Model name: model_name=EAM_Dynamo_MendelevKing_2008_Cu__MO_748636486270_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=3.6390298828482632
cohesive_energy=3.422988348542933
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: 0.01306609636252217
Energy: 1.024318675300866
Energy: 0.01306609636252217
Energy: 1.0243186753014508
Energy: 0.01306609636252217
Energy: 1.024318675301141
Energy: 1.024318675300866
Energy: 0.3812548403848892
Energy: 1.024318675301141
Energy: 0.8915681115199878
Energy: 1.0243186753005566
Energy: 0.8800184545476469
Energy: 0.01306609636252217
Energy: 1.024318675301141
Energy: 0.01306609636252217
Energy: 1.0243186753014508
Energy: 0.01306609636252217
Energy: 1.024318675301141
Energy: 1.024318675301141
Energy: 0.8915681115208819
Energy: 1.0243186753014508
Energy: 0.9859153503790788
Energy: 1.0243186753014508
Energy: 0.8800184545485753
Energy: 0.01306609636252217
Energy: 1.024318675300866
Energy: 0.01306609636252217
Energy: 1.0243186753017604
Energy: 0.01306609636252217
Energy: 1.024318675301141
Energy: 1.024318675301141
Energy: 0.8800184545476469
Energy: 1.024318675301141
Energy: 0.8800184545488848
Energy: 1.024318675301141
Energy: 0.8800184545479564

minimum gb energy = 0.01306609636252217 eV
minimum distance =  2.29411636364781 Angstroms
sigma value = 1


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

Energy: 0.9835040417534137
Energy: 0.9514232523989251
Energy: 0.9835040417519237
Energy: 0.95142325239818
Energy: 0.9835040417511788
Energy: 0.9514232523996698
Energy: 1.1297526284359278
Energy: 0.8978239048846339
Energy: 1.1297526265520341
Energy: 0.8978239048846339
Energy: 1.1297526214498606
Energy: 0.8978239048838891
Energy: 0.9721211701528243
Energy: 1.0067412133770544
Energy: 0.9721211701483544
Energy: 1.0067412133800344
Energy: 0.9721211701528243
Energy: 1.0067412133755647
Energy: 1.097170477033856
Energy: 0.9303002044217258
Energy: 1.097170477027151
Energy: 0.9303002044217258
Energy: 1.0971704770249162
Energy: 0.9303002044217258
Energy: 0.9532369299820571
Energy: 1.0443175491489431
Energy: 0.953236929982802
Energy: 1.0443175491481982
Energy: 0.9532369299842921
Energy: 1.0443175491504328
Energy: 1.0246184897034802
Energy: 0.8978356022430215
Energy: 1.0246184897027353
Energy: 0.8978356022437666
Energy: 1.0246184897027353
Energy: 0.8978356022437666
Energy: 0.9231222446619939
Energy: 0.9677913893954653
Energy: 0.9231222446686985
Energy: 0.9677913893939755
Energy: 0.9231222446634839
Energy: 0.9677913893947203
Energy: 0.9234396564103232
Energy: 1.0445935786823948
Energy: 0.9234396564095783
Energy: 1.0445935786667506
Energy: 0.9234396564080884
Energy: 1.0445935786823948
Energy: 1.0330061646849542
Energy: 0.9679851846253287
Energy: 1.0330061646864441
Energy: 0.9679851846275636
Energy: 1.0330061646856994
Energy: 0.9679851846260737
Energy: 0.8825479114741787
Energy: 1.042537991597322
Energy: 0.8825479114741787
Energy: 1.0425379915965773
Energy: 0.8825479114741787
Energy: 1.042537991597322
Energy: 0.9875073436148861
Energy: 0.8979618556863068
Energy: 0.9875073436141412
Energy: 0.8979618556863068
Energy: 0.9875073436148861
Energy: 0.8979618556863068
Energy: 0.8762033988494449
Energy: 1.020988879225985
Energy: 0.8762033988494449
Energy: 1.020988845739442
Energy: 0.8762033988494449
Energy: 1.0209887921040248
Energy: 1.1208071032023779
Energy: 0.8651796380543179
Energy: 1.120807103203123
Energy: 0.8651796380535728
Energy: 1.1208071031993982
Energy: 0.8651796380528278
Energy: 0.911862761133722
Energy: 1.0079332407522976
Energy: 0.9118627611344671
Energy: 1.0079332407560222
Energy: 0.911862761135212
Energy: 1.0079332407574784
Energy: 1.1205104009090905
Energy: 0.8899632478205973
Energy: 1.1205104009083455
Energy: 0.8899632478198524
Energy: 1.1205104009083455
Energy: 0.8899632478198524
Energy: 1.1251617129731675
Energy: 1.008706292327801
Energy: 1.1251617129731675
Energy: 1.0087062923270558
Energy: 1.1251617129731675
Energy: 1.008706292327801
Energy: 0.9598354021406342
Energy: 0.9687921274429391
Energy: 0.9598354021421243
Energy: 0.9687921274407042
Energy: 0.959835402144359
Energy: 0.9687921274407042
Energy: 0.9599360065569658
Energy: 0.935358969539423
Energy: 0.9599360065584557
Energy: 0.935358969537188
Energy: 0.9599360065562208
Energy: 0.9353589695431477
Energy: 0.9600855109892696
Energy: 0.929069651087318
Energy: 0.9600855109915045
Energy: 0.9290696510902977
Energy: 0.9600855109907596
Energy: 0.929069651087318
Energy: 1.0162302942232175
Energy: 0.8979529138172166
Energy: 1.0162302942261976
Energy: 0.8979529138179616
Energy: 1.0162302942209827
Energy: 0.8979529138179616
Energy: 0.9079039394565637
Energy: 1.2214965923912224
Energy: 0.9079039394580535
Energy: 1.2214965923852625
Energy: 0.9079039394573085
Energy: 1.221496592377813
Energy: 1.0018168115617339
Energy: 0.9708474258760306
Energy: 1.001816811558754
Energy: 0.9708474258752856
Energy: 1.001816811559499
Energy: 0.9708474258752856
Energy: 0.8809606329213104
Energy: 1.272821849874701
Energy: 0.8809606329213104
Energy: 1.272821849874701
Energy: 0.8809606329213104
Energy: 1.2728218498732111

minimum gb energy = 0.8651796380528278 eV
minimum distance =  2.2739162238433 Angstroms
sigma value = 33


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

Energy: 0.9867984148202257
Energy: 1.037738858287432
Energy: 0.9867984148202257
Energy: 1.0377388582887035
Energy: 0.9867984148219208
Energy: 1.0377388582878557
Energy: 1.027921683546032
Energy: 0.9361714778471121
Energy: 1.0279216835498455
Energy: 0.9361714778471121
Energy: 1.0279216835447609
Energy: 0.9361714778466885
Energy: 0.8663751207122706
Energy: 0.9347198350326068
Energy: 0.8663751207143893
Energy: 0.9347198350410815
Energy: 0.8663751207131182
Energy: 0.9347198350427763
Energy: 1.0095106565005596
Energy: 1.0634077463983158
Energy: 1.009510656501407
Energy: 1.0634077463983158
Energy: 1.0095106565001357
Energy: 1.0634077463987395
Energy: 0.9354140170003227
Energy: 0.9739907860658905
Energy: 0.9354140169986276
Energy: 0.9739907860616531
Energy: 0.9354140169956615
Energy: 0.9739907860658905
Energy: 0.934634393928187
Energy: 0.8665090572204729
Energy: 0.9346343939260684
Energy: 0.866509057218778
Energy: 0.934634393923526
Energy: 0.8665090572175067
Energy: 1.0374762154549406
Energy: 0.9861723042592592
Energy: 1.0374762154557882
Energy: 0.9861723042618017
Energy: 1.037476215448161
Energy: 0.9861723042592592
Energy: 0.8655276857436165
Energy: 0.9863531273330294
Energy: 0.865527685742769
Energy: 0.9863531273368429
Energy: 0.8655276857431927
Energy: 0.9863531273393854
Energy: 0.9215494458569008
Energy: 0.8697072428490065
Energy: 0.9215494458573245
Energy: 0.8697072428485827
Energy: 0.9215494458560534
Energy: 0.8697072428485827
Energy: 0.8499711021518092
Energy: 1.0114673448819025
Energy: 0.8499711021551991
Energy: 1.0114673448785128
Energy: 0.8499711021522329
Energy: 1.0114673448785128
Energy: 1.012388873474872
Energy: 0.8530392063707216
Energy: 1.012388873480804
Energy: 0.8530392063711454
Energy: 1.0123888734850415
Energy: 0.8530392063707216
Energy: 0.8672818956653382
Energy: 0.9203661550763865
Energy: 0.8672818956653382
Energy: 0.9203661550763865
Energy: 0.8672818956649146
Energy: 0.9203661550763865
Energy: 0.986294253765552
Energy: 0.8638868955676053
Energy: 0.986294253765552
Energy: 0.8638868955676053
Energy: 0.9862942537630097
Energy: 0.8638868955676053
Energy: 0.9861728524431155
Energy: 1.0375698760039136
Energy: 0.986172852448624
Energy: 1.0375698760034897
Energy: 0.9861728524465053
Energy: 1.037569875998405
Energy: 0.9431742443760962
Energy: 0.9349633428877053
Energy: 0.9431742443697403
Energy: 0.9349633428894003
Energy: 0.9431742443773674
Energy: 0.9349633428864342
Energy: 0.8665266448636741
Energy: 0.9349974728705531
Energy: 0.8665266448611318
Energy: 0.9349974728730955
Energy: 0.8665266448607081
Energy: 0.9349974728739431
Energy: 1.0645392371897904
Energy: 1.062549815116625
Energy: 1.0645392371872482
Energy: 1.0625498151195911
Energy: 1.0645392371821634
Energy: 1.0625498151178963
Energy: 0.9349950544549707
Energy: 0.8665314678176097
Energy: 0.9349950544520047
Energy: 0.866531467815491
Energy: 0.9349950544600171
Energy: 0.8665314678133723
Energy: 0.9351596814931692
Energy: 0.9429401600010594
Energy: 0.9351596814931692
Energy: 0.9429401600023305
Energy: 0.9351596814940167
Energy: 0.9429401600057203
Energy: 1.0400703021597335
Energy: 0.9897575512561629
Energy: 1.040070302161852
Energy: 0.9897575512565865
Energy: 1.0400703021580386
Energy: 0.9897575512565865
Energy: 0.8631026061198296
Energy: 0.9865397376808056
Energy: 0.8631026061185583
Energy: 0.9865397376744497
Energy: 0.8631026061185583
Energy: 0.9865397376879705
Energy: 0.9345770025560571
Energy: 0.8698215841606814
Energy: 0.9345770025607181
Energy: 0.8698215841611052
Energy: 0.9345770025696165
Energy: 0.8698215841606814
Energy: 0.8502402207374133
Energy: 1.011588264603587
Energy: 0.8502402207374133
Energy: 1.0115882646112142
Energy: 0.8502402207374133
Energy: 1.0115882646095193
Energy: 1.0111308628959983
Energy: 0.9362339580562488
Energy: 1.0111308628968458
Energy: 0.9362339580554012
Energy: 1.0111308628968458
Energy: 0.9362339580554012
Energy: 0.8666276391978868
Energy: 0.9349725779384045
Energy: 0.8666276391932257
Energy: 0.9349725779290825
Energy: 0.8666276391953442
Energy: 0.9349725779358622
Energy: 0.9862863054822657
Energy: 1.0064586447863622
Energy: 0.9862863054886216
Energy: 1.0064586448003452
Energy: 0.9862863054822657
Energy: 1.0064586447846673
Energy: 0.9862975581085136
Energy: 1.006312149702765
Energy: 0.9862975581000777
Energy: 1.0063121497095446
Energy: 0.9862975580979589
Energy: 1.0063121497095446
Energy: 0.8664460586654895
Energy: 0.9349688709752483
Energy: 0.8664460586680318
Energy: 0.9349688709849554
Energy: 0.8664460586654895
Energy: 0.9349688709777906
Energy: 1.011116117138644
Energy: 0.9363026399026483
Energy: 1.0111161171390677
Energy: 0.9363026399018011
Energy: 1.011116117132288
Energy: 0.9363026399026483
Energy: 0.8502399906269794
Energy: 1.0120923240589135
Energy: 0.8502399906274032
Energy: 1.012092324043274
Energy: 0.8502399906282506
Energy: 1.01209232404963
Energy: 0.9349881125886969
Energy: 0.8700543252422085
Energy: 0.9349881125971714
Energy: 0.8700543252422085
Energy: 0.9349881125908155
Energy: 0.8700543252422085
Energy: 0.8630240181680789
Energy: 0.9866031101026428
Energy: 0.8630240181689262
Energy: 0.986603110103914
Energy: 0.8630240181685026
Energy: 0.9866031101005241
Energy: 1.0400676807843239
Energy: 0.9897645213636824
Energy: 1.0400676807847475
Energy: 0.9897645213649534
Energy: 1.0400676807839002
Energy: 0.9897645213645299
Energy: 0.9352733520415637
Energy: 0.9428679362918295
Energy: 0.9352733520411399
Energy: 0.9428679362918295
Energy: 0.935273352039445
Energy: 0.9428679362884397
Energy: 0.9348167633806407
Energy: 0.866542407654948
Energy: 0.9348167633810643
Energy: 0.866542407654948
Energy: 0.934816763383183
Energy: 0.866542407654948
Energy: 1.0645317507079952
Energy: 1.062577073729861
Energy: 1.0645317507050291
Energy: 1.0625770737357934
Energy: 1.0645317507058765
Energy: 1.0625770737315559
Energy: 0.8664563031593557
Energy: 0.9347575201211539
Energy: 0.8664563031593557
Energy: 0.9347575201203064
Energy: 0.8664563031602033
Energy: 0.934757520125391
Energy: 0.9429869495957451
Energy: 0.9349654664594026
Energy: 0.9429869495982878
Energy: 0.9349654664581313
Energy: 0.9429869495978639
Energy: 0.9349654664674535
Energy: 0.9861826670048166
Energy: 1.0377685190396384
Energy: 0.9861826670048166
Energy: 1.0377685190286214
Energy: 0.9861826670137149
Energy: 1.0377685190328587
Energy: 0.986274786468517
Energy: 0.8640788085175276
Energy: 0.9862747864697881
Energy: 0.8640788085175276
Energy: 0.9862747864689406
Energy: 0.8640788085162565
Energy: 0.867295531229793
Energy: 0.9203356926449603
Energy: 0.8672955312289456
Energy: 0.9203356926449603
Energy: 0.8672955312289456
Energy: 0.9203356926453841

minimum gb energy = 0.8499711021518092 eV
minimum distance =  2.39696790104712 Angstroms
sigma value = 51


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

Energy: 0.9733675623816881
Energy: 0.995197561874699
Energy: 0.9733675623816881
Energy: 0.9951975618737172
Energy: 0.9733675623816881
Energy: 0.995197561874699
Energy: 1.0566792760526993
Energy: 0.9498391745041079
Energy: 1.0566792760615131
Energy: 0.9498391745041079
Energy: 1.0566792760546406
Energy: 0.9498391745041079
Energy: 0.9349504030183273
Energy: 0.9834736076475952
Energy: 0.9349504030173456
Energy: 0.9834736075563348
Energy: 0.9349504030173456
Energy: 0.9834736074218989
Energy: 0.9813987330383539
Energy: 0.8756504951919306
Energy: 0.9813987330393357
Energy: 0.8756504951938942
Energy: 0.9813987330383539
Energy: 0.8756504951929124
Energy: 1.0020853958234337
Energy: 0.9453581963744234
Energy: 1.0020853958253972
Energy: 0.9453581963744234
Energy: 1.002085395826379
Energy: 0.9453581963754052
Energy: 1.0025812778834502
Energy: 0.9450734404900949
Energy: 1.0025812778844319
Energy: 0.9450734404910768
Energy: 1.0025812778824683
Energy: 0.9450734404910768
Energy: 0.973445068349984
Energy: 0.9450314717759121
Energy: 0.97344506834512
Energy: 0.9450314717759121
Energy: 0.973445068349984
Energy: 0.9450314717768938
Energy: 0.9166084514522247
Energy: 0.9460013741483413
Energy: 0.9166084514522247
Energy: 0.9460013741483413
Energy: 0.9166084514532066
Energy: 0.9460013741493231
Energy: 1.1595623903294643
Energy: 0.8755759213348624
Energy: 1.1595623903304462
Energy: 0.8755759213358442
Energy: 1.1595623903284824
Energy: 0.8755759213348624
Energy: 0.8937005234338593
Energy: 1.1348550343944526
Energy: 0.8937005234328778
Energy: 1.1348550343944526
Energy: 0.8937005234338593
Energy: 1.1348550343954342
Energy: 1.1466037293485905
Energy: 0.8836796755703736
Energy: 1.1466037264124196
Energy: 0.8836796755703736
Energy: 1.1466037188482818
Energy: 0.8836796755703736
Energy: 0.9690008770940421
Energy: 0.994962007871296
Energy: 0.9690008770930604
Energy: 0.994962007871296
Energy: 0.9690008770920787
Energy: 0.9949620078703142
Energy: 1.151484445003638
Energy: 0.9511011146372317
Energy: 1.1514844450065609
Energy: 0.9511011146372317
Energy: 1.1514844450056017
Energy: 0.9511011146382135
Energy: 0.9348764039020293
Energy: 0.931490908865086
Energy: 0.9348764039010475
Energy: 0.9314909088641045
Energy: 0.934876403899084
Energy: 0.9314909088641045
Energy: 0.9843303722429588
Energy: 0.9926576659721781
Energy: 0.9843303722449225
Energy: 0.9926576659721781
Energy: 0.984330372246886
Energy: 0.9926576659721781
Energy: 1.0024413768614615
Energy: 0.9452119997660354
Energy: 1.0024413768644067
Energy: 0.9452119997650537
Energy: 1.002441376863425
Energy: 0.9452119997660354
Energy: 1.0021919697062895
Energy: 1.0248465291695052
Energy: 1.0021919697023625
Energy: 1.0248465291695052
Energy: 1.0021919697062895
Energy: 1.0248465291695052
Energy: 0.9749599515817321
Energy: 0.9452271578195817
Energy: 0.9749599515817321
Energy: 0.9452271578185999
Energy: 0.9749599515807503
Energy: 0.9452271578195817

minimum gb energy = 0.8755759213348624 eV
minimum distance =  2.2469049129145 Angstroms
sigma value = 19


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

Energy: 0.8166998669828971
Energy: 0.8369539443651471
Energy: 0.8166998669846443
Energy: 0.8369539443668944
Energy: 0.8166998669828971
Energy: 0.8369539443668944
Energy: 0.9560184288421348
Energy: 0.99282245343969
Energy: 0.9560184288403877
Energy: 0.9928224534408546
Energy: 0.9560184288409701
Energy: 0.9928224534414369
Energy: 0.7884599276306539
Energy: 0.99265391697363
Energy: 0.7884599276306539
Energy: 0.9926539169701358
Energy: 0.7884599276300717
Energy: 0.99265391697363
Energy: 0.8588169326810782
Energy: 0.7884623574579094
Energy: 0.8588169326845723
Energy: 0.7884623574579094
Energy: 0.8588169326851548
Energy: 0.7884623574613772
Energy: 0.8109342816808183
Energy: 0.8160898417647209
Energy: 0.8109342816866418
Energy: 0.8160898417623914
Energy: 0.810934281688389
Energy: 0.8160898417653031
Energy: 0.810888240146956
Energy: 0.8161018118571854
Energy: 0.8108882401475385
Energy: 0.8161018118606798
Energy: 0.810888240146956
Energy: 0.816101811857768
Energy: 0.8588090080197117
Energy: 0.7884578845494296
Energy: 0.8588090080127232
Energy: 0.7884578845488471
Energy: 0.8588090080167998
Energy: 0.7884578845494296
Energy: 0.7884622313777734
Energy: 0.9926281637234281
Energy: 0.7884622313777734
Energy: 0.9926281637286694
Energy: 0.7884622313771912
Energy: 0.9926281637292517
Energy: 0.9560239845255707
Energy: 0.9928317048537122
Energy: 0.9560239845238238
Energy: 0.9928317048473061
Energy: 0.9560239845261531
Energy: 0.9928317048565973
Energy: 0.8166998669852266
Energy: 0.836953944366312
Energy: 0.8166998669823148
Energy: 0.8369539443668944
Energy: 0.8166998669782383
Energy: 0.8369539443668944
Energy: 0.9560184288432996
Energy: 0.9928224534391076
Energy: 0.9560184288368937
Energy: 0.9928224534420195
Energy: 0.9560184288351465
Energy: 0.9928224534391076
Energy: 0.7884599276312364
Energy: 0.9926539169695535
Energy: 0.7884599276306539
Energy: 0.9926539169695535
Energy: 0.7884599276294892
Energy: 0.9926539169718829
Energy: 0.8588169326886487
Energy: 0.7884623574579094
Energy: 0.8588169326863193
Energy: 0.7884623574607948
Energy: 0.8588169326828253
Energy: 0.7884623574590477
Energy: 0.8109342816854771
Energy: 0.8160898417664678
Energy: 0.8109342816872243
Energy: 0.8160898417629737
Energy: 0.8109342816860594
Energy: 0.8160898417635561
Energy: 0.810888240146956
Energy: 0.8161018118536915
Energy: 0.8108882401463737
Energy: 0.816101811857768
Energy: 0.8108882401475385
Energy: 0.8161018118618444
Energy: 0.8588090080179644
Energy: 0.788457884545353
Energy: 0.8588090080115587
Energy: 0.7884578845459352
Energy: 0.8588090080144705
Energy: 0.788457884545353
Energy: 0.7884622313771912
Energy: 0.9926281637240105
Energy: 0.7884622313777734
Energy: 0.9926281637228456
Energy: 0.7884622313771912
Energy: 0.992628163725175
Energy: 0.9560239845302295
Energy: 0.9928317048467237
Energy: 0.9560239845273177
Energy: 0.9928317048496356
Energy: 0.9560239845226589
Energy: 0.9928317048490531
Energy: 0.8166998669817324
Energy: 0.8369539443639825
Energy: 0.8166998669828971
Energy: 0.8369539443674766
Energy: 0.8166998669817324
Energy: 0.8369539443657295
Energy: 0.9560184288415525
Energy: 0.9928224534379428
Energy: 0.9560184288386407
Energy: 0.9928224534379428
Energy: 0.9560184288403877
Energy: 0.9928224534408546
Energy: 0.7884599276306539
Energy: 0.9926539169678062
Energy: 0.7884599276306539
Energy: 0.9926539169683887
Energy: 0.7884599276300717
Energy: 0.9926539169724652
Energy: 0.8588169326892312
Energy: 0.7884623574607948
Energy: 0.8588169326851548
Energy: 0.7884623574613772
Energy: 0.8588169326909781
Energy: 0.7884623574567448
Energy: 0.8109342816860594
Energy: 0.8160898417647209
Energy: 0.810934281688389
Energy: 0.8160898417658855
Energy: 0.8109342816866418
Energy: 0.8160898417641385
Energy: 0.8108882401498679
Energy: 0.8161018118589327
Energy: 0.8108882401475385
Energy: 0.8161018118589327
Energy: 0.8108882401498679
Energy: 0.8161018118548561
Energy: 0.8588090080202939
Energy: 0.7884578845459352
Energy: 0.8588090080156351
Energy: 0.7884578845494296
Energy: 0.858809008012141
Energy: 0.7884578845488471
Energy: 0.7884622313777734
Energy: 0.9926281637245928
Energy: 0.7884622313771912
Energy: 0.9926281637280869
Energy: 0.7884622313777734
Energy: 0.9926281637269222
Energy: 0.9560239845273177
Energy: 0.9928317048508003
Energy: 0.9560239845244062
Energy: 0.9928317048513827
Energy: 0.9560239845267355
Energy: 0.9928317048478885
Energy: 0.8166998669794029
Energy: 0.8369539443657295
Energy: 0.816699866985809
Energy: 0.8369539443639825
Energy: 0.8166998669852266
Energy: 0.8369539443651471
Energy: 0.9560184288421348
Energy: 0.9928224534367781
Energy: 0.9560184288409701
Energy: 0.9928224534391076
Energy: 0.9560184288421348
Energy: 0.9928224534431841
Energy: 0.7884599276300717
Energy: 0.9926539169713006
Energy: 0.7884599276312364
Energy: 0.9926539169713006
Energy: 0.7884599276312364
Energy: 0.99265391697363

minimum gb energy = 0.788457884545353 eV
minimum distance =  2.25294034892593 Angstroms
sigma value = 27


