Model name: model_name=EAM_Dynamo_WilsonMendelev_2015_NiZr__MO_306032198193_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.518121123313904
cohesive_energy=4.385853675361089
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.017911061784274523
Energy: 1.3305229901649773
Energy: 0.017911061783943406
Energy: 1.3305229901643518
Energy: 0.017911061783943406
Energy: 1.3305229901646463
Energy: 1.3305229901653084
Energy: 1.2908254076722336
Energy: 1.3305229901649773
Energy: 1.2908254076719026
Energy: 1.3305229901649773
Energy: 1.2908254076715715
Energy: 0.017911061783943406
Energy: 1.3305229901649773
Energy: 0.017911061783943406
Energy: 1.3305229901649773
Energy: 0.017911061783943406
Energy: 1.3305229901646463
Energy: 1.3305229901646463
Energy: 1.2908254076715715
Energy: 1.3305229901646463
Energy: 1.2908254076712404
Energy: 1.3305229901646463
Energy: 1.2908254076719026
Energy: 0.017911061783943406
Energy: 1.3305229901653084
Energy: 0.017911061783943406
Energy: 1.3305229901643518
Energy: 0.017911061783943406
Energy: 1.3305229901649773
Energy: 1.3305229901643518
Energy: 1.2908254076715715
Energy: 1.3305229901649773
Energy: 1.2908254076722336
Energy: 1.3305229901643518
Energy: 1.2908254076719026

minimum gb energy = 0.017911061783943406 eV
minimum distance =  2.24820038323179 Angstroms
sigma value = 1


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

Energy: 1.3613763508555186
Energy: 1.302469196562544
Energy: 1.3613763508555186
Energy: 1.302469196562544
Energy: 1.3613763508563155
Energy: 1.3024691965617468
Energy: 1.4658928868711094
Energy: 1.2019616723315534
Energy: 1.4658928868735004
Energy: 1.2019616723323503
Energy: 1.4658928868806738
Energy: 1.2019616723323503
Energy: 1.280365188873871
Energy: 1.3664738891770207
Energy: 1.280365188873871
Energy: 1.366473889171514
Energy: 1.280365188873871
Energy: 1.3664738891699197
Energy: 1.489557173816913
Energy: 1.254314920060994
Energy: 1.489557173816913
Energy: 1.2543149200594002
Energy: 1.48955717381771
Energy: 1.2543149200601973
Energy: 1.3147106242611009
Energy: 1.4360088915364877
Energy: 1.3147106242658833
Energy: 1.4360088915364877
Energy: 1.3147106242666804
Energy: 1.4360088915372846
Energy: 1.3957610219102485
Energy: 1.2199941041319349
Energy: 1.3957610219070604
Energy: 1.219994104131138
Energy: 1.3957610219086547
Energy: 1.2199941041295437
Energy: 1.24628632483263
Energy: 1.338588210114462
Energy: 1.2462863248350213
Energy: 1.3385882101168531
Energy: 1.2462863248382092
Energy: 1.338588210113665
Energy: 1.2472990856454136
Energy: 1.443399048647088
Energy: 1.2472990856438197
Energy: 1.4433990486462909
Energy: 1.2472990856454136
Energy: 1.4433990486407116
Energy: 1.4071973371230315
Energy: 1.3391140163145467
Energy: 1.4071973371230315
Energy: 1.3391140163161408
Energy: 1.4071973371222346
Energy: 1.3391140163153439
Energy: 1.1852794796436872
Energy: 1.4297861599130768
Energy: 1.1852794796420933
Energy: 1.4297861599035122
Energy: 1.1852794796420933
Energy: 1.4297861599011215
Energy: 1.3694159120542675
Energy: 1.2197447412492564
Energy: 1.3694159120542675
Energy: 1.2197447412484597
Energy: 1.3694159120550644
Energy: 1.2197447412492564
Energy: 1.1496067633105642
Energy: 1.3821254901325735
Energy: 1.149606763309767
Energy: 1.3821254901317765
Energy: 1.149606763309767
Energy: 1.3821254901333706
Energy: 1.5063891920778956
Energy: 1.1379727840501113
Energy: 1.5063891920866628
Energy: 1.1379727840509082
Energy: 1.5063891920802865
Energy: 1.1379727840509082
Energy: 1.2380976321882082
Energy: 1.2806254714284928
Energy: 1.238097632187411
Energy: 1.2806254714284928
Energy: 1.2380976321890051
Energy: 1.2806254714284928
Energy: 1.5285448553297172
Energy: 1.1900459157946865
Energy: 1.528544855343267
Energy: 1.1900459157954837
Energy: 1.5285448553329053
Energy: 1.1900459157962806
Energy: 1.5269754949148229
Energy: 1.3710962532211906
Energy: 1.52697549491562
Energy: 1.371096253217205
Energy: 1.5269754949148229
Energy: 1.3710962532180022
Energy: 1.3279293469242994
Energy: 1.3226083503648431
Energy: 1.3279293469235023
Energy: 1.322608350364046
Energy: 1.3279293469219082
Energy: 1.322608350366437
Energy: 1.3289951580526695
Energy: 1.2615433350514245
Energy: 1.3289951580478871
Energy: 1.2615433350506273
Energy: 1.3289951580502783
Energy: 1.2615433350506273
Energy: 1.3109686045693854
Energy: 1.253721567407457
Energy: 1.3109686045693854
Energy: 1.253721567408254
Energy: 1.3109686045693854
Energy: 1.25372156740666
Energy: 1.380153912202444
Energy: 1.2198357898588261
Energy: 1.380153912205632
Energy: 1.219835789857232
Energy: 1.380153912203241
Energy: 1.219835789858029
Energy: 1.2114145308768187
Energy: 1.4586331983329341
Energy: 1.2114145308768187
Energy: 1.4586331983289489
Energy: 1.2114145308768187
Energy: 1.458633198332137
Energy: 1.3884267350761303
Energy: 1.3415538104442832
Energy: 1.3884267350785215
Energy: 1.3415538104442832
Energy: 1.3884267350785215
Energy: 1.3415538104426892
Energy: 1.1885006518340486
Energy: 1.531151470338804
Energy: 1.1885006518332517
Energy: 1.531151470338804
Energy: 1.1885006518332517
Energy: 1.531151470338804

minimum gb energy = 1.1379727840501113 eV
minimum distance =  2.25538104799167 Angstroms
sigma value = 33


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

Energy: 1.5664637644664636
Energy: 1.4130471707663912
Energy: 1.5121987262381327
Energy: 1.4130471707682044
Energy: 1.5664637644664636
Energy: 1.4130471707663912
Energy: 1.5064241073341138
Energy: 1.2690436696655834
Energy: 1.5064241073250464
Energy: 1.2690436696646765
Energy: 1.5064241073332068
Energy: 1.2690436696615033
Energy: 1.2635844244515855
Energy: 1.2680402260085588
Energy: 1.263584424447052
Energy: 1.2680402260094654
Energy: 1.2635844244511323
Energy: 1.2680402260117323
Energy: 1.4708396045505996
Energy: 1.434721194698794
Energy: 1.4708396045460659
Energy: 1.4347211946992473
Energy: 1.4708396045515062
Energy: 1.4347211947010607
Energy: 1.372648644344301
Energy: 1.3273863593268582
Energy: 1.3726486443447543
Energy: 1.3273863593259518
Energy: 1.3726486443483812
Energy: 1.3273863593359256
Energy: 1.234442398343656
Energy: 1.2635595752735758
Energy: 1.2344423983450161
Energy: 1.2635595752731223
Energy: 1.2344423983463761
Energy: 1.2635595752781092
Energy: 1.4456206310444961
Energy: 1.5016464510897882
Energy: 1.4456206310744173
Energy: 1.5016464510911482
Energy: 1.4456206310680701
Energy: 1.5016464510952283
Energy: 1.1646284103528872
Energy: 1.572817792893988
Energy: 1.164628410360141
Energy: 1.572817792892628
Energy: 1.164628410352434
Energy: 1.5728177929007883
Energy: 1.2229776119463962
Energy: 1.2691794694840968
Energy: 1.2229776119414093
Energy: 1.2691794694836434
Energy: 1.222977611945943
Energy: 1.2691794694936172
Energy: 1.241146218501652
Energy: 1.5490300470397522
Energy: 1.2411524742695117
Energy: 1.549030047034765
Energy: 1.2411462185021054
Energy: 1.5490300470379386
Energy: 1.518320695298018
Energy: 1.2433624098413387
Energy: 1.518320695303458
Energy: 1.243362409839979
Energy: 1.5183206952984711
Energy: 1.2433624098390723
Energy: 1.2660625291108476
Energy: 1.3246075867157927
Energy: 1.2657514434377366
Energy: 1.3246075867153393
Energy: 1.2660625291108476
Energy: 1.3246075867176061
Energy: 1.4776115255500593
Energy: 1.2091216229326542
Energy: 1.477604750526655
Energy: 1.2091216229331074
Energy: 1.4776115255477926
Energy: 1.2091216229376411
Energy: 1.4773372831300031
Energy: 1.4618030546628338
Energy: 1.4773382215586908
Energy: 1.4618030546637402
Energy: 1.4773372831300031
Energy: 1.4618030546583
Energy: 1.398613868484827
Energy: 1.2681618475689838
Energy: 1.3986138684902671
Energy: 1.268161847568077
Energy: 1.398613868484827
Energy: 1.2681618475612766
Energy: 1.2644086791677949
Energy: 1.2690478623706547
Energy: 1.2644086791795408
Energy: 1.2690478623679347
Energy: 1.2644086791673417
Energy: 1.2690478623629478
Energy: 1.4619812259489484
Energy: 1.4010317900291738
Energy: 1.4619812259426015
Energy: 1.4010317900296272
Energy: 1.4619812259480418
Energy: 1.4010317900405076
Energy: 1.3724652859854813
Energy: 1.263683246565913
Energy: 1.3724652859945485
Energy: 1.2636832465654595
Energy: 1.3724652859832145
Energy: 1.2636832465681798
Energy: 1.2351845826548897
Energy: 1.300565857987544
Energy: 1.2351845826535295
Energy: 1.3005658579929842
Energy: 1.235184582653983
Energy: 1.3005658580025046
Energy: 1.4574100312312908
Energy: 1.4993521927541869
Energy: 1.4576394268541277
Energy: 1.4993521927541869
Energy: 1.4574100312321976
Energy: 1.4993521927714144
Energy: 1.1955033982954166
Energy: 1.5563126013950284
Energy: 1.1954993571278554
Energy: 1.5563126014017878
Energy: 1.1955033982954166
Energy: 1.556312601405868
Energy: 1.2258950523967598
Energy: 1.267901404208367
Energy: 1.225895052394493
Energy: 1.2679014042088204
Energy: 1.22589505239948
Energy: 1.2679014042178876
Energy: 1.24234910179322
Energy: 1.5474780194436208
Energy: 1.2423482424845838
Energy: 1.5474780194286604
Energy: 1.2423491017941268
Energy: 1.547478019441354
Energy: 1.5391087702843207
Energy: 1.3736948487889935
Energy: 1.539108770288401
Energy: 1.37369484878854
Energy: 1.5391087702843207
Energy: 1.373694848792167
Energy: 1.2635986010867077
Energy: 1.2341905083829943
Energy: 1.26388043058942
Energy: 1.234190508385714
Energy: 1.2635986010862543
Energy: 1.2341905083848075
Energy: 1.5743002188404775
Energy: 1.4114947815493846
Energy: 1.5199309162905552
Energy: 1.4114947815530112
Energy: 1.574300218839571
Energy: 1.411494781544439
Energy: 1.5743562137625955
Energy: 1.3939813731903798
Energy: 1.5116448099727107
Energy: 1.3939813731872062
Energy: 1.574356213767129
Energy: 1.3939813731736057
Energy: 1.2638980545725509
Energy: 1.2692025907948858
Energy: 1.2638980545761778
Energy: 1.269202590801233
Energy: 1.2638980545730043
Energy: 1.269202590801233
Energy: 1.5487611908667067
Energy: 1.2688784020300587
Energy: 1.5487611908621735
Energy: 1.2688784020309654
Energy: 1.5487611908635333
Energy: 1.268878402031419
Energy: 1.2424491175260215
Energy: 1.516712142332685
Energy: 1.242449117525568
Energy: 1.5167121423317782
Energy: 1.242449117526475
Energy: 1.5167121423322316
Energy: 1.3739048788070465
Energy: 1.2680233669697352
Energy: 1.3739048788043264
Energy: 1.2680233669697352
Energy: 1.3739048788020596
Energy: 1.2680233669756287
Energy: 1.2080454341961975
Energy: 1.407077560125571
Energy: 1.2080454341989173
Energy: 1.40707756010789
Energy: 1.2080454341966507
Energy: 1.40707756010789
Energy: 1.4278453258757935
Energy: 1.498886560428661
Energy: 1.4278453258721666
Energy: 1.4988865604277544
Energy: 1.4278453258739803
Energy: 1.4988865604341013
Energy: 1.2676141589374224
Energy: 1.398721811594066
Energy: 1.2676141589442227
Energy: 1.398721811594066
Energy: 1.2676141589383292
Energy: 1.3987218115976927
Energy: 1.2682020721629321
Energy: 1.263688757233226
Energy: 1.2682020721679192
Energy: 1.263688757233226
Energy: 1.268202072165199
Energy: 1.2636887572223454
Energy: 1.4314670006861587
Energy: 1.4620044197679911
Energy: 1.4314670006897856
Energy: 1.4620044197675788
Energy: 1.4314670006857053
Energy: 1.4620044197585118
Energy: 1.2640365377649847
Energy: 1.373635944589759
Energy: 1.2640311788694425
Energy: 1.373635944589759
Energy: 1.264036537764078
Energy: 1.373635944593798
Energy: 1.2641826591856253
Energy: 1.2339277344628061
Energy: 1.2641829231897272
Energy: 1.2339277344618993
Energy: 1.2641826591860785
Energy: 1.2339277344501534
Energy: 1.4773377694055645
Energy: 1.4669857261849022
Energy: 1.4773371728870308
Energy: 1.4669857261794619
Energy: 1.477337769404658
Energy: 1.4669857261803687
Energy: 1.5609201735036824
Energy: 1.2031150447201937
Energy: 1.560920173509576
Energy: 1.2031150447183805
Energy: 1.560920173503229
Energy: 1.203115044726994
Energy: 1.26595550372982
Energy: 1.2218782568482853
Energy: 1.2659555037239263
Energy: 1.2218782568491922
Energy: 1.26595550372982
Energy: 1.2218782568537259

minimum gb energy = 1.164628410352434 eV
minimum distance =  2.32868198132636 Angstroms
sigma value = 51


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

Energy: 1.3321186124972408
Energy: 1.3599302891119822
Energy: 1.332118612498291
Energy: 1.3599302891119822
Energy: 1.332118612498291
Energy: 1.3599302891119822
Energy: 1.4476965346174404
Energy: 1.2668360849362164
Energy: 1.4476965346174404
Energy: 1.2668360849362164
Energy: 1.4476965346174404
Energy: 1.2668360849372666
Energy: 1.2812441738135851
Energy: 1.3427930998179876
Energy: 1.2812441738135851
Energy: 1.3427930998179876
Energy: 1.2812441738146356
Energy: 1.3427930998148363
Energy: 1.3242361203241664
Energy: 1.1640346358293736
Energy: 1.3242361203241664
Energy: 1.1640346358293736
Energy: 1.3242361203252169
Energy: 1.1640346358293736
Energy: 1.3493651444401678
Energy: 1.2931679721653966
Energy: 1.3493651444370167
Energy: 1.2931679721653966
Energy: 1.3493651444401678
Energy: 1.2931679721632958
Energy: 1.2568300514267634
Energy: 1.2930783303562206
Energy: 1.2568300514267634
Energy: 1.2930783303562206
Energy: 1.2568300514299149
Energy: 1.2930783303562206
Energy: 1.2810516257910582
Energy: 1.2928492065934274
Energy: 1.2810516257910582
Energy: 1.2928492065944779
Energy: 1.2810516257921087
Energy: 1.2928492065923771
Energy: 1.2450642938242673
Energy: 1.2944462289579277
Energy: 1.2450642938242673
Energy: 1.2944462289589782
Energy: 1.2450642938242673
Energy: 1.2944462289600285
Energy: 1.5077298420369714
Energy: 1.1641174443804494
Energy: 1.507729842035921
Energy: 1.1641174443804494
Energy: 1.5077298420380219
Energy: 1.1641174443804494
Energy: 1.1859847515458914
Energy: 1.5113434686525309
Energy: 1.1859847515458914
Energy: 1.5113434686514804
Energy: 1.1859847515448412
Energy: 1.5113434686514804
Energy: 1.4103379428771337
Energy: 1.1846622229403867
Energy: 1.4103379428792344
Energy: 1.1846622229403867
Energy: 1.4103379428760834
Energy: 1.1846622229403867
Energy: 1.329231473296817
Energy: 1.3629091397756048
Energy: 1.329231473296817
Energy: 1.362909139773504
Energy: 1.3292314732957664
Energy: 1.3629091397745545
Energy: 1.442580549253504
Energy: 1.26650365125834
Energy: 1.442580549258756
Energy: 1.2665036512593904
Energy: 1.442580549264008
Energy: 1.2665036512593904
Energy: 1.2814246200828405
Energy: 1.2631557265988447
Energy: 1.2814246200817903
Energy: 1.263155726599895
Energy: 1.2814246200828405
Energy: 1.263155726599895
Energy: 1.3241258555501534
Energy: 1.335942249799352
Energy: 1.3241258555501534
Energy: 1.3359422498004023
Energy: 1.3241258555501534
Energy: 1.3359422498004023
Energy: 1.3494439949736046
Energy: 1.2930458198330461
Energy: 1.3494439949736046
Energy: 1.2930458198340966
Energy: 1.3494439949725543
Energy: 1.2930458198319958
Energy: 1.3496005664147568
Energy: 1.400767233684171
Energy: 1.3496005664126558
Energy: 1.4007672336862718
Energy: 1.3496005664126558
Energy: 1.400767233684171
Energy: 1.3359690508970155
Energy: 1.2981520837020695
Energy: 1.335969050895965
Energy: 1.2981520837010192
Energy: 1.335969050895965
Energy: 1.2981520837010192

minimum gb energy = 1.1640346358293736 eV
minimum distance =  2.18991701188569 Angstroms
sigma value = 19


