energy: 0.9042200298820138
Energy: 0.9832410178604173
Energy: 0.904220029881487
Energy: 0.9932682382419968
Energy: 0.8916620061235551
Energy: 0.9932682382430503
Energy: 0.8916620061230283
Energy: 0.99326823824147
Energy: 0.8916620061235551
Energy: 0.9129650660289437
Energy: 1.0313520438284245
Energy: 0.9129650660278902
Energy: 1.0313520438289512
Energy: 0.9129650660289437
Energy: 1.0313520438289512
Energy: 0.9326180236614746
Energy: 0.9453659202834895
Energy: 0.9326180236609478
Energy: 0.9453659202829627
Energy: 0.9326180236614746
Energy: 0.9453659202834895
Energy: 1.0155007443012247
Energy: 0.8931919872921646
Energy: 1.0155007443012247
Energy: 0.8931919872926914
Energy: 1.0155007443012247
Energy: 0.8931919872926914
Energy: 0.8665935469171485
Energy: 0.9705656967336256
Energy: 0.866593546916095
Energy: 0.9705656967336256
Energy: 0.8665935469166217
Energy: 0.9705656967330989
Energy: 0.8659759689732437
Energy: 0.9570670949280623
Energy: 0.8659759689727168
Energy: 0.957067094928589
Energy: 0.8659759689721901
Energy: 0.957067094928589
Energy: 1.005806756658101
Energy: 0.8815845146852413
Energy: 1.0058067566570474
Energy: 0.8815845146852413
Energy: 1.0058067566586277
Energy: 0.8815845146847147
Energy: 0.9036230237814215
Energy: 0.9032945608366403
Energy: 0.903623023780368
Energy: 0.9032945608361136
Energy: 0.9036230237814215
Energy: 0.9032945608361136
Energy: 0.8702634821326412
Energy: 1.1234959248310799
Energy: 0.8702634821315877
Energy: 1.1234959248316065
Energy: 0.8702634821321144
Energy: 1.1234959248326601
Energy: 1.020458930458467
Energy: 0.880279755123276
Energy: 1.0204589304595206
Energy: 0.8802797551238029
Energy: 1.0204589304626812
Energy: 0.880279755123276
Energy: 1.0193634089881762
Energy: 0.8802859072576741
Energy: 1.0193634089881762
Energy: 0.8802859072571474
Energy: 1.0193634089881762
Energy: 0.8802859072571474
Energy: 0.8707557651803488
Energy: 1.045158192400667
Energy: 0.8707557651798221
Energy: 1.045158192400667
Energy: 0.8707557651803488
Energy: 1.045158192400667
Energy: 0.9824630009354592
Energy: 0.9233493412588633
Energy: 0.9824630009344058
Energy: 0.9233493412588633
Energy: 0.9824630009354592
Energy: 0.9233493412588633
Energy: 0.9924072973110086
Energy: 0.8931485874957047
Energy: 0.9924072973131158
Energy: 0.8931485874957047
Energy: 0.9924072973120621
Energy: 0.8931485874962314
Energy: 0.9124825891117424
Energy: 1.0017572569924675
Energy: 0.9124825891101622
Energy: 1.0017572569919408
Energy: 0.9124825891112157
Energy: 1.0017572569919408
Energy: 0.9126076603305663
Energy: 0.9443147555172287
Energy: 0.9126076603316197
Energy: 0.9443147555177556
Energy: 0.9126076603305663
Energy: 0.944314755516702
Energy: 1.045190727659742
Energy: 0.8914683075444231
Energy: 1.0451907276607955
Energy: 0.8914683075444231
Energy: 1.0451907276607955
Energy: 0.8914683075449498
Energy: 0.8660699407519357
Energy: 0.9547876980749225
Energy: 0.8660699407514089
Energy: 0.9547876980749225
Energy: 0.8660699407508822
Energy: 0.9547876980749225
Energy: 0.8660680474944715
Energy: 1.017246490039976
Energy: 0.8660680474949983
Energy: 1.017246490040503
Energy: 0.866068047495525
Energy: 1.017246490039976
Energy: 1.0191752310025666
Energy: 0.8801470647382834
Energy: 1.0191752310030933
Energy: 0.8801470647382834
Energy: 1.0191752310030933
Energy: 0.8801470647382834
Energy: 1.019171023166399
Energy: 0.8801755410319879
Energy: 1.019171023166399
Energy: 0.8801755410314612
Energy: 1.0191710231674527
Energy: 0.8801755410314612

minimum gb energy = 0.8659759689721901 eV
minimum distance =  2.34448835305106 Angstroms
sigma value = 33


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

Energy: 0.014174715247676183
Energy: 0.7230847316329482
Energy: 0.014174715247676183
Energy: 0.7230847316342367
Energy: 0.014174715247676183
Energy: 0.7230847316329482
Energy: 0.014982992604090873
Energy: 0.2773330398462187
Energy: 0.014982992604090873
Energy: 0.2773330398462187
Energy: 0.014982992603653215
Energy: 0.2773330398462187
Energy: 0.7235271000217639
Energy: 0.2771204547957078
Energy: 0.723514203378641
Energy: 0.27712045775527083
Energy: 0.7235361930654278
Energy: 0.2771204542238351
Energy: 0.014982992603215556
Energy: 0.2773330398453677
Energy: 0.014982992603653215
Energy: 0.2773330398458054
Energy: 0.014982992603215556
Energy: 0.2773330398458054

minimum gb energy = 0.014174715247676183 eV
minimum distance =  2.56595535896732 Angstroms
sigma value = 1