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

Energy: 0.8174812721767362
Energy: 0.8034409416522142
Energy: 0.8174812721767362
Energy: 0.803440941653641
Energy: 0.8174812721753097
Energy: 0.8034409416522142
Energy: 0.9456791077395514
Energy: 0.841767791953256
Energy: 0.9456791077438309
Energy: 0.841767791953256
Energy: 0.9456791077395514
Energy: 0.8417677919546827
Energy: 0.776202966275309
Energy: 0.8969107812101571
Energy: 0.7762029662724561
Energy: 0.8969107812101571
Energy: 0.7762029662738825
Energy: 0.8969107812101571
Energy: 0.9217547595658826
Energy: 0.7801641952630072
Energy: 0.9217547595658826
Energy: 0.7801641952630072
Energy: 0.9217547595658826
Energy: 0.7801641952615807
Energy: 0.9217544348912949
Energy: 0.7801820834356216
Energy: 0.9217544348912949
Energy: 0.780182083437048
Energy: 0.9217544348898684
Energy: 0.7801820834356216
Energy: 0.9202118868460603
Energy: 0.9509033614924882
Energy: 0.9202118868460603
Energy: 0.9509033614924882
Energy: 0.9202118868446338
Energy: 0.9509033614924882
Energy: 0.8954945047295837
Energy: 0.8442623825247286
Energy: 0.89549450473101
Energy: 0.8442623825247286
Energy: 0.8954945047281572
Energy: 0.8442623825247286
Energy: 0.8167843760451062
Energy: 0.8031973749141489
Energy: 0.8167843760451062
Energy: 0.8031973749141489
Energy: 0.8167843760451062
Energy: 0.8031973749155754
Energy: 0.9457122704349238
Energy: 0.8228902263475658
Energy: 0.9457122704349238
Energy: 0.8228902263447129
Energy: 0.9457122704349238
Energy: 0.8228902263461393
Energy: 0.8900484704797217
Energy: 0.9422415911369002
Energy: 0.8900484704797217
Energy: 0.942241591134047
Energy: 0.8900484704797217
Energy: 0.9422415911354737
Energy: 0.8408177580205876
Energy: 0.7816076216598621
Energy: 0.8408177580205876
Energy: 0.7816076216598621
Energy: 0.9428632164140788
Energy: 0.7816076216598621
Energy: 0.9672467101809629
Energy: 0.8825416140775229
Energy: 0.9672467101809629
Energy: 0.8825416140775229
Energy: 0.9672467101809629
Energy: 0.8825416140775229

minimum gb energy = 0.7762029662724561 eV
minimum distance =  2.21839472639088 Angstroms
sigma value = 9


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

Energy: 0.811819875608465
Energy: 0.7983861181875178
Energy: 0.8118198756068616
Energy: 0.7983861181879186
Energy: 0.811819875608465
Energy: 0.7983861181871169
Energy: 0.8537295349248294
Energy: 0.7679326800450688
Energy: 0.8537295349272342
Energy: 0.8132433930256336
Energy: 0.8537295349196188
Energy: 0.767047956346211
Energy: 0.7257640609840857
Energy: 0.9175497225752417
Energy: 0.7257640609840857
Energy: 0.917549722580015
Energy: 0.7257640609848874
Energy: 0.9175497225852255
Energy: 0.7563087236905369
Energy: 0.7113504028561713
Energy: 0.7563087236909377
Energy: 0.7113504028561713
Energy: 0.7563087236901361
Energy: 0.7113504028569729
Energy: 0.7939435426426643
Energy: 0.7665349284095221
Energy: 0.7939435426426643
Energy: 0.766534928409923
Energy: 0.7939435426434659
Energy: 0.7665349284091213
Energy: 0.7937793064126075
Energy: 0.8031959213892116
Energy: 0.7937793064110042
Energy: 0.8248334871669049
Energy: 0.7937793064065954
Energy: 0.790600685708841
Energy: 0.7515545073846388
Energy: 0.8256119602677139
Energy: 0.7515545073858413
Energy: 0.825611960267313
Energy: 0.751554507386643
Energy: 0.825611960267313
Energy: 0.7006250110836152
Energy: 0.8022266342475183
Energy: 0.7006250110844168
Energy: 0.8022266342475183
Energy: 0.7006250110832143
Energy: 0.8022266342479191
Energy: 0.933330731863022
Energy: 0.7666012228510962
Energy: 0.9333307318622205
Energy: 0.7666012228510962
Energy: 0.9333307318626213
Energy: 0.7666012228506954
Energy: 0.7943647114142329
Energy: 0.8620465725856862
Energy: 0.7943647114094232
Energy: 0.8620465725832813
Energy: 0.7943647114146337
Energy: 0.8620465725844837
Energy: 0.7534420930240976
Energy: 0.7191709626664115
Energy: 0.7534420930224943
Energy: 0.7191709626660107
Energy: 0.753442093020891
Energy: 0.7191709626656099
Energy: 0.7576193860422948
Energy: 0.7975885161743942
Energy: 0.7576193860422948
Energy: 0.7975885161751959
Energy: 0.7576193860426956
Energy: 0.7975885161747949
Energy: 0.7687599802265102
Energy: 0.7784416607225926
Energy: 0.7687599802196964
Energy: 0.7784416607269651
Energy: 0.768759980162381
Energy: 0.7784416607261635
Energy: 0.8060328142233082
Energy: 0.9661429686201938
Energy: 0.8060328142248749
Energy: 0.9661429686197929
Energy: 0.8060328142237089
Energy: 0.9661429686209954
Energy: 0.728415077907212
Energy: 0.808139771299578
Energy: 0.7284150779076128
Energy: 0.808139771297574
Energy: 0.728415077907212
Energy: 0.8081397712983758
Energy: 0.7333788995724996
Energy: 0.774870853279271
Energy: 0.7333788995644833
Energy: 0.7748708532804733
Energy: 0.733378899563281
Energy: 0.7748708532796718
Energy: 0.9335186269142066
Energy: 0.711871718689619
Energy: 0.9335186269146075
Energy: 0.7118717186783964
Energy: 0.9335186269146075
Energy: 0.7118717186900198
Energy: 0.7432971034163575
Energy: 0.7674514935634403
Energy: 0.7432971034163575
Energy: 0.7674514935638411
Energy: 0.7432971034159566
Energy: 0.7674514935634403
Energy: 0.6968304855156225
Energy: 0.9199393976439303
Energy: 0.6968304855148211
Energy: 0.919939397642327
Energy: 0.6968304855176267
Energy: 0.9199393976466995
Energy: 0.8609325699390706
Energy: 0.8481124836283593
Energy: 0.8609325699398721
Energy: 0.7619281655855217
Energy: 0.8609325699382688
Energy: 0.7619281655839184
Energy: 0.6968431306784899
Energy: 0.9198823636170204
Energy: 0.6968431306800932
Energy: 0.9198823636174212
Energy: 0.6968431306816963
Energy: 0.9198823636174212
Energy: 0.7431240774963955
Energy: 0.7674277628192481
Energy: 0.7431240774967963
Energy: 0.767427762819649
Energy: 0.7431240774988004
Energy: 0.767427762819649
Energy: 0.9334286132965738
Energy: 0.7119853622526995
Energy: 0.9334286132965738
Energy: 0.7119853622567074
Energy: 0.9334286132977762
Energy: 0.7119853622478897
Energy: 0.7333649310555388
Energy: 0.7957859015647586
Energy: 0.733364931055138
Energy: 0.7957859015711716
Energy: 0.7333649310599477
Energy: 0.7957859015695683
Energy: 0.7285730511461901
Energy: 0.8081165582356912
Energy: 0.7285730511473926
Energy: 0.8081165582356912
Energy: 0.7285730511485949
Energy: 0.8081165582348894
Energy: 0.8060025968121567
Energy: 0.8014758685089659
Energy: 0.8060025968125575
Energy: 0.8014758685081643
Energy: 0.8060025968149621
Energy: 0.8014758685081643
Energy: 0.7689597002393717
Energy: 0.7786127915055621
Energy: 0.768959700234562
Energy: 0.7786127915031573
Energy: 0.7689597002445822
Energy: 0.7786127915023556
Energy: 0.7575772205091057
Energy: 0.7756106082563057
Energy: 0.7575772205107089
Energy: 0.7756106082534999
Energy: 0.7575772205107089
Energy: 0.775610608251496
Energy: 0.7534214804073408
Energy: 0.7192783260436754
Energy: 0.7534214804065392
Energy: 0.7192783260440762
Energy: 0.753421480404936
Energy: 0.7192783260440762
Energy: 0.7944135521977707
Energy: 0.9334314199907026
Energy: 0.7944135521961675
Energy: 0.9334314199923057
Energy: 0.7944135521925602
Energy: 0.9334314199899009
Energy: 0.9332825852300932
Energy: 0.7665861628926928
Energy: 0.933282585230494
Energy: 0.7665861628942959
Energy: 0.9332825852296924
Energy: 0.7665861628975025
Energy: 0.7006637558012014
Energy: 0.8020943026801071
Energy: 0.7006637558028046
Energy: 0.8020943026797063
Energy: 0.7006637558008006
Energy: 0.8020943026817102
Energy: 0.7516179499349888
Energy: 0.8255813196858998
Energy: 0.751617949936592
Energy: 0.8255813196863006
Energy: 0.7516179499337864
Energy: 0.8255813196863006
Energy: 0.7937476198163271
Energy: 0.7796206748756893
Energy: 0.7937476198231408
Energy: 0.7796206748752885
Energy: 0.79374761982274
Energy: 0.7796206748744868
Energy: 0.7939865811570106
Energy: 0.7664687611493157
Energy: 0.7939865811566097
Energy: 0.7664687611493157
Energy: 0.7939865811554073
Energy: 0.7664687611493157
Energy: 0.7563240543276621
Energy: 0.7112707051574715
Energy: 0.7563240543280629
Energy: 0.7112707051562691
Energy: 0.7563240543276621
Energy: 0.7112707051566699
Energy: 0.7257929695807528
Energy: 0.9175224561369648
Energy: 0.7257929695819552
Energy: 0.917522456142576
Energy: 0.7257929695799875
Energy: 0.9175224561409728
Energy: 0.8540127430128729
Energy: 0.7680781143404043
Energy: 0.8540127430120712
Energy: 0.7979909922472325
Energy: 0.8540127430168809
Energy: 0.7680781143408051
Energy: 0.811819875608465
Energy: 0.7983861181887202
Energy: 0.8118198756056592
Energy: 0.7983861181883194
Energy: 0.8118198756088657
Energy: 0.7983861181887202
Energy: 0.8537295349208214
Energy: 0.7670479563494175
Energy: 0.8537295349228253
Energy: 0.7670479563494175
Energy: 0.8537295349216227
Energy: 0.7670479563498183
Energy: 0.7257640609800777
Energy: 0.917549722580015
Energy: 0.7257640609808794
Energy: 0.917549722584023
Energy: 0.7257640609800777
Energy: 0.9175497225784482
Energy: 0.7563087236897352
Energy: 0.7113504028589769
Energy: 0.7563087236897352
Energy: 0.7113504028589769
Energy: 0.7563087236897352
Energy: 0.7113504028593777
Energy: 0.7939435426406604
Energy: 0.7665349284115262
Energy: 0.7939435426410612
Energy: 0.7665349284115262
Energy: 0.7939435426398587
Energy: 0.7665349284115262

minimum gb energy = 0.6968304855148211 eV
minimum distance =  2.33139435518 Angstroms
sigma value = 57


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

Energy: 0.37679563903192725
Energy: 0.38516307011372075
Energy: 0.37679563903192725
Energy: 0.38516307011372075
Energy: 0.37679563903192725
Energy: 0.3851630701128084
Energy: 0.4397437841278162
Energy: 0.3773652429835429
Energy: 0.43974378412872855
Energy: 0.3773652429744191
Energy: 0.4397437841424142
Energy: 0.37736524298719243
Energy: 0.4072054349780048
Energy: 0.44498972495397426
Energy: 0.4072054349780048
Energy: 0.44498972495214945
Energy: 0.40720543497709244
Energy: 0.44498972495397426
Energy: 0.3868693275328384
Energy: 0.3764348488764184
Energy: 0.38686932753375075
Energy: 0.37643484887459366
Energy: 0.3868693275264517
Energy: 0.376434848880068
Energy: 0.43741843693038324
Energy: 0.43718644311777033
Energy: 0.4374184369312956
Energy: 0.4371864431223322
Energy: 0.43741843693038324
Energy: 0.437186443124157
Energy: 0.37655601463030214
Energy: 0.40707035773502365
Energy: 0.37655601462847743
Energy: 0.40707035773502365
Energy: 0.3765560146239155
Energy: 0.40707035773502365
Energy: 0.37656903595630714
Energy: 0.40716011661566737
Energy: 0.37656903595174523
Energy: 0.40716011661566737
Energy: 0.37656903595448243
Energy: 0.40716011661657975
Energy: 0.43728402043915515
Energy: 0.43709925667439636
Energy: 0.43728402043915515
Energy: 0.4370992566680098
Energy: 0.43728402042911896
Energy: 0.43709925668443256
Energy: 0.3870490880403391
Energy: 0.376431189070258
Energy: 0.3870490880467258
Energy: 0.37643118906660844
Energy: 0.38704908803851434
Energy: 0.3764311890684332
Energy: 0.4072532239590441
Energy: 0.44501021924297685
Energy: 0.4072532239590441
Energy: 0.44501021917641437
Energy: 0.4072532239590441
Energy: 0.44501021946095315
Energy: 0.43976690415725483
Energy: 0.37737723627018793
Energy: 0.43976690416546627
Energy: 0.37737723626927555
Energy: 0.43976690416181674
Energy: 0.3773772362720127
Energy: 0.37679563903192725
Energy: 0.3851630701128084
Energy: 0.3767956390328397
Energy: 0.38516307011189604
Energy: 0.37679563903192725
Energy: 0.3851630701128084
Energy: 0.43974378412964094
Energy: 0.37736524297624385
Energy: 0.4397437841223419
Energy: 0.3773652429826305
Energy: 0.43974378413329046
Energy: 0.3773652429826305
Energy: 0.40720543497709244
Energy: 0.44498972495671135
Energy: 0.40720543497709244
Energy: 0.44498972496127326
Energy: 0.4072054349780048
Energy: 0.4449897249649229
Energy: 0.38686932753740033
Energy: 0.37643484887550605
Energy: 0.38686932752918884
Energy: 0.3764348488901042
Energy: 0.3868693275310136
Energy: 0.37643484888280515
Energy: 0.4374184369276461
Energy: 0.4371864431296313
Energy: 0.4374184369312956
Energy: 0.4371864431214198
Energy: 0.4374184369331203
Energy: 0.4371864431287189
Energy: 0.376556014627565
Energy: 0.40707035773502365
Energy: 0.3765560146293898
Energy: 0.40707035773502365
Energy: 0.37655601462574023
Energy: 0.40707035773502365
Energy: 0.3765690359480957
Energy: 0.40716011661566737
Energy: 0.3765690359435338
Energy: 0.40716011661566737
Energy: 0.37656903594627095
Energy: 0.40716011661566737
Energy: 0.4372840204327684
Energy: 0.4370992566680098
Energy: 0.4372840204382427
Energy: 0.4370992566707469
Energy: 0.43728402042911896
Energy: 0.4370992566807831

minimum gb energy = 0.37643118906660844 eV
minimum distance =  2.46020162434645 Angstroms
sigma value = 11


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

Energy: 0.6477585942991326
Energy: 0.7775818825988441
Energy: 0.6477585943024744
Energy: 0.7775818825988441
Energy: 0.6477585943004692
Energy: 0.7775818825995126
Energy: 0.8157854489943316
Energy: 0.7655863160836941
Energy: 0.8157854489943316
Energy: 0.7655863160843625
Energy: 0.8157854489956681
Energy: 0.7655863160843625
Energy: 0.7230816077375235
Energy: 0.998395909984564
Energy: 0.8667137571941091
Energy: 0.9983959099838957
Energy: 0.8436599354813467
Energy: 0.998395909984564
Energy: 0.8908755077934468
Energy: 0.6190028055287302
Energy: 0.8908755077934468
Energy: 0.6190028055287302
Energy: 0.8908755077934468
Energy: 0.6190028055287302
Energy: 0.7511772655690595
Energy: 0.6010272271653716
Energy: 0.7511772655670546
Energy: 0.6010272271647031
Energy: 0.7511772655670546
Energy: 0.6010272271653716
Energy: 0.7106722456595564
Energy: 0.6190328304829853
Energy: 0.7106722456575515
Energy: 0.6190328304829853
Energy: 0.7106722456595564
Energy: 0.6190328304823169
Energy: 0.5960624615014309
Energy: 0.8281870306081137
Energy: 0.5960624615014309
Energy: 0.8281870306087822
Energy: 0.5960624615007627
Energy: 0.8281870306087822
Energy: 0.7679547811198822
Energy: 0.5801958813892739
Energy: 0.7679547811218872
Energy: 0.5801958813886056
Energy: 0.7679547811205506
Energy: 0.5801958813899424
Energy: 0.7669078892969827
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Energy: 0.9402546050391328
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Energy: 0.5892792129313513
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Energy: 0.9610345204711505
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Energy: 0.9610345204704819
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Energy: 0.9610345204704819
Energy: 0.9165662211456058
Energy: 0.7657868053285823
Energy: 0.9165662211436009
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Energy: 0.9165662211449376
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Energy: 0.6426954631625661
Energy: 0.77075328068916
Energy: 0.6426954631618979
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Energy: 0.6426954631618979
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Energy: 0.6839830302598399
Energy: 0.7518718368889411
Energy: 0.6839830302598399
Energy: 0.7518718368882727
Energy: 0.6839830302592322
Energy: 0.7518718368882727
Energy: 0.9815093962956662
Energy: 0.8499648540260706
Energy: 0.9815093962956662
Energy: 0.8499648540260706
Energy: 0.9815093962956662
Energy: 0.8499648540260706
Energy: 0.8409305857624959
Energy: 0.616402585559586
Energy: 0.8409305857637719
Energy: 0.6164025855609228
Energy: 0.8409305857637719
Energy: 0.616402585559586
Energy: 0.7523161895341078
Energy: 0.6882190368955081
Energy: 0.7523161895347763
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Energy: 0.7523161895354445
Energy: 0.6882190368955081
Energy: 0.5897031039559838
Energy: 0.7669970007812456
Energy: 0.5897031039586571
Energy: 0.7669970007812456
Energy: 0.589703103956652
Energy: 0.7669970007812456
Energy: 0.7271570613255157
Energy: 0.8276905859172751
Energy: 0.7271570613268524
Energy: 0.8276905859172751
Energy: 0.7271570613281891
Energy: 0.8276905859172751
Energy: 0.7756251197344266
Energy: 0.695116250942044
Energy: 0.7756251197344266
Energy: 0.6951162509433807
Energy: 0.775625119735095
Energy: 0.695116250944049
Energy: 0.768596297705496
Energy: 0.6742199136585648
Energy: 0.7685962977021543
Energy: 0.6742199136585648
Energy: 0.768596297705496
Energy: 0.6742199136585648
Energy: 0.5900112273866179
Energy: 0.9390511848419242
Energy: 0.5900112273872863
Energy: 0.9390511848365775
Energy: 0.5900112273879545
Energy: 0.9390511848379142
Energy: 1.081100853981871
Energy: 0.8108941283397726
Energy: 1.0811008539812028
Energy: 0.8108941283403802
Energy: 1.081100853981871
Energy: 0.8108941283403802

minimum gb energy = 0.5801958813886056 eV
minimum distance =  2.31949372318815 Angstroms
sigma value = 41