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

Energy: 1.2562909639907023
Energy: 1.2994336429971283
Energy: 1.1110788379154803
Energy: 1.2994336429971283
Energy: 1.256290963990079
Energy: 1.2994336430002156
Energy: 1.3871615302925118
Energy: 1.339052503701219
Energy: 1.387161530294381
Energy: 1.339052503700596
Energy: 1.3871615303006115
Energy: 1.3390525037030883
Energy: 1.20920435374118
Energy: 1.1680334288099001
Energy: 1.209204353736819
Energy: 1.1680334288067846
Energy: 1.2092043537330803
Energy: 1.1680334288130156
Energy: 1.3373313855509914
Energy: 1.2094531061670235
Energy: 1.3373313855540785
Energy: 1.2094217297300587
Energy: 1.3373313855547015
Energy: 1.2094531061639082
Energy: 1.2486145517109024
Energy: 1.1804700017753715
Energy: 1.248614551709656
Energy: 1.1076118212654606
Energy: 1.2486145517102794
Energy: 1.1804700017728793
Energy: 1.0973531746431848
Energy: 1.1803822664533543
Energy: 1.0973531746425618
Energy: 1.1075903920752308
Energy: 1.0973531746431848
Energy: 1.1803822664570927
Energy: 1.1684660521637176
Energy: 1.209637255558964
Energy: 1.1684660521618482
Energy: 1.209637255558341
Energy: 1.1684660521637176
Energy: 1.2096372555558486
Energy: 1.2092543642361766
Energy: 1.4946636701418539
Energy: 1.2092545348731223
Energy: 1.4946636701430998
Energy: 1.2092543642380458
Energy: 1.494663670144346
Energy: 1.2597469677148618
Energy: 1.2853420214531774
Energy: 1.2597469679023225
Energy: 1.2853420214862004
Energy: 1.2597469680542681
Energy: 1.2853420215117184
Energy: 1.1110788379154803
Energy: 1.299433642995259
Energy: 1.1110788379154803
Energy: 1.299433642995259
Energy: 1.1110788379154803
Energy: 1.2994336429977515
Energy: 1.3871615302887732
Energy: 1.3390525036987269
Energy: 1.3871615302925118
Energy: 1.339052503701219
Energy: 1.387161530297496
Energy: 1.3390525037037113
Energy: 1.2092043537374417
Energy: 1.1680334288130156
Energy: 1.2092043537343264
Energy: 1.1680334288049155
Energy: 1.2092043537324573
Energy: 1.1680334288130156
Energy: 1.3373313855540785
Energy: 1.2094097656262253
Energy: 1.3373313855565707
Energy: 1.209438478885282
Energy: 1.3373313855565707
Energy: 1.2094097656218636
Energy: 1.248614551715264
Energy: 1.10761182126733
Energy: 1.2486145517084102
Energy: 1.1802628589166084
Energy: 1.2486145517121487
Energy: 1.1076118212691992
Energy: 1.0973531746431848
Energy: 1.1075903920746077
Energy: 1.0973531746388232
Energy: 1.1803420714899782
Energy: 1.0973531746400693
Energy: 1.1075903920808385
Energy: 1.1684660521624712
Energy: 1.209637255558964
Energy: 1.1684660521624712
Energy: 1.2096372555570947
Energy: 1.1684660521637176
Energy: 1.2096372555558486
Energy: 1.2092934420134902
Energy: 1.4946636701474614
Energy: 1.209142099208521
Energy: 1.4946636701462153
Energy: 1.2092934420166055
Energy: 1.4946636701424767
Energy: 1.2469700557784043
Energy: 1.2853420214656388
Energy: 1.2597469678973379
Energy: 1.2853420214787235
Energy: 1.2469700557721732
Energy: 1.285342021507385
Energy: 1.2562909639888329
Energy: 1.2994336429940132
Energy: 1.1110788379148573
Energy: 1.2994336429965052
Energy: 1.2562909639931943
Energy: 1.2994336429977515
Energy: 1.3871615302937577
Energy: 1.339052503701219
Energy: 1.3871615302931346
Energy: 1.339052503701219
Energy: 1.3871615302981193
Energy: 1.3390525037055805
Energy: 1.2092043537355726
Energy: 1.1680334288117693
Energy: 1.2092043537324573
Energy: 1.1680334288074077
Energy: 1.209204353731834
Energy: 1.1680334288130156
Energy: 1.3373313855522377
Energy: 1.2094531061670235
Energy: 1.3373313855553248
Energy: 1.209421729732551
Energy: 1.3373313855534836
Energy: 1.209453106162662
Energy: 1.248614551714641
Energy: 1.1804700017778638
Energy: 1.2486145517071638
Energy: 1.107611821266084
Energy: 1.2486145517090332
Energy: 1.1804700017728793
Energy: 1.0973531746413154
Energy: 1.1803822664558463
Energy: 1.0973531746382
Energy: 1.1075903920733614
Energy: 1.0973531746419385
Energy: 1.1803822664589618
Energy: 1.1684660521637176
Energy: 1.2096372555577177
Energy: 1.1684660521630943
Energy: 1.209637255558341
Energy: 1.1684660521655583
Energy: 1.2096372555546024
Energy: 1.2092543642355535
Energy: 1.494663670144346
Energy: 1.209254534871876
Energy: 1.494663670143723
Energy: 1.2092543642374227
Energy: 1.4946636701449691
Energy: 1.2597469676874464
Energy: 1.2853420214569158
Energy: 1.259746967872415
Energy: 1.2853420214837081
Energy: 1.2597469680094349
Energy: 1.285342021510472
Energy: 1.1110788379148573
Energy: 1.2994336429971283
Energy: 1.1110788379154803
Energy: 1.2994336429977515
Energy: 1.111078837914234
Energy: 1.299433643003954
Energy: 1.387161530294381
Energy: 1.339052503701219
Energy: 1.3871615302950038
Energy: 1.3390525037037113
Energy: 1.3871615302993654
Energy: 1.3390525037068268
Energy: 1.209204353738688
Energy: 1.1680334288117693
Energy: 1.2092043537361956
Energy: 1.1680334288074077
Energy: 1.209204353729965
Energy: 1.1680334288130156

minimum gb energy = 1.0973531746382 eV
minimum distance =  2.32354013921278 Angstroms
sigma value = 27


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

Energy: 1.1025749415844988
Energy: 1.0811313833855176
Energy: 1.1025749415844988
Energy: 1.0811313833855176
Energy: 1.1025749415844988
Energy: 1.0811313833855176
Energy: 1.2470255931851562
Energy: 1.121580635376769
Energy: 1.2470255931851562
Energy: 1.121580635376769
Energy: 1.2470255931851562
Energy: 1.121580635376769
Energy: 1.2416045541744207
Energy: 1.2455625949378692
Energy: 1.142361966835568
Energy: 1.2455625949378692
Energy: 1.1423619668554088
Energy: 1.245562594936343
Energy: 1.25789778326102
Energy: 1.0486302715253475
Energy: 1.2578977832655986
Energy: 1.0486302715253475
Energy: 1.2578977832640723
Energy: 1.0486302715238212
Energy: 1.2553653487223513
Energy: 1.0486303133846289
Energy: 1.2553653487223513
Energy: 1.0486303133846289
Energy: 1.2553653487238776
Energy: 1.0486303133846289
Energy: 1.2772703545067006
Energy: 1.3213619512754353
Energy: 1.2772703545051745
Energy: 1.3213619512754353
Energy: 1.277270354502122
Energy: 1.3213619512754353
Energy: 1.1402099533892975
Energy: 1.1229266230525763
Energy: 1.1402099533908236
Energy: 1.1229266230510502
Energy: 1.2431756061748904
Energy: 1.1229266230525763
Energy: 1.0972379587411278
Energy: 1.0828242420232639
Energy: 1.0972379587411278
Energy: 1.08282424202479
Energy: 1.0972379587411278
Energy: 1.0828242420232639
Energy: 1.2495160820318332
Energy: 1.1420521762659297
Energy: 1.2495160820318332
Energy: 1.1420521753155126
Energy: 1.2495160820318332
Energy: 1.1420521765100204
Energy: 1.2301561692212495
Energy: 1.2602415407956926
Energy: 1.230156169225828
Energy: 1.2602415408017975
Energy: 1.230156169224302
Energy: 1.260241540798745
Energy: 1.1665672083212106
Energy: 1.049743833299429
Energy: 1.1665672083212106
Energy: 1.049743833299429
Energy: 1.1665672083212106
Energy: 1.049743833299429
Energy: 1.323116987429329
Energy: 1.1909232932281097
Energy: 1.323116987429329
Energy: 1.1909232932281097
Energy: 1.323116987429329
Energy: 1.1909232932296359

minimum gb energy = 1.0486302715238212 eV
minimum distance =  2.17287714309145 Angstroms
sigma value = 9


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

Energy: 1.112370303358002
Energy: 1.0568161797641975
Energy: 1.1123703033549999
Energy: 1.0568161797611955
Energy: 1.1123703033584305
Energy: 1.0568161797594804
Energy: 1.0614043344928719
Energy: 1.128878713060298
Energy: 1.0614043344907278
Energy: 1.0663128749344064
Energy: 1.0614043344890123
Energy: 1.0663128749344064
Energy: 0.9922937471225207
Energy: 1.1009597682746095
Energy: 0.9922937471204155
Energy: 1.1009597682754282
Energy: 0.9922937471208444
Energy: 1.1009597682741807
Energy: 1.0115415026173018
Energy: 0.9710222788304977
Energy: 1.011541502619446
Energy: 0.9710222788309266
Energy: 1.0115415026203038
Energy: 0.9710222788313555
Energy: 1.0721303466261933
Energy: 1.0513337196812873
Energy: 1.072130346624478
Energy: 1.0513337196782855
Energy: 1.0721303466261933
Energy: 1.0513337196804295
Energy: 1.0799043127573549
Energy: 1.1379899861521705
Energy: 1.0799043127500647
Energy: 1.1098086126934499
Energy: 1.0799043127509225
Energy: 1.1098086126900193
Energy: 1.0291769882646342
Energy: 1.083106521006965
Energy: 1.0291769882663495
Energy: 1.083106521006965
Energy: 1.0291769882672073
Energy: 1.083106521006965
Energy: 0.9553310359678523
Energy: 1.0873286202141568
Energy: 0.9553310359674235
Energy: 1.0873286202145855
Energy: 0.9553310359657081
Energy: 1.0873286202150143
Energy: 1.116728476942194
Energy: 1.0523254773423592
Energy: 1.1167284769370478
Energy: 1.0523254773423592
Energy: 1.1167284769404784
Energy: 1.0523254773410726
Energy: 1.1134875300006943
Energy: 1.2010636572332078
Energy: 1.113487530006269
Energy: 1.2010636572310638
Energy: 1.1134875300015523
Energy: 1.2010636572323503
Energy: 1.0089843171585442
Energy: 0.9784166571135106
Energy: 1.0089843171564001
Energy: 0.9784166571130818
Energy: 1.0089843171585442
Energy: 0.9784166571139394
Energy: 1.091107659431733
Energy: 1.0793933601962735
Energy: 1.0911076594325906
Energy: 1.0793933601876973
Energy: 1.0911076594308755
Energy: 1.0793933601838375
Energy: 1.0560750137851977
Energy: 1.0947455761296332
Energy: 1.0560750137779076
Energy: 1.0947455761334928
Energy: 1.0560750137753345
Energy: 1.0947455761292046
Energy: 1.1075858568577388
Energy: 1.0367063754711856
Energy: 1.1075858568633137
Energy: 1.0367063754771892
Energy: 1.1075858568650288
Energy: 1.0367063754750452
Energy: 0.9931393029396081
Energy: 1.0696254628464783
Energy: 0.9931393029400368
Energy: 1.0696254628460493
Energy: 0.993139302937035
Energy: 1.0696254628464783
Energy: 1.0310066900276498
Energy: 1.0629646453943855
Energy: 1.0310066900237902
Energy: 1.0629646453986736
Energy: 1.0310066900250767
Energy: 1.062964645395243
Energy: 1.31094815297907
Energy: 0.9719943020126015
Energy: 1.3109481529799278
Energy: 0.971994302011315
Energy: 1.310948152979499
Energy: 0.971994302011315
Energy: 1.0021859196906762
Energy: 1.0381456010199388
Energy: 1.0021859196919627
Energy: 1.0381456010207966
Energy: 1.0021859196902472
Energy: 1.0381456010203678
Energy: 0.9522908898752128
Energy: 1.278061937398495
Energy: 0.952290889869638
Energy: 1.2780619373989237
Energy: 0.9522908898713532
Energy: 1.278061937398066
Energy: 1.1543513513149517
Energy: 1.069076141157379
Energy: 1.1543513513162382
Energy: 1.176860420708659
Energy: 1.1543513513153807
Energy: 1.06907614115695
Energy: 0.9522862621168189
Energy: 1.2782316508722031
Energy: 0.9522862621155324
Energy: 1.278231650877349
Energy: 0.9522862621181054
Energy: 1.2782316508726321
Energy: 1.0021649644254902
Energy: 1.038030060082818
Energy: 1.002164964425919
Energy: 1.0380300600832468
Energy: 1.002164964425919
Energy: 1.038030060082818
Energy: 1.3110769561019375
Energy: 0.971703697985596
Energy: 1.3110769560976492
Energy: 0.971703697985596
Energy: 1.3110769561010798
Energy: 0.9717036979860247
Energy: 1.0307244748432094
Energy: 1.0929648881160325
Energy: 1.0307244748453535
Energy: 1.0929648881104577
Energy: 1.0307244748423519
Energy: 1.0929648881091711
Energy: 0.9931869598676338
Energy: 1.0694554930445435
Energy: 0.9931869598702068
Energy: 1.0694554930445435
Energy: 0.9931869598667762
Energy: 1.0694554930419704
Energy: 1.107667808072509
Energy: 1.0700765454861714
Energy: 1.1076678080665054
Energy: 1.070076545487029
Energy: 1.1076678080690785
Energy: 1.0700765454866004
Energy: 1.0558687468500478
Energy: 1.0946089014589189
Energy: 1.055868746851763
Energy: 1.0946089014653513
Energy: 1.0558687468449017
Energy: 1.0946089014619207
Energy: 1.090660471127457
Energy: 1.056129504674035
Energy: 1.0906604711283145
Energy: 1.056129504669318
Energy: 1.090660471132603
Energy: 1.0561295046641723
Energy: 1.0090258987127532
Energy: 0.9787701779185433
Energy: 1.0090258987127532
Energy: 0.978770177918972
Energy: 1.0090258987144685
Energy: 0.9787701779198298
Energy: 1.1124184243016184
Energy: 1.0226462298341497
Energy: 1.1124184242977588
Energy: 1.0226462298294323
Energy: 1.1124184242986166
Energy: 1.0226462298397243
Energy: 1.117216736299486
Energy: 1.0522866326748406
Energy: 1.1172167363003436
Energy: 1.052286632673554
Energy: 1.1172167363007726
Energy: 1.052286632672696
Energy: 0.9553436834307686
Energy: 1.0877002120185177
Energy: 0.9553436834311974
Energy: 1.087700212018089
Energy: 0.9553436834311974
Energy: 1.0877002120193755
Energy: 1.0293677404596961
Energy: 1.082948598992138
Energy: 1.029367740462698
Energy: 1.082948598992567
Energy: 1.029367740463127
Energy: 1.082948598992138
Energy: 1.079855618740477
Energy: 1.0744617162581303
Energy: 1.0798556187516268
Energy: 1.0744617162585592
Energy: 1.079855618761451
Energy: 1.0744617162478385
Energy: 1.071971783883894
Energy: 1.0512238384464268
Energy: 1.0719717838873246
Energy: 1.0512238384464268
Energy: 1.071971783886467
Energy: 1.0512238384455692
Energy: 1.0115082634445773
Energy: 0.9707744418604485
Energy: 1.0115082634467214
Energy: 0.9707744418608771
Energy: 1.0115082634467214
Energy: 0.9707744418604485
Energy: 0.9923065151159475
Energy: 1.1010358049595637
Energy: 0.9923065151120879
Energy: 1.1010358049728184
Energy: 0.9923065151129455
Energy: 1.101035804963852
Energy: 1.0610263767484842
Energy: 1.0300689010815476
Energy: 1.061026376718466
Energy: 1.0300689010794035
Energy: 1.0610263767763193
Energy: 1.0300689010802613
Energy: 1.1123703033489962
Energy: 1.056816179757336
Energy: 1.1123703033502828
Energy: 1.0568161797556206
Energy: 1.1123703033485675
Energy: 1.0568161797539055
Energy: 1.061404334485153
Energy: 1.0663128749297284
Energy: 1.0614043344830089
Energy: 1.0663128749284418
Energy: 1.0614043344864394
Energy: 1.0663128749284418
Energy: 0.9922937471178427
Energy: 1.1009597682767147
Energy: 0.9922937471187003
Energy: 1.1009597682792875
Energy: 0.9922937471178427
Energy: 1.1009597682749994
Energy: 1.0115415026228765
Energy: 0.9710222788266383
Energy: 1.0115415026198749
Energy: 0.9710222788262093
Energy: 1.0115415026215901
Energy: 0.9710222788279248
Energy: 1.0721303466201897
Energy: 1.0513337196757127
Energy: 1.0721303466223338
Energy: 1.0513337196727108
Energy: 1.072130346619761
Energy: 1.0513337196739974

minimum gb energy = 0.9522862621155324 eV
minimum distance =  2.23582163851203 Angstroms
sigma value = 57


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

Energy: 0.852146820603822
Energy: 0.8118253228023871
Energy: 0.852146820603822
Energy: 0.8118253228023871
Energy: 0.852146820603822
Energy: 0.8118253228023871
Energy: 0.7057998827833437
Energy: 0.80035157448338
Energy: 0.7057998827823675
Energy: 0.800351574482404
Energy: 0.7057998827833437
Energy: 0.800351574482404
Energy: 0.8527793672958275
Energy: 1.0832778446102758
Energy: 0.8527793672968037
Energy: 1.0832778446122282
Energy: 0.8527793672958275
Energy: 1.0832778446083233
Energy: 0.6197574220552776
Energy: 0.5783903266804498
Energy: 0.6197574220562537
Energy: 0.5783903266794737
Energy: 0.6197574220552776
Energy: 0.5783903266804498
Energy: 0.6831040208466161
Energy: 0.7062598386138653
Energy: 0.6831040208456399
Energy: 0.7062598386138653
Energy: 0.6831040208456399
Energy: 0.7062598386128892
Energy: 0.5785940727635397
Energy: 0.8540149906390021
Energy: 0.5785940727625635
Energy: 0.8540149906390021
Energy: 0.5785940727625635
Energy: 0.8540149906390021
Energy: 0.5784441185198784
Energy: 0.8482988374791528
Energy: 0.5784441185198784
Energy: 0.8482988374791528
Energy: 0.5784441185198784
Energy: 0.8482988374781766
Energy: 0.7058132296064449
Energy: 0.6830117589195187
Energy: 0.7058132296074211
Energy: 0.6830117589185426
Energy: 0.7058132296074211
Energy: 0.6830117589185426
Energy: 0.6187093191934979
Energy: 0.578395823391488
Energy: 0.6187093191934979
Energy: 0.578395823391488
Energy: 0.6187093191944741
Energy: 0.5783958233905118
Energy: 0.849204697257358
Energy: 0.9529813063492651
Energy: 0.849204697257358
Energy: 0.9529813063502411
Energy: 0.8492046972563818
Energy: 0.9529813063502411
Energy: 0.6828218453723547
Energy: 0.8012112912735081
Energy: 0.6828218453713786
Energy: 0.8012112912735081
Energy: 0.6828218453694263
Energy: 0.8012112912735081
Energy: 0.8521468206008934
Energy: 0.8118253227994586
Energy: 0.8521468206018696
Energy: 0.8118253227984824
Energy: 0.8521468206018696
Energy: 0.8118253227994586
Energy: 0.7057998827833437
Energy: 0.800351574482404
Energy: 0.7057998827833437
Energy: 0.80035157448338
Energy: 0.7057998827833437
Energy: 0.80035157448338
Energy: 0.8527793672987559
Energy: 1.083277844588844
Energy: 0.8527793672997321
Energy: 1.0832778445849394
Energy: 0.8527793672977799
Energy: 1.0832778445907965
Energy: 0.6197574220552776
Energy: 0.5783903266853306
Energy: 0.6197574220552776
Energy: 0.5783903266863069
Energy: 0.6197574220562537
Energy: 0.5783903266863069
Energy: 0.6831040208427115
Energy: 0.7062598386109368
Energy: 0.6831040208436876
Energy: 0.7062598386109368
Energy: 0.6831040208417353
Energy: 0.7062598386109368
Energy: 0.5785940727616317
Energy: 0.8540149906380259
Energy: 0.5785940727616317
Energy: 0.8540149906390021
Energy: 0.5785940727606554
Energy: 0.8540149906390021
Energy: 0.5784441185208546
Energy: 0.8482988374791528
Energy: 0.5784441185208546
Energy: 0.848298837480129
Energy: 0.5784441185208546
Energy: 0.848298837480129
Energy: 0.7058132296054688
Energy: 0.683011758921471
Energy: 0.7058132296044926
Energy: 0.683011758921471
Energy: 0.7058132296035164
Energy: 0.6830117589224473

minimum gb energy = 0.5783903266794737 eV
minimum distance =  2.42686276455378 Angstroms
sigma value = 11


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

Energy: 1.0012335535262629
Energy: 1.123204373640219
Energy: 1.0012335535269778
Energy: 1.123204373639504
Energy: 1.0012335535284083
Energy: 1.123204373639504
Energy: 1.1400764189787256
Energy: 1.0052049328668544
Energy: 1.1400764189794403
Energy: 1.0052049328661394
Energy: 1.1400764189780102
Energy: 1.0052049328661394
Energy: 1.1467851095909407
Energy: 1.260291221279953
Energy: 1.1467851095930857
Energy: 1.260291221279238
Energy: 1.1467851095930857
Energy: 1.2602912212820983
Energy: 1.2872667657933843
Energy: 0.9343919201970644
Energy: 1.287266765791954
Energy: 0.9343919201970644
Energy: 1.2872667657933843
Energy: 0.9343919201970644
Energy: 1.0986906707626531
Energy: 0.8945147037900523
Energy: 1.0986906707647983
Energy: 0.8945147037900523
Energy: 1.0986906707655135
Energy: 0.8945147037900523
Energy: 1.081400607501946
Energy: 0.921961862810732
Energy: 1.0814006075055214
Energy: 0.9219618628100169
Energy: 1.081400607503376
Energy: 0.9219618628114469
Energy: 0.9113685400678512
Energy: 0.9688070681648471
Energy: 0.911368540068566
Energy: 0.9688070681548362
Energy: 0.9113685400678512
Energy: 0.9688070681705677
Energy: 1.1413606242608632
Energy: 0.8785301899162818
Energy: 1.141360624263723
Energy: 0.8785301899162818
Energy: 1.141360624262293
Energy: 0.8785301899162818
Energy: 1.1383731113999849
Energy: 0.8787072605319254
Energy: 1.1383731113999849
Energy: 0.8787072605312103
Energy: 1.1383731113999849
Energy: 0.8787072605319254
Energy: 0.8988628712731515
Energy: 1.1888508584805138
Energy: 0.8988628712738665
Energy: 1.188850858481229
Energy: 0.8988628712731515
Energy: 1.188850858481944
Energy: 1.1179670379310584
Energy: 1.0968466227233984
Energy: 1.1179670379310584
Energy: 1.096846622719823
Energy: 1.1179670379324886
Energy: 1.0968466227241134
Energy: 1.005634408018161
Energy: 0.8972056653478971
Energy: 1.0056344080188762
Energy: 0.897205665347182
Energy: 1.005634408018161
Energy: 0.8972056653486123
Energy: 1.164100925279966
Energy: 0.935722813758756
Energy: 1.164100925281396
Energy: 0.935722813758756
Energy: 1.164100925279966
Energy: 0.9357228137594709
Energy: 1.1204134796613392
Energy: 1.2320408134154883
Energy: 1.1204134796634846
Energy: 1.2320408134147731
Energy: 1.1204134796627694
Energy: 1.232040813414058
Energy: 1.1605946562026555
Energy: 1.0360648652322488
Energy: 1.1605946562062306
Energy: 1.0360648652322488
Energy: 1.1605946562048006
Energy: 1.0360648652343292
Energy: 0.9634897530484098
Energy: 1.1479417352153756
Energy: 0.9634897530476947
Energy: 1.1479417352146608
Energy: 0.9634897530462647
Energy: 1.1479417352153756
Energy: 0.9749829162505659
Energy: 1.0022060665650157
Energy: 0.9749829162498508
Energy: 1.0022060665635855
Energy: 0.9749829162527109
Energy: 1.0022060665650157
Energy: 1.2714802878825444
Energy: 1.1408928983502942
Energy: 1.2714802878811142
Energy: 1.1408928983502942
Energy: 1.2714802878818292
Energy: 1.1408928983517244
Energy: 1.285944877228085
Energy: 0.93475851766503
Energy: 1.28594487722737
Energy: 0.93475851766503
Energy: 1.28594487722737
Energy: 0.93475851766503
Energy: 1.1012497195569244
Energy: 1.0337180451635146
Energy: 1.1012497195576394
Energy: 1.0337180451635146
Energy: 1.1012497195569244
Energy: 1.0337180451627994
Energy: 0.8955997447810974
Energy: 0.920860644024009
Energy: 0.8955997447825274
Energy: 0.9208606440211486
Energy: 0.8955997447825274
Energy: 0.920860644023294
Energy: 0.9536826399234457
Energy: 0.9771271906278234
Energy: 0.9536826399234457
Energy: 0.9771271906263934
Energy: 0.9536826399220155
Energy: 0.9771271906271085
Energy: 1.0266866519276936
Energy: 1.0580236596210388
Energy: 1.0266866519276936
Energy: 1.0580236596203236
Energy: 1.0266866519276936
Energy: 1.0580236596203236
Energy: 1.1375090224883828
Energy: 0.9990199121168958
Energy: 1.1375090224883828
Energy: 0.9990199121168958
Energy: 1.137509022489098
Energy: 0.9990199121161807
Energy: 0.8961469447364643
Energy: 1.1904534844243222
Energy: 0.8961469447364643
Energy: 1.1904534844257524
Energy: 0.8961469447378944
Energy: 1.190453484423607
Energy: 1.4630968274411595
Energy: 1.1011354868115444
Energy: 1.4630968274397294
Energy: 1.1011354868165497
Energy: 1.4630968274411595
Energy: 1.1011354868101142

minimum gb energy = 0.8785301899162818 eV
minimum distance =  2.25097642866503 Angstroms
sigma value = 41


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

Energy: 1.0925856680619441
Energy: 0.9729648853397188
Energy: 1.0925856680608172
Energy: 0.9729648853397188
Energy: 1.0925856680613806
Energy: 0.9729648853397188
Energy: 1.0502347207985032
Energy: 1.1945495451876234
Energy: 1.0502347208007572
Energy: 1.1945495451887507
Energy: 1.0502347207985032
Energy: 1.1945495451893142
Energy: 1.1435514967593963
Energy: 1.132062777622514
Energy: 1.143551496757142
Energy: 1.1320627776213867
Energy: 1.1435514967588327
Energy: 1.1320627776219505
Energy: 1.0298119721970682
Energy: 0.9728565809097992
Energy: 1.0298119721976318
Energy: 0.9728565809097992
Energy: 1.0298119721993226
Energy: 0.9728565809097992
Energy: 0.9491818423279176
Energy: 0.9978787555296752
Energy: 0.9491818423290449
Energy: 0.9978787555291115
Energy: 0.9491818423273541
Energy: 0.9978787555296752
Energy: 1.2231632005321817
Energy: 1.2099799839975174
Energy: 1.223163200533309
Energy: 1.209979983998081
Energy: 1.2231632005327453
Energy: 1.2099799839975174
Energy: 0.9837076832205637
Energy: 1.3035424176474122
Energy: 0.9837076832211272
Energy: 1.3035424176474122
Energy: 0.9837076832211272
Energy: 1.303542417647976
Energy: 0.960926804704685
Energy: 0.9725592641509688
Energy: 0.9609268047041213
Energy: 0.9725592641515324
Energy: 0.9609268047035576
Energy: 0.9725592641515324
Energy: 0.9502493610745829
Energy: 0.9836039435415874
Energy: 0.9502493610751463
Energy: 0.9836039435421509
Energy: 0.9502493610745829
Energy: 0.9836039435427144
Energy: 1.0305059696777117
Energy: 1.0550120452551282
Energy: 1.0305059696777117
Energy: 1.0550120452562555
Energy: 1.0305059696771481
Energy: 1.0550120452568192
Energy: 1.0334417347782847
Energy: 1.3023889915634719
Energy: 1.0334417347788483
Energy: 1.3023889915640354
Energy: 1.0334417347777212
Energy: 1.3023889915640354
Energy: 0.9426461395320065
Energy: 1.1733750002493972
Energy: 0.942646139529752
Energy: 1.1733750002499606
Energy: 0.94264613953257
Energy: 1.1733750002499606
Energy: 0.9612604652613248
Energy: 0.9717187266309343
Energy: 0.9612604652596338
Energy: 0.9717187266314979
Energy: 0.9612604652607611
Energy: 0.9717187266314979
Energy: 0.9354381698337846
Energy: 1.0661177861301718
Energy: 0.9354381698332209
Energy: 1.0661177861301718
Energy: 0.9354381698337846
Energy: 1.066117786131863
Energy: 1.0319836232403397
Energy: 1.210811248331255
Energy: 1.0319836232375215
Energy: 1.2108112483318187
Energy: 1.0319836232414665
Energy: 1.2108112483318187
Energy: 0.9348797056223997
Energy: 1.2811203936622544
Energy: 0.9348797056229634
Energy: 1.2811203936616908
Energy: 0.9348797056240906
Energy: 1.1718429065213354
Energy: 0.976521643844353
Energy: 0.9718125900812025
Energy: 0.9765216438454802
Energy: 0.9718125900823298
Energy: 0.9765216438449167
Energy: 0.9718125900817661
Energy: 0.9999747560761342
Energy: 1.3741179322485058
Energy: 0.999974756083461
Energy: 1.3741179322473784
Energy: 0.9999747560783886
Energy: 1.3741179322473784
Energy: 1.0487118153582082
Energy: 1.1944855873620366
Energy: 1.0487118153582082
Energy: 1.1944855873609095
Energy: 1.0487118153576445
Energy: 1.1944855873609095
Energy: 1.0298184910532548
Energy: 0.9788015072698363
Energy: 1.0298184910532548
Energy: 0.9788015072664547
Energy: 1.0298184910521277
Energy: 0.9788015072642003
Energy: 0.950190871833037
Energy: 1.1518933220815064
Energy: 0.9501908718319099
Energy: 1.1518933220815064
Energy: 0.9501908718352402
Energy: 1.1518933220815064
Energy: 1.02461067101975
Energy: 1.3132572728335998
Energy: 1.024610671015241
Energy: 1.3132572728335998
Energy: 1.0246106710203133
Energy: 1.3132572728335998
Energy: 1.0291111414715888
Energy: 0.9729405462823942
Energy: 1.0291111414693341
Energy: 0.9729405462829577
Energy: 1.0291111414738432
Energy: 0.9729405462823942
Energy: 0.9349582641865416
Energy: 1.1488045914636547
Energy: 0.9349582641865416
Energy: 1.1488045914630909
Energy: 0.9349582641859782
Energy: 1.1488045914636547
Energy: 0.9339910029434156
Energy: 1.3481038290400948
Energy: 0.9339910029428521
Energy: 1.3481038290400948
Energy: 0.9339910029445427
Energy: 1.348103829039531
Energy: 0.9801910809402035
Energy: 1.0604625432323875
Energy: 0.9801910809424578
Energy: 1.0604625432323875
Energy: 0.9801910809418941
Energy: 1.0604625432323875
Energy: 0.9595365831207285
Energy: 0.9727319057970268
Energy: 0.959536583119038
Energy: 0.9727319057970268
Energy: 0.9595365831212922
Energy: 0.9727319057970268
Energy: 0.9506050066557803
Energy: 1.1339091460701014
Energy: 0.9506050066574712
Energy: 1.1339091460701014
Energy: 0.9506050066557803
Energy: 1.1339091460701014
Energy: 1.035122631313628
Energy: 1.200779011792341
Energy: 1.0351226313147552
Energy: 1.200779011792341
Energy: 1.0351226313125008
Energy: 1.2007790117940316
Energy: 1.116784785056218
Energy: 1.0206418704368947
Energy: 1.1167847850556543
Energy: 1.0206418704397127
Energy: 1.1167847850539636
Energy: 1.0206418704374582
Energy: 0.9401829465780431
Energy: 1.1755525200010806
Energy: 0.9401829465791702
Energy: 1.1755525200010806
Energy: 0.9401829465797339
Energy: 1.1755525200010806
Energy: 0.9636020263441031
Energy: 0.9849766520267194
Energy: 0.9636020263452303
Energy: 0.9849766520261557
Energy: 0.963602026342976
Energy: 0.9849766520267194
Energy: 0.9338751157539995
Energy: 1.1726896751651161
Energy: 0.9338751157534362
Energy: 1.1726896751651161
Energy: 0.9338751157528725
Energy: 1.1726896751656797

minimum gb energy = 0.9338751157528725 eV
minimum distance =  2.29302585498891 Angstroms
sigma value = 33