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

Energy: 0.7229228246056133
Energy: 0.658301588451086
Energy: 0.7229228246050865
Energy: 0.6583015884516127
Energy: 0.7229228246056133
Energy: 0.658301588451086
Energy: 0.8345219237224961
Energy: 0.8947034523886036
Energy: 0.8345219237219694
Energy: 0.8947034523880768
Energy: 0.8345219237219694
Energy: 0.8947034523880768
Energy: 0.7869266407362533
Energy: 1.070684422568312
Energy: 0.7869266407351997
Energy: 1.0706844225688388
Energy: 0.7869266407357266
Energy: 1.0706844225688388
Energy: 0.802774736986346
Energy: 0.6549143925537376
Energy: 0.8027747369858194
Energy: 0.6549143925537376
Energy: 0.8027747369858194
Energy: 0.6549143925532108
Energy: 0.6397465906400875
Energy: 0.6860900955720975
Energy: 0.6397465906395607
Energy: 0.6860900955715709
Energy: 0.6397465906395607
Energy: 0.6860900955715709
Energy: 0.8082842425281597
Energy: 0.9214198909506865
Energy: 0.8082842425276328
Energy: 0.9214198909506865
Energy: 0.8082842425276328
Energy: 0.9214198909506865
Energy: 0.6492255198748814
Energy: 0.9164607444705487
Energy: 0.6492255198743547
Energy: 0.9164607444710755
Energy: 0.6492255198743547
Energy: 0.9164607444710755
Energy: 0.6405943752207427
Energy: 0.6551848176711635
Energy: 0.640594375220216
Energy: 0.6551848176716903
Energy: 0.6405943752207427
Energy: 0.6551848176716903
Energy: 0.6491510843638815
Energy: 0.6771887552827361
Energy: 0.6491510843644082
Energy: 0.6771887552827361
Energy: 0.6491510843644082
Energy: 0.6771887552827361
Energy: 0.6910099918676155
Energy: 0.9696581576960606
Energy: 0.6910099918676155
Energy: 0.9696581576955339
Energy: 0.6910099918676155
Energy: 0.9696581576960606
Energy: 0.6855026719796182
Energy: 0.9667153255797626
Energy: 0.685502671980145
Energy: 0.9667153255797626
Energy: 0.6855026719796182
Energy: 0.9667153255792359
Energy: 0.6316328331567297
Energy: 0.776402433932637
Energy: 0.6316328331567297
Energy: 0.776402433932637
Energy: 0.6316328331551492
Energy: 0.7764024339315835
Energy: 0.6400130534083082
Energy: 0.650783332867409
Energy: 0.6400130534098885
Energy: 0.6507833328668823
Energy: 0.6400130534083082
Energy: 0.6507833328668823
Energy: 0.6190374533685072
Energy: 0.8616696625905225
Energy: 0.6190374533690101
Energy: 0.8616696625905225
Energy: 0.6190374533679806
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Energy: 0.8066031399201029
Energy: 0.8030419912756918
Energy: 0.8066031399201029
Energy: 0.8030419912762186
Energy: 0.8066031399211565
Energy: 0.8030419912762186
Energy: 0.6197071854999879
Energy: 0.8653816226953076
Energy: 0.6197071855010414
Energy: 0.865381622696361
Energy: 0.619707185499461
Energy: 0.78711969842712
Energy: 0.6464183946168897
Energy: 0.6509553904895449
Energy: 0.6464183946153095
Energy: 0.6509553904895449
Energy: 0.6464183946158362
Energy: 0.6509553904890181
Energy: 0.8776632092951251
Energy: 1.1261595484033045
Energy: 0.8776632092935448
Energy: 1.1261595484038311
Energy: 0.8776632092940715
Energy: 1.1261595484033045
Energy: 0.8324017439328305
Energy: 0.8915595947105648
Energy: 0.8324017439323038
Energy: 0.8915595947110916
Energy: 0.8324017439312503
Energy: 0.8915595947105648
Energy: 0.6848648358225368
Energy: 0.7663580098382589
Energy: 0.6848648358225368
Energy: 0.7663580098387857
Energy: 0.6848648358235904
Energy: 0.7663580098387857
Energy: 0.6728505280890223
Energy: 0.8909412931699365
Energy: 0.672850528089549
Energy: 0.8909412931694097
Energy: 0.6728505280884957
Energy: 0.8909412931694097
Energy: 0.787560515883115
Energy: 1.0299678503949166
Energy: 0.787560515883115
Energy: 1.0299678503949166
Energy: 0.7875605158836418
Energy: 1.0299678503949166
Energy: 0.7878340191124141
Energy: 0.6505536191972645
Energy: 0.7878340191118873
Energy: 0.6505536191972645
Energy: 0.7878340191124141
Energy: 0.6505536191972645
Energy: 0.6200312329724713
Energy: 0.7922221494106454
Energy: 0.6200312329719445
Energy: 0.7922221494101187
Energy: 0.6200312329724713
Energy: 0.7922221494106454
Energy: 0.6242734358832253
Energy: 0.9216376149925407
Energy: 0.6242734358842787
Energy: 0.9216376149925407
Energy: 0.6242734358832253
Energy: 0.9216376149925407
Energy: 0.6497072591461602
Energy: 0.8653612132159791
Energy: 0.6497072591451067
Energy: 0.8653612132159791
Energy: 0.6497072591461602
Energy: 0.8653612132165058
Energy: 0.6431648720115763
Energy: 0.6503976693391529
Energy: 0.6431648720105229
Energy: 0.6503976693391529
Energy: 0.6431648720110495
Energy: 0.6503976693391529
Energy: 0.6494102108730595
Energy: 0.7841914144835956
Energy: 0.6494102108735863
Energy: 0.7841914144841224
Energy: 0.6494102108725328
Energy: 0.7841914144841224
Energy: 0.6848778693096724
Energy: 0.9014967572721696
Energy: 0.6848778693091456
Energy: 0.9014967572716428
Energy: 0.6848778693091456
Energy: 0.9014967572721696
Energy: 0.8940700672449895
Energy: 0.8404328079286562
Energy: 0.8940700672449895
Energy: 0.8404328079281294
Energy: 0.8940700672455162
Energy: 0.8404328079286562
Energy: 0.6342631868924733
Energy: 0.7733776641866545
Energy: 0.6342631868914197
Energy: 0.7733776641861277
Energy: 0.6342631868924733
Energy: 0.7733776641861277
Energy: 0.6570810655828356
Energy: 0.6682310489532702
Energy: 0.6570810655812553
Energy: 0.6682310489532702
Energy: 0.6570810655833624
Energy: 0.6682310489532702
Energy: 0.6237589317672569
Energy: 0.8038005246298865
Energy: 0.6237589317662035
Energy: 0.8038005246293598
Energy: 0.6237589317667303
Energy: 0.8038005246304133

minimum gb energy = 0.6190374533679806 eV
minimum distance =  2.38785689662223 Angstroms
sigma value = 33


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

Energy: 0.7430040183685968
Energy: 0.6853673789269545
Energy: 0.7430040183663786
Energy: 0.6853673789365665
Energy: 0.7430040183689663
Energy: 0.6853673789291727
Energy: 0.748489565850313
Energy: 0.6662186279179534
Energy: 0.7484895658425833
Energy: 0.6662186279168443
Energy: 0.748489565845171
Energy: 0.666218627917214
Energy: 0.9179227247176892
Energy: 1.065733447617644
Energy: 0.9179227247195377
Energy: 1.0657334476231894
Energy: 0.9179227247206468
Energy: 1.0657334476239289
Energy: 0.7028256544479338
Energy: 0.6770721193047495
Energy: 0.7028256544449762
Energy: 0.6770721193136221
Energy: 0.7028256544542185
Energy: 0.677072119307707
Energy: 0.6917692413444417
Energy: 0.6735952003863502
Energy: 0.6917692413459205
Energy: 0.6735952003279732
Energy: 0.6917692413444417
Energy: 0.6735952003560358
Energy: 0.9103850488315237
Energy: 0.6950490213215584
Energy: 0.910385048832263
Energy: 0.6950490213211887
Energy: 0.9103850488315237
Energy: 0.6950490213211887
Energy: 0.6900818301076497
Energy: 0.7463306505549037
Energy: 0.6900818301080193
Energy: 0.7463306505549037
Energy: 0.6900818301098677
Energy: 0.7463306505549037
Energy: 0.7213665199672612
Energy: 0.7266084412273889
Energy: 0.7213665199680006
Energy: 0.7266084412270192
Energy: 0.7213665199643038
Energy: 0.7266084412270192
Energy: 0.6948433593490991
Energy: 0.7086836329397392
Energy: 0.6948433593579717
Energy: 0.7086836329404786
Energy: 0.6948433593638866
Energy: 0.7086836329382605
Energy: 0.9484773916191056
Energy: 0.6848886321043559
Energy: 0.9484773916191056
Energy: 0.6848886321043559
Energy: 0.9484773916191056
Energy: 0.6848886321047256
Energy: 0.7211860172588057
Energy: 0.7200110714031084
Energy: 0.7211860172588057
Energy: 0.7200110714038477
Energy: 0.7211860172588057
Energy: 0.7200110714019993
Energy: 1.0911640400978995
Energy: 0.6771272087965106
Energy: 1.091164040096051
Energy: 0.6771272087957712
Energy: 1.0911640400964207
Energy: 0.6771272087946623
Energy: 0.7084765948775887
Energy: 0.6957371235474328
Energy: 0.7084765948738917
Energy: 0.6957365263001642
Energy: 0.7084765948716736
Energy: 0.6957365413434807
Energy: 0.7358883947331255
Energy: 0.7252366070115221
Energy: 0.7358883947331255
Energy: 0.7252366070115221
Energy: 0.735888394734974
Energy: 0.7252366070126312
Energy: 0.7282743632910348
Energy: 0.6888286306734827
Energy: 0.7282743632899258
Energy: 0.6888286306745918
Energy: 0.7282743632906651
Energy: 0.6888286306734827
Energy: 0.6990704861132072
Energy: 0.9140405941033571
Energy: 0.6990704861117285
Energy: 0.914040594103727
Energy: 0.699070486110989
Energy: 0.9140405941040965
Energy: 0.8896376084946495
Energy: 0.6725550943549041
Energy: 0.8896376084979765
Energy: 0.6725550943637766
Energy: 0.8896376084913221
Energy: 0.6725550943663644
Energy: 0.6742350350504115
Energy: 0.7029348454106735
Energy: 0.6742350350529994
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Energy: 0.6742350350526296
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Energy: 0.9443519529673551
Energy: 0.9201237515931623
Energy: 0.9443519529669854
Energy: 0.9201237515931623
Energy: 0.9443519529669854
Energy: 0.9201237515931623
Energy: 0.8808230976013246
Energy: 0.7073547587735591
Energy: 0.8808230975991065
Energy: 0.7073547587680138
Energy: 0.8808230975968884
Energy: 0.7073547587717106
Energy: 0.6725006405941077
Energy: 0.7424012930197421
Energy: 0.672500640592629
Energy: 0.7424012930193724
Energy: 0.6725006405889322
Energy: 0.742401293017524
Energy: 0.6635228033206185
Energy: 0.7550553421932721
Energy: 0.6635228033206185
Energy: 0.7550553421929025
Energy: 0.6635228033198791
Energy: 0.7550553421914237
Energy: 0.9064441060674386
Energy: 0.8803613508707953
Energy: 0.9064441060685479
Energy: 0.880361350869686
Energy: 0.9064441060685479
Energy: 0.8803613508674679
Energy: 0.681224273133165
Energy: 0.7019980803211535
Energy: 0.6812242731324256
Energy: 0.7019980803204141
Energy: 0.6812242731313165
Energy: 0.70199808032522
Energy: 0.6768215463415199
Energy: 0.6725795184822618
Energy: 0.6768215463422592
Energy: 0.6725795184826314
Energy: 0.6768215463422592
Energy: 0.6725795184830012
Energy: 0.691954856385141
Energy: 0.9078154820608612
Energy: 0.69195485638625
Energy: 0.9078154820608612
Energy: 0.69195485638625
Energy: 0.9078154820604913
Energy: 0.7528402769500014
Energy: 0.6921017595564014
Energy: 0.7528402769474472
Energy: 0.6921017595567712
Energy: 0.7528402769467077
Energy: 0.6921017595567712
Energy: 0.7215883939285445
Energy: 0.6817542142496212
Energy: 0.721588393926696
Energy: 0.6817542142492515
Energy: 0.7215883939259566
Energy: 0.6817542142507302
Energy: 0.7099813162085725
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Energy: 0.7099813162089421
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Energy: 0.7099813162130088
Energy: 0.6939648516522378
Energy: 0.6824562666547569
Energy: 0.946226492129504
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Energy: 0.9462264921283948
Energy: 0.6824562666536478
Energy: 0.9462264921317222
Energy: 0.7003764297152721
Energy: 0.6727013694386704
Energy: 0.700376429713054
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Energy: 0.6814538853439268
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Energy: 1.0939621980382648
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Energy: 0.691846158765791
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Energy: 0.8806800738204048
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Energy: 0.7222925364190647
Energy: 0.7315134665718059
Energy: 0.7222925364179555
Energy: 0.7315134665718059
Energy: 0.7222925364164768
Energy: 0.7315134665721758
Energy: 0.7221955807774885
Energy: 0.7314594990817274
Energy: 0.7221955807774885
Energy: 0.7314594990824668
Energy: 0.7221955807763795
Energy: 0.7314594990817274
Energy: 0.8805225212257788
Energy: 0.6918942168300017
Energy: 0.8805225212424147
Energy: 0.6918942168144749
Energy: 0.8805225212379785
Energy: 0.6918942168318502
Energy: 0.6814005552631972
Energy: 1.093971597385656
Energy: 0.6814005552620882
Energy: 1.0939715973860258
Energy: 0.6814005552620882
Energy: 1.093971597385656
Energy: 0.7004061440970079
Energy: 0.6728867486783549
Energy: 0.7004061440977472
Energy: 0.6728867486779851
Energy: 0.7004061440958987
Energy: 0.6728867486776154
Energy: 0.6824832318391489
Energy: 0.9461806864638055
Energy: 0.6824832318398883
Energy: 0.9461806864649145
Energy: 0.6824832318395186
Energy: 0.9461806864660235
Energy: 0.7098863122284006
Energy: 0.8752518544331748
Energy: 0.7098863122298795
Energy: 0.87525185442689
Energy: 0.7098863122309885
Energy: 0.8752518544320655
Energy: 0.7215664539965879
Energy: 0.6818231055941965
Energy: 0.7215664539951092
Energy: 0.6818231055934572
Energy: 0.7215664539958485
Energy: 0.6818231055927177
Energy: 0.7528290288717627
Energy: 0.692245509444637
Energy: 0.752829028870284
Energy: 0.692245509444637
Energy: 0.7528290288706537
Energy: 0.6922455094450066
Energy: 0.6918169369672991
Energy: 0.9077793649464335
Energy: 0.691816936965081
Energy: 0.9077793649453243
Energy: 0.6918169369658204
Energy: 0.9077793649453243
Energy: 0.6765645736025991
Energy: 0.6726229254984639
Energy: 0.676564573605187
Energy: 0.6726229255106637
Energy: 0.6765645736059264
Energy: 0.6726229255069669
Energy: 0.6811217533914877
Energy: 0.701683873096281
Energy: 0.6811217533962938
Energy: 0.7016838730992384
Energy: 0.6811217533940757
Energy: 0.7016838730944662
Energy: 0.9064888499653835
Energy: 0.8804379199551668
Energy: 0.9064888499653835
Energy: 0.8804379199555364
Energy: 0.9064888499650139
Energy: 0.8804379199562757
Energy: 0.6638408288120301
Energy: 0.7549140905822627
Energy: 0.6638408288138785
Energy: 0.7549140905844808
Energy: 0.6638408288131392
Energy: 0.7549140905811872

minimum gb energy = 0.6635228033198791 eV
minimum distance =  2.35051950763064 Angstroms
sigma value = 67


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

Energy: 0.7903865918502492
Energy: 0.7558973627449612
Energy: 0.7903865918510075
Energy: 0.7558973627449612
Energy: 0.7903865918500248
Energy: 0.7558973627449612
Energy: 0.7761927786858088
Energy: 0.7084333857819811
Energy: 0.7761927786853035
Energy: 0.7084333857817564
Energy: 0.7761927786855561
Energy: 0.7084333857817564
Energy: 0.9328498854582948
Energy: 0.856504388978206
Energy: 0.9328498854570595
Energy: 0.8565043889784588
Energy: 1.11726158026859
Energy: 0.856504388978206
Energy: 0.7761917366082093
Energy: 0.708141029396861
Energy: 0.776191736608434
Energy: 0.708141029396861
Energy: 0.7761917366074512
Energy: 0.7081410293971135
Energy: 0.7903865918490139
Energy: 0.7558973627469265
Energy: 0.7903865918495192
Energy: 0.7558973627471792
Energy: 0.7903865918487892
Energy: 0.7558973627469265
Energy: 0.7761927786860615
Energy: 0.7084333857841991
Energy: 0.7761927786860615
Energy: 0.7084333857841991
Energy: 0.7761927786855561
Energy: 0.7084333857839744
Energy: 0.6874881076979673
Energy: 0.8565043889769707
Energy: 0.687488107696732
Energy: 0.8565043889774759
Energy: 0.687488107696732
Energy: 0.8565043889774759

minimum gb energy = 0.687488107696732 eV
minimum distance =  2.3522282435649 Angstroms
sigma value = 3