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

Energy: 1.0945357504575264
Energy: 1.0169384903316678
Energy: 1.0945357504551532
Energy: 1.0169384903336096
Energy: 1.0945357504570947
Energy: 1.0169384903328185
Energy: 1.1691248462505524
Energy: 1.0005497965189762
Energy: 1.1691248462461654
Energy: 1.0005497965181853
Energy: 1.1691248462493296
Energy: 1.0005497965189762
Energy: 1.078803824549626
Energy: 1.1624022987895595
Energy: 1.0788038245499856
Energy: 1.1624022987800666
Energy: 1.078803824551999
Energy: 1.1624022987852447
Energy: 1.1025916975926529
Energy: 1.011059562673384
Energy: 1.1025916975926529
Energy: 1.0110595626718017
Energy: 1.1025916975942351
Energy: 1.0110595626718017
Energy: 1.0392587776257234
Energy: 1.1031767104269872
Energy: 1.039258777624141
Energy: 1.103176710424614
Energy: 1.0392587776265143
Energy: 1.1031767104261962
Energy: 1.3838594491191258
Energy: 1.0245879639573994
Energy: 1.3838594491207077
Energy: 1.024587963957831
Energy: 1.3838594491207077
Energy: 1.0245879639581903
Energy: 1.0413900245009609
Energy: 1.1225577814639238
Energy: 1.0413900244998102
Energy: 1.122557781466297
Energy: 1.0413900245009609
Energy: 1.1225577814651464
Energy: 1.082687957951513
Energy: 1.1019871089584239
Energy: 1.0826879579510815
Energy: 1.101987108957633
Energy: 1.0826879579546773
Energy: 1.1019871089587836
Energy: 1.1267521793972008
Energy: 1.0338672015278467
Energy: 1.1267521793984234
Energy: 1.0338672015282782
Energy: 1.1267521794023787
Energy: 1.0338672015278467
Energy: 1.4326823508903348
Energy: 1.0179780789423907
Energy: 1.4326823508891842
Energy: 1.017978078942822
Energy: 1.432682350886811
Energy: 1.0179780789423907
Energy: 1.0807386887496884
Energy: 1.084022920169757
Energy: 1.0807386887469554
Energy: 1.0840229201685345
Energy: 1.080738688746524
Energy: 1.0840229201689662
Energy: 1.6734385720288754
Energy: 1.011127203484087
Energy: 1.6734385720272933
Energy: 1.011127203484878
Energy: 1.6734385720277245
Energy: 1.011127203484087
Energy: 1.034893631231428
Energy: 1.1296467375616024
Energy: 1.0348936312302774
Energy: 1.1296467374908377
Energy: 1.0348936312318593
Energy: 1.129646737568722
Energy: 1.0977510112192634
Energy: 1.0791565362745643
Energy: 1.0977510112173217
Energy: 1.0791565362734137
Energy: 1.0977510112157398
Energy: 1.0791565362726223
Energy: 1.0930203890029457
Energy: 1.0450432748008542
Energy: 1.0930203889997814
Energy: 1.0450432748020049
Energy: 1.0930203889994217
Energy: 1.0450432748012137
Energy: 1.026486243005063
Energy: 1.386234810515754
Energy: 1.0264862430038404
Energy: 1.386234810515754
Energy: 1.0264862430022583
Energy: 1.3862348105165452
Energy: 1.3966623523962174
Energy: 1.0211541492782394
Energy: 1.3966623523982309
Energy: 1.0211541492778797
Energy: 1.3966623524080832
Energy: 1.0211541492770888
Energy: 1.0082064244334015
Energy: 1.0979907088379643
Energy: 1.0082064244341926
Energy: 1.0979907088355914
Energy: 1.0082064244306688
Energy: 1.0979907088395466
Energy: 1.1609738689712716
Energy: 1.0782300348346454
Energy: 1.1609738689712716
Energy: 1.0782300348338543
Energy: 1.1609738689704807
Energy: 1.0782300348318408
Energy: 1.3903975265245143
Energy: 1.0372829971495838
Energy: 1.3903975265253055
Energy: 1.0372829971495838
Energy: 1.3903975265280384
Energy: 1.0372829971487925
Energy: 1.0204689522208221
Energy: 1.099540961426857
Energy: 1.0204689522275823
Energy: 1.099540961426857
Energy: 1.020468952222045
Energy: 1.099540961426857
Energy: 0.9983781072214117
Energy: 1.133158163924187
Energy: 0.9983781072241446
Energy: 1.1331581639245465
Energy: 0.9983781072241446
Energy: 1.1331581639213824
Energy: 1.0934017208493167
Energy: 0.9982163822663498
Energy: 1.0934017208493167
Energy: 0.9982163822659184
Energy: 1.0934017208505393
Energy: 0.9982163822663498
Energy: 1.0140837158396527
Energy: 1.1102390446358252
Energy: 1.0140837158384302
Energy: 1.1102390446381982
Energy: 1.0140837158372795
Energy: 1.1102390446362567
Energy: 1.1031842217193997
Energy: 1.0213936903938523
Energy: 1.1031842217122803
Energy: 1.021393690395003
Energy: 1.103184221709116
Energy: 1.0213936903962257
Energy: 1.0245917310311228
Energy: 1.0939564198881035
Energy: 1.024591731031482
Energy: 1.093956419889254
Energy: 1.0245917310311228
Energy: 1.0939564198888942
Energy: 1.1327857118092248
Energy: 1.0400928401394531
Energy: 1.132785711810016
Energy: 1.0400928401374394
Energy: 1.1327857118108071
Energy: 1.0400928401398126
Energy: 1.0875895496558186
Energy: 1.0159156820801127
Energy: 1.0875895496558186
Energy: 1.0159156820777397
Energy: 1.0875895496574004
Energy: 1.015915682079753
Energy: 1.0361275465241455
Energy: 1.127536035143392
Energy: 1.0361275465241455
Energy: 1.1275360351438235
Energy: 1.0361275465241455
Energy: 1.127536035143392
Energy: 1.0187311965171482
Energy: 1.431977973427466
Energy: 1.0187311965187302
Energy: 1.4319779734282572
Energy: 1.0187311965175798
Energy: 1.4319779734282572
Energy: 1.0612331544707658
Energy: 1.0096165611898085
Energy: 1.0612331544735705
Energy: 1.0096165611882264
Energy: 1.061233154474721
Energy: 1.009616561189449
Energy: 1.0141761936227933
Energy: 1.3956521969343145
Energy: 1.0141761936251668
Energy: 1.3956521969426567
Energy: 1.014176193622362
Energy: 1.395652196936688
Energy: 1.3903885735582429
Energy: 1.03162861861976
Energy: 1.3903885735621986
Energy: 1.0316286186201196
Energy: 1.3903885735661536
Energy: 1.031628618618969
Energy: 1.0787819506684804
Energy: 1.0937247317153813
Energy: 1.0787819506681207
Energy: 1.0937247317153813
Energy: 1.0787819506700624
Energy: 1.0937247317153813
Energy: 1.0785830263410134
Energy: 1.0937377963238262
Energy: 1.0785830263378489
Energy: 1.0937377963238262
Energy: 1.0785830263433864
Energy: 1.0937377963242578
Energy: 1.390371540999038
Energy: 1.0317277019804962
Energy: 1.3903715409986064
Energy: 1.0317277019801365
Energy: 1.390371540998247
Energy: 1.0317277019793456
Energy: 1.0148778773573293
Energy: 1.3974189861612896
Energy: 1.014877877359271
Energy: 1.3974189861739466
Energy: 1.0148778773604934
Energy: 1.3974189861577657
Energy: 1.0608239709029694
Energy: 1.009295649887146
Energy: 1.0608239709029694
Energy: 1.009295649887937
Energy: 1.0608239709053424
Energy: 1.009295649887937
Energy: 1.0187835715991638
Energy: 1.4319023160151918
Energy: 1.0187835716019684
Energy: 1.4319023160136095
Energy: 1.0187835716007458
Energy: 1.431902316014832
Energy: 1.0361381975853934
Energy: 1.127882266543733
Energy: 1.036138197585753
Energy: 1.1278822665508526
Energy: 1.0361381975869755
Energy: 1.1278822665445238
Energy: 1.0875777248888698
Energy: 1.0159198477763496
Energy: 1.0875777248872878
Energy: 1.01591984777599
Energy: 1.0875777248880791
Energy: 1.0159198477751987
Energy: 1.1326906094057425
Energy: 1.0400573478473627
Energy: 1.1326906094057425
Energy: 1.0400573478473627
Energy: 1.1326906094057425
Energy: 1.0400573478473627
Energy: 1.0246709414250343
Energy: 1.093723370835639
Energy: 1.0246709414269761
Energy: 1.09372337083643
Energy: 1.024670941426185
Energy: 1.0937233708376528
Energy: 1.103356923798216
Energy: 1.0214761847619926
Energy: 1.1033569237974248
Energy: 1.0214761847619926
Energy: 1.1033569237939012
Energy: 1.0214761847623526
Energy: 1.0140506825496707
Energy: 1.1099993997521855
Energy: 1.014050682554417
Energy: 1.1099993997506032
Energy: 1.014050682552044
Energy: 1.109999399753408
Energy: 1.0931422954809638
Energy: 1.0065779688906806
Energy: 1.0931422954809638
Energy: 1.0065779688906806
Energy: 1.093142295482546
Energy: 1.006577968891472
Energy: 0.9983517021829756
Energy: 1.1323580192542642
Energy: 0.9983517021821844
Energy: 1.132358019252682
Energy: 0.9983517021845576
Energy: 1.1323580192534732

minimum gb energy = 0.9982163822659184 eV
minimum distance =  2.2914313931516 Angstroms
sigma value = 67


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

Energy: 1.1697743227510338
Energy: 1.0798210683801515
Energy: 1.1697743227510338
Energy: 1.0798210683801515
Energy: 1.1697743227510338
Energy: 1.0798210683801515
Energy: 1.1489381635933542
Energy: 1.0551707476220633
Energy: 1.1489381635933542
Energy: 1.0551707476220633
Energy: 1.1489381635933542
Energy: 1.0551707476220633
Energy: 1.043384594780551
Energy: 1.2552816047504187
Energy: 1.043384594759403
Energy: 1.2552816047504187
Energy: 1.0433845947831946
Energy: 1.2552816047504187
Energy: 1.1489475690141986
Energy: 1.0553729874037199
Energy: 1.1489475690141986
Energy: 1.0553729874037199
Energy: 1.1489475690141986
Energy: 1.0553729874037199
Energy: 1.1697743227483903
Energy: 1.0798210683801515
Energy: 1.1697743227483903
Energy: 1.0798210683801515
Energy: 1.1697743227483903
Energy: 1.0798210683801515
Energy: 1.1489381635959977
Energy: 1.0551707476273502
Energy: 1.1489381635959977
Energy: 1.0551707476273502
Energy: 1.1489381635959977
Energy: 1.0551707476273502
Energy: 1.0433845947831946
Energy: 1.2552816047504187
Energy: 1.0433845947620464
Energy: 1.2552816047504187
Energy: 1.0433845947779075
Energy: 1.2552816047504187

minimum gb energy = 1.043384594759403 eV
minimum distance =  2.29110610747267 Angstroms
sigma value = 3


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

Energy: 1.4001300511002344
Energy: 1.2539727495871968
Energy: 1.4001300511002344
Energy: 1.2539727495871968
Energy: 1.4001300511002344
Energy: 1.2539727495871968
Energy: 1.2489390457215779
Energy: 1.1852507227925138
Energy: 1.2489390457323697
Energy: 1.1852507227925138
Energy: 1.2489390457251752
Energy: 1.1852507227925138
Energy: 1.2179771636789505
Energy: 1.3746797119924623
Energy: 1.2179771636789505
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Energy: 1.2793676435011865
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Energy: 1.3044973468881949
Energy: 1.3364611259636614
Energy: 1.232718676286876
Energy: 1.3364611259636614
Energy: 1.232718676286876
Energy: 1.3364611259636614
Energy: 1.232718676286876
Energy: 1.2033883424039369
Energy: 1.33774080106742
Energy: 1.2033883424075342
Energy: 1.3377408010746148
Energy: 1.2033883424039369
Energy: 1.3377408010746148
Energy: 1.3850656059390254
Energy: 1.190209494028593
Energy: 1.3850656059354283
Energy: 1.190209494028593
Energy: 1.3850656059390254
Energy: 1.190209494028593
Energy: 1.2165726814234465
Energy: 1.2440086455977695
Energy: 1.2165726814234465
Energy: 1.2440086456552613
Energy: 1.2165726814234465
Energy: 1.2440086456552613
Energy: 1.3116346905789296
Energy: 1.1754016400375435
Energy: 1.3116346905753322
Energy: 1.1754016400375435
Energy: 1.3116346905861243
Energy: 1.1754016400339462
Energy: 1.274615669534554
Energy: 1.2590192933042128
Energy: 1.2746156695309567
Energy: 1.2590192933006155
Energy: 1.2746156695309567
Energy: 1.2590192933042128
Energy: 1.3057789863075793
Energy: 1.207853206730632
Energy: 1.3057789863075793
Energy: 1.207853206730632
Energy: 1.3057789863075793
Energy: 1.207853206730632
Energy: 1.2753020784504077
Energy: 1.241880069476289
Energy: 1.275302078454005
Energy: 1.2418800694726917
Energy: 1.2753020784504077
Energy: 1.241880069476289
Energy: 1.2877482236983964
Energy: 1.229888578364046
Energy: 1.2877482237019937
Energy: 1.229888578364046
Energy: 1.2877482236983964
Energy: 1.229888578353254
Energy: 1.2033246889526552
Energy: 1.3145459761658949
Energy: 1.2033246889526552
Energy: 1.3145459761694924
Energy: 1.2033246889526552
Energy: 1.3145459761694924
Energy: 1.2393634080065838
Energy: 1.2400537124922126
Energy: 1.2393634080029865
Energy: 1.2400537124922126
Energy: 1.2393634080029865
Energy: 1.2400537124886153
Energy: 1.2697215125012087
Energy: 1.2428513072330487
Energy: 1.269721512504806
Energy: 1.2428513072330487
Energy: 1.2697215125012087
Energy: 1.2428513072330487

minimum gb energy = 1.1626693327103204 eV
minimum distance =  2.23015591151014 Angstroms
sigma value = 81


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

Energy: 1.354192981727761
Energy: 1.2419189191542743
Energy: 1.354192981727761
Energy: 1.2419189191542743
Energy: 1.3541929817267735
Energy: 1.2419189191542743
Energy: 1.274741369791823
Energy: 1.2664452018526113
Energy: 1.2747413697888605
Energy: 1.2664452018521175
Energy: 1.2747413697908356
Energy: 1.2664452018521175
Energy: 1.3467018049734636
Energy: 1.1604423550212444
Energy: 1.3467018049719823
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Energy: 1.3467018049724762
Energy: 1.160442355020257
Energy: 1.2816446529047711
Energy: 1.2809307762947193
Energy: 1.28164465290522
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Energy: 1.248274466325822
Energy: 1.311456993153729
Energy: 1.2482744663253282
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Energy: 1.2482744663248346
Energy: 1.198592735302774
Energy: 1.1569167775100981
Energy: 1.1985927353022805
Energy: 1.1569167775100981
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Energy: 1.183486150570496
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Energy: 1.2489108263725581
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Energy: 1.3172695943677009
Energy: 1.2489108263720643
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Energy: 1.1571301611210134
Energy: 1.3042640791075693
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Energy: 1.3042640791060882
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Energy: 1.28052956890969
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Energy: 1.3654446209616304
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Energy: 1.3654446209571869
Energy: 1.273210027290136
Energy: 1.31512544317115
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Energy: 1.3151254431706565
Energy: 1.2179205912532223
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Energy: 1.2179205912522348
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Energy: 1.2179205912512474
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Energy: 1.217473895997558
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Energy: 1.1152599552700617
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Energy: 1.2917656946068614
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Energy: 1.317848085389064
Energy: 1.3336586446802787
Energy: 1.317848085396425
Energy: 1.33365864468176
Energy: 1.317848085390545
Energy: 1.3336586446827474
Energy: 1.3007818558626587
Energy: 1.4365757511728563
Energy: 1.3007818558626587
Energy: 1.4365757511738437
Energy: 1.3007818558631525
Energy: 1.4365757511733501
Energy: 1.1486780690839882
Energy: 1.2822821485883744
Energy: 1.1486780690849756
Energy: 1.282282148588868
Energy: 1.1486780690844818
Energy: 1.2822821485878806
Energy: 1.2553425854482805
Energy: 1.157185074630613
Energy: 1.2553425854546991
Energy: 1.1571850746311068
Energy: 1.2553425854537117
Energy: 1.1571850746316004
Energy: 1.265798927442468
Energy: 1.2812944627545146
Energy: 1.2657989274419743
Energy: 1.2812944627535272
Energy: 1.265798927442468
Energy: 1.2812944627530336
Energy: 1.1592151914026385
Energy: 1.1609388044756648
Energy: 1.159215191403626
Energy: 1.1609388044751712
Energy: 1.159215191402145
Energy: 1.1609388044756648
Energy: 1.2837487148760676
Energy: 1.3000240186177805
Energy: 1.2837487148780427
Energy: 1.3000240186167928
Energy: 1.2837487148780427
Energy: 1.300024018618768
Energy: 1.2482186513964395
Energy: 1.3124468017574256
Energy: 1.2482186513989082
Energy: 1.3124468017574256
Energy: 1.2482186513979208
Energy: 1.3124468017574256
Energy: 1.156263832227977
Energy: 1.2017455114746904
Energy: 1.156263832226496
Energy: 1.2017455114746904
Energy: 1.1562638322269896
Energy: 1.201745511470247
Energy: 1.1575293508245632
Energy: 1.1297075721455294
Energy: 1.1575293508240696
Energy: 1.1297075721450358
Energy: 1.1575293508250573
Energy: 1.1297075721460232
Energy: 1.210383518671982
Energy: 1.4789195397794472
Energy: 1.2103835186739569
Energy: 1.4789195397794472
Energy: 1.2103835186769194
Energy: 1.4789195397794472
Energy: 1.384265740961237
Energy: 1.279058090499343
Energy: 1.3842657409597556
Energy: 1.2790580904953934
Energy: 1.3842657409622245
Energy: 1.2790580904963806
Energy: 1.2660239938705764
Energy: 1.276493798033637
Energy: 1.2660239938720577
Energy: 1.2764937980331432
Energy: 1.2660239938740325
Energy: 1.2764937980331432
Energy: 1.1696268587513514
Energy: 1.1608492096206238
Energy: 1.169626858751845
Energy: 1.1608492096216112
Energy: 1.169626858751845
Energy: 1.160849209622105

minimum gb energy = 1.1152599552700617 eV
minimum distance =  2.29236883805073 Angstroms
sigma value = 43


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

Energy: 1.4199106835606157
Energy: 1.262049425526319
Energy: 1.4199106835606157
Energy: 1.2620494255257126
Energy: 1.4199106835587962
Energy: 1.2620494255257126
Energy: 1.269738194509706
Energy: 1.1779630752678438
Energy: 1.269738194508493
Energy: 1.1779630752672374
Energy: 1.2697381945090995
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Energy: 1.2220682590291376
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Energy: 1.3203007087241492
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Energy: 1.2120450903525255
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Energy: 1.2652664265985745
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Energy: 1.2917652217750406
Energy: 1.2275740767398688
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Energy: 1.3042958007612064
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Energy: 1.3553370826885158
Energy: 1.1462243238230916
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Energy: 1.2099843696110157
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Energy: 1.284836430547147
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Energy: 1.2848364305477533
Energy: 1.2398370827680114
Energy: 1.28483643054836
Energy: 1.3234167903059677
Energy: 1.1781932855134192
Energy: 1.3234167903053615
Energy: 1.1781932855128128
Energy: 1.323416790306574
Energy: 1.1781932855134192
Energy: 1.3269786146844567
Energy: 1.2270757988769327
Energy: 1.3269786146850633
Energy: 1.2270757988769327
Energy: 1.32697861468567
Energy: 1.2270757988775391
Energy: 1.3269473482196859
Energy: 1.2337681808684595
Energy: 1.3269473482190792
Energy: 1.2337681808684595
Energy: 1.3269473482208987
Energy: 1.2337681808684595
Energy: 1.3209083070923875
Energy: 1.1799317595160135
Energy: 1.3209083070960261
Energy: 1.179931759515407
Energy: 1.3209083070972392
Energy: 1.1799317595166199
Energy: 1.2408021036112036
Energy: 1.3003230573467766
Energy: 1.24080210361181
Energy: 1.3003230573461704
Energy: 1.24080210361181
Energy: 1.3003230573467766
Energy: 1.351092430838544
Energy: 1.2569905306083597
Energy: 1.3510924308391505
Energy: 1.2569905306089662
Energy: 1.3510924308391505
Energy: 1.2569905306083597
Energy: 1.1463221761247286
Energy: 1.2894655591654471
Energy: 1.1463221761247286
Energy: 1.2894655591660535
Energy: 1.1463221761253353
Energy: 1.2894655591660535
Energy: 1.3020864713654225
Energy: 1.265857364487036
Energy: 1.3020864713642097
Energy: 1.265857364488855
Energy: 1.302086471366029
Energy: 1.2658573644882487
Energy: 1.2278167499638868
Energy: 1.2458018544759326
Energy: 1.2278167499632804
Energy: 1.2458018544759326
Energy: 1.2278167499644932
Energy: 1.2458018544759326
Energy: 1.3581162793330712
Energy: 1.2533253332197576
Energy: 1.358116279334284
Energy: 1.2533253332209706
Energy: 1.3581162793318582
Energy: 1.2533253332203642
Energy: 1.245707293457086
Energy: 1.3375211528918822
Energy: 1.2457072934576925
Energy: 1.3375211528937017
Energy: 1.245707293455873
Energy: 1.3375211528918822
Energy: 1.34898908136256
Energy: 1.2529491513900357
Energy: 1.3489890813528571
Energy: 1.2529491513900357
Energy: 1.348989081354676
Energy: 1.2529491513900357
Energy: 1.227701800770236
Energy: 1.2970507599263177
Energy: 1.2277018007696296
Energy: 1.297050759925711
Energy: 1.2277018007696296
Energy: 1.297050759925711
Energy: 1.2720364952489946
Energy: 1.2852268151719868
Energy: 1.2720364952489946
Energy: 1.2852268151725934
Energy: 1.272036495248388
Energy: 1.2852268151725934
Energy: 1.298581852135796
Energy: 1.2656459019009212
Energy: 1.2985818521364025
Energy: 1.2656459019015278
Energy: 1.2985818521364025
Energy: 1.2656459019015278

minimum gb energy = 1.1462243238230916 eV
minimum distance =  2.25389361557212 Angstroms
sigma value = 57


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

Energy: 1.3145905926670312
Energy: 1.1553315927254013
Energy: 1.3145905926662458
Energy: 1.1553315927254013
Energy: 1.3145905926686015
Energy: 1.1553315927254013
Energy: 1.2375282975860507
Energy: 1.1101036307463734
Energy: 1.2375282975852655
Energy: 1.1101036307455885
Energy: 1.2375282975868358
Energy: 1.1101036307455885
Energy: 1.2554517394818456
Energy: 1.3525281011959345
Energy: 1.2554517394818456
Energy: 1.3525281011967196
Energy: 1.2554517394818456
Energy: 1.3525281011967196
Energy: 1.2345171959748371
Energy: 1.2512186474299969
Energy: 1.2345171959732666
Energy: 1.2512186474292115
Energy: 1.2345171959732666
Energy: 1.251218647430782
Energy: 1.3227484092662394
Energy: 1.2489799067187437
Energy: 1.3227484092638837
Energy: 1.2489799067210996
Energy: 1.3227484092654542
Energy: 1.248979906719529
Energy: 1.2527682830940936
Energy: 1.2187856933263508
Energy: 1.2527682830940936
Energy: 1.2187856933255659
Energy: 1.2527682830909526
Energy: 1.2187856933255659
Energy: 1.2251096355252515
Energy: 1.3057220956687488
Energy: 1.2251096355221107
Energy: 1.3057220956687488
Energy: 1.2251096355244662
Energy: 1.3057220956687488
Energy: 1.3244088172879145
Energy: 1.156926671937933
Energy: 1.3244088172863437
Energy: 1.1569266719395033
Energy: 1.3244088172879145
Energy: 1.156926671937933
Energy: 1.2414810229131958
Energy: 1.1082930478085777
Energy: 1.2414810229179072
Energy: 1.1082930478077926
Energy: 1.2414810229139808
Energy: 1.1082930478085777
Energy: 1.087968037945064
Energy: 1.237567067129672
Energy: 1.0879680379442789
Energy: 1.237567067128887
Energy: 1.087968037945064
Energy: 1.237567067129672
Energy: 1.2248206129585433
Energy: 1.250521665309857
Energy: 1.2248206129593284
Energy: 1.2505216653090716
Energy: 1.2248206129577581
Energy: 1.2505216653090716
Energy: 1.3576439840105639
Energy: 1.3041527589196364
Energy: 1.3576439840105639
Energy: 1.304152758921207
Energy: 1.3576439840105639
Energy: 1.3041527589204216
Energy: 1.2367305518307232
Energy: 1.1087665244575722
Energy: 1.236730551833079
Energy: 1.108766524456787
Energy: 1.2367305518322935
Energy: 1.1087665244575722
Energy: 1.312652297769958
Energy: 1.1152910354105587
Energy: 1.312652297769958
Energy: 1.1152910354113441
Energy: 1.3126522977691728
Energy: 1.1152910354113441
Energy: 1.2052905828218308
Energy: 1.1146437583861357
Energy: 1.20529058281869
Energy: 1.1146437583861357
Energy: 1.2052905828218308
Energy: 1.1146437583877062
Energy: 1.241665144531316
Energy: 1.1943091657503182
Energy: 1.2416651445203226
Energy: 1.1943091657511034
Energy: 1.2416651445258193
Energy: 1.1943091657503182
Energy: 1.0840837693636447
Energy: 1.220418221342924
Energy: 1.084083769365215
Energy: 1.2204182213240782
Energy: 1.0840837693628593
Energy: 1.2204182213413535
Energy: 1.2270912549798325
Energy: 1.2380607343571688
Energy: 1.2270912549774764
Energy: 1.2380607343571688
Energy: 1.2270912549743358
Energy: 1.2380607343571688
Energy: 1.084125350243373
Energy: 1.220538774682906
Energy: 1.0841253502441581
Energy: 1.2205387747080334
Energy: 1.0841253502449433
Energy: 1.2205387746805505
Energy: 1.2426454891310248
Energy: 1.194345686187741
Energy: 1.2426454891373067
Energy: 1.194345686190882
Energy: 1.2426454891325953
Energy: 1.1943456861885264
Energy: 1.205468755406504
Energy: 1.1128980593241073
Energy: 1.2054687554088597
Energy: 1.1128980593233222
Energy: 1.2054687554072891
Energy: 1.1128980593241073
Energy: 1.3127286717182831
Energy: 1.1411489859744774
Energy: 1.3127286717190685
Energy: 1.1411489859744774
Energy: 1.312728671717498
Energy: 1.1411489859736925
Energy: 1.2368161637669504
Energy: 1.1087843497075052
Energy: 1.2368161637685207
Energy: 1.1087843497067202
Energy: 1.2368161637677355
Energy: 1.1087843497020087
Energy: 1.3577697582160537
Energy: 1.3041198818092778
Energy: 1.3577697582176238
Energy: 1.3041198818116337
Energy: 1.3577697582168387
Energy: 1.304119881806137

minimum gb energy = 1.0840837693628593 eV
minimum distance =  2.27705274856326 Angstroms
sigma value = 17


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

Energy: 1.2126425889176347
Energy: 1.0938806213184693
Energy: 1.2126425889176347
Energy: 1.0938806213184693
Energy: 1.212642588916524
Energy: 1.0938806213184693
Energy: 1.0471124830198195
Energy: 1.0447670253740446
Energy: 1.047112483018709
Energy: 1.0447670253740446
Energy: 1.04711248302093
Energy: 1.0447670253740446
Energy: 1.2330175414181619
Energy: 1.2328709744567647
Energy: 1.2330175414181619
Energy: 1.2328709744567647
Energy: 1.2330175414181619
Energy: 1.2328709744567647
Energy: 0.9785761287611319
Energy: 1.195663884677398
Energy: 0.9785761287600213
Energy: 1.1956638846762877
Energy: 0.9785761287622423
Energy: 1.1956638846762877
Energy: 1.179401290697838
Energy: 1.140172594928217
Energy: 1.179401290697838
Energy: 1.140172594928217
Energy: 1.1794012906989482
Energy: 1.140172594928217
Energy: 1.0857279062112732
Energy: 1.171897983003766
Energy: 1.0857279062112732
Energy: 1.1718979830048764
Energy: 1.0857279062112732
Energy: 1.1718979830059868
Energy: 1.109918924224593
Energy: 1.0369214080704314
Energy: 1.1099189242234826
Energy: 1.0369214080704314
Energy: 1.109918924224593
Energy: 1.0369214080704314
Energy: 0.9784155877825302
Energy: 1.1830604585214108
Energy: 0.9784155877814198
Energy: 1.1830604585225213
Energy: 0.9784155877803092
Energy: 1.1830604585214108
Energy: 1.1445000508319887
Energy: 1.0437836148772732
Energy: 1.1445000508330991
Energy: 1.0437836148783837
Energy: 1.1445000508319887
Energy: 1.0437836148772732
Energy: 1.1179085266301654
Energy: 1.0490954075645267
Energy: 1.1179085266301654
Energy: 1.0490954075645267
Energy: 1.1179085266301654
Energy: 1.0490954075645267
Energy: 1.1009144084230358
Energy: 1.1436392122473402
Energy: 1.1009144084230358
Energy: 1.1436392122473402
Energy: 1.1009144084230358
Energy: 1.1436392122473402
Energy: 1.1268448052920725
Energy: 1.047518418609856
Energy: 1.1268448052920725
Energy: 1.047518418609856
Energy: 1.1268448052920725
Energy: 1.0475184186109665
Energy: 0.9785798932294857
Energy: 1.1737294379895709
Energy: 0.9785798932294857
Energy: 1.1737294379895709
Energy: 0.978579893228375
Energy: 1.1737294379895709
Energy: 1.1174686796719722
Energy: 1.1454198727649336
Energy: 1.117468679669751
Energy: 1.1454198727649336
Energy: 1.1174686796708617
Energy: 1.1454198727649336
Energy: 1.084533077579731
Energy: 1.240653131568495
Energy: 1.0845330775808417
Energy: 1.240653131568495
Energy: 1.084533077581952
Energy: 1.240653131568495
Energy: 1.085341179165901
Energy: 1.1689593709711195
Energy: 1.0853411791670116
Energy: 1.1689593709711195
Energy: 1.0853411791647904
Energy: 1.1689593709711195
Energy: 1.1168703826758073
Energy: 1.1474722953425807
Energy: 1.116870382674697
Energy: 1.1474722953425807
Energy: 1.1168703826735866
Energy: 1.1474722953425807

minimum gb energy = 0.9784155877803092 eV
minimum distance =  2.22051463021184 Angstroms
sigma value = 17