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

Energy: 0.9159490172672542
Energy: 0.8803799684531244
Energy: 0.9159490172645645
Energy: 0.8803799684524519
Energy: 0.9159490172662151
Energy: 0.8803799684534913
Energy: 0.8488397840173634
Energy: 0.7975694996430435
Energy: 0.8488397840217037
Energy: 0.7975694996443884
Energy: 0.8488397840220705
Energy: 0.7975694996420044
Energy: 0.9479117476671455
Energy: 0.955522985102309
Energy: 0.9479117476658004
Energy: 0.9555229851020033
Energy: 0.9479117476661062
Energy: 0.9555229851016366
Energy: 0.8894053750756393
Energy: 0.8493612941049599
Energy: 0.889405375070932
Energy: 0.8493612941019644
Energy: 0.8894053750726438
Energy: 0.8493612941006196
Energy: 0.8623308490911623
Energy: 0.8956383514272158
Energy: 0.8623308490908566
Energy: 0.8956383514272158
Energy: 0.8623308490918348
Energy: 0.8956383514316173
Energy: 0.8273965674369901
Energy: 0.8315977044917443
Energy: 0.8273965674386408
Energy: 0.8315977044920501
Energy: 0.8273965674396798
Energy: 0.8315977044924169
Energy: 0.8556129014090689
Energy: 0.8978970314858034
Energy: 0.8556129014090689
Energy: 0.8978970314864759
Energy: 0.8556129014121255
Energy: 0.8978970314858034
Energy: 0.9196397649464683
Energy: 0.8632340653860299
Energy: 0.9196397649514814
Energy: 0.9009480349532938
Energy: 0.9196397649461017
Energy: 0.8934453262570068
Energy: 0.8712543893221335
Energy: 0.8875803486396261
Energy: 0.8712543893211553
Energy: 0.8875803486376086
Energy: 0.8712543893228059
Energy: 0.8875803486396261
Energy: 0.8679893163813851
Energy: 0.8314816914257663
Energy: 0.8679893163951398
Energy: 0.831481691426133
Energy: 0.8679893163887822
Energy: 0.831481691426133
Energy: 0.8396202242132232
Energy: 0.9033299909714256
Energy: 0.8396202242156073
Energy: 0.9033299909711199
Energy: 0.8396202242135901
Energy: 0.9033299909714256
Energy: 0.8171223005953404
Energy: 0.8989267125676338
Energy: 0.8171223005902665
Energy: 0.8989267125615817
Energy: 0.8171223005916114
Energy: 0.8989267125656163
Energy: 0.9110058651771177
Energy: 0.8422241874914723
Energy: 0.9110058651788294
Energy: 0.8422241874941623
Energy: 0.9110058651761396
Energy: 0.8422241874914723
Energy: 0.8684114761843734
Energy: 0.912414785490301
Energy: 0.8684114761732473
Energy: 0.912414785490301
Energy: 0.8684114761850458
Energy: 0.912414785489934
Energy: 0.9269594408551171
Energy: 0.815444723509098
Energy: 0.9269594408524884
Energy: 0.8154447235232195
Energy: 0.9269594408534665
Energy: 0.8154447235117878
Energy: 0.8601963584587975
Energy: 0.8382071268912962
Energy: 0.8601963584601424
Energy: 0.838207126879192
Energy: 0.860196358458125
Energy: 0.835648716540912
Energy: 0.9397477868088536
Energy: 0.7992436439708844
Energy: 0.939747786802496
Energy: 0.7992436439658105
Energy: 0.9397477867920425
Energy: 0.7992436439668497
Energy: 0.8864927069768134
Energy: 1.0005740061043982
Energy: 0.8864927069848827
Energy: 1.0005740061037258
Energy: 0.8864927069795032
Energy: 1.0005740061043982
Energy: 0.9268418200433927
Energy: 0.8916408608169816
Energy: 0.9268418200427202
Energy: 0.8916408608169816
Energy: 0.9268418200430869
Energy: 0.8916408608166758
Energy: 0.8172730393309217
Energy: 0.8757146619705694
Energy: 0.8172730393359345
Energy: 0.8757146619705694
Energy: 0.8172730393369737
Energy: 0.8757146619709362
Energy: 0.9006630185425507
Energy: 0.8331478857870159
Energy: 0.9006630184215706
Energy: 0.8331478857859766
Energy: 0.9006630185583226
Energy: 0.8331478857863435
Energy: 0.8439758475806124
Energy: 0.8974605153822227
Energy: 0.8439758475792674
Energy: 0.8974605153825896
Energy: 0.8439758475782894
Energy: 0.8974605153822227
Energy: 0.956046045547919
Energy: 0.8716162675564005
Energy: 0.9560460455465739
Energy: 0.8716162675570731
Energy: 0.9560460455455959
Energy: 0.8716162675560339
Energy: 0.8246104737004094
Energy: 0.8652217276758181
Energy: 0.8246104737030993
Energy: 0.8652217276751456
Energy: 0.8246104736990645
Energy: 0.865221727676185
Energy: 0.9351784435356845
Energy: 0.8331117260432331
Energy: 0.9351784435347065
Energy: 0.8331117260439055
Energy: 0.935178443530305
Energy: 0.8331117260435389
Energy: 0.817560300374222
Energy: 0.8427637038581448
Energy: 0.8175603003813132
Energy: 0.8427637038585117
Energy: 0.8175603003732439
Energy: 0.8427637038568
Energy: 0.8584678421664194
Energy: 0.8960050298480309
Energy: 0.8584678421674586
Energy: 0.8960050298477251
Energy: 0.8584678421661137
Energy: 0.8960050298487033
Energy: 0.8678671820125724
Energy: 0.8143914102376704
Energy: 0.8678671820152012
Energy: 0.8143914102376704
Energy: 0.8678671820115331
Energy: 0.8143914102373037
Energy: 0.8760563867716493
Energy: 0.7990378434426492
Energy: 0.8760563867703044
Energy: 0.7990378434416711
Energy: 0.8760563867659641
Energy: 0.7990378434426492
Energy: 0.8596862124364831
Energy: 0.8258463580695937
Energy: 0.8596862124337932
Energy: 0.8258463580695937
Energy: 0.8596862124364831
Energy: 0.8258463580689214
Energy: 0.8916386937382798
Energy: 0.8241001229021402
Energy: 0.8916386937426201
Energy: 0.8241001229014678
Energy: 0.8916386937396246
Energy: 0.8241001229018344
Energy: 0.8676737058097547
Energy: 0.7978611441531472
Energy: 0.8676737058087153
Energy: 0.7978611441518022
Energy: 0.8676737058137892
Energy: 0.7978611441547977
Energy: 0.8604855550123325
Energy: 0.8835935252154843
Energy: 0.8604855550089702
Energy: 0.8835935252198246
Energy: 0.8604855550022457
Energy: 0.8835935252161566
Energy: 0.9784408206029505
Energy: 0.8984768575811063
Energy: 0.9784408205995883
Energy: 0.8984768575811063
Energy: 0.9784408206005664
Energy: 0.8984768575811063
Energy: 0.8228270414108081
Energy: 0.8408988119578635
Energy: 0.8228270414071402
Energy: 0.8408988119578635
Energy: 0.8228270414091574
Energy: 0.8408988119571911
Energy: 0.8737593287744245
Energy: 0.8321597794977955
Energy: 0.873759327522505
Energy: 0.8321597794974899
Energy: 0.8737593229498405
Energy: 0.8321597794974899
Energy: 0.8230490244981588
Energy: 0.9257137837621469
Energy: 0.8230490244951021
Energy: 0.925713783764164
Energy: 0.8230490244991369
Energy: 0.9257137837578063
Energy: 1.0304007639320354
Energy: 0.8632680746798375
Energy: 1.0304007639377206
Energy: 0.8632680746795317
Energy: 1.0304007639350308
Energy: 0.8632680746791649
Energy: 0.7941658173634215
Energy: 0.8967667402098418
Energy: 0.7941658173667226
Energy: 0.8967667402102085
Energy: 0.7941658173684343
Energy: 0.8967667402098418
Energy: 0.8539123904459612
Energy: 0.8321250673289841
Energy: 0.8539123904489568
Energy: 0.8321250673293507
Energy: 0.8539123904352021
Energy: 0.8321250673293507
Energy: 0.8178803908311972
Energy: 0.8515312451560925
Energy: 0.8178803908177482
Energy: 0.8515312451584768
Energy: 0.8178803908295467
Energy: 0.8515312451504072
Energy: 0.9533571171740726
Energy: 0.8325603197664875
Energy: 0.9533571171730945
Energy: 0.8325603197661208
Energy: 0.9533571171713828
Energy: 0.8325603197664875
Energy: 0.8370806375451676
Energy: 1.00848157522538
Energy: 0.8370806375435172
Energy: 1.0084815752257468
Energy: 0.8370806375455344
Energy: 1.00848157522538
Energy: 0.8711265558882995
Energy: 0.7979697509895252
Energy: 0.8711265554641665
Energy: 0.7979697509966164
Energy: 0.8711265532635412
Energy: 0.7979697509975944
Energy: 0.8601853343668955
Energy: 0.8838412520959117
Energy: 0.8601853343645114
Energy: 0.8838412520959117
Energy: 0.8601853343678736
Energy: 0.8838412520959117
Energy: 0.8969699470022774
Energy: 0.8224450037312169
Energy: 0.8969699470046005
Energy: 0.8224450037305444
Energy: 0.896969947002583
Energy: 0.8224450037305444
Energy: 0.8823062746846816
Energy: 0.9133140032476995
Energy: 0.8823062746837035
Energy: 0.9133140032476995
Energy: 0.8823062746819919
Energy: 0.9133140032476995
Energy: 0.9106529346337586
Energy: 0.8408507321798694
Energy: 0.9106529346330863
Energy: 0.8408507321788301
Energy: 0.9106529346367541
Energy: 0.840850732176507
Energy: 0.8177964946543456
Energy: 0.8945315980111863
Energy: 0.8177964946560572
Energy: 0.8945315980219455
Energy: 0.8177964946513501
Energy: 0.8945315980199283
Energy: 0.8411324010053599
Energy: 0.8318622997177921
Energy: 0.8411324010060323
Energy: 0.8318622997167529
Energy: 0.8411324010046874
Energy: 0.8318622997174253
Energy: 0.8674375718791422
Energy: 0.831478614365575
Energy: 0.8674375718834826
Energy: 0.8314786143642302
Energy: 0.8674375718834826
Energy: 0.831478614364536

minimum gb energy = 0.7941658173634215 eV
minimum distance =  2.29844443530158 Angstroms
sigma value = 81


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

Energy: 0.942900335019454
Energy: 0.8836378781219426
Energy: 0.8519852116650191
Energy: 0.8836378781224039
Energy: 0.9429003350189927
Energy: 0.8836378781260957
Energy: 0.8622399025416146
Energy: 0.8375092448782732
Energy: 0.8622399025443834
Energy: 0.8375092448778118
Energy: 0.8622399025411533
Energy: 0.8375092448764273
Energy: 0.8790282185797115
Energy: 0.9088469320995587
Energy: 0.9340852736864814
Energy: 0.9088469320995587
Energy: 0.879028218584326
Energy: 0.9088469321014045
Energy: 0.8392578594515944
Energy: 0.945510535234122
Energy: 0.8392578594488255
Energy: 0.9455105352336607
Energy: 0.8392578594520559
Energy: 0.9455105352336607
Energy: 0.868594677828597
Energy: 0.790359185924105
Energy: 0.8685946778290585
Energy: 0.7903591859231821
Energy: 0.868594677828597
Energy: 0.790359185924105
Energy: 0.8393532325253531
Energy: 0.7743123845121473
Energy: 0.8393532325281219
Energy: 0.7743123845121473
Energy: 0.8393532325253531
Energy: 0.774312384513993
Energy: 0.7532672039577611
Energy: 0.773296044949052
Energy: 0.7532672039637602
Energy: 0.7732960449485906
Energy: 0.7532672039586842
Energy: 0.773296044950898
Energy: 0.8365860505306438
Energy: 0.8729456971334416
Energy: 0.8365266417987619
Energy: 0.8729456971343647
Energy: 0.8365860505292596
Energy: 0.8729456971306729
Energy: 0.9995163182879071
Energy: 0.8984940056238873
Energy: 0.9995163182809852
Energy: 0.8984940056225029
Energy: 0.9995163182800622
Energy: 0.8984940056248102
Energy: 0.9244294119511566
Energy: 1.0374189040349664
Energy: 0.9244294119497724
Energy: 1.0374189040358892
Energy: 0.9244294119520796
Energy: 1.0374189040363508
Energy: 0.9501078347566478
Energy: 0.8365747819172824
Energy: 0.9501078347492644
Energy: 0.8365747819168209
Energy: 0.9501078347552635
Energy: 0.8365747819154364
Energy: 0.7745066534117512
Energy: 0.835124930604819
Energy: 0.8597658954466916
Energy: 0.835124930604819
Energy: 0.7745066534112897
Energy: 0.8351249306043577
Energy: 0.8618710124930445
Energy: 0.8355573936281055
Energy: 0.8618710124916601
Energy: 0.8355573936281055
Energy: 0.8618710124939674
Energy: 0.83555739362949
Energy: 0.9001594198447339
Energy: 0.9081160590985757
Energy: 0.9001594198461184
Energy: 0.9081160590985757
Energy: 0.9001594198442724
Energy: 0.9081160590990373
Energy: 0.9076895208328845
Energy: 0.7949812570648996
Energy: 0.9076895208351917
Energy: 0.7949812570648996
Energy: 0.9076895208324229
Energy: 0.7949812570639766
Energy: 0.8364723806012855
Energy: 0.7755780419380566
Energy: 0.8364723806003626
Energy: 0.775578041937595
Energy: 0.8364723806008239
Energy: 0.775578041937595
Energy: 0.8918048986890776
Energy: 0.7742353304328942
Energy: 0.8918048986895392
Energy: 0.7742353304333556
Energy: 0.8918048986895392
Energy: 0.7742353304342785
Energy: 0.8208429420002668
Energy: 0.9288609070208996
Energy: 0.8208164427855862
Energy: 0.9288609070222841
Energy: 0.8208429419998053
Energy: 0.9288609070236684
Energy: 0.9107007389989599
Energy: 0.8312507778898462
Energy: 0.9107007389989599
Energy: 0.8312507778903077
Energy: 0.9107007389989599
Energy: 0.8312507778884619
Energy: 0.9454058847298326
Energy: 0.9624224712456872
Energy: 0.9454058847252179
Energy: 0.9624224712438413
Energy: 0.9454058847312169
Energy: 0.9624224712470717
Energy: 0.7900723752437354
Energy: 0.8354900787232065
Energy: 0.7900723752418894
Energy: 0.8354900787232065
Energy: 0.7900723752437354
Energy: 0.8354900787222833
Energy: 0.8596565540840535
Energy: 0.8382199012719892
Energy: 0.7735563930244742
Energy: 0.8382199012715278
Energy: 0.8596565540845149
Energy: 0.8382199012715278
Energy: 0.8597513612974745
Energy: 0.7548817050981075
Energy: 0.7734381732107376
Energy: 0.7548817051017993
Energy: 0.8597513612974745
Energy: 0.7548817050994919
Energy: 0.877396548091014
Energy: 0.8683014448704399
Energy: 0.877396548089168
Energy: 0.8683014448713627
Energy: 0.8773965480914754
Energy: 0.8683014448718243
Energy: 0.8991455979602963
Energy: 0.8956633436197603
Energy: 0.8991455979644495
Energy: 0.8956633821455795
Energy: 0.8991455979607577
Energy: 0.8956634249343699
Energy: 0.9105008061737372
Energy: 1.0113505654665358
Energy: 0.9105008061760445
Energy: 1.0113505654711503
Energy: 0.9105008061741987
Energy: 1.011350565466074
Energy: 0.8209461353199236
Energy: 0.8426540397372387
Energy: 0.8209461353208466
Energy: 0.8426540397372387
Energy: 0.8209461353194621
Energy: 0.8426540397372387
Energy: 0.8834853172916355
Energy: 0.7739221522681682
Energy: 0.8834853172911741
Energy: 0.7739221522677067
Energy: 0.8834853172916355
Energy: 0.7739221522681682
Energy: 0.8360202511449534
Energy: 0.8622103606134897
Energy: 0.8361178803187428
Energy: 0.8622103606130282
Energy: 0.8360202511444921
Energy: 0.8622103606134897
Energy: 0.9079106435615727
Energy: 0.7946520093310697
Energy: 0.9079106435592654
Energy: 0.7946520093310697
Energy: 0.9079106435615727
Energy: 0.794652009333377
Energy: 0.945709428654561
Energy: 0.90940466523655
Energy: 0.9457094286540995
Energy: 0.909404665237473
Energy: 0.945709428654561
Energy: 0.90940466523655
Energy: 0.7752236611108293
Energy: 0.8683165742951534
Energy: 0.7752236611089833
Energy: 0.8683165742951534
Energy: 0.7752236611117521
Energy: 0.8683165742937691
Energy: 0.7729309104973262
Energy: 0.8379529307599184
Energy: 0.8596423704302043
Energy: 0.8379529307603799
Energy: 0.7729309104977878
Energy: 0.8379529307622257
Energy: 0.9107600417111618
Energy: 0.7521512125844705
Energy: 0.9965488095606301
Energy: 0.7521512125844705
Energy: 0.9107600417111618
Energy: 0.7521512125872393
Energy: 0.8425567212570895
Energy: 1.0361013330070599
Energy: 0.9647416184710031
Energy: 1.0361013330070599
Energy: 0.8425567212584738
Energy: 1.036101333006137
Energy: 0.9683083999373566
Energy: 0.9448641298855243
Energy: 0.9683083999382794
Energy: 0.9448641298873701
Energy: 0.9683083999364336
Energy: 0.9448641298956765
Energy: 0.8361763130031721
Energy: 0.7905804189465194
Energy: 0.8361763130031721
Energy: 0.7905804189455966
Energy: 0.8361763130031721
Energy: 0.790580418946981
Energy: 0.8376566858457095
Energy: 0.773479485500484
Energy: 0.8376566858420178
Energy: 0.7734794855009453
Energy: 0.8376566858466327
Energy: 0.7734794855023297

minimum gb energy = 0.7521512125844705 eV
minimum distance =  2.37376086837404 Angstroms
sigma value = 43


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

Energy: 1.0012522626507212
Energy: 0.8079173981756338
Energy: 1.0012522626507212
Energy: 0.8079173981750669
Energy: 1.0012522626507212
Energy: 0.8079173981756338
Energy: 0.8830231977164734
Energy: 0.7982345253753984
Energy: 0.8830231977176071
Energy: 0.7982345253753984
Energy: 0.8830231977176071
Energy: 0.7982345253748315
Energy: 0.9224897941148519
Energy: 0.9686080310778241
Energy: 0.9224897941176861
Energy: 0.9686080310783909
Energy: 0.922489794114285
Energy: 0.9686080310778241
Energy: 0.943327474130889
Energy: 0.8459771233728755
Energy: 0.9433274741314558
Energy: 0.8459771233734423
Energy: 0.943327474130889
Energy: 0.8459771233740092
Energy: 0.887128431147723
Energy: 0.8889624463330392
Energy: 0.8871284311482897
Energy: 0.8889624463341472
Energy: 0.8871284311482897
Energy: 0.8889624463336061
Energy: 0.8391012820683014
Energy: 0.8650327765298252
Energy: 0.839101282068868
Energy: 0.865032776530392
Energy: 0.8391012820694349
Energy: 0.8650327765298252
Energy: 0.8661503220926645
Energy: 0.9187517204496842
Energy: 0.8661503220937979
Energy: 0.9187517204491173
Energy: 0.8661503220932313
Energy: 0.9187517204496842
Energy: 0.8463287695717453
Energy: 0.8818062788650426
Energy: 0.8463287695734458
Energy: 0.881806278863909
Energy: 0.8463287695717453
Energy: 0.881806278863909
Energy: 0.9623722321078042
Energy: 0.8075882304139043
Energy: 0.9623722321078042
Energy: 0.8075882304139043
Energy: 0.9623722321083711
Energy: 0.8075882304139043
Energy: 0.8410383211877503
Energy: 0.9721550914836675
Energy: 0.8410383211877503
Energy: 0.9721550914836675
Energy: 0.8410383211877503
Energy: 0.9721550914831006
Energy: 0.9162732262910378
Energy: 0.8646901403493529
Energy: 0.9162732262910378
Energy: 0.8646901403499198
Energy: 0.9162732262921716
Energy: 0.8646901403493529
Energy: 0.8463510913214757
Energy: 0.8711602411962575
Energy: 0.8463510913214757
Energy: 0.8711602412274332
Energy: 0.8463510913214757
Energy: 0.8711602412636843
Energy: 0.9165718406506758
Energy: 0.8655927429805359
Energy: 0.9165718406523763
Energy: 0.8655927429805359
Energy: 0.9165718406512426
Energy: 0.8655927429805359
Energy: 0.7731653312573789
Energy: 0.9510060067910172
Energy: 0.7731653312556784
Energy: 0.951006006791584
Energy: 0.7731653312568121
Energy: 0.9510060067910172
Energy: 0.8238532666130868
Energy: 0.8898621377035889
Energy: 0.8238532666136537
Energy: 0.8898621377035889
Energy: 0.8238532666130868
Energy: 0.8898621377041558
Energy: 0.8629037772891311
Energy: 0.9094195415623536
Energy: 0.8629037772891311
Energy: 0.9094195415640539
Energy: 0.862903777289698
Energy: 0.9094195415629205
Energy: 0.9021243639299384
Energy: 0.7984339837195928
Energy: 0.9021243639288047
Energy: 0.7984339837195928
Energy: 0.9021243639310721
Energy: 0.7984339837195928
Energy: 0.9249125922305748
Energy: 0.8504512424039471
Energy: 0.9249125922300081
Energy: 0.8504512424033802
Energy: 0.9249125922300081
Energy: 0.8504512424033802
Energy: 0.9225258463522148
Energy: 0.8403502021697864
Energy: 0.9225258463522148
Energy: 0.8403502021709202
Energy: 0.9225258463527817
Energy: 0.8403502021709202
Energy: 0.899700783513962
Energy: 0.7983423427232896
Energy: 0.8997007835128282
Energy: 0.7983423427238565
Energy: 0.8997007835156625
Energy: 0.7983423427232896
Energy: 0.8648656221458623
Energy: 0.8750236786300055
Energy: 0.8648656221452954
Energy: 0.8750236786300055
Energy: 0.8648656221458623
Energy: 0.8750236786300055
Energy: 0.9242511906189088
Energy: 0.8971854778116792
Energy: 0.9242511906189088
Energy: 0.8971854778111124
Energy: 0.9242511906183422
Energy: 0.8971854778111124
Energy: 0.7730198045591968
Energy: 0.8990057860778733
Energy: 0.7730198045586301
Energy: 0.8990057860784402
Energy: 0.7730198045586301
Energy: 0.8990057860778733
Energy: 0.9164667675844911
Energy: 0.8650406246708777
Energy: 0.9164667675856248
Energy: 0.8650406246708777
Energy: 0.9164667675844911
Energy: 0.8650406246708777
Energy: 0.8465311315866054
Energy: 0.8362083880687264
Energy: 0.8465311315866054
Energy: 0.8362083880681597
Energy: 0.8465311315871722
Energy: 0.8362083880687264
Energy: 0.9257000194654209
Energy: 0.8686144692620115
Energy: 0.9257000194659877
Energy: 0.8686144692614446
Energy: 0.9257000194659877
Energy: 0.8686144692614446
Energy: 0.8647903577389034
Energy: 0.9087394424646973
Energy: 0.8647903577389034
Energy: 0.9087394424652641
Energy: 0.8647903577389034
Energy: 0.9087394424652641
Energy: 0.9034756601714857
Energy: 0.8064298221540398
Energy: 0.903475660173753
Energy: 0.8064298221546066
Energy: 0.9034756601754536
Energy: 0.8064298221546066
Energy: 0.8465225590682645
Energy: 0.8814279137428656
Energy: 0.8465225590693723
Energy: 0.881427913741165
Energy: 0.8465225590682645
Energy: 0.8814279137422987
Energy: 0.8816937856780421
Energy: 0.8959373372845508
Energy: 0.8816937856774755
Energy: 0.8959373372851176
Energy: 0.8816937856774755
Energy: 0.8959373372851176
Energy: 0.8394404855348783
Energy: 0.8651522115014894
Energy: 0.8394404855331777
Energy: 0.8651522115009227
Energy: 0.8394404855331777
Energy: 0.8651522115014894

minimum gb energy = 0.7730198045586301 eV
minimum distance =  2.31371238544464 Angstroms
sigma value = 57