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

Energy: 1.0968396836972043
Energy: 0.9801445639467633
Energy: 1.096839683697633
Energy: 0.9801445639471921
Energy: 1.0968396836972043
Energy: 0.9801445639471921
Energy: 0.9874931654771082
Energy: 0.95091075531973
Energy: 0.9874931654736775
Energy: 0.9509107553210165
Energy: 0.9874931654783946
Energy: 0.9509107553205877
Energy: 1.0861049202107258
Energy: 1.0579017089330995
Energy: 1.0861049202111548
Energy: 1.0579017089322418
Energy: 1.086104920208153
Energy: 1.0579017089305265
Energy: 0.9160607585644931
Energy: 1.028943408697948
Energy: 0.9160607585623491
Energy: 1.028943408697948
Energy: 0.9160607585644931
Energy: 1.0289434086988059
Energy: 1.0878804157840172
Energy: 0.9470163429564697
Energy: 1.0878804157857327
Energy: 0.9470163429556121
Energy: 1.0878804157848752
Energy: 0.9470163429564697
Energy: 1.0227476206348614
Energy: 0.9588936568836622
Energy: 1.022747620638721
Energy: 0.9588936568832335
Energy: 1.0227476206340038
Energy: 0.9588936568836622
Energy: 0.9891085579470771
Energy: 0.9680654986930072
Energy: 0.9891085579492214
Energy: 0.9680654986921495
Energy: 0.989108557939787
Energy: 0.9680654986934358
Energy: 0.9933686592140117
Energy: 1.176529563161553
Energy: 0.9933686592148695
Energy: 1.1765295631611243
Energy: 0.9933686592135829
Energy: 1.176529563161553
Energy: 1.004551666748581
Energy: 1.0469753748369695
Energy: 1.0045516667447214
Energy: 1.0469753748361117
Energy: 1.004551666748581
Energy: 1.0469753748382555
Energy: 0.991042621998347
Energy: 0.8923141309890601
Energy: 0.9910426220022066
Energy: 0.8923141309903464
Energy: 0.9910426219992047
Energy: 0.892314130991204
Energy: 0.9162937557569851
Energy: 1.1401815718610517
Energy: 0.9162937557608447
Energy: 1.1401815718627673
Energy: 0.9162937557582718
Energy: 1.1401815718601944
Energy: 1.0793660090144401
Energy: 0.9734362083874095
Energy: 1.0793660090122958
Energy: 0.9734362083865518
Energy: 1.0793660090157267
Energy: 0.9734362083878383
Energy: 1.0166296761721323
Energy: 0.9740521870323087
Energy: 1.0166296761695595
Energy: 0.9740521870357391
Energy: 1.0166296761708458
Energy: 0.9740521870335949
Energy: 1.00002442827463
Energy: 1.0607100666642688
Energy: 1.0000244282780606
Energy: 1.06071006666384
Energy: 1.0000244282754875
Energy: 1.0607100666642688
Energy: 1.0456962285627802
Energy: 1.078890734655401
Energy: 1.0456962285576343
Energy: 1.0788907346545435
Energy: 1.0456962285610647
Energy: 1.0788907346523993
Energy: 0.9173080140735848
Energy: 1.1495751220126624
Energy: 0.9173080140748713
Energy: 1.1625604740854192
Energy: 0.9173080140740136
Energy: 1.1190816562573052
Energy: 1.015548613999023
Energy: 1.0123604828710409
Energy: 1.0155486139985943
Energy: 1.0123604828710409
Energy: 1.0155486139973078
Energy: 1.0123604828701833
Energy: 1.0366694312774982
Energy: 1.1784690975772385
Energy: 1.0366694312822153
Energy: 1.1784690975772385
Energy: 1.036669431282644
Energy: 1.1784690975776673
Energy: 0.9937785414630234
Energy: 1.1208937804240307
Energy: 0.9937785414595927
Energy: 1.1208937804248884
Energy: 0.9937785414655964
Energy: 1.1208937804240307
Energy: 1.014635196447753
Energy: 0.9167807090270264
Energy: 1.014635196444751
Energy: 1.0488281915874444
Energy: 1.0146351964451799
Energy: 1.0166647934265498
Energy: 0.9934867879484032
Energy: 1.1211419202965986
Energy: 0.9934867879505475
Energy: 1.1211419202957411
Energy: 0.9934867879505475
Energy: 1.1211419202965986
Energy: 1.0367005097884994
Energy: 1.1784522979701624
Energy: 1.0367005097893571
Energy: 1.1784522979693048
Energy: 1.0367005097876418
Energy: 1.1784522979701624
Energy: 1.0156006013976733
Energy: 1.012449333686463
Energy: 1.0156006013933851
Energy: 1.0124493336868918
Energy: 1.0156006013972447
Energy: 1.0124493336868918
Energy: 0.917173314381784
Energy: 1.0927462159583474
Energy: 0.9171733143796397
Energy: 1.0927462159583474
Energy: 0.917173314381784
Energy: 1.0927462159587764
Energy: 1.045530678410842
Energy: 1.0791485861164276
Energy: 1.045530678415988
Energy: 1.07914858611557
Energy: 1.0455306784142726
Energy: 1.0791485861211059
Energy: 0.9999365614177759
Energy: 1.0606361888017468
Energy: 0.9999365614126299
Energy: 1.0606361888017468
Energy: 0.9999365614186335
Energy: 1.0606361888021756
Energy: 1.0169044195438675
Energy: 0.9738878252905848
Energy: 1.0169044195460117
Energy: 0.9738878252905848
Energy: 1.016904419539579
Energy: 0.9738878252914425
Energy: 1.0793492284929502
Energy: 0.9735289314049671
Energy: 1.0793492284942368
Energy: 0.9735289314053961
Energy: 1.0793492284950947
Energy: 0.9735289314058249
Energy: 0.9160398811038072
Energy: 1.1403199159887896
Energy: 0.916039881107238
Energy: 1.1403199159875033
Energy: 0.9160398811046649
Energy: 1.140319915990076
Energy: 0.99133638949167
Energy: 0.8928978401673249
Energy: 0.9913363894955296
Energy: 0.966115033722249
Energy: 0.9913363894925278
Energy: 0.9833601571276933
Energy: 1.006111328849976
Energy: 1.0468028076958673
Energy: 1.0061113288538353
Energy: 1.0468028076962959
Energy: 1.006111328849547
Energy: 1.0468028076962959
Energy: 0.9932942058963898
Energy: 1.176477185976422
Energy: 0.9932942059367
Energy: 1.1764771859772798
Energy: 0.9932942059487072
Energy: 1.1764771859772798
Energy: 0.9890528334795938
Energy: 0.9678806434295522
Energy: 0.9890528334800226
Energy: 0.9678806434274079
Energy: 0.9890528334825955
Energy: 0.9678806434286944
Energy: 1.022778744245603
Energy: 0.9588776046543545
Energy: 1.0227787442447454
Energy: 0.9588776046552121
Energy: 1.0227787442473184
Energy: 0.9588776046547832
Energy: 1.0879869577336594
Energy: 0.9470842435967622
Energy: 1.087986957735375
Energy: 0.9470842435963334
Energy: 1.0879869577328019
Energy: 0.9470842435959045
Energy: 0.915862470795746
Energy: 1.0353743303278775
Energy: 0.9158624707978902
Energy: 1.0353743303287355
Energy: 0.915862470798319
Energy: 1.035374330329593
Energy: 1.0863408386413957
Energy: 1.0580297716731566
Energy: 1.0863408386409668
Energy: 1.058029771672728
Energy: 1.0863408386409668
Energy: 1.058029771672299
Energy: 0.9894095297382243
Energy: 0.9444755127092229
Energy: 0.9894095297390819
Energy: 0.9444755127096517
Energy: 0.9894095297386531
Energy: 0.9444755127096517
Energy: 1.0968396836997771
Energy: 0.9801445639454768
Energy: 1.0968396837044945
Energy: 0.9801445639463344
Energy: 1.096839683703208
Energy: 0.9801445639459057
Energy: 0.9874931654719621
Energy: 0.9552577460212558
Energy: 0.9874931654715333
Energy: 0.9552577460216848
Energy: 0.9874931654711046
Energy: 0.9552577460199694
Energy: 1.08610492021287
Energy: 1.0579017089348146
Energy: 1.0861049202124413
Energy: 1.0579017089348146
Energy: 1.0861049202115836
Energy: 1.0579017089348146
Energy: 0.9160607585657797
Energy: 1.0126839720350689
Energy: 0.9160607585597761
Energy: 1.0126839720384995
Energy: 0.9160607585597761
Energy: 1.0126839720367844
Energy: 1.0878804157848752
Energy: 0.9470163429564697
Energy: 1.087880415785304
Energy: 0.9470163429568985
Energy: 1.0878804157857327
Energy: 0.9470163429564697

minimum gb energy = 0.8923141309890601 eV
minimum distance =  2.28406965094526 Angstroms
sigma value = 57


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

Energy: 1.0086448318721093
Energy: 0.9072235188660682
Energy: 1.0086448318756003
Energy: 0.9072235188660682
Energy: 1.0086448318714112
Energy: 0.9072235188667666
Energy: 1.0266091006376117
Energy: 0.8829147679532875
Energy: 1.0266091006383098
Energy: 0.8829147679532875
Energy: 1.026609100635517
Energy: 0.8829147679532875
Energy: 1.0100271349193026
Energy: 0.9923208434647519
Energy: 1.061462879369353
Energy: 0.9923208434654501
Energy: 1.0100271349172079
Energy: 0.9923208434682431
Energy: 0.8640793870141482
Energy: 0.9715290130961293
Energy: 0.8640793870197343
Energy: 0.9715290130968275
Energy: 0.864079387004373
Energy: 0.9715290130968275
Energy: 0.9976049899895242
Energy: 0.8377502128603509
Energy: 0.9976049899867947
Energy: 0.8377502128617473
Energy: 0.9976049899881912
Energy: 0.8377502128617473
Energy: 0.9629289093457037
Energy: 0.8928768490570473
Energy: 0.962928909346402
Energy: 0.8928768490570473
Energy: 0.9629289093471004
Energy: 0.8928768490584439
Energy: 1.0677827923304735
Energy: 0.939927868170914
Energy: 1.0677827923297751
Energy: 0.9399278681695176
Energy: 1.0677827923311716
Energy: 0.939927868170914
Energy: 1.1076345319707175
Energy: 1.0830862559171925
Energy: 1.1076345319686227
Energy: 1.0830862559171925
Energy: 1.1076345319707175
Energy: 1.0830862559164942
Energy: 0.8846703760537763
Energy: 0.8950609527496893
Energy: 0.8846703760530782
Energy: 0.8950609527482927
Energy: 0.8846703760530782
Energy: 0.8950609527489909
Energy: 0.9981531540240369
Energy: 0.9024511608173059
Energy: 0.998153154021244
Energy: 0.9024511608166077
Energy: 0.998153154021244
Energy: 0.9024511608180041
Energy: 1.0682042344874307
Energy: 1.0960633249513612
Energy: 1.0682042344867324
Energy: 1.0960633249520593
Energy: 1.0682042344874307
Energy: 1.0960633249520593
Energy: 0.9237398911735313
Energy: 0.855692193017588
Energy: 0.9237398911742296
Energy: 0.855692193017588
Energy: 0.9237398911735313
Energy: 0.8556921930127003
Energy: 0.9105895832447644
Energy: 1.0012355977107903
Energy: 0.9105895832447644
Energy: 1.0012355977100922
Energy: 0.9105895832447644
Energy: 1.0012355977093939
Energy: 0.8626683544830267
Energy: 1.035837306743279
Energy: 0.8626683544816302
Energy: 1.0358373067439772
Energy: 0.8626683544809318
Energy: 1.0358373067418825
Energy: 0.9917375741831022
Energy: 0.9089245060191367
Energy: 0.9917375741817055
Energy: 0.9089245060184384
Energy: 0.9917375741817055
Energy: 0.9089245060191367
Energy: 0.9100172195498294
Energy: 0.9910647388579581
Energy: 0.9100172195526223
Energy: 0.9910647388579581
Energy: 0.9100172195526223
Energy: 0.99106473885726
Energy: 0.9251494394157687
Energy: 0.9997215477958868
Energy: 0.9251494394136739
Energy: 0.9997215477965851
Energy: 0.925149439410881
Energy: 0.9997215477958868
Energy: 1.0449459119840108
Energy: 1.0552491934280746
Energy: 1.0449459119798212
Energy: 1.0552491934273764
Energy: 1.044945911981916
Energy: 1.0552491934294712
Energy: 0.8681463383429292
Energy: 1.050325888892599
Energy: 0.8681463383415328
Energy: 1.0503258888919007
Energy: 0.8681463383401363
Energy: 1.050325888892599
Energy: 0.8679900722663856
Energy: 0.964412006651127
Energy: 0.8679900722635927
Energy: 0.964412006651127
Energy: 0.8679900722649891
Energy: 0.9644120066525236
Energy: 0.9495141325373679
Energy: 1.099514637793459
Energy: 0.9495141325401611
Energy: 1.0995146377941574
Energy: 0.9495141325387645
Energy: 1.0995146377941574
Energy: 0.846087178768697
Energy: 1.053969266126635
Energy: 0.8460871787679987
Energy: 1.053969266126635
Energy: 0.8460871787700934
Energy: 1.0539692661273334
Energy: 0.9378336124451884
Energy: 0.9221666109986578
Energy: 0.9378336124451884
Energy: 0.9221666109986578
Energy: 0.9378336124458867
Energy: 0.9221666110000544
Energy: 0.9131021588800391
Energy: 1.0534837928798555
Energy: 0.913102158873755
Energy: 1.0534837928798555
Energy: 0.9131021588779444
Energy: 1.0534837928798555
Energy: 1.0317995990141706
Energy: 1.1015560218768132
Energy: 1.031799599012774
Energy: 1.1015560218768132
Energy: 1.0317995990141706
Energy: 1.1015560218782094
Energy: 0.907906593981442
Energy: 0.9211122659168585
Energy: 0.9079065939828385
Energy: 0.9211122659175567
Energy: 0.9079065939828385
Energy: 0.9211122659175567
Energy: 0.8459380569856088
Energy: 1.050274650452609
Energy: 0.8459380569842123
Energy: 1.0502746504533071
Energy: 0.8459380569842123
Energy: 1.0502746504533071

minimum gb energy = 0.8377502128603509 eV
minimum distance =  2.22205901114828 Angstroms
sigma value = 43


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

Energy: 1.0729967542568566
Energy: 0.8267811156422809
Energy: 1.0729967542558392
Energy: 0.826781115641772
Energy: 1.0729967542553305
Energy: 0.826781115641772
Energy: 0.8815745294603801
Energy: 0.9180178649830122
Energy: 0.8815745294598714
Energy: 0.9180178649830122
Energy: 0.8815745294598714
Energy: 0.9180178649825035
Energy: 0.8847872328221241
Energy: 0.9204812503168094
Energy: 0.8847872328216153
Energy: 0.9204812503178269
Energy: 0.8847872328211066
Energy: 0.9204812503178269
Energy: 1.0159195431916361
Energy: 0.8455365097973881
Energy: 1.0159195431921448
Energy: 0.8455365097968796
Energy: 1.0159195431926535
Energy: 0.8455365097973881
Energy: 0.8747485606854706
Energy: 0.8716800404599676
Energy: 0.8747485606864882
Energy: 0.8716800404614937
Energy: 0.8747485606854706
Energy: 0.8716800404599676
Energy: 0.8304480871666404
Energy: 0.8816041602800613
Energy: 0.8304480871661316
Energy: 0.8816041602800613
Energy: 0.8304480871671491
Energy: 0.8816041602795525
Energy: 0.9490832013076792
Energy: 0.8264281959699687
Energy: 0.9490832013076792
Energy: 0.8264281959689513
Energy: 0.9490832013076792
Energy: 0.82642819596946
Energy: 0.8738119887220949
Energy: 0.9213965755160809
Energy: 0.8738119887236211
Energy: 0.9213965755160809
Energy: 0.8738119887246386
Energy: 0.9213965755155722
Energy: 0.7933039704125573
Energy: 0.8688738116045618
Energy: 0.7933039704120485
Energy: 0.8688738116045618
Energy: 0.7933039704140835
Energy: 0.868873811604053
Energy: 0.8857323576477283
Energy: 0.7887640751225525
Energy: 0.8857323576482371
Energy: 0.7887640751240788
Energy: 0.8857323576472196
Energy: 0.7887640751230612
Energy: 0.9428370652133898
Energy: 0.9314270012568607
Energy: 0.9428370652118636
Energy: 0.9314270012568607
Energy: 0.9428370652128811
Energy: 0.9314270012573694
Energy: 0.7606628868053181
Energy: 0.8678612370360144
Energy: 0.7606628868048093
Energy: 0.8678612370370319
Energy: 0.7606628868053181
Energy: 0.8678612370360144
Energy: 0.8866461248842119
Energy: 0.749614701034932
Energy: 0.8866461248852293
Energy: 0.7496147010339145
Energy: 0.8866461248852293
Energy: 0.7496147010359495
Energy: 0.9357311565418678
Energy: 0.9361784146429539
Energy: 0.935731156541359
Energy: 0.9361784146429539
Energy: 0.9357311565408502
Energy: 0.9361784146429539
Energy: 0.7834703064182604
Energy: 0.8676844721594992
Energy: 0.783470306419278
Energy: 0.8676844721594992
Energy: 0.7834703064187691
Energy: 0.8676844721594992
Energy: 0.9117032863892247
Energy: 0.8245856052756406
Energy: 0.9117032863892247
Energy: 0.8245856052741144
Energy: 0.9117032863897334
Energy: 0.8245856052756406
Energy: 0.9512587325373768
Energy: 0.9333716937770731
Energy: 0.9512587325358506
Energy: 0.9333716937765644
Energy: 0.9512587325378854
Energy: 0.9333716937765644
Energy: 0.8066100358947327
Energy: 0.9408256400621597
Energy: 0.8066100358932063
Energy: 0.9408256400631774
Energy: 0.806610035893715
Energy: 0.940825640061651
Energy: 0.8799318448625186
Energy: 0.8769080947520483
Energy: 0.8799318448650625
Energy: 0.876908094752557
Energy: 0.8799318448620099
Energy: 0.8769080947515396
Energy: 0.9834423373361937
Energy: 0.8594913473840211
Energy: 0.9834423373367024
Energy: 0.8594913473840211
Energy: 0.983442337335685
Energy: 0.8594913473855474
Energy: 0.8674333159920663
Energy: 0.814485040146851
Energy: 0.8674333159895226
Energy: 0.8144850401463422
Energy: 0.8674333159910488
Energy: 0.8144850401463422
Energy: 0.9291381053983935
Energy: 0.8732579861835754
Energy: 0.9291381053983935
Energy: 0.8732579861789966
Energy: 0.9291381053989022
Energy: 0.8732579861784879
Energy: 0.9451899206022167
Energy: 0.8723640562184001
Energy: 0.9451899205976381
Energy: 0.8723640562184001
Energy: 0.9451899206032343
Energy: 0.8723640562184001
Energy: 0.9060165490007761
Energy: 0.8157764520424642
Energy: 0.9060165489977237
Energy: 0.8157764520429729
Energy: 0.9060165489987412
Energy: 0.8157764520414467
Energy: 0.8712750577728468
Energy: 0.856127292867456
Energy: 0.8712750577733555
Energy: 0.856127292867456
Energy: 0.8712750577733555
Energy: 0.8561272928669473
Energy: 0.8708179002480823
Energy: 0.8429447928193291
Energy: 0.8708179002475736
Energy: 0.8429447928167854
Energy: 0.8708179002480823
Energy: 0.8429447928203464
Energy: 0.8444106957558011
Energy: 0.9713723595886629
Energy: 0.8444106957563098
Energy: 0.9713723595886629
Energy: 0.8444106957568185
Energy: 0.9713723595891716
Energy: 0.8369923161126226
Energy: 0.8487720492236571
Energy: 0.83699231611364
Energy: 0.8487720492241658
Energy: 0.83699231611364
Energy: 0.8487720492241658
Energy: 0.7917492478816103
Energy: 0.7962195833048767
Energy: 0.7917492478826278
Energy: 0.796219583304368
Energy: 0.7917492478826278
Energy: 0.7962195833038592
Energy: 0.782438389585168
Energy: 0.9235853244453949
Energy: 0.7824383895826245
Energy: 0.9235853244453949
Energy: 0.7824383895831333
Energy: 0.9235853244418336
Energy: 0.8387765285498231
Energy: 0.8486252559130799
Energy: 0.8387765285498231
Energy: 0.8486252559125712
Energy: 0.8158265713635313
Energy: 0.8486252559125712
Energy: 0.7926878845209472
Energy: 0.7694992426731223
Energy: 0.7926878845204384
Energy: 0.7694992426726136
Energy: 0.7926878845204384
Energy: 0.7694992426726136
Energy: 0.7564267889495226
Energy: 0.8554000988326029
Energy: 0.7564267889490138
Energy: 0.8554000988320942
Energy: 0.7564267889500315
Energy: 0.8554000988320942
Energy: 0.9411309400938249
Energy: 0.9488847259002975
Energy: 0.9411309400943337
Energy: 0.9488847258997888
Energy: 0.9411309400928074
Energy: 0.9488847258987713
Energy: 0.8241548235112293
Energy: 0.7482725717724034
Energy: 0.8241548235107204
Energy: 0.7482725717718947
Energy: 0.8241548235107204
Energy: 0.7482725717718947
Energy: 0.7098635925514998
Energy: 0.8541783122913956
Energy: 0.7098635925520085
Energy: 0.8541783122903782
Energy: 0.7098635925525172
Energy: 0.8541783122919044

minimum gb energy = 0.7098635925514998 eV
minimum distance =  2.20750131477409 Angstroms
sigma value = 81


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

Energy: 0.11716291530274292
Energy: 0.1671158977801401
Energy: 0.11716291530274292
Energy: 0.1671158977801401
Energy: 0.11716291530274292
Energy: 0.16711589777640165
Energy: 0.657708047547393
Energy: 0.11801250096519739
Energy: 0.657708047547393
Energy: 0.11801250072789056
Energy: 0.657708047547393
Energy: 0.11801250083252476
Energy: 0.6577010912987691
Energy: 0.11792265399170576
Energy: 0.6577010912968999
Energy: 0.1179226539468868
Energy: 0.6577010912987691
Energy: 0.11792265422153568
Energy: 0.11716291530274292
Energy: 0.16711589777640165
Energy: 0.11716291530274292
Energy: 0.16711589777827088
Energy: 0.11716291530274292
Energy: 0.16711589777640165
Energy: 0.657708047547393
Energy: 0.11801250086430164
Energy: 0.657708047547393
Energy: 0.11801250082317864
Energy: 0.657708047547393
Energy: 0.11801250067185623
Energy: 0.6577010912987691
Energy: 0.11792265434673138
Energy: 0.6577010912968999
Energy: 0.11792265400292112
Energy: 0.6577010912968999
Energy: 0.11792265410194765
Energy: 0.11716291530274292
Energy: 0.16711589777827088
Energy: 0.11716291530274292
Energy: 0.16711589777827088
Energy: 0.11716291530274292
Energy: 0.1671158977801401
Energy: 0.657708047547393
Energy: 0.11801250103057782
Energy: 0.657708047547393
Energy: 0.11801250092407439
Energy: 0.657708047547393
Energy: 0.11801250085869396
Energy: 0.6577010912968999
Energy: 0.11792265430934686
Energy: 0.6577010912968999
Energy: 0.11792265436168518
Energy: 0.6577010912987691
Energy: 0.11792265391884842
Energy: 0.11716291530274292
Energy: 0.16711589777640165
Energy: 0.11716291530274292
Energy: 0.16711589777640165
Energy: 0.1171629153008737
Energy: 0.16711589777827088

minimum gb energy = 0.1171629153008737 eV
minimum distance =  2.46299073531165 Angstroms
sigma value = 3


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

Energy: 0.946294403728436
Energy: 0.8286211965569049
Energy: 0.9462944037278767
Energy: 0.8286211965563455
Energy: 0.9462944037289954
Energy: 0.8286211965569049
Energy: 0.7996241992386227
Energy: 0.8222249090985263
Energy: 0.7996241992397415
Energy: 0.8222249090974075
Energy: 0.7996241992380634
Energy: 0.8222249090979669
Energy: 0.8628829168489066
Energy: 0.8360704925693883
Energy: 0.8628829168572971
Energy: 0.8360704925699477
Energy: 0.8127965317616621
Energy: 0.8360704925693883
Energy: 0.8760140660847004
Energy: 0.8553834914880206
Energy: 0.8760140660847004
Energy: 0.85538349148858
Energy: 0.8760140660841409
Energy: 0.85538349148858
Energy: 0.7084116104821844
Energy: 0.8222372996438331
Energy: 0.708411610481625
Energy: 0.8222372996427142
Energy: 0.7084116104821844
Energy: 0.8222372996432736
Energy: 0.8179510512136737
Energy: 0.81903800537917
Energy: 0.8179510512136737
Energy: 0.8190380053825262
Energy: 0.8179510512136737
Energy: 0.8190380053814076
Energy: 0.8086852443707183
Energy: 0.8501418309274333
Energy: 0.808685244371837
Energy: 0.850141830926874
Energy: 0.8086852443723962
Energy: 0.8501418309274333
Energy: 0.7086653146908755
Energy: 0.8217521149723337
Energy: 0.708665314690316
Energy: 0.8217521149751307
Energy: 0.7086653146891972
Energy: 0.8217521149723337
Energy: 0.8241820487019751
Energy: 0.8203426053958823
Energy: 0.8241820487070094
Energy: 0.8203426053958823
Energy: 0.8241820487025344
Energy: 0.8203426053964417
Energy: 0.8103037270893302
Energy: 0.7425654491728219
Energy: 0.8103037270893302
Energy: 0.7425654491722625
Energy: 0.8103037270887709
Energy: 0.7425654491728219
Energy: 0.745078924811698
Energy: 0.8269993816023214
Energy: 0.745078924811698
Energy: 0.8269993816023214
Energy: 0.745078924811698
Energy: 0.8269993816017621
Energy: 0.8427769707023501
Energy: 0.85757900046008
Energy: 0.8427769707023501
Energy: 0.85757900046008
Energy: 0.8427769707012314
Energy: 0.8575790004606392
Energy: 0.8334649685024578
Energy: 0.7070972078720674
Energy: 0.8334649685024578
Energy: 0.7070972078698299
Energy: 0.8334649685013392
Energy: 0.7070972078709488
Energy: 0.769427214188785
Energy: 0.837807176823385
Energy: 0.7694272141899038
Energy: 0.8378071768228257
Energy: 0.7694272141893443
Energy: 0.837807176823385
Energy: 0.8094839665684839
Energy: 0.8372631492356579
Energy: 0.8094839665684839
Energy: 0.8372631492356579
Energy: 0.8094839665684839
Energy: 0.8372631492345394
Energy: 0.833095590309776
Energy: 0.7018117784337439
Energy: 0.8330955903086571
Energy: 0.7018117784315065
Energy: 0.8330955903086571
Energy: 0.7018117784315065
Energy: 0.8213298448258229
Energy: 0.8679038232095072
Energy: 0.8213298448258229
Energy: 0.8679038232089477
Energy: 0.8213298448275012
Energy: 0.8679038232089477
Energy: 0.825928757905222
Energy: 0.8194000728097108
Energy: 0.8259287579057815
Energy: 0.8194000728097108
Energy: 0.825928757905222
Energy: 0.8194000728097108
Energy: 0.8324180043147782
Energy: 0.7825735894034742
Energy: 0.8324180043136594
Energy: 0.782573589402915
Energy: 0.8324180043136594
Energy: 0.7825735894034742
Energy: 0.798442618342376
Energy: 0.9256201864888203
Energy: 0.7984426183418167
Energy: 0.9256201864888203
Energy: 0.7984426183429354
Energy: 0.9256201864888203
Energy: 0.8637764735427793
Energy: 0.8056212962025824
Energy: 0.8637764735438981
Energy: 0.8056212962031418
Energy: 0.8637764735427793
Energy: 0.8056212962031418
Energy: 0.8756079384082933
Energy: 0.7997835876399584
Energy: 0.8756079384077341
Energy: 0.7997835876393989
Energy: 0.8756079384088526
Energy: 0.7997835876399584
Energy: 0.8253711291168582
Energy: 0.8711167579834062
Energy: 0.8253711291162988
Energy: 0.8711167579834062
Energy: 0.8253711291157394
Energy: 0.8711167579828467
Energy: 0.8196708914265317
Energy: 0.7837775698941483
Energy: 0.819670891427091
Energy: 0.7837775698947077
Energy: 0.8196708914276505
Energy: 0.7837775698947077
Energy: 0.8326600059443713
Energy: 0.8203120626890447
Energy: 0.8326600059449308
Energy: 0.8203120626890447
Energy: 0.8326600059449308
Energy: 0.8203120626884853
Energy: 0.7900047562775399
Energy: 0.8354243416588543
Energy: 0.7900047562786586
Energy: 0.8354243416594136
Energy: 0.7900047562775399
Energy: 0.8354243416599729
Energy: 0.8364509063294155
Energy: 0.7219596870618777
Energy: 0.8364509063277373
Energy: 0.7219596870534872
Energy: 0.836450906328856
Energy: 0.7219596870652341
Energy: 0.8090516554017811
Energy: 0.8247719095815006
Energy: 0.8090516554006626
Energy: 0.8247719095826191
Energy: 0.8090516554017811
Energy: 0.8247719095820598
Energy: 0.7604893222175246
Energy: 0.8356160887967814
Energy: 0.7604893222169652
Energy: 0.8356160887956625
Energy: 0.7604893222164059
Energy: 0.8356160887967814
Energy: 0.9112700224894663
Energy: 0.7598603377007009
Energy: 0.9112700224877882
Energy: 0.7598603377007009
Energy: 0.9112700224889071
Energy: 0.7598603377001415
Energy: 0.8120103623617195
Energy: 0.8225410253377113
Energy: 0.8120103623611602
Energy: 0.8225410253377113
Energy: 0.8120103623611602
Energy: 0.8225410253377113
Energy: 0.7343205465869338
Energy: 0.8197147654964347
Energy: 0.7343205465863744
Energy: 0.8197147654964347
Energy: 0.7343205465880526
Energy: 0.8197147654958755
Energy: 0.82082914462912
Energy: 0.8142785246050718
Energy: 0.8208291446302387
Energy: 0.8142785246246498
Energy: 0.82082914462912
Energy: 0.8142785246112247

minimum gb energy = 0.7018117784315065 eV
minimum distance =  2.28107757500503 Angstroms
sigma value = 67


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

Energy: 1.053255933262039
Energy: 1.0043520931855965
Energy: 1.0532559332636333
Energy: 1.0043520931855965
Energy: 1.053255933262039
Energy: 1.0043520931863936
Energy: 0.9439688665995821
Energy: 0.983680997635283
Energy: 0.9439688665987852
Energy: 0.9836809976344861
Energy: 0.9439688665979881
Energy: 0.983680997635283
Energy: 0.9750206365683628
Energy: 0.983498610861679
Energy: 0.9750206365659717
Energy: 0.9834986108624761
Energy: 0.9750206365691598
Energy: 0.9834986108624761
Energy: 0.9986284657767799
Energy: 0.9548421235848978
Energy: 0.998628465779171
Energy: 0.9548421235864919
Energy: 0.9986284657767799
Energy: 0.9548421235872889
Energy: 0.8644884811073673
Energy: 0.926035700850807
Energy: 0.8644884811129468
Energy: 0.9260357008500099
Energy: 0.8644884811089616
Energy: 0.9260357008500099
Energy: 0.9783947932641017
Energy: 0.9606202047660048
Energy: 0.9783947932641017
Energy: 0.9606202047660048
Energy: 0.9783947932633046
Energy: 0.9606202047660048
Energy: 0.9569536572350441
Energy: 0.9286360872236693
Energy: 0.9569536572334498
Energy: 0.9286360872220752
Energy: 0.956953657234247
Energy: 0.9286360872212783
Energy: 0.9334026293666213
Energy: 0.9157108439653626
Energy: 0.9334026293658242
Energy: 0.9157108439637686
Energy: 0.9334026293666213
Energy: 0.9157108439637686
Energy: 0.999029477351764
Energy: 1.0078534050517782
Energy: 0.9990294773525609
Energy: 1.0078534050517782
Energy: 0.999029477351764
Energy: 1.0078534050525754
Energy: 0.9530929805415067
Energy: 0.8811937623354357
Energy: 0.9530929805407099
Energy: 0.8811937623362326
Energy: 0.9530929805423038
Energy: 0.8811937623346385
Energy: 0.9867882201004831
Energy: 0.9664585820745923
Energy: 0.9867882201012802
Energy: 0.9664585820745923
Energy: 0.9867882200980921
Energy: 0.9664585820745923
Energy: 0.9518505645673542
Energy: 0.9752160484302175
Energy: 0.951850564566557
Energy: 0.9752160484294203
Energy: 0.9518505645673542
Energy: 0.9752160484302175
Energy: 0.9514534254543698
Energy: 0.9244736016802582
Energy: 0.9514534254543698
Energy: 0.9244736016802582
Energy: 0.9514534254543698
Energy: 0.924473601679461
Energy: 0.9638943935159646
Energy: 1.0034864967024757
Energy: 0.9638943935159646
Energy: 1.0034864967008814
Energy: 0.9638943935143706
Energy: 1.0034864967016786
Energy: 0.9554130857794342
Energy: 0.9416021077320701
Energy: 0.9554130857818252
Energy: 0.941602107732867
Energy: 0.9554130857802312
Energy: 0.9416021077320701
Energy: 0.9881310178553715
Energy: 0.9520433735102399
Energy: 0.9881310178537774
Energy: 0.9520433735118339
Energy: 0.9881310178553715
Energy: 0.952043373511037
Energy: 0.9889666790163898
Energy: 0.9893122729369035
Energy: 0.9889666790163898
Energy: 0.9893122729361065
Energy: 0.9889666790155927
Energy: 0.9893122729369035
Energy: 0.9744944495679148
Energy: 0.9233095232402503
Energy: 0.9744944495711029
Energy: 0.9233095232402503
Energy: 0.9744944495703058
Energy: 0.9233095232402503
Energy: 0.9713235322479911
Energy: 0.9869785477392246
Energy: 0.9713235322495851
Energy: 0.9869785477392246
Energy: 0.971323532248788
Energy: 0.9869785477392246
Energy: 0.9172820293617687
Energy: 0.9844599175199351
Energy: 0.9172820293625658
Energy: 0.9844599175199351
Energy: 0.9172820293609716
Energy: 0.9844599175199351
Energy: 1.012768486574848
Energy: 0.9257361151964856
Energy: 1.012768486575645
Energy: 0.9257361151964856
Energy: 1.012768486575645
Energy: 0.9257361151964856
Energy: 0.9964374392965086
Energy: 1.0077247235693214
Energy: 0.9964374392973058
Energy: 1.0077247235693214
Energy: 0.9964374392981029
Energy: 1.0077247235693214
Energy: 0.9122053416661782
Energy: 0.9833916241066256
Energy: 0.9122053416669753
Energy: 0.9833916241058286
Energy: 0.9122053416677722
Energy: 0.9833916241058286

minimum gb energy = 0.8644884811073673 eV
minimum distance =  2.29796294925785 Angstroms
sigma value = 33