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

Energy: 0.900552571699648
Energy: 0.7957599150675468
Energy: 0.9005525717003819
Energy: 0.7957599150675468
Energy: 0.9005525717003819
Energy: 0.7957599150675468
Energy: 0.8552946153495876
Energy: 0.7608529583509827
Energy: 0.8552946153481197
Energy: 0.7608529583509827
Energy: 0.8552946153503216
Energy: 0.7608529583509827
Energy: 0.8694835166236665
Energy: 0.9638529876813844
Energy: 0.869483516627336
Energy: 0.9638529876813844
Energy: 0.8694835166221986
Energy: 0.9638529876813844
Energy: 1.0750385343417903
Energy: 0.8891869900579689
Energy: 1.0750385343403226
Energy: 0.8891869900594366
Energy: 1.0750385343410565
Energy: 0.8891869900587028
Energy: 0.7969705008565418
Energy: 0.8880669651149331
Energy: 0.7969705008565418
Energy: 0.8880669651090618
Energy: 0.7969705008565418
Energy: 0.8880669651090618
Energy: 0.8705884373449743
Energy: 0.8422438360576309
Energy: 0.8705884373449743
Energy: 0.8602698478910619
Energy: 0.8705884373449743
Energy: 0.8422438360583648
Energy: 0.8689429716399335
Energy: 0.9123575872512952
Energy: 0.8689429716391995
Energy: 0.9123575872505948
Energy: 0.8689429716406675
Energy: 0.9123575872505948
Energy: 0.8401507920527429
Energy: 0.7983964948621194
Energy: 0.8401507920542107
Energy: 0.7983964948628534
Energy: 0.8401507920520089
Energy: 0.7983964948628534
Energy: 0.8305307157829547
Energy: 0.7607188325939375
Energy: 0.8305307157836886
Energy: 0.7607188325932035
Energy: 0.8305307157844225
Energy: 0.7607188325939375
Energy: 0.7551999696775928
Energy: 0.8587512570482234
Energy: 0.7551999696775928
Energy: 0.8587512570482234
Energy: 0.7551999696783267
Energy: 0.8587512570482234
Energy: 0.8708286349568052
Energy: 0.8896857362463805
Energy: 0.8708286349575391
Energy: 0.8896857362456465
Energy: 0.8708286349568052
Energy: 0.8896857362463805
Energy: 0.8148403116643591
Energy: 0.9205360269897268
Energy: 0.8148403116643591
Energy: 0.9205360221281769
Energy: 0.8148403116643591
Energy: 0.9205360172659264
Energy: 0.8569638158491201
Energy: 0.7606227139795644
Energy: 0.8569638158483861
Energy: 0.7606227139795644
Energy: 0.8569638158483861
Energy: 0.7606227139795644
Energy: 0.9384251716793577
Energy: 0.7674266594225339
Energy: 0.938425171677156
Energy: 0.7674266594225339
Energy: 0.9384251716778899
Energy: 0.7674266594232678
Energy: 0.8276674940375587
Energy: 0.7653936245186614
Energy: 0.8276674940375587
Energy: 0.7653936245186614
Energy: 0.8276674940382924
Energy: 0.7653936245186614
Energy: 0.8086330489361794
Energy: 0.8235357857555216
Energy: 0.808633048939115
Energy: 0.8235357857555216
Energy: 0.8086330489376473
Energy: 0.8235357857555216
Energy: 0.7532283410782223
Energy: 0.8566278397604764
Energy: 0.7532283410789563
Energy: 0.8566278397604764
Energy: 0.7532283410796902
Energy: 0.8566278397604764
Energy: 0.8521118851547415
Energy: 0.8571647235659801
Energy: 0.8521118851547415
Energy: 0.8571647235652463
Energy: 0.8521118851554754
Energy: 0.8571647235652463
Energy: 0.7531712828299448
Energy: 0.8566252740428086
Energy: 0.7531712828292109
Energy: 0.8566252740428086
Energy: 0.7531712828292109
Energy: 0.8566252740428086
Energy: 0.8328975369266715
Energy: 0.8234945082079941
Energy: 0.8328975369266715
Energy: 0.8234945082079941
Energy: 0.8328975369266715
Energy: 0.8234945082079941
Energy: 0.8278963112618059
Energy: 0.7651351393855914
Energy: 0.8278963112610719
Energy: 0.7651351393855914
Energy: 0.8278963112618059
Energy: 0.7651351393855914
Energy: 0.9385685014165578
Energy: 0.7914442596795174
Energy: 0.9385685014172916
Energy: 0.7914442596787834
Energy: 0.9385685014180256
Energy: 0.7914442596787834
Energy: 0.856698541935533
Energy: 0.7605849790368523
Energy: 0.8566985419384686
Energy: 0.7605849790368523
Energy: 0.856698541934799
Energy: 0.7605849790368523
Energy: 0.8148548978390835
Energy: 0.9205238862511923
Energy: 0.8148548978383495
Energy: 0.9205238816339374
Energy: 0.8148548978376156
Energy: 0.9205238750814703

minimum gb energy = 0.7531712828292109 eV
minimum distance =  2.27495469763183 Angstroms
sigma value = 17


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

Energy: 0.8401311479078652
Energy: 0.7547767975377725
Energy: 0.8401311479068273
Energy: 0.7547767975377725
Energy: 0.8401311479078652
Energy: 0.7547767975377725
Energy: 0.7271734188532631
Energy: 0.7213704682605389
Energy: 0.7271734188532631
Energy: 0.7213704682605389
Energy: 0.7271734188532631
Energy: 0.7213704682605389
Energy: 0.8260668931054924
Energy: 0.852405549215763
Energy: 0.8260668931023788
Energy: 0.8524055492168009
Energy: 0.8260668931054924
Energy: 0.852405549215763
Energy: 0.6831764927909505
Energy: 0.8554343934405063
Energy: 0.6831764927909505
Energy: 0.8554343934415443
Energy: 0.6831764927909505
Energy: 0.8554343934415443
Energy: 0.8379459433873055
Energy: 0.804180358181009
Energy: 0.8379459433873055
Energy: 0.804180358181009
Energy: 0.8379459433883433
Energy: 0.804180358181009
Energy: 0.7746225457458901
Energy: 0.8266252557286966
Energy: 0.7746225457458901
Energy: 0.8266252557276587
Energy: 0.7746225457448521
Energy: 0.8266252557276587
Energy: 0.8234979998153797
Energy: 0.7255615757999268
Energy: 0.8234979998164177
Energy: 0.7255615757999268
Energy: 0.8234979998164177
Energy: 0.7255615757999268
Energy: 0.6831408116341939
Energy: 0.818534023565169
Energy: 0.6831408116331562
Energy: 0.818534023565169
Energy: 0.6831408116341939
Energy: 0.818534023565169
Energy: 0.8296428109122037
Energy: 0.721329205971874
Energy: 0.8296428109111658
Energy: 0.721329205971874
Energy: 0.8296428109122037
Energy: 0.721329205971874
Energy: 0.7749084051722069
Energy: 0.7291122955182979
Energy: 0.7749084051722069
Energy: 0.7291122955182979
Energy: 0.7749084051722069
Energy: 0.7291122955193359
Energy: 0.7636397081213881
Energy: 0.7583200375650923
Energy: 0.7636397081213881
Energy: 0.7583200375650923
Energy: 0.7636397081213881
Energy: 0.7583200375650923
Energy: 0.7730853707612028
Energy: 0.7209816265707291
Energy: 0.7730853707612028
Energy: 0.7209816265707291
Energy: 0.7730853707612028
Energy: 0.7209816265707291
Energy: 0.6831081936931455
Energy: 0.8257273077885325
Energy: 0.6831081936931455
Energy: 0.8257273077885325
Energy: 0.6831081936931455
Energy: 0.8257273077885325
Energy: 0.7744514001308115
Energy: 0.8344715138704691
Energy: 0.7744514001308115
Energy: 0.8344715138704691
Energy: 0.7744514001308115
Energy: 0.8344715138704691
Energy: 0.7740854302726945
Energy: 0.8003399298531159
Energy: 0.7740854302737323
Energy: 0.8003399298531159
Energy: 0.7740854302737323
Energy: 0.8003399298531159
Energy: 0.7742221354354122
Energy: 0.7212117863696773
Energy: 0.7742221354354122
Energy: 0.7212117863696773
Energy: 0.7742221354343742
Energy: 0.7212117863696773
Energy: 0.7732908077411771
Energy: 0.8354937543493308
Energy: 0.7732908077411771
Energy: 0.8354937543493308
Energy: 0.7732908077401629
Energy: 0.8354937543503687

minimum gb energy = 0.6831081936931455 eV
minimum distance =  2.32374999022872 Angstroms
sigma value = 17


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

Energy: 0.7559197697195483
Energy: 0.679235312659064
Energy: 0.7559197697207506
Energy: 0.6792353126586632
Energy: 0.7559197697191474
Energy: 0.679235312659064
Energy: 0.6867884455231148
Energy: 0.6730791515005082
Energy: 0.6867884455243174
Energy: 0.6730791515005082
Energy: 0.6867884455243174
Energy: 0.6730791515009089
Energy: 0.7229592104717585
Energy: 0.7281784111006332
Energy: 0.7229592104930012
Energy: 0.7281784111002324
Energy: 0.7229592104353214
Energy: 0.7281784111010339
Energy: 0.6353086428227527
Energy: 0.7458110120757069
Energy: 0.6353086428231536
Energy: 0.7458110120809174
Energy: 0.6353086428231536
Energy: 0.7458110120821198
Energy: 0.6888616017459517
Energy: 0.6552804143928971
Energy: 0.6888616017479557
Energy: 0.6552804143928971
Energy: 0.6888616017459517
Energy: 0.6552804143932979
Energy: 0.7351662105413416
Energy: 0.6898937351876753
Energy: 0.7351662105413416
Energy: 0.6898937351872745
Energy: 0.735166210542544
Energy: 0.6898937351868736
Energy: 0.6882345602946983
Energy: 0.6893700620216893
Energy: 0.6882345602959006
Energy: 0.6893700620220901
Energy: 0.688234560295099
Energy: 0.6893700620220901
Energy: 0.7027920849429232
Energy: 0.768684997927348
Energy: 0.7027920849441256
Energy: 0.7686849979269472
Energy: 0.7027920849429232
Energy: 0.7686849979277488
Energy: 0.7157289389555657
Energy: 0.7260822431588537
Energy: 0.7157289389563671
Energy: 0.7260822431588537
Energy: 0.7157289389551649
Energy: 0.7260822431588537
Energy: 0.6896067255934991
Energy: 0.6219083194254231
Energy: 0.6896067255934991
Energy: 0.6219083194258239
Energy: 0.6896067255938999
Energy: 0.6219083194262248
Energy: 0.6350272943903182
Energy: 0.7420728791740747
Energy: 0.6350272943891158
Energy: 0.7420728791864999
Energy: 0.6350272943895166
Energy: 0.7420728791816902
Energy: 0.7714851052534506
Energy: 0.6718403431532008
Energy: 0.7714851052542523
Energy: 0.6718403431523994
Energy: 0.7714851052538515
Energy: 0.6718403431528002
Energy: 0.6955195848547323
Energy: 0.6731705031777409
Energy: 0.6955195848567364
Energy: 0.6731705031773401
Energy: 0.6955195848551331
Energy: 0.6731705031777409
Energy: 0.7029892016035674
Energy: 0.6803953850245158
Energy: 0.7029892016023651
Energy: 0.6803953850237142
Energy: 0.7029892016043691
Energy: 0.6803953850241151
Energy: 0.7321219065702692
Energy: 0.6724627141175847
Energy: 0.73212190657067
Energy: 0.6724627141175847
Energy: 0.7321219065710708
Energy: 0.6724627141175847
Energy: 0.6349951806819832
Energy: 0.7136984191317978
Energy: 0.6349951806815823
Energy: 0.7136984191317978
Energy: 0.6349951806811815
Energy: 0.7136984191321987
Energy: 0.7016918313797131
Energy: 0.7267724952543654
Energy: 0.7016918313813162
Energy: 0.7267724952547662
Energy: 0.7016918313793122
Energy: 0.7267724952547662
Energy: 0.7378835533489286
Energy: 0.7188094995993526
Energy: 0.7378835533501311
Energy: 0.7188094995993526
Energy: 0.7378835533465239
Energy: 0.7188094996001543
Energy: 0.7027400176425365
Energy: 0.7173523570615694
Energy: 0.7027400176425365
Energy: 0.7173523570599663
Energy: 0.7027400176429371
Energy: 0.717352357060367
Energy: 0.700770563753127
Energy: 0.6216895888433426
Energy: 0.7007705637519245
Energy: 0.706294140676107
Energy: 0.7007705637543294
Energy: 0.7210668404304887
Energy: 0.7027019849232119
Energy: 0.717805141909434
Energy: 0.7027019849224102
Energy: 0.7178051419098349
Energy: 0.7027019849236126
Energy: 0.717805141909434
Energy: 0.7380170970806165
Energy: 0.7189354251160126
Energy: 0.7380170970770091
Energy: 0.7189354251164134
Energy: 0.7380170970782116
Energy: 0.7189354251172151
Energy: 0.7018423466714094
Energy: 0.7268612451326908
Energy: 0.7018423466718102
Energy: 0.7268612451326908
Energy: 0.7018423466714094
Energy: 0.7268612451334925
Energy: 0.6349452171694467
Energy: 0.7854920928610472
Energy: 0.634945217169046
Energy: 0.7854920928606465
Energy: 0.6349452171698475
Energy: 0.7854920928638529
Energy: 0.732136370997729
Energy: 0.6726296689537148
Energy: 0.732136370997729
Energy: 0.6726296689541156
Energy: 0.7321363709993323
Energy: 0.672629668953314
Energy: 0.7029663618800257
Energy: 0.6803914879752774
Energy: 0.702966361879625
Energy: 0.6803914879748765
Energy: 0.7029663618800257
Energy: 0.6803914879740749
Energy: 0.6951908863324414
Energy: 0.6732191579639702
Energy: 0.6951908863308381
Energy: 0.6732191579635693
Energy: 0.695190886333243
Energy: 0.6732191579639702
Energy: 0.7714500950121689
Energy: 0.671852510880995
Energy: 0.7714500950141729
Energy: 0.6718525108785901
Energy: 0.7714500950117682
Energy: 0.6718525108789909
Energy: 0.63495011479058
Energy: 0.742261481206326
Energy: 0.6349501147873735
Energy: 0.7422614812071276
Energy: 0.6349501147889768
Energy: 0.7422614812079291
Energy: 0.6896435800137304
Energy: 0.6218857186924589
Energy: 0.689643580014532
Energy: 0.6218857186924589
Energy: 0.6896435800133296
Energy: 0.6218857186924589
Energy: 0.7157253432164102
Energy: 0.7263898237711383
Energy: 0.715725343216811
Energy: 0.7263898237707374
Energy: 0.715725343216811
Energy: 0.7263898237707374
Energy: 0.7027062293156033
Energy: 0.7686189974670975
Energy: 0.7027062293196114
Energy: 0.768618997465895
Energy: 0.7027062293172066
Energy: 0.768618997465895
Energy: 0.688337834193298
Energy: 0.6892072829769947
Energy: 0.688337834193298
Energy: 0.6892072829773955
Energy: 0.6883378341912939
Energy: 0.6892072829765941
Energy: 0.7351458378357799
Energy: 0.6651455111391866
Energy: 0.7351458378333751
Energy: 0.6651455111387858
Energy: 0.7351458378357799
Energy: 0.665145511138385
Energy: 0.6889244467316987
Energy: 0.6553934980674325
Energy: 0.6889244467296947
Energy: 0.6553934980670317
Energy: 0.6889244467320995
Energy: 0.6553934980674325
Energy: 0.6350147634540744
Energy: 0.7335081419366167
Energy: 0.6350147634524712
Energy: 0.7335081419330095
Energy: 0.6350147634540744
Energy: 0.7335081419370174
Energy: 0.7228249642783967
Energy: 0.7282033261136868
Energy: 0.7228249642808016
Energy: 0.7282033261136868
Energy: 0.7228249641742233
Energy: 0.7282033261140876
Energy: 0.6867955013804795
Energy: 0.6646631533736475
Energy: 0.6867955013784754
Energy: 0.6646631533732466
Energy: 0.686795501379277
Energy: 0.6646631533736475
Energy: 0.7559197697239571
Energy: 0.6792353126554568
Energy: 0.7559197697223539
Energy: 0.6792353126558576
Energy: 0.7559197697223539
Energy: 0.6792353126554568
Energy: 0.6867884455263212
Energy: 0.675276687191426
Energy: 0.6867884455271229
Energy: 0.675276687191426
Energy: 0.6867884455279246
Energy: 0.675276687207859
Energy: 0.7229592104681876
Energy: 0.7281784111006332
Energy: 0.7229592104946044
Energy: 0.7281784111010339
Energy: 0.7229592104481473
Energy: 0.7281784111006332
Energy: 0.6353086428251575
Energy: 0.739044076068005
Energy: 0.635308642824356
Energy: 0.7390440760651995
Energy: 0.6353086428251575
Energy: 0.7390440760700092
Energy: 0.6888616017455508
Energy: 0.6552804143953019
Energy: 0.6888616017459517
Energy: 0.6552804143940995
Energy: 0.6888616017459517
Energy: 0.6552804143949011

minimum gb energy = 0.6216895888433426 eV
minimum distance =  2.35907562527721 Angstroms
sigma value = 57


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

Energy: 0.692648227556998
Energy: 0.6253936512419479
Energy: 0.6926482275556927
Energy: 0.6253936512419479
Energy: 0.6926482275576505
Energy: 0.6253936512419479
Energy: 0.7058942120600814
Energy: 0.6152398964106685
Energy: 0.705894212060734
Energy: 0.6152398964119737
Energy: 0.7058942120594288
Energy: 0.615239896411321
Energy: 0.7182344402941719
Energy: 0.6732555073230291
Energy: 0.7182344402986809
Energy: 0.6732555073230291
Energy: 0.7182344402948244
Energy: 0.6732555073230291
Energy: 0.5948161378841879
Energy: 0.6912361095225972
Energy: 0.5948161378861456
Energy: 0.6912361095219446
Energy: 0.5948161378854931
Energy: 0.6912361095225972
Energy: 0.7073307059419014
Energy: 0.6076252198453582
Energy: 0.7073307059399436
Energy: 0.6076252198460108
Energy: 0.7073307059432066
Energy: 0.6076252198460108
Energy: 0.6868607363831993
Energy: 0.6167252552447008
Energy: 0.6868607363818942
Energy: 0.6167252552447008
Energy: 0.6868607363825467
Energy: 0.6167252552453533
Energy: 0.5917878562851708
Energy: 0.6650592916196023
Energy: 0.5917878562871286
Energy: 0.6650592916189496
Energy: 0.5917878562884339
Energy: 0.6650592916202548
Energy: 0.7814870285709913
Energy: 0.6483442867149491
Energy: 0.7814870285722965
Energy: 0.6483442867142964
Energy: 0.781487028569686
Energy: 0.6483442867123387
Energy: 0.6262817631513135
Energy: 0.6170142054577666
Energy: 0.6262817631500083
Energy: 0.6170142054577666
Energy: 0.626281763151966
Energy: 0.6170142054571139
Energy: 0.6303165299217578
Energy: 0.6365967065979692
Energy: 0.6303165299217578
Energy: 0.6365967065973165
Energy: 0.6303165299230631
Energy: 0.6365967065973165
Energy: 0.7731516510431573
Energy: 0.7903053899632887
Energy: 0.7731516510411995
Energy: 0.7903053899620429
Energy: 0.773151651041852
Energy: 0.7903053899632887
Energy: 0.6575552938823903
Energy: 0.5955811538271797
Energy: 0.6575552938804325
Energy: 0.5955811538297902
Energy: 0.6575552938823903
Energy: 0.5955811538278324
Energy: 0.6284904034023701
Energy: 0.6819354164130985
Energy: 0.6284904034036752
Energy: 0.6819354164137512
Energy: 0.6284904034023701
Energy: 0.6819354164124459
Energy: 0.6298713734425949
Energy: 0.7310171407811178
Energy: 0.6298713734439002
Energy: 0.7310171407804652
Energy: 0.6298713734419423
Energy: 0.7310171407811178
Energy: 0.705533266018121
Energy: 0.6618483555623454
Energy: 0.7055332660155106
Energy: 0.6618483555610403
Energy: 0.7055332660168159
Energy: 0.6618483555616927
Energy: 0.6463160050218908
Energy: 0.701580635411159
Energy: 0.6463160050199329
Energy: 0.701580635411159
Energy: 0.6463160050199329
Energy: 0.7015806354105065
Energy: 0.6476313812683747
Energy: 0.7122241208246523
Energy: 0.6476313812677222
Energy: 0.7122241208246523
Energy: 0.6476313812677222
Energy: 0.7122241208246523
Energy: 0.6660620735976803
Energy: 0.6260710516178515
Energy: 0.6660620735937647
Energy: 0.6260710516198092
Energy: 0.66606207359507
Energy: 0.6260710516185041
Energy: 0.5955680417585499
Energy: 0.7459145101310374
Energy: 0.5955680417605077
Energy: 0.7459145101297322
Energy: 0.5955680417572448
Energy: 0.7459145101297322
Energy: 0.6269927750609966
Energy: 0.6877290672693488
Energy: 0.6269927750616492
Energy: 0.687729067270654
Energy: 0.6269927750623018
Energy: 0.687729067270654
Energy: 0.6736404638168615
Energy: 0.6606556966431555
Energy: 0.6736404638188193
Energy: 0.6606556966392397
Energy: 0.6736404638214297
Energy: 0.6606556966398924
Energy: 0.5859536753976929
Energy: 0.7492514761272142
Energy: 0.5859536753983455
Energy: 0.7492514761291721
Energy: 0.5859536753983455
Energy: 0.7492514761272142
Energy: 0.6469772199684444
Energy: 0.6582089097796814
Energy: 0.6469772199684444
Energy: 0.6582089097790288
Energy: 0.6469772199677918
Energy: 0.6582089097790288
Energy: 0.6445055450099306
Energy: 0.8714860425305428
Energy: 0.6445055450105832
Energy: 0.8714860425305428
Energy: 0.6445055450105832
Energy: 0.8714860425311955
Energy: 0.6450083881192031
Energy: 0.7999944701111549
Energy: 0.6450083881192031
Energy: 0.7999944701111549
Energy: 0.6450083881205083
Energy: 0.7999944701105023
Energy: 0.6273608993022681
Energy: 0.6573803173097647
Energy: 0.6273608993022681
Energy: 0.6573803173104172
Energy: 0.6273608993042259
Energy: 0.6573803173104172
Energy: 0.5862371398586222
Energy: 0.7458803871800535
Energy: 0.5862371398605801
Energy: 0.7458803871833165
Energy: 0.5862371398579697
Energy: 0.7458803871839692

minimum gb energy = 0.5859536753976929 eV
minimum distance =  2.31438542582147 Angstroms
sigma value = 43


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

Energy: 0.6831360776042117
Energy: 0.5643917610644114
Energy: 0.6831360776042117
Energy: 0.5643917610644114
Energy: 0.6831360776046872
Energy: 0.5643917610644114
Energy: 0.6134313981155917
Energy: 0.572075047338592
Energy: 0.6134313981122631
Energy: 0.572075047338592
Energy: 0.613431398114165
Energy: 0.5720750473371655
Energy: 0.6209279654915819
Energy: 0.6189259348671514
Energy: 0.6209279654949104
Energy: 0.6189259348671514
Energy: 0.6209279654930084
Energy: 0.6189259348671514
Energy: 0.5518943850038044
Energy: 0.5919260646836361
Energy: 0.5518943850014267
Energy: 0.5919260646836361
Energy: 0.5518943850042798
Energy: 0.5919260646836361
Energy: 0.6118909459713787
Energy: 0.5449309088041352
Energy: 0.6118909459713787
Energy: 0.5449309088069882
Energy: 0.6118909459713787
Energy: 0.5449309088065128
Energy: 0.6161886567950989
Energy: 0.5541094275306023
Energy: 0.61618865679605
Energy: 0.5541094275310778
Energy: 0.6161886567950989
Energy: 0.5541094275301268
Energy: 0.6215031883917396
Energy: 0.5776207821150139
Energy: 0.6215031883917396
Energy: 0.5776207821154895
Energy: 0.6215031883912641
Energy: 0.5776207821150139
Energy: 0.7411226159927136
Energy: 0.5992535390193663
Energy: 0.7411226159946155
Energy: 0.5992535390193663
Energy: 0.7411226159931891
Energy: 0.5992535390193663
Energy: 0.5571011759693171
Energy: 0.547163274813451
Energy: 0.5571011759683662
Energy: 0.5471632748129754
Energy: 0.5571011759693171
Energy: 0.5471632748139265
Energy: 0.6210046525535013
Energy: 0.5502877722771553
Energy: 0.621004652554928
Energy: 0.5502877722776307
Energy: 0.621004652553977
Energy: 0.5502877722776307
Energy: 0.6222655597402845
Energy: 0.6050851816449829
Energy: 0.6222655597393336
Energy: 0.6050851816449829
Energy: 0.6222655597398091
Energy: 0.6050851816449829
Energy: 0.52815555946096
Energy: 0.5450050183819793
Energy: 0.528155559461911
Energy: 0.5450050183815038
Energy: 0.5281555594604844
Energy: 0.5450050183815038
Energy: 0.6207429713875156
Energy: 0.521490404184467
Energy: 0.6207429713875156
Energy: 0.5214904041849426
Energy: 0.6207429713889421
Energy: 0.521490404184467
Energy: 0.6182037475626471
Energy: 0.6049389940098645
Energy: 0.6182037475635981
Energy: 0.6049389940093892
Energy: 0.6182037475635981
Energy: 0.6049389940093892
Energy: 0.5488451954889185
Energy: 0.6075073127637404
Energy: 0.5488451954879675
Energy: 0.6075073127637404
Energy: 0.5488451954879675
Energy: 0.6075073127642159
Energy: 0.5769473547627133
Energy: 0.6081989921810063
Energy: 0.5769473547622378
Energy: 0.6081989921810063
Energy: 0.5769473547622378
Energy: 0.6081989921810063
Energy: 0.6207779820547257
Energy: 0.6650325919814788
Energy: 0.6207779820542502
Energy: 0.6650325919824299
Energy: 0.620777982055201
Energy: 0.6650325919819543
Energy: 0.5653752247911615
Energy: 0.6078654620448158
Energy: 0.5653752247921124
Energy: 0.6078654620448158
Energy: 0.5653752247911615
Energy: 0.6078654620443403
Energy: 0.5566266771714249
Energy: 0.6142110346310253
Energy: 0.5566266771699984
Energy: 0.6142110346319762
Energy: 0.5566266771709495
Energy: 0.6142110346324516
Energy: 0.5781800969625482
Energy: 0.6027166888718833
Energy: 0.5781800969634994
Energy: 0.6027166888718833
Energy: 0.5781800969639749
Energy: 0.6027166888723589
Energy: 0.6077718465859197
Energy: 0.5721711061534516
Energy: 0.6077718465868706
Energy: 0.5721711061544025
Energy: 0.6077718465882971
Energy: 0.5721711061539271
Energy: 0.5706637882318112
Energy: 0.5628560118616179
Energy: 0.5706637882322866
Energy: 0.5628560118620934
Energy: 0.5706637882313357
Energy: 0.5628560118616179
Energy: 0.5899453583374018
Energy: 0.6106324343045241
Energy: 0.5899453583397795
Energy: 0.6106324343045241
Energy: 0.5899453583374018
Energy: 0.6106324343040487
Energy: 0.6384973594173478
Energy: 0.5564657272788085
Energy: 0.6384973594173478
Energy: 0.5564657272797596
Energy: 0.6384973594182987
Energy: 0.5564657272788085
Energy: 0.5254209642969241
Energy: 0.5332768312872338
Energy: 0.525420964300728
Energy: 0.5332768312872338
Energy: 0.5254209642993015
Energy: 0.5332768312872338
Energy: 0.5402071752800376
Energy: 0.590423778764352
Energy: 0.5402071752800376
Energy: 0.590423778764352
Energy: 0.540207175278611
Energy: 0.5904237787638765
Energy: 0.5863187703404685
Energy: 0.6941061286744163
Energy: 0.5863187703395176
Energy: 0.6941061286739408
Energy: 0.5985774244697869
Energy: 0.6941061286744163
Energy: 0.5554610420454088
Energy: 0.5955543713925144
Energy: 0.5554610420463598
Energy: 0.5955543713925144
Energy: 0.5554610420449334
Energy: 0.5955543713925144
Energy: 0.5399546218358148
Energy: 0.5589518846767332
Energy: 0.5399546218348636
Energy: 0.5589518846767332
Energy: 0.5399546218358148
Energy: 0.5589518846772087
Energy: 0.546277329321561
Energy: 0.6587914783608599
Energy: 0.546277329319659
Energy: 0.658791478361811
Energy: 0.54627732932061
Energy: 0.6587914783608599
Energy: 0.5177756372573467
Energy: 0.7427088499187948
Energy: 0.5177756372587732
Energy: 0.7427088499183192
Energy: 0.5342635050572242
Energy: 0.7427088499183192
Energy: 0.5404339209586729
Energy: 0.5408713991431341
Energy: 0.540433920957722
Energy: 0.5408713991436096
Energy: 0.5404339209581975
Energy: 0.5408713991436096
Energy: 0.5258652388697782
Energy: 0.5995456320241457
Energy: 0.5258652388707291
Energy: 0.5995456320265232
Energy: 0.5258652388712046
Energy: 0.5995456320269987
Energy: 0.6247619093685495
Energy: 0.6665822227588576
Energy: 0.6247619093695004
Energy: 0.6665822227574311
Energy: 0.6247619093671228
Energy: 0.6665822227598086
Energy: 0.5417465291110896
Energy: 0.521452825097791
Energy: 0.541746529110614
Energy: 0.521452825097791
Energy: 0.5417465291110896
Energy: 0.5214528250982664
Energy: 0.4846911747957222
Energy: 0.5989962029280221
Energy: 0.48469117479524665
Energy: 0.5989962029280221
Energy: 0.4846911747938201
Energy: 0.5989962029280221

minimum gb energy = 0.4846911747938201 eV
minimum distance =  2.30906360340213 Angstroms
sigma value = 81


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

Energy: 0.2330702800451877
Energy: 0.2634336248652482
Energy: 0.03561802877852294
Energy: 0.2634336248652482
Energy: 0.2330702800451877
Energy: 0.2634336248655857
Energy: 0.7924091438188332
Energy: 0.03782963401428262
Energy: 0.792409143819012
Energy: 0.03782963401096714
Energy: 0.7924091438186546
Energy: 0.03782963401428262
Energy: 0.23229325523667366
Energy: 0.036034747619951076
Energy: 0.23229325523631633
Energy: 0.03603474761977239
Energy: 0.2322932552368325
Energy: 0.03603474761856135
Energy: 0.035618028778165584
Energy: 0.2634336248657644
Energy: 0.035618028778165584
Energy: 0.2634336248657644
Energy: 0.03561802877834426
Energy: 0.26343362486365995
Energy: 0.792409143819012
Energy: 0.037829633647038875
Energy: 0.7924091438195282
Energy: 0.037829633655238226
Energy: 0.792409143818476
Energy: 0.03782963366276258
Energy: 0.23229325523631633
Energy: 0.03603474761959371
Energy: 0.2322932552358001
Energy: 0.03603474761977239
Energy: 0.2322932552358001
Energy: 0.036034747619434884
Energy: 0.2330702800450289
Energy: 0.26343362486612176
Energy: 0.03561802877852294
Energy: 0.2634336248657644
Energy: 0.2330702800450289
Energy: 0.2634336248655857
Energy: 0.7924091438216325
Energy: 0.03782963333288248
Energy: 0.7924091438214539
Energy: 0.037829633344575994
Energy: 0.7924091438216325
Energy: 0.03782963332047426
Energy: 0.23229325523595892
Energy: 0.03603474762134079
Energy: 0.23229325523562147
Energy: 0.03603474762134079
Energy: 0.23229325523595892
Energy: 0.03603474762187683
Energy: 0.035618028778165584
Energy: 0.2634336248659431
Energy: 0.03561802877834426
Energy: 0.2634336248659431
Energy: 0.03561802877870162
Energy: 0.26343362486612176

minimum gb energy = 0.035618028778165584 eV
minimum distance =  2.51522646841806 Angstroms
sigma value = 3


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

Energy: 0.5993149258221266
Energy: 0.5190549274946596
Energy: 0.5993149258226494
Energy: 0.5190549274941368
Energy: 0.5993149258216038
Energy: 0.5190549274946596
Energy: 0.5316503877046971
Energy: 0.5352000511611461
Energy: 0.5316503877067882
Energy: 0.535200051161669
Energy: 0.5316503877057425
Energy: 0.5352000511606234
Energy: 0.5730150078218723
Energy: 0.5332333449353481
Energy: 0.5373566437578796
Energy: 0.5332333449358709
Energy: 0.5373566437584024
Energy: 0.5332333449353481
Energy: 0.5338705066405541
Energy: 0.5403890869080162
Energy: 0.5338705066405541
Energy: 0.5403890869080162
Energy: 0.5338705066415997
Energy: 0.5403890869080162
Energy: 0.4649011617227602
Energy: 0.6197534594935451
Energy: 0.46490116172171453
Energy: 0.6197534594930223
Energy: 0.4649011617227602
Energy: 0.6197534594930223
Energy: 0.5389964892320687
Energy: 0.5381067592435766
Energy: 0.5389964892325915
Energy: 0.5381067592440996
Energy: 0.5389964892320687
Energy: 0.5381067592440996
Energy: 0.5367329727368425
Energy: 0.606661373906701
Energy: 0.5367329727368425
Energy: 0.606661373906701
Energy: 0.5367329727373654
Energy: 0.606661373907224
Energy: 0.465499834232496
Energy: 0.5356668089608189
Energy: 0.46549983423197316
Energy: 0.5356668089602962
Energy: 0.4654998342330188
Energy: 0.5356668089597733
Energy: 0.5489039230932118
Energy: 0.54233797396248
Energy: 0.5489039230921662
Energy: 0.54233797396248
Energy: 0.5489039230926891
Energy: 0.5423379739619572
Energy: 0.5190829656614815
Energy: 0.5692589210080465
Energy: 0.5190829656614815
Energy: 0.5692589210085692
Energy: 0.5190829656614815
Energy: 0.5692589210080465
Energy: 0.49701441799700125
Energy: 0.531702365126331
Energy: 0.49701441799752405
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Energy: 0.49701441799700125
Energy: 0.5317023651268538
Energy: 0.5651234012908424
Energy: 0.5714337106312221
Energy: 0.5651234012908424
Energy: 0.5714337106322677
Energy: 0.5651234012897968
Energy: 0.5714337106317449
Energy: 0.5402031625128155
Energy: 0.4766642692226452
Energy: 0.5402031625133383
Energy: 0.4766642692226452
Energy: 0.5402031625138612
Energy: 0.4766642692226452
Energy: 0.5168582542346928
Energy: 0.5552716729691062
Energy: 0.5168582542346928
Energy: 0.5552716729691062
Energy: 0.5168582542346928
Energy: 0.5552716729685834
Energy: 0.5362269454682116
Energy: 0.5594361569105442
Energy: 0.5362269454682116
Energy: 0.5594361569105442
Energy: 0.5362269454692572
Energy: 0.5594361569105442
Energy: 0.5390502288676202
Energy: 0.46819757403680684
Energy: 0.5390502288676202
Energy: 0.4681975740373297
Energy: 0.5390502288670975
Energy: 0.46819757403785245
Energy: 0.5407110964836737
Energy: 0.5843266507525373
Energy: 0.5407110964831509
Energy: 0.5843266507525373
Energy: 0.5407110964836737
Energy: 0.5843266507525373
Energy: 0.5395701214824172
Energy: 0.5301226326536516
Energy: 0.5395701214829399
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Energy: 0.5395701214824172
Energy: 0.5301226326531289
Energy: 0.5400366310605829
Energy: 0.6231290371478864
Energy: 0.5400366310605829
Energy: 0.6231290371478864
Energy: 0.5400366310605829
Energy: 0.6231290371478864
Energy: 0.5249418095516692
Energy: 0.5284317294355303
Energy: 0.5249418095516692
Energy: 0.528431729436053
Energy: 0.5249418095511463
Energy: 0.5284317294370986
Energy: 0.5597861016505356
Energy: 0.5313276307755467
Energy: 0.5597861016515574
Energy: 0.5313276307765923
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Energy: 0.5313276307760696
Energy: 0.5549333278907961
Energy: 0.5210645053055095
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Energy: 0.5210645053060324
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Energy: 0.5210645053060324
Energy: 0.5444520435720892
Energy: 0.5290101517321444
Energy: 0.5444520435726121
Energy: 0.52901015173319
Energy: 0.5444520435726121
Energy: 0.52901015173319
Energy: 0.5480824713161495
Energy: 0.5193522684773221
Energy: 0.5480824713156266
Energy: 0.5193522684767993
Energy: 0.5480824713166723
Energy: 0.5193522684767993
Energy: 0.540044214762007
Energy: 0.5395614358465861
Energy: 0.5400442147630526
Energy: 0.5395614358471088
Energy: 0.5400442147625298
Energy: 0.5395614358465861
Energy: 0.5311967820344566
Energy: 0.5407166396387078
Energy: 0.5311967820349793
Energy: 0.5407166396387078
Energy: 0.5311967820355022
Energy: 0.5407166396381847
Energy: 0.6188283910489081
Energy: 0.4664361641918519
Energy: 0.6188283910494309
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Energy: 0.6188283910489081
Energy: 0.4664361641918519
Energy: 0.5362186951468493
Energy: 0.5522722603619552
Energy: 0.5362186951478949
Energy: 0.5522722603619552
Energy: 0.5362186951478949
Energy: 0.5522722603619552
Energy: 0.5155811454228261
Energy: 0.5360362167827115
Energy: 0.5155811454243946
Energy: 0.5360362167821887
Energy: 0.515581145420212
Energy: 0.5360362167821887
Energy: 0.6070182576729884
Energy: 0.4978111313651895
Energy: 0.6070182576729884
Energy: 0.4978111313672807
Energy: 0.6070182576719428
Energy: 0.49781113136780364
Energy: 0.5487293175387963
Energy: 0.5494699431090352
Energy: 0.5487293175387963
Energy: 0.5494699431090352
Energy: 0.5487293175377506
Energy: 0.5494699431090352
Energy: 0.5689100359523518
Energy: 0.525655466332405
Energy: 0.5689100359523518
Energy: 0.525655466332405
Energy: 0.568910035951829
Energy: 0.525655466332405
Energy: 0.5538191156225932
Energy: 0.5500603520624139
Energy: 0.553819115623116
Energy: 0.5500603520629368
Energy: 0.5538191156225932
Energy: 0.5500603520624139

minimum gb energy = 0.46490116172171453 eV
minimum distance =  2.36764911014297 Angstroms
sigma value = 67


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

Energy: 0.7360155003555534
Energy: 0.6792516846820114
Energy: 0.7360155003570434
Energy: 0.6792516846820114
Energy: 0.7360155003570434
Energy: 0.6792516846820114
Energy: 0.6593226470171821
Energy: 0.6707092777130066
Energy: 0.6593226470171821
Energy: 0.6707092777122616
Energy: 0.6593226470171821
Energy: 0.6707092777130066
Energy: 0.687982963212673
Energy: 0.6836888855640749
Energy: 0.687982963212673
Energy: 0.6836888855633301
Energy: 0.6879829632119282
Energy: 0.6836888855640749
Energy: 0.6963287958310386
Energy: 0.6628042127547341
Energy: 0.6963287958310386
Energy: 0.6628042127554791
Energy: 0.6963287958310386
Energy: 0.6628042127517543
Energy: 0.5924249313279749
Energy: 0.6437864653290356
Energy: 0.5924249313302099
Energy: 0.6437864653290356
Energy: 0.5924249313287199
Energy: 0.6437864653282908
Energy: 0.6900191366904666
Energy: 0.6776603340391503
Energy: 0.6900191366897216
Energy: 0.6776603340391503
Energy: 0.6900191366897216
Energy: 0.6776603340391503
Energy: 0.6734768388591674
Energy: 0.7289764049206081
Energy: 0.6734768388591674
Energy: 0.7289764049206081
Energy: 0.6734768388599125
Energy: 0.728976404921353
Energy: 0.6534149606240716
Energy: 0.6419199915449428
Energy: 0.6534149606263063
Energy: 0.6419199915441979
Energy: 0.6534149606263063
Energy: 0.6419199915441979
Energy: 0.7119110018643525
Energy: 0.7207229820502741
Energy: 0.7119110018658424
Energy: 0.7207229820502741
Energy: 0.7119110018658424
Energy: 0.7207229820502741
Energy: 0.6716289811974687
Energy: 0.6066597407723117
Energy: 0.6716289811989586
Energy: 0.6066597407723117
Energy: 0.6716289811974687
Energy: 0.6066597407715667
Energy: 0.6891694639901897
Energy: 0.681112127329708
Energy: 0.6891694639909346
Energy: 0.681112127329708
Energy: 0.6891694639909346
Energy: 0.681112127329708
Energy: 0.6505720482374703
Energy: 0.6815654376384608
Energy: 0.6505720482389262
Energy: 0.6815654376384608
Energy: 0.6505720482382151
Energy: 0.6815654376377157
Energy: 0.6688266288666455
Energy: 0.7807478233645916
Energy: 0.6688266288681015
Energy: 0.7807478233645916
Energy: 0.6688266288673904
Energy: 0.7807478233645916
Energy: 0.6573166715015151
Energy: 0.6991501453085497
Energy: 0.65731667150226
Energy: 0.6991501453085497
Energy: 0.65731667150226
Energy: 0.6991501453070598
Energy: 0.663372629875276
Energy: 0.654088900939324
Energy: 0.6633726298737862
Energy: 0.6540889009385792
Energy: 0.663372629874531
Energy: 0.654088900939324
Energy: 0.695571020034806
Energy: 0.6716974863548459
Energy: 0.695571020034806
Energy: 0.6716974863548459
Energy: 0.6955710200340611
Energy: 0.6716974863548459
Energy: 0.6888714848494261
Energy: 0.6954031381249488
Energy: 0.6888714848494261
Energy: 0.6954031381256939
Energy: 0.688871484850171
Energy: 0.6954031381256939
Energy: 0.6806814547309076
Energy: 0.6410418982100942
Energy: 0.6806814547309076
Energy: 0.6410418982100942
Energy: 0.6806814547309076
Energy: 0.6410418982100942
Energy: 0.6841119010502285
Energy: 0.6950152600298021
Energy: 0.6841119010502285
Energy: 0.695015260029057
Energy: 0.6841119010509733
Energy: 0.6950152600298021
Energy: 0.767147146340847
Energy: 0.6865217411474076
Energy: 0.767147146340847
Energy: 0.6865217411474076
Energy: 0.767147146340847
Energy: 0.6865217411474076
Energy: 0.7108824337254003
Energy: 0.6458463917541231
Energy: 0.7108824337283801
Energy: 0.6458463917541231
Energy: 0.7108824337268902
Energy: 0.6458463917541231
Energy: 0.7030174802605442
Energy: 0.7266863252004219
Energy: 0.7030174802612891
Energy: 0.7266863252011668
Energy: 0.7030174802620341
Energy: 0.7266863252019119
Energy: 0.6339140278584825
Energy: 0.68335833294498
Energy: 0.6339140278577374
Energy: 0.683358332945725
Energy: 0.6339140278584825
Energy: 0.68335833294498

minimum gb energy = 0.5924249313279749 eV
minimum distance =  2.37151046836761 Angstroms
sigma value = 33


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

Energy: 0.8182351750004857
Energy: 0.7367059569262279
Energy: 0.8182351750000131
Energy: 0.7367059569262279
Energy: 0.8182351750004857
Energy: 0.7367059569262279
Energy: 0.7338962568458818
Energy: 0.7557162260436122
Energy: 0.7338962568444639
Energy: 0.7557162260431396
Energy: 0.7338962568487172
Energy: 0.755716226042667
Energy: 0.7885931234632702
Energy: 0.7658286008895019
Energy: 0.788593123462325
Energy: 0.7658286008895019
Energy: 0.7885931234637429
Energy: 0.7658286008895019
Energy: 0.8180055024382754
Energy: 0.7465719195341656
Energy: 0.818005502436385
Energy: 0.746571919533693
Energy: 0.8180055024382754
Energy: 0.7465719195360558
Energy: 0.7359407761600365
Energy: 0.7538437151715964
Energy: 0.7359407761600365
Energy: 0.7538437151715964
Energy: 0.7359407761600365
Energy: 0.7538437151720689
Energy: 0.832324681265323
Energy: 0.7699407532776978
Energy: 0.8323246812672133
Energy: 0.7995072042028066
Energy: 0.8323246812691036
Energy: 0.7961887129350192
Energy: 0.7359899922393448
Energy: 0.8357925396839806
Energy: 0.7359899922383997
Energy: 0.8357925396844531
Energy: 0.7359899922374973
Energy: 0.8357925396844531
Energy: 0.7830455488570218
Energy: 0.7722208361297422
Energy: 0.7830455488570218
Energy: 0.7722208361297422
Energy: 0.7830455488570218
Energy: 0.7722208361297422
Energy: 0.75114564427929
Energy: 0.7844699561583386
Energy: 0.7511456442764545
Energy: 0.7844699561588113
Energy: 0.7511456442797625
Energy: 0.7844699561592838
Energy: 0.809896779633193
Energy: 0.7324710640926576
Energy: 0.8098967796350834
Energy: 0.7371257659961972
Energy: 0.8098967796341382
Energy: 0.7244927576803987
Energy: 0.7736192178625084
Energy: 0.7650638372688008
Energy: 0.7736192178625084
Energy: 0.7650638372683282
Energy: 0.7736192178639261
Energy: 0.7650638372688008
Energy: 0.7374949780567094
Energy: 0.7419692640401044
Energy: 0.7374949780571821
Energy: 0.7419692640401044
Energy: 0.7374949780562369
Energy: 0.7419692640401044
Energy: 0.8131546378861132
Energy: 0.7438074983410338
Energy: 0.8131546378865856
Energy: 0.7438074983410338
Energy: 0.8131546378870583
Energy: 0.7438074983410338
Energy: 0.7417408708424456
Energy: 0.7678169424884352
Energy: 0.7417408708415003
Energy: 0.7678169424884352
Energy: 0.7417408708424456
Energy: 0.7678169424884352
Energy: 0.7706300035098447
Energy: 0.7537115045652804
Energy: 0.770630003511735
Energy: 0.7537115045657529
Energy: 0.7706300035098447
Energy: 0.7537115045648076
Energy: 0.7788836208359013
Energy: 0.7847424356550178
Energy: 0.778883620836374
Energy: 0.7847424356564355
Energy: 0.7788836208354287
Energy: 0.7847424356559631
Energy: 0.681159189525713
Energy: 0.7663147452928912
Energy: 0.6811591895280759
Energy: 0.7663147452928912
Energy: 0.681159189526658
Energy: 0.7663147452928912
Energy: 0.8062775357226618
Energy: 0.8214238940167478
Energy: 0.8062775357231344
Energy: 0.821423894017693
Energy: 0.8062775357226618
Energy: 0.821423894017693
Energy: 0.7314463885804663
Energy: 0.8034931478264158
Energy: 0.7314463885799937
Energy: 0.8034931478264158
Energy: 0.7314463885799937
Energy: 0.8034931478264158
Energy: 0.8390860431248605
Energy: 0.7670619985700713
Energy: 0.8390860431262782
Energy: 0.7670619985700713
Energy: 0.8390860431239152
Energy: 0.7670619985700713
Energy: 0.7797733011214719
Energy: 0.7855405746759898
Energy: 0.7797733011219444
Energy: 0.7855405746759898
Energy: 0.7797733011228898
Energy: 0.7855405746759898
Energy: 0.7692050065061056
Energy: 0.7214664799982778
Energy: 0.7692050065065781
Energy: 0.7214664799982778
Energy: 0.7692050065065781
Energy: 0.7214664799982778
Energy: 0.7657310780584523
Energy: 0.7649952109844672
Energy: 0.7657310780584523
Energy: 0.7649952109849397
Energy: 0.7657310780608152
Energy: 0.7649952109844672
Energy: 0.8070028386534729
Energy: 0.7380729434363745
Energy: 0.8070028386530002
Energy: 0.7380729434363745
Energy: 0.8070028386530002
Energy: 0.7380729434363745
Energy: 0.7363754349695406
Energy: 0.7388746162551335
Energy: 0.7363754349690681
Energy: 0.7388746162546609
Energy: 0.7363754349700132
Energy: 0.7388746162556061
Energy: 0.7657941016734936
Energy: 0.7773744728500817
Energy: 0.7657941016749112
Energy: 0.7773744728505543
Energy: 0.7657941016739661
Energy: 0.7773744728505543
Energy: 0.7359900508220706
Energy: 0.7214447295243642
Energy: 0.7359900508253787
Energy: 0.7214447295248367
Energy: 0.7359900508225432
Energy: 0.7214447295248367
Energy: 0.7763911046266331
Energy: 0.8212571621608238
Energy: 0.7763911046294686
Energy: 0.8212571621603512
Energy: 0.7763911046299412
Energy: 0.8212571621598785
Energy: 0.8398875009339716
Energy: 0.7550533732780019
Energy: 0.8398875009330264
Energy: 0.7550533732780019
Energy: 0.8398875009339716
Energy: 0.7550533732780019
Energy: 0.731563178580477
Energy: 0.7758763179085071
Energy: 0.731563178580477
Energy: 0.7758763179089796
Energy: 0.731563178580477
Energy: 0.7758763179089796
Energy: 0.836493611169212
Energy: 0.8199294825866785
Energy: 0.8364936111706298
Energy: 0.8199294825862058
Energy: 0.836493611169212
Energy: 0.8199294825866785
Energy: 0.7370910397539636
Energy: 0.7667000070169588
Energy: 0.7370910397544361
Energy: 0.7667000070169588
Energy: 0.7370910397544361
Energy: 0.7667000070169588
Energy: 0.781467592137505
Energy: 0.7838075357997871
Energy: 0.7814675921384502
Energy: 0.7838075358007324
Energy: 0.7814675921384502
Energy: 0.7838075357993146
Energy: 0.7685850841786126
Energy: 0.7560473399752168
Energy: 0.7685850841809755
Energy: 0.7560473399756894
Energy: 0.7685850841805029
Energy: 0.756047339976162
Energy: 0.7383111726012397
Energy: 0.76610925940508
Energy: 0.7383111726021848
Energy: 0.76610925940508
Energy: 0.7383111726002946
Energy: 0.7661092594046075
Energy: 0.8127152761953021
Energy: 0.7388432552309968
Energy: 0.8127152761953021
Energy: 0.7388432552314694
Energy: 0.8127152761948296
Energy: 0.7388432552314694
Energy: 0.7372403689732641
Energy: 0.7560980986477644
Energy: 0.7372403689727914
Energy: 0.7560980986472918
Energy: 0.7372403689723189
Energy: 0.7560980986472918

minimum gb energy = 0.681159189525713 eV
minimum distance =  2.35160106752412 Angstroms
sigma value = 41


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

Energy: 0.9250776994072192
Energy: 0.8742732950815801
Energy: 0.9250776994072192
Energy: 0.8742732950815801
Energy: 0.9250776994072192
Energy: 0.8742732950815801
Energy: 0.8522656792045108
Energy: 0.881314219590817
Energy: 0.8522656792045108
Energy: 0.8813142195921073
Energy: 0.8522656792045108
Energy: 0.8813142195921073
Energy: 0.987846744012141
Energy: 0.8790235943659613
Energy: 1.0072931366223434
Energy: 0.8790235943659613
Energy: 0.9793819566012921
Energy: 0.8790235943659613
Energy: 0.9164502854363633
Energy: 0.9320834139430295
Energy: 0.916450285435073
Energy: 0.9320834139443198
Energy: 0.9164502854363633
Energy: 0.9320834139443198
Energy: 0.9290424103709234
Energy: 0.8980652768562817
Energy: 0.9290424103709234
Energy: 0.8980652768562817
Energy: 0.9290424103722137
Energy: 0.8980652768562817
Energy: 1.00327790812642
Energy: 0.938649712314927
Energy: 1.00327790812642
Energy: 0.938649712314927
Energy: 1.0032779081251297
Energy: 0.938649712314927
Energy: 0.91689801390901
Energy: 0.8300720283538829
Energy: 0.91689801390901
Energy: 0.8300720283538829
Energy: 0.91689801390901
Energy: 0.8300720283538829
Energy: 0.915175741815341
Energy: 0.8828893813557938
Energy: 0.915175741815341
Energy: 0.8828893813557938
Energy: 0.915175741815341
Energy: 0.8828893813557938
Energy: 0.8530028973774311
Energy: 0.8557390600966871
Energy: 0.8530028973787216
Energy: 0.8557390600966871
Energy: 0.8530028973774311
Energy: 0.8557390600966871
Energy: 0.9197996799552739
Energy: 0.872854629053982
Energy: 0.9197996799552739
Energy: 0.872854629053982
Energy: 0.9197996799552739
Energy: 0.872854629053982
Energy: 0.8534598924798087
Energy: 0.8795172110847846
Energy: 0.8534598924798087
Energy: 0.8795172110847846
Energy: 0.8534598924798087
Energy: 0.879517211086075
Energy: 0.9062742759511375
Energy: 0.8810534438616193
Energy: 0.9062742759524278
Energy: 0.8810534438616193
Energy: 0.9062742759524278
Energy: 0.8810534438616193
Energy: 0.9181443322558599
Energy: 0.9304562361806371
Energy: 0.9181443322558599
Energy: 0.9304562361806371
Energy: 0.9181443322558599
Energy: 0.9304562361806371
Energy: 0.9271379496795229
Energy: 0.8818524248654955
Energy: 0.9271379496795229
Energy: 0.8818524248654955
Energy: 0.9271379496795229
Energy: 0.8818524248654955

minimum gb energy = 0.8300720283538829 eV
minimum distance =  2.32278198851469 Angstroms
sigma value = 11


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

Energy: 1.0562917001222438
Energy: 1.053058995120185
Energy: 1.0562917001216767
Energy: 1.053058995120185
Energy: 1.0562917001216767
Energy: 1.053058995120185
Energy: 0.9549045302875365
Energy: 0.996891706508888
Energy: 0.9549045302898039
Energy: 0.9968917065094549
Energy: 0.9549045302886703
Energy: 0.9968917065094549
Energy: 1.023537827054799
Energy: 0.9875815498161208
Energy: 1.0235378270542321
Energy: 0.9875815498161208
Energy: 1.0423046242981617
Energy: 0.9875815498161208
Energy: 1.0079473865989994
Energy: 0.9604461014349744
Energy: 1.0079473865984325
Energy: 0.9604461014349744
Energy: 1.0079473865984325
Energy: 0.9604461014355413
Energy: 1.0215383483829574
Energy: 0.9694218915478717
Energy: 1.0215383483835245
Energy: 0.9694218915473048
Energy: 1.0215383483823908
Energy: 0.9694218915478717
Energy: 0.9839075406524244
Energy: 1.0183682336526316
Energy: 0.9839075406529911
Energy: 1.0183682336526316
Energy: 0.9839075406529911
Energy: 1.0183682336526316
Energy: 1.0036016155046923
Energy: 0.9913286611415957
Energy: 1.0036016155046923
Energy: 0.9913286611421624
Energy: 1.0036016155052592
Energy: 0.9913286611415957
Energy: 0.9861544021130207
Energy: 0.9905179881257551
Energy: 0.9861544021124539
Energy: 0.9905179881274556
Energy: 0.9861544021130207
Energy: 0.9905179881280225
Energy: 1.008199978655118
Energy: 0.9939871395392674
Energy: 1.0081999786539846
Energy: 0.9939871395392674
Energy: 1.0081999786539846
Energy: 0.9939871395381339
Energy: 0.9758916079806922
Energy: 1.0121667974611175
Energy: 0.9758916079806922
Energy: 1.0121667974605508
Energy: 0.9758916079801254
Energy: 1.0121667974611175
Energy: 0.9878940675187675
Energy: 0.9876570369969482
Energy: 0.9878940675193344
Energy: 0.9876570369963814
Energy: 0.9878940675187675
Energy: 0.9876570369963814
Energy: 0.9986685020189399
Energy: 1.0178372523659194
Energy: 0.9986685020195067
Energy: 1.0178372523659194
Energy: 0.9986685020189399
Energy: 1.0178372523659194
Energy: 1.0080747196882052
Energy: 0.9841284149789193
Energy: 1.0080747196882052
Energy: 0.9841284149789193
Energy: 1.008074719688772
Energy: 0.9841284149789193
Energy: 1.0107974132479192
Energy: 1.0183268295088632
Energy: 1.010797413248486
Energy: 1.0183268295088632
Energy: 1.0107974132479192
Energy: 1.0183268295088632
Energy: 0.9766968045986689
Energy: 0.9973811031754929
Energy: 0.9766968045986689
Energy: 0.9973811031754929
Energy: 0.9766968045986689
Energy: 0.9973811031754929
Energy: 1.0031191061343967
Energy: 0.9949651065127384
Energy: 1.0031191061343967
Energy: 0.994965106513872
Energy: 1.0031191061343967
Energy: 0.9949651065150056
Energy: 0.9592818483232318
Energy: 0.9870826304017869
Energy: 0.9592818483226649
Energy: 0.9870826304017869
Energy: 0.9592818483232318
Energy: 0.9870826304012201
Energy: 1.0115756301842025
Energy: 1.023166412784327
Energy: 1.0115756301904117
Energy: 1.023166412784327
Energy: 1.0115756301808014
Energy: 1.023166412784327
Energy: 0.97660160547749
Energy: 0.9441721935556107
Energy: 0.9766016054786237
Energy: 0.9441721935561775
Energy: 0.9766016054780569
Energy: 0.9441721935556107
Energy: 1.0043168828357576
Energy: 0.9858899189919639
Energy: 1.0043168828385916
Energy: 0.9858899189919639
Energy: 1.0043168828368911
Energy: 0.9858899189919639
Energy: 0.9925981823981234
Energy: 0.9765495781570185
Energy: 0.9925981823981234
Energy: 0.9765495781570185
Energy: 0.9925981823969897
Energy: 0.9765495781570185
Energy: 1.0505172067208388
Energy: 1.0287580192093986
Energy: 1.050517206720272
Energy: 1.0287580192093986
Energy: 1.0505172067208388
Energy: 1.0287580192093986
Energy: 0.9932465076215846
Energy: 0.9879138145516596
Energy: 0.9932465076210177
Energy: 0.9879138145516596
Energy: 0.9932465076210177
Energy: 0.9879138145516596
Energy: 1.0299642114709011
Energy: 0.9961189376989693
Energy: 1.0299642114703342
Energy: 0.9961189376989693
Energy: 1.0299642114703342
Energy: 0.9961189376984024
Energy: 0.9806994286376758
Energy: 0.9953017728460417
Energy: 0.9806994286376758
Energy: 0.9953017728454749
Energy: 0.9806994286376758
Energy: 0.9953017728454749
Energy: 0.990698542945734
Energy: 0.9854095576400846
Energy: 0.9906985429446002
Energy: 0.9854095576395178
Energy: 0.9906985429446002
Energy: 0.9854095576395178
Energy: 0.975747412587758
Energy: 1.0219838331927467
Energy: 0.975747412587758
Energy: 1.0219838331904791
Energy: 0.9757474125871911
Energy: 1.0219838331899125
Energy: 1.0081172063702915
Energy: 0.9777990931995157
Energy: 1.008117206371425
Energy: 0.9777990932000825
Energy: 1.0081172063708583
Energy: 0.9777990932000825
Energy: 1.0065259267188542
Energy: 1.0215927404953868
Energy: 1.0065259267188542
Energy: 1.0215927404953868
Energy: 1.0065259267182873
Energy: 1.0215927404953868
Energy: 0.9825499850998394
Energy: 0.9458480593602832
Energy: 0.9825499850992725
Energy: 0.9458480593602832
Energy: 0.9825499850987057
Energy: 0.9458480593591495
Energy: 0.9745189759290559
Energy: 1.0342476321130418
Energy: 0.9745189759301895
Energy: 1.034247632112475
Energy: 0.9745189759296227
Energy: 1.0342476321130418

minimum gb energy = 0.9441721935556107 eV
minimum distance =  2.22900382248303 Angstroms
sigma value = 57


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

Energy: 0.9452327480838405
Energy: 0.9794729124900027
Energy: 0.9452327480838405
Energy: 0.9794729124900027
Energy: 0.9452327480838405
Energy: 0.9794729124900027
Energy: 1.0044013611868812
Energy: 0.9667545597929493
Energy: 1.00440136118789
Energy: 0.9667545597929493
Energy: 1.0044013611868812
Energy: 0.9667545597929493
Energy: 1.0253032705382257
Energy: 0.9568197572326106
Energy: 1.0253032705392344
Energy: 0.9568197572326106
Energy: 1.0253032705382257
Energy: 0.9568197572326106
Energy: 0.9542760393104993
Energy: 1.1733011086197593
Energy: 0.9542760393104993
Energy: 1.2415042051593177
Energy: 0.9542760393104993
Energy: 1.0737512688292072
Energy: 1.0253915976270793
Energy: 0.9568305381193558
Energy: 1.0253915976270793
Energy: 0.9568305381193558
Energy: 1.0253915976270793
Energy: 0.9568305381193558
Energy: 1.004967441464658
Energy: 0.9667475333149206
Energy: 1.0049674414636494
Energy: 1.020096104567913
Energy: 1.0049674414636494
Energy: 0.9998311648244204
Energy: 0.945232748081823
Energy: 0.979472912488994
Energy: 0.9452327480828318
Energy: 0.979472912488994
Energy: 0.945232748081823
Energy: 0.979472912488994
Energy: 1.0044013611848637
Energy: 0.9667545597909319
Energy: 1.0044013611858724
Energy: 0.9667545597909319
Energy: 1.0044013611848637
Energy: 0.9667545597909319
Energy: 1.0253032705351997
Energy: 0.9568197572305932
Energy: 1.0253032705362082
Energy: 0.9568197572305932
Energy: 1.0253032705351997
Energy: 0.9568197572305932
Energy: 0.9542760393115081
Energy: 1.1487417557979338
Energy: 0.9542760393115081
Energy: 1.1385756250644632
Energy: 0.9542760393115081
Energy: 1.0737512688281985
Energy: 1.025391597625062
Energy: 0.9568305381213732
Energy: 1.025391597625062
Energy: 0.9568305381213732
Energy: 1.025391597625062
Energy: 0.9568305381213732
Energy: 1.0049674414676841
Energy: 0.9667475333149206
Energy: 1.0049674414676841
Energy: 0.9667475333149206
Energy: 1.0049674414666756
Energy: 0.9667475333149206
Energy: 0.9452327480848263
Energy: 0.979472912488994
Energy: 0.9452327480838405
Energy: 0.979472912488994
Energy: 0.9452327480838405
Energy: 0.9794729124900027
Energy: 1.0044013611868812
Energy: 0.9667545597929493
Energy: 1.00440136118789
Energy: 0.9667545597929493
Energy: 1.0044013611868812
Energy: 0.9667545597929493
Energy: 1.0253032705392344
Energy: 0.9568197572326106
Energy: 1.0253032705382257
Energy: 0.9568197572326106
Energy: 1.0253032705382257
Energy: 0.9568197572326106
Energy: 0.9542760393104993
Energy: 1.0737512688302158
Energy: 0.9542760393104993
Energy: 1.0737512688281985
Energy: 0.9542760393104993
Energy: 1.0737512688292072
Energy: 1.0253915976270793
Energy: 0.9568305381193558
Energy: 1.0253915976270793
Energy: 0.9568305381193558
Energy: 1.0253915976270793
Energy: 0.9568305381193558

minimum gb energy = 0.945232748081823 eV
minimum distance =  2.3050664544734 Angstroms
sigma value = 9


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

Energy: 1.0449241280349184
Energy: 1.0261510371574107
Energy: 1.0449241280340948
Energy: 1.0261510371574107
Energy: 1.0449241280349184
Energy: 1.0261510371582343
Energy: 1.0623731907649896
Energy: 1.019471841812201
Energy: 1.0623731907658132
Energy: 1.019471841812201
Energy: 1.0623731907658132
Energy: 1.019471841812201
Energy: 1.0479871553405555
Energy: 1.0229009355548944
Energy: 1.1028349279891045
Energy: 1.0229009355548944
Energy: 1.116901675005303
Energy: 1.0229009355548944
Energy: 0.9984157177276124
Energy: 1.1641282558797406
Energy: 0.9984157177276124
Energy: 1.1641282558797406
Energy: 0.9984157177284358
Energy: 1.1641282558797406
Energy: 1.0335751658939942
Energy: 1.019206660713166
Energy: 1.0335751658931707
Energy: 1.019206660713166
Energy: 1.0335751658939942
Energy: 1.0192066607123422
Energy: 1.0514169161184508
Energy: 1.0184072947314315
Energy: 1.0514169161184508
Energy: 1.018407294730608
Energy: 1.0514169161192746
Energy: 1.0184072947314315
Energy: 0.9973001884568288
Energy: 1.0710957723386498
Energy: 0.9973001884560052
Energy: 1.0710957723386498
Energy: 0.9973001884560052
Energy: 1.0710957723386498
Energy: 1.0150238347761296
Energy: 1.0605532987948219
Energy: 1.0150238347753058
Energy: 1.0605532987948219
Energy: 1.0150238347761296
Energy: 1.0605532987948219
Energy: 1.1580966379660789
Energy: 1.0200492508589805
Energy: 1.1580966379669029
Energy: 1.0200492508589805
Energy: 1.1580966379636082
Energy: 1.0200492508589805
Energy: 0.9990554943261336
Energy: 1.0557769944653048
Energy: 0.9990554943261336
Energy: 1.0557769944653048
Energy: 0.9990554943261336
Energy: 1.0557769944653048
Energy: 1.0441131606851635
Energy: 1.0624106099951969
Energy: 1.0441131606835163
Energy: 1.0624106099951969
Energy: 1.0441131606843397
Energy: 1.0624106099960202
Energy: 1.1083999785034426
Energy: 1.019841801803661
Energy: 1.1083999785034426
Energy: 1.019841801803661
Energy: 1.1083999785034426
Energy: 1.019841801803661
Energy: 0.9999096677812821
Energy: 1.0697071691644382
Energy: 0.9999096677804585
Energy: 1.0697071691652618
Energy: 0.9999096677821057
Energy: 1.0697071691652618
Energy: 1.0433210058349747
Energy: 1.0527892750997396
Energy: 1.0433210058357982
Energy: 1.052789275098916
Energy: 1.0433210058357982
Energy: 1.052789275098916
Energy: 1.0601423805978132
Energy: 1.019339397602191
Energy: 1.0601423805969896
Energy: 1.0193393976013674
Energy: 1.0835179933323436
Energy: 1.0193393976013674
Energy: 1.0426215615642136
Energy: 1.0503362854173834
Energy: 1.0426215615642136
Energy: 1.0503362854173834
Energy: 1.0426215615642136
Energy: 1.0503362854182072
Energy: 1.0411300310944998
Energy: 1.058978028614789
Energy: 1.0411300310961469
Energy: 1.058978028614789
Energy: 1.0411300310953235
Energy: 1.0589780286156127
Energy: 1.1598707627554339
Energy: 1.019258136742364
Energy: 1.1598707627554339
Energy: 1.0192581367415405
Energy: 1.1598707627554339
Energy: 1.0192581367415405
Energy: 1.004719380017739
Energy: 1.0663231473635801
Energy: 1.0047193800185623
Energy: 1.0663231473635801
Energy: 1.004719380017739
Energy: 1.0663231473635801
Energy: 1.0182685879900613
Energy: 1.0260331513643304
Energy: 1.0182685879884141
Energy: 1.0260331513635068
Energy: 1.0182685879892377
Energy: 1.026033151365154
Energy: 1.1109031869358734
Energy: 1.019583145595934
Energy: 1.110903186936697
Energy: 1.019583145595934
Energy: 1.110903186936697
Energy: 1.019583145595934

minimum gb energy = 0.9973001884560052 eV
minimum distance =  2.27215204836081 Angstroms
sigma value = 27


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

Energy: 1.0656418436270096
Energy: 1.0236181551176955
Energy: 1.0656418436270096
Energy: 0.9790222094341148
Energy: 1.065641843627704
Energy: 0.9790527854864728
Energy: 1.0559368004624603
Energy: 1.0138392907653995
Energy: 1.0559368004631549
Energy: 1.0138392907647051
Energy: 1.0559368004624603
Energy: 1.0138392907619282
Energy: 1.0642981914832719
Energy: 0.9673448953768485
Energy: 1.0642981914818834
Energy: 0.9673448953768485
Energy: 1.0642981914818834
Energy: 0.9673448953775429
Energy: 0.9643214717923124
Energy: 1.0013503303997577
Energy: 0.9643214717902298
Energy: 1.0013503304032287
Energy: 0.9643214717888413
Energy: 1.0013503303997577
Energy: 0.9901097226584523
Energy: 1.0513492803793478
Energy: 0.9901097226584523
Energy: 1.0513492803793478
Energy: 0.9901097226584523
Energy: 1.0513492803786537
Energy: 1.1242477145780205
Energy: 1.0452031866931477
Energy: 1.1242477145780205
Energy: 1.045203186693842
Energy: 1.124247714579409
Energy: 1.0452031866931477
Energy: 0.9630158773187192
Energy: 1.077994455850824
Energy: 0.9630158773187192
Energy: 1.077994455850824
Energy: 0.9630158773194134
Energy: 1.077994455850824
Energy: 0.9968755912914858
Energy: 1.0139765513764873
Energy: 0.9968755912956513
Energy: 1.01397655137715
Energy: 0.9968755912921802
Energy: 1.013976551375793
Energy: 1.0315639790720517
Energy: 0.9778293632271673
Energy: 1.0315639790720517
Energy: 0.977829363226473
Energy: 1.0315639790720517
Energy: 0.977829363226473
Energy: 1.0528315404829904
Energy: 0.9859416749071177
Energy: 1.0528315404829904
Energy: 0.9859416749064235
Energy: 1.0528315404829904
Energy: 0.9859416749064235
Energy: 1.0558501656528845
Energy: 1.0324936840714622
Energy: 1.0558501656521901
Energy: 1.0324936840714622
Energy: 1.0558501656535786
Energy: 1.0324936840714622
Energy: 1.079644522248034
Energy: 0.9639103349368349
Energy: 1.0796445222466455
Energy: 0.9639103349375292
Energy: 1.0796445222466455
Energy: 0.9639103349368349
Energy: 1.048419571052233
Energy: 1.000741418162097
Energy: 1.048419571052233
Energy: 1.000741418158626
Energy: 1.048419571052233
Energy: 1.000741418161403
Energy: 0.9828911199521424
Energy: 1.0378061557141463
Energy: 0.9828911199521424
Energy: 1.0378061557134521
Energy: 0.9828911199514482
Energy: 1.0378061557141463
Energy: 1.1224217389914983
Energy: 1.04501367436031
Energy: 1.1224217389914983
Energy: 1.045013674359616
Energy: 1.1224217389921924
Energy: 1.0450136743582272
Energy: 1.015861619328507
Energy: 1.0510754700279297
Energy: 1.015861619328507
Energy: 1.0510754700272356
Energy: 1.0158616193292014
Energy: 1.0510754700272356
Energy: 0.9644188767246346
Energy: 1.0636542594006495
Energy: 0.9644188767267172
Energy: 1.0636542594013436
Energy: 0.9644188767253288
Energy: 1.0636542594013436
Energy: 1.0020709235133693
Energy: 0.9679697156550268
Energy: 1.0020709235105925
Energy: 0.9679697156550268
Energy: 1.0020709235098981
Energy: 0.9679697156543325
Energy: 1.0065763659082356
Energy: 0.9768858576797227
Energy: 1.00657636590893
Energy: 0.9768858576804168
Energy: 1.0065763659075413
Energy: 0.9768858576804168
Energy: 1.065641843627704
Energy: 1.023672639535072
Energy: 1.065641843627704
Energy: 0.9790238928553913
Energy: 1.0656418436270096
Energy: 0.9790532697330999
Energy: 1.0559368004624603
Energy: 1.0138392907653995
Energy: 1.0559368004624603
Energy: 1.0138392907626226
Energy: 1.0559368004624603
Energy: 1.0138392907667877
Energy: 1.064298191487437
Energy: 0.967344895374766
Energy: 1.064298191487437
Energy: 0.9673448953740718
Energy: 1.0642981914867429
Energy: 0.967344895374766
Energy: 0.9643214717895355
Energy: 1.0013503304039229
Energy: 0.9643214717895355
Energy: 1.001350330407394
Energy: 0.964321471790924
Energy: 1.0013503304039229
Energy: 0.9901097226584523
Energy: 1.0513492803835132
Energy: 0.9901097226591465
Energy: 1.0513492803835132
Energy: 0.9901097226591465
Energy: 1.051349280382819
Energy: 1.124247714576632
Energy: 1.0452031866924534
Energy: 1.124247714576632
Energy: 1.0452031866924534
Energy: 1.1242477145773264
Energy: 1.0452031866924534

minimum gb energy = 0.9630158773187192 eV
minimum distance =  2.27357214684828 Angstroms
sigma value = 19


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

Energy: 0.9787717846056085
Energy: 1.1183007850117987
Energy: 0.9787717846056085
Energy: 1.1183007850117987
Energy: 0.9787717846056085
Energy: 1.1183007850117987
Energy: 1.0202650256924566
Energy: 0.9503385527689527
Energy: 1.0202650256930557
Energy: 0.9503385527695519
Energy: 1.020265025691258
Energy: 0.9503385527695519
Energy: 1.0898483940108101
Energy: 0.9249555481750509
Energy: 1.094258085742997
Energy: 0.9249555481750509
Energy: 1.0325371972336985
Energy: 0.9249555481750509
Energy: 0.936256164227709
Energy: 1.0132391105184595
Energy: 0.9362561642289073
Energy: 1.0132391105172611
Energy: 0.936256164228308
Energy: 1.01323911051786
Energy: 0.9830587604665387
Energy: 1.0165189897250442
Energy: 0.9830587604665387
Energy: 1.0165189897256437
Energy: 0.9830587604671379
Energy: 1.0165189897256437
Energy: 1.0207084389378507
Energy: 0.9489315084041894
Energy: 1.0207084389378507
Energy: 0.9489315084041894
Energy: 1.02070843893845
Energy: 0.9489315084041894
Energy: 0.92470090503852
Energy: 1.1100748276992063
Energy: 0.9247009050379208
Energy: 1.1100748276992063
Energy: 0.92470090503852
Energy: 1.1100748276986068
Energy: 0.9549593718026331
Energy: 1.0674467253791318
Energy: 0.9549593718026331
Energy: 1.0674467253791318
Energy: 0.9549593718026331
Energy: 1.0674467253791318
Energy: 1.0489605178989156
Energy: 0.9247572236075078
Energy: 1.048960517899515
Energy: 0.9247572236069085
Energy: 1.0489605178971178
Energy: 0.9247572236069085
Energy: 0.9708290749063082
Energy: 0.9909341124738806
Energy: 0.9708290749063082
Energy: 0.9909341124732813
Energy: 0.970829074905709
Energy: 0.9909341124738806
Energy: 0.9278092411453878
Energy: 1.1110375700710888
Energy: 0.9278092411447887
Energy: 1.1110375700699175
Energy: 0.9278092411447887
Energy: 1.1110375700710888
Energy: 1.0352079784483237
Energy: 0.9248061999189744
Energy: 1.0352079784477242
Energy: 0.9248061999195737
Energy: 1.0352079784477242
Energy: 0.9248061999195737
Energy: 0.9567865854286302
Energy: 0.9623890170531443
Energy: 0.956786585428031
Energy: 0.9623890170531443
Energy: 0.9567865854262331
Energy: 0.9623890170531443
Energy: 0.9436934518557758
Energy: 1.0156618226163898
Energy: 0.9436934518551765
Energy: 1.0156618226157905
Energy: 0.9436934518557758
Energy: 1.0156618226163898
Energy: 1.0114479695761733
Energy: 0.9211324406317167
Energy: 1.011447969575574
Energy: 0.9211324406317167
Energy: 1.0114479695767724
Energy: 0.9211324406305184
Energy: 1.0929914210473282
Energy: 0.921444792032925
Energy: 1.0929914210479275
Energy: 0.921444792032925
Energy: 1.0929914210479275
Energy: 0.921444792032925
Energy: 0.9364709509800004
Energy: 1.0363409984149383
Energy: 0.9364709509800004
Energy: 1.0363409984149383
Energy: 0.9364709509800004
Energy: 1.0363409984149383
Energy: 1.0162902648950236
Energy: 0.9816846189660546
Energy: 1.0162902648944243
Energy: 0.9816846189666538
Energy: 1.0162902648944243
Energy: 0.9816846189666538
Energy: 1.0327667976145165
Energy: 0.9471052313996507
Energy: 1.032766797613318
Energy: 0.9471052313996507
Energy: 1.0593643311713052
Energy: 0.9471052313996507
Energy: 0.9362643307375189
Energy: 1.0324784681193813
Energy: 0.9362643307375189
Energy: 1.0324784681181824
Energy: 0.9362643307375189
Energy: 1.0324784681187817
Energy: 0.9151705311555614
Energy: 1.020694466350354
Energy: 0.9151705311549623
Energy: 1.0206944663497548
Energy: 0.9151705311549623
Energy: 1.020694466350354
Energy: 1.0893608928917933
Energy: 0.9249585780918762
Energy: 1.0893608928923926
Energy: 0.9249585780924753
Energy: 1.089360892890595
Energy: 0.9249585780918762
Energy: 0.9777968962768796
Energy: 0.9759816356636345
Energy: 0.9777968962750818
Energy: 0.9759816356624359
Energy: 0.9777968962786773
Energy: 0.9759816356624359
Energy: 0.9769711357752888
Energy: 1.0576170132015785
Energy: 0.9769711357746894
Energy: 1.0576170132021776
Energy: 0.9769711357752888
Energy: 1.05761701320038
Energy: 1.018309873245335
Energy: 0.9250604003551204
Energy: 1.0183098732465337
Energy: 0.9250604003551204
Energy: 1.0183098732471327
Energy: 0.9250604003551204
Energy: 0.9753172806981151
Energy: 0.947432038909488
Energy: 0.9753172806969165
Energy: 0.9474320389070913
Energy: 0.9753172806981151
Energy: 0.947432038909488
Energy: 0.9216211143547229
Energy: 1.0231854048847315
Energy: 0.921621114355322
Energy: 1.0231854048847315
Energy: 0.9216211143559214
Energy: 1.02318540488593
Energy: 1.007382238779411
Energy: 0.9458013201568366
Energy: 1.0073822387812088
Energy: 0.9458013201568366
Energy: 1.0073822387830065
Energy: 0.9458013201580352
Energy: 1.0306416947115213
Energy: 0.9462684517745459
Energy: 1.0306416947109223
Energy: 0.9462684517745459
Energy: 1.0306416947109223
Energy: 0.9462684517745459

minimum gb energy = 0.9151705311549623 eV
minimum distance =  2.29714515327136 Angstroms
sigma value = 101


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

Energy: 0.9159728043657852
Energy: 1.011525687420477
Energy: 0.9159728043657852
Energy: 1.011525687420477
Energy: 0.9159728043657852
Energy: 1.011525687421004
Energy: 0.9170359267486484
Energy: 0.8956674794079017
Energy: 0.9170359267544427
Energy: 0.8956674794079017
Energy: 0.9170359267518089
Energy: 0.8956674794079017
Energy: 0.9991159607519067
Energy: 0.8829950339611864
Energy: 0.99911596075138
Energy: 0.8829950339596061
Energy: 0.9991159607529604
Energy: 0.8829950339601328
Energy: 0.8685412733571599
Energy: 1.1486050710297968
Energy: 0.8685412733566331
Energy: 1.206183689077563
Energy: 0.8685412733566331
Energy: 1.0697058929784737
Energy: 0.9064831406516726
Energy: 0.9421611902146827
Energy: 0.9064831406506191
Energy: 0.9421611902146827
Energy: 0.9064831406521994
Energy: 0.9421611902146827
Energy: 0.9920042561490688
Energy: 0.883729702888219
Energy: 0.9920042561495956
Energy: 0.8837297028887457
Energy: 0.9920042561490688
Energy: 0.883729702888219
Energy: 0.8952404910249404
Energy: 0.9034082010851698
Energy: 0.8952404910259939
Energy: 0.9034082010856965
Energy: 0.8952404910249404
Energy: 0.903408201084643
Energy: 0.8718234102229675
Energy: 1.0654402897169437
Energy: 0.8718234102224408
Energy: 1.046895100074896
Energy: 0.8718234102229675
Energy: 1.0079928639399178
Energy: 0.9913082112517392
Energy: 0.8842646579328867
Energy: 0.9913082112506857
Energy: 0.8842646579328867
Energy: 0.9913082112506857
Energy: 0.8842646579328867
Energy: 0.949689948087502
Energy: 0.8884410787753823
Energy: 0.9496899480901358
Energy: 0.9366696888760243
Energy: 0.9496899480896088
Energy: 0.9052685660720966
Energy: 0.8708768286127919
Energy: 1.1086207624230262
Energy: 0.8708768286127919
Energy: 1.1086207624230262
Energy: 0.8708768286117384
Energy: 1.1086207624230262
Energy: 0.9659607718374229
Energy: 0.8955807235002559
Energy: 0.965960771839506
Energy: 0.8955807235034166
Energy: 0.9659607718379497
Energy: 0.8955807235034166
Energy: 0.9836371455881513
Energy: 0.8837061843258891
Energy: 0.9836371455876246
Energy: 0.8837061843258891
Energy: 0.9836371455881513
Energy: 0.8837061843253623
Energy: 0.9200862687771687
Energy: 1.022382165940565
Energy: 0.9200862687771687
Energy: 1.045422188996532
Energy: 0.9200862687766419
Energy: 1.022514477535201
Energy: 0.9176443882807074
Energy: 0.9442868533764961
Energy: 0.9176443882791271
Energy: 0.9442868533764961
Energy: 0.9176443882812341
Energy: 0.9442868533764961
Energy: 0.9995409352156193
Energy: 0.8843295510238
Energy: 0.9995409352156193
Energy: 0.884329551025907
Energy: 0.999540935216146
Energy: 0.8843295510232733
Energy: 0.8681973551314739
Energy: 0.9509542896525617
Energy: 0.8681973551320006
Energy: 0.9509542896520348
Energy: 0.8681973551314739
Energy: 0.9509542896520348
Energy: 0.8708172093429868
Energy: 0.9415266883865708
Energy: 0.8708172093408796
Energy: 0.9415266883865708
Energy: 0.8708172093414066
Energy: 0.9415266883865708
Energy: 0.9936807114498282
Energy: 0.8843173671222738
Energy: 0.9936807114498282
Energy: 0.884317367121747
Energy: 0.9936807114498282
Energy: 0.884317367121747
Energy: 0.8896724223318772
Energy: 0.8886617166815324
Energy: 0.88967242232977
Energy: 0.888661716684693
Energy: 0.8896724223313505
Energy: 0.8886617166815324
Energy: 0.8706403739251942
Energy: 1.103908122912458
Energy: 0.8706403739236139
Energy: 1.103908122912458
Energy: 0.8706403739251942
Energy: 1.1039081229129852
Energy: 1.1092934553576759
Energy: 0.8802208014071891
Energy: 1.109293455357149
Energy: 0.8802208014077159
Energy: 1.109293455357149
Energy: 0.8802208014077159
Energy: 1.0123170679550404
Energy: 0.8803377371426673
Energy: 1.0123170679550404
Energy: 0.8803377371416138
Energy: 1.012317067955567
Energy: 0.8803377371426673
Energy: 0.8682790447845398
Energy: 1.0226033521508684
Energy: 0.8682790447855694
Energy: 1.0226033521508684
Energy: 0.8682790447840131
Energy: 1.0226033521508684
Energy: 0.9652515972195961
Energy: 0.9214682054237503
Energy: 0.9652515972195961
Energy: 0.9214682054226966
Energy: 0.9652515972190693
Energy: 0.9214682054232236
Energy: 0.9824866603212633
Energy: 0.8839535697620933
Energy: 0.9824866603228435
Energy: 0.8839535697615665
Energy: 0.98248666032179
Energy: 0.8839535697620933
Energy: 0.9155245448115359
Energy: 0.9912307833117706
Energy: 0.9155245448110091
Energy: 0.9912307833117706
Energy: 0.9155245448115359
Energy: 0.9912307833117706
Energy: 0.9156694626171945
Energy: 0.9515246603274684
Energy: 0.915669462616141
Energy: 0.9515246603274684
Energy: 0.9156694626171945
Energy: 0.9515246603274684
Energy: 1.0225998365676077
Energy: 0.8939029510678274
Energy: 1.0225998365676077
Energy: 0.8939029510673007
Energy: 1.0225998365681344
Energy: 0.8939029510673007
Energy: 0.8707821123217175
Energy: 0.9288829312038221
Energy: 0.870782112322771
Energy: 0.9288829312032955
Energy: 0.8707821123222443
Energy: 0.9288829312038221
Energy: 0.8681709615506646
Energy: 1.0006156699970319
Energy: 0.8681709615511914
Energy: 1.0006156699970319
Energy: 0.8681709615506646
Energy: 1.000615669996505
Energy: 1.0136304658603075
Energy: 0.8805448954217725
Energy: 1.0136304658603075
Energy: 0.8805448954222993
Energy: 1.0136304658603075
Energy: 0.8805448954217725
Energy: 1.0125443020939138
Energy: 0.8804468090202887
Energy: 1.0125443020933869
Energy: 0.8804468090208155
Energy: 1.0125443020933869
Energy: 0.8804468090202887

minimum gb energy = 0.8681709615506646 eV
minimum distance =  2.325952211499 Angstroms
sigma value = 33


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

Energy: 0.014775601571987781
Energy: 0.7095143632139969
Energy: 0.014775601571987781
Energy: 0.7095143632135834
Energy: 0.014775601571987781
Energy: 0.7095143632139969
Energy: 0.015288332906068281
Energy: 0.292142297841433
Energy: 0.015288332906068281
Energy: 0.292142297841433
Energy: 0.015288332906068281
Energy: 0.292142297841433
Energy: 1.2019300799169346
Energy: 0.2921293202799236
Energy: 1.4528516671127825
Energy: 0.2921293201828336
Energy: 0.7101349407559177
Energy: 0.29212932033723416
Energy: 0.015288332906481638
Energy: 0.29214229784357265
Energy: 0.015288332906919309
Energy: 0.29214229784357265
Energy: 0.015288332906919309
Energy: 0.29214229784357265

minimum gb energy = 0.014775601571987781 eV
minimum distance =  2.56477659817456 Angstroms
sigma value = 1