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

Energy: 1.1454378390810753
Energy: 1.0803233268810413
Energy: 1.145437839080064
Energy: 1.0803233268810413
Energy: 1.1454378390820865
Energy: 1.0803233268810413
Energy: 1.0516929964241757
Energy: 1.0600581022379587
Energy: 1.0516929964241757
Energy: 1.0600581022374533
Energy: 1.0516929964241757
Energy: 1.0600581022374533
Energy: 1.0987519847850409
Energy: 1.0571962894980802
Energy: 1.0987519847840297
Energy: 1.0571962894990916
Energy: 1.0987519847855465
Energy: 1.0571962894990916
Energy: 1.0836092840405112
Energy: 1.0846015989878492
Energy: 1.0836092840389941
Energy: 1.0846015989883546
Energy: 1.0836092840405112
Energy: 1.0846015989883546
Energy: 1.0430125601526243
Energy: 1.0570116911065666
Energy: 1.0430125601536357
Energy: 1.0570116911050496
Energy: 1.0430125601536357
Energy: 1.0570116911045442
Energy: 1.1380925257827144
Energy: 1.0568407532040356
Energy: 1.13809252578322
Energy: 1.1546820376409999
Energy: 1.1380925257827144
Energy: 1.1148071642913988
Energy: 1.0786801765673917
Energy: 1.037704015057623
Energy: 1.078680176569414
Energy: 1.0377040150586345
Energy: 1.0786801765678973
Energy: 1.037704015057623
Energy: 1.1020715019522211
Energy: 1.0627743019632558
Energy: 1.1020715019532323
Energy: 1.0627743019627502
Energy: 1.1020715019557603
Energy: 1.0627743019627502
Energy: 1.034271634153068
Energy: 1.085713602234651
Energy: 1.0342716341520566
Energy: 1.0857136022341451
Energy: 1.0342716341540792
Energy: 1.0857136022336398
Energy: 1.1274347562252216
Energy: 1.0399336815473204
Energy: 1.127434756224716
Energy: 1.0461252741357432
Energy: 1.127434756224716
Energy: 1.0361603907092896
Energy: 1.0670115660905386
Energy: 1.0575020449550252
Energy: 1.067011566090033
Energy: 1.0575020449575532
Energy: 1.0670115660910444
Energy: 1.057502044956542
Energy: 1.052875596130536
Energy: 1.0432683482442855
Energy: 1.0528755961285134
Energy: 1.0432683482442855
Energy: 1.0528755961300305
Energy: 1.0432683482442855
Energy: 1.130167714874879
Energy: 1.0597084140413828
Energy: 1.1301677148743734
Energy: 1.0597084140413828
Energy: 1.130167714874879
Energy: 1.059708414040877
Energy: 1.0383745060177152
Energy: 1.061195032575805
Energy: 1.0383745060177152
Energy: 1.061195032575805
Energy: 1.0383745060177152
Energy: 1.061195032575805
Energy: 1.0839763035856287
Energy: 1.0743538016347427
Energy: 1.0839763035866399
Energy: 1.074353801634237
Energy: 1.0839763035866399
Energy: 1.0743538016352483
Energy: 1.0835332852992792
Energy: 1.0897739490727707
Energy: 1.0835332852987736
Energy: 1.0897739490727707
Energy: 1.0835332852967512
Energy: 1.089773949072265
Energy: 1.0213656538225568
Energy: 1.0576079911915675
Energy: 1.0213656538190632
Energy: 1.0576079911915675
Energy: 1.0213656538225568
Energy: 1.0576079911915675
Energy: 1.1238601495738527
Energy: 1.121058136858515
Energy: 1.1238601495743585
Energy: 1.121058136858515
Energy: 1.1238601495743585
Energy: 1.121058136858515
Energy: 1.0433821904810174
Energy: 1.1316931876998273
Energy: 1.0433821904815228
Energy: 1.1316931876998273
Energy: 1.0433821904810174
Energy: 1.1316931876998273
Energy: 1.0546190968864544
Energy: 1.06067733150874
Energy: 1.0546190968864544
Energy: 1.0606773315082343
Energy: 1.0546190968859488
Energy: 1.0606773315082343
Energy: 1.0791973214480886
Energy: 1.0896880315157496
Energy: 1.079197321447583
Energy: 1.0896880315157496
Energy: 1.0791973214480886
Energy: 1.0896880315157496
Energy: 1.080032812636646
Energy: 1.024289800714597
Energy: 1.0800328126351293
Energy: 1.024289800714597
Energy: 1.0800328126361405
Energy: 1.0242898007135859
Energy: 1.0874330227098588
Energy: 1.057760058500497
Energy: 1.0874330227139037
Energy: 1.057760058500497
Energy: 1.0874330227113755
Energy: 1.057760058500497
Energy: 1.1272880466656068
Energy: 1.0389550031072834
Energy: 1.1272880466656068
Energy: 1.038955003107789
Energy: 1.1272880466651012
Energy: 1.0389550031072834
Energy: 1.0506965266517523
Energy: 1.0382434462659196
Energy: 1.0506965266527635
Energy: 1.0382434462659196
Energy: 1.0506965266512467
Energy: 1.0382434462654138
Energy: 1.085687811811618
Energy: 1.0807526804170255
Energy: 1.0856878118126294
Energy: 1.0807526804165202
Energy: 1.085687811811618
Energy: 1.0807526804170255
Energy: 1.0515093196335288
Energy: 1.024723491766644
Energy: 1.0515093196325174
Energy: 1.024723491766644
Energy: 1.0515093196340346
Energy: 1.024723491768161
Energy: 1.0754027118557115
Energy: 1.122311578028804
Energy: 1.0754027118562168
Energy: 1.1889227832859754
Energy: 1.0754027118557115
Energy: 1.1152448339632834
Energy: 1.0526491925427612
Energy: 1.0569990370917006
Energy: 1.0526491925488288
Energy: 1.0569990370922062
Energy: 1.05264919254984
Energy: 1.056999037091195
Energy: 1.0428543274927453
Energy: 1.035462629870681
Energy: 1.0428543274897117
Energy: 1.0354626298696699
Energy: 1.0428543274902173
Energy: 1.035462629869164
Energy: 1.1414725816323847
Energy: 1.117957493503158
Energy: 1.141472581633396
Energy: 1.117957493503158
Energy: 1.141472581633396
Energy: 1.117957493503158
Energy: 1.0414424024472635
Energy: 1.0605805696434318
Energy: 1.0414424024467577
Energy: 1.0605805696439372
Energy: 1.0414424024467577
Energy: 1.0605805696434318
Energy: 1.0813426479621786
Energy: 1.0890555524640881
Energy: 1.0813426479621786
Energy: 1.0890555524650996
Energy: 1.0813426479621786
Energy: 1.0890555524645935
Energy: 1.0811698877097615
Energy: 1.0596898030789428
Energy: 1.0811698877097615
Energy: 1.0596898030784374
Energy: 1.081169887710773
Energy: 1.0596898030794486
Energy: 1.0395522120635197
Energy: 1.057544070638791
Energy: 1.0395522120650367
Energy: 1.0575440706392967
Energy: 1.0395522120645309
Energy: 1.057544070638791
Energy: 1.1483747662677093
Energy: 1.0646671741960794
Energy: 1.148374766266698
Energy: 1.0646671741960794
Energy: 1.1483747662672037
Energy: 1.0646671741960794
Energy: 1.051435926994243
Energy: 1.0820472796208958
Energy: 1.0514359269927263
Energy: 1.0820472796208958
Energy: 1.0514359269937374
Energy: 1.08204727962039

minimum gb energy = 1.0213656538190632 eV
minimum distance =  2.26816249678233 Angstroms
sigma value = 41


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

Energy: 1.2437449666572806
Energy: 1.2315115667884526
Energy: 1.2437449666586609
Energy: 1.2315115667884526
Energy: 1.2437449666586609
Energy: 1.2315115667884526
Energy: 1.2044183500014103
Energy: 1.178412955671924
Energy: 1.2044183500014103
Energy: 1.178412955671924
Energy: 1.2044183500014103
Energy: 1.178412955671924
Energy: 1.3212303901301998
Energy: 1.1726871224476376
Energy: 1.3844389615353294
Energy: 1.1726871224476376
Energy: 1.3029092486894516
Energy: 1.1726871224476376
Energy: 1.226233018048498
Energy: 1.2741047345517873
Energy: 1.2262330180471175
Energy: 1.2741047345531678
Energy: 1.226233018048498
Energy: 1.2741047345531678
Energy: 1.2941878908087523
Energy: 1.1973082112643618
Energy: 1.2941878908087523
Energy: 1.1973082112643618
Energy: 1.2941878908087523
Energy: 1.197308211267123
Energy: 1.3150225522263048
Energy: 1.2829392155959034
Energy: 1.3150225522276853
Energy: 1.2829392155959034
Energy: 1.3150225522276853
Energy: 1.2829392155972839
Energy: 1.2244771918779118
Energy: 1.1563638234002902
Energy: 1.2244771918792923
Energy: 1.1563638234002902
Energy: 1.2244771918792923
Energy: 1.1563638234002902
Energy: 1.259133680995521
Energy: 1.1789851344003308
Energy: 1.259133680995521
Energy: 1.1789851344003308
Energy: 1.259133680995521
Energy: 1.1789851344003308
Energy: 1.2059274512437899
Energy: 1.2058197602938656
Energy: 1.2059274512437899
Energy: 1.2058197602924854
Energy: 1.2059274512424094
Energy: 1.2058197602938656
Energy: 1.2255774467407308
Energy: 1.199510222424549
Energy: 1.225577446743492
Energy: 1.199510222424549
Energy: 1.2255774467407308
Energy: 1.199510222424549
Energy: 1.203063324226748
Energy: 1.1730404347595211
Energy: 1.203063324226748
Energy: 1.1730404347595211
Energy: 1.2030633242253677
Energy: 1.1730404347595211
Energy: 1.2494601542349593
Energy: 1.1774178587255673
Energy: 1.24946015423634
Energy: 1.1774178587241866
Energy: 1.2494601542349593
Energy: 1.1774178587241866
Energy: 1.244895475875804
Energy: 1.273476956233807
Energy: 1.244895475875804
Energy: 1.2734769562324266
Energy: 1.2448954758744233
Energy: 1.273476956233807
Energy: 1.2913217927693907
Energy: 1.1795943475034303
Energy: 1.2913217927707712
Energy: 1.1795943475034303
Energy: 1.2913217927680105
Energy: 1.1795943475034303

minimum gb energy = 1.1563638234002902 eV
minimum distance =  2.27080446951172 Angstroms
sigma value = 11


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

Energy: 1.432937786293608
Energy: 1.4300924333690308
Energy: 1.432937786293608
Energy: 1.430092433367818
Energy: 1.432937786293608
Energy: 1.4300924333696374
Energy: 1.3673807402396665
Energy: 1.3490473128290048
Energy: 1.3673807402390599
Energy: 1.3490473128283986
Energy: 1.3673807402372407
Energy: 1.3490473128290048
Energy: 1.4151521996772474
Energy: 1.339531036345621
Energy: 1.415152199677854
Energy: 1.3395310363450146
Energy: 1.4151521996766412
Energy: 1.3395310363450146
Energy: 1.3651271042962296
Energy: 1.3529172824685152
Energy: 1.365127104296836
Energy: 1.3529172824691216
Energy: 1.36512710429441
Energy: 1.3529172824691216
Energy: 1.4368877381250895
Energy: 1.3423790743417454
Energy: 1.4368877381238767
Energy: 1.3423790743417454
Energy: 1.4368877381250895
Energy: 1.342379074342352
Energy: 1.3631837260074806
Energy: 1.4164701313032406
Energy: 1.363183726008087
Energy: 1.4164701313032406
Energy: 1.3631837260092998
Energy: 1.4164701313032406
Energy: 1.3723668244965448
Energy: 1.390519673041258
Energy: 1.3723668244965448
Energy: 1.3905196730406515
Energy: 1.3723668244953315
Energy: 1.390519673041258
Energy: 1.366738922833227
Energy: 1.3718475912992434
Energy: 1.366738922833227
Energy: 1.3718475912992434
Energy: 1.366738922833227
Energy: 1.3718475912992434
Energy: 1.3999988348518724
Energy: 1.3705287381498212
Energy: 1.399998834851266
Energy: 1.3705287381510338
Energy: 1.399998834851266
Energy: 1.3705287381510338
Energy: 1.3459676650595904
Energy: 1.4172779285682275
Energy: 1.345967665058984
Energy: 1.4172779285682275
Energy: 1.3459676650601968
Energy: 1.4172779285676211
Energy: 1.3802419364114125
Energy: 1.3558274915737842
Energy: 1.3802419364126253
Energy: 1.3558274915737842
Energy: 1.3802419364120189
Energy: 1.3558274915737842
Energy: 1.3999380613346308
Energy: 1.4006788227420286
Energy: 1.3999380613346308
Energy: 1.4006788227432414
Energy: 1.3999380613346308
Energy: 1.400678822742635
Energy: 1.365869632681399
Energy: 1.366540069724475
Energy: 1.3658696326832183
Energy: 1.366540069724475
Energy: 1.3658696326826119
Energy: 1.3665400697238685
Energy: 1.422937911312944
Energy: 1.372885292481567
Energy: 1.422937911312944
Energy: 1.3728852924821735
Energy: 1.4229379113135503
Energy: 1.3728852924821735
Energy: 1.3673465517076413
Energy: 1.4083222850607033
Energy: 1.3673465517076413
Energy: 1.4083222850600967
Energy: 1.3673465517076413
Energy: 1.4083222850600967
Energy: 1.3706664870445664
Energy: 1.390243202357663
Energy: 1.3706664870445664
Energy: 1.3902432023570563
Energy: 1.37066648704396
Energy: 1.3902432023570563
Energy: 1.337904649822254
Energy: 1.3481244936717216
Energy: 1.3379046498234668
Energy: 1.348124493672328
Energy: 1.3379046498234668
Energy: 1.3481244936717216
Energy: 1.3949642131877722
Energy: 1.3838501310796243
Energy: 1.394964213187166
Energy: 1.3838501310796243
Energy: 1.3949642131865596
Energy: 1.3838501310796243
Energy: 1.3474037518341562
Energy: 1.326067356288863
Energy: 1.3474037518347624
Energy: 1.32606735628765
Energy: 1.347403751832943
Energy: 1.3260673562882563
Energy: 1.4085360465065617
Energy: 1.347615343689245
Energy: 1.4085360465071681
Energy: 1.347615343690458
Energy: 1.4085360465041359
Energy: 1.3476153436898517
Energy: 1.385180744577818
Energy: 1.3670826513783851
Energy: 1.3851807445796371
Energy: 1.3670826513777787
Energy: 1.3851807445772117
Energy: 1.3670826513777787
Energy: 1.4164609229498966
Energy: 1.4016172807364093
Energy: 1.4164609229511094
Energy: 1.401617280735803
Energy: 1.4164609229498966
Energy: 1.4016172807370157
Energy: 1.3770727252872803
Energy: 1.3400115663999208
Energy: 1.3770727252878867
Energy: 1.3400115663993144
Energy: 1.3770727252884933
Energy: 1.3400115663999208
Energy: 1.4198206863988085
Energy: 1.340027075601413
Energy: 1.4198206863982021
Energy: 1.340027075601413
Energy: 1.4198206863975957
Energy: 1.340027075601413
Energy: 1.3607674963168317
Energy: 1.3917749821080736
Energy: 1.3607674963168317
Energy: 1.3917749821068608
Energy: 1.360767496316225
Energy: 1.3917749821068608
Energy: 1.3849469781577333
Energy: 1.3480755360027703
Energy: 1.3849469781583397
Energy: 1.348075536002164
Energy: 1.3849469781595527
Energy: 1.3480755360039833
Energy: 1.3531572306315829
Energy: 1.4181405406908862
Energy: 1.3531572306315829
Energy: 1.4181405406908862
Energy: 1.3531572306303976
Energy: 1.4181405406908862
Energy: 1.3668649019870254
Energy: 1.3662900879202975
Energy: 1.3668649019876318
Energy: 1.3662900879202975
Energy: 1.3668649019870254
Energy: 1.3662900879202975
Energy: 1.4032273054247288
Energy: 1.3731090320785544
Energy: 1.4032273054253352
Energy: 1.373109032079161
Energy: 1.4032273054253352
Energy: 1.373109032079161
Energy: 1.3822752770566995
Energy: 1.3599792914945203
Energy: 1.3822752770585192
Energy: 1.3599792914945203
Energy: 1.3822752770566995
Energy: 1.359979291493914
Energy: 1.3417365644445798
Energy: 1.4358173991044225
Energy: 1.3417365644445798
Energy: 1.4358173991044225
Energy: 1.3417365644451862
Energy: 1.4358173991044225

minimum gb energy = 1.32606735628765 eV
minimum distance =  2.20209638264759 Angstroms
sigma value = 57


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

Energy: 1.3441288341222544
Energy: 1.443816704851159
Energy: 1.3441288341222544
Energy: 1.443816704851159
Energy: 1.3441288341233337
Energy: 1.443816704851159
Energy: 1.3838340672266514
Energy: 1.4551013502174974
Energy: 1.383834067227731
Energy: 1.4551013502174974
Energy: 1.3838340672255722
Energy: 1.455101350215339
Energy: 1.4191941121429217
Energy: 1.3533437586177957
Energy: 1.4191941121429217
Energy: 1.3533437586177957
Energy: 1.4191941121429217
Energy: 1.3533437586177957
Energy: 1.3359012312401046
Energy: 1.5062192200607212
Energy: 1.3359012312411835
Energy: 1.5062192200618005
Energy: 1.335901231239025
Energy: 1.5062192200618005
Energy: 1.4191746687232247
Energy: 1.3533615666579155
Energy: 1.4191746687232247
Energy: 1.3533615666579155
Energy: 1.4191746687232247
Energy: 1.3533615666579155
Energy: 1.3840646347963863
Energy: 1.4634404910136538
Energy: 1.3840646347974654
Energy: 1.4634404910125747
Energy: 1.3840646347963863
Energy: 1.4634404910168914
Energy: 1.3441288341190172
Energy: 1.4438167048490007
Energy: 1.3441288341190172
Energy: 1.4438167048490007
Energy: 1.344128834120096
Energy: 1.4438167048500798
Energy: 1.383834067223414
Energy: 1.455101350215339
Energy: 1.383834067224493
Energy: 1.4551013502164183
Energy: 1.383834067223414
Energy: 1.4551013502164183
Energy: 1.4191941121396843
Energy: 1.3533437586177957
Energy: 1.4191941121396843
Energy: 1.3533437586177957
Energy: 1.4191941121386051
Energy: 1.3533437586177957
Energy: 1.335901231239025
Energy: 1.5062192200574835
Energy: 1.3359012312401046
Energy: 1.5062192200574835
Energy: 1.3359012312379461
Energy: 1.506219220058563
Energy: 1.4191746687167495
Energy: 1.3533615666600738
Energy: 1.4191746687167495
Energy: 1.3533615666600738
Energy: 1.4191746687178288
Energy: 1.3533615666600738
Energy: 1.3840646347974654
Energy: 1.463440491015812
Energy: 1.3840646347985446
Energy: 1.4634404910136538
Energy: 1.3840646347985446
Energy: 1.4634404910179706
Energy: 1.3441288341222544
Energy: 1.443816704851159
Energy: 1.3441288341211755
Energy: 1.443816704851159
Energy: 1.3441288341222544
Energy: 1.4438167048500798
Energy: 1.3838340672266514
Energy: 1.455101350215339
Energy: 1.3838340672266514
Energy: 1.4551013502164183
Energy: 1.383834067227731
Energy: 1.4551013502174974
Energy: 1.4191941121440013
Energy: 1.3533437586177957
Energy: 1.4191941121440013
Energy: 1.3533437586177957
Energy: 1.4191941121440013
Energy: 1.3533437586177957
Energy: 1.3359012312401046
Energy: 1.5062192200607212
Energy: 1.3359012312411835
Energy: 1.5062192200618005
Energy: 1.3359012312401046
Energy: 1.5062192200607212
Energy: 1.4191746687232247
Energy: 1.3533615666579155
Energy: 1.4191746687232247
Energy: 1.3533615666579155
Energy: 1.4191746687232247
Energy: 1.3533615666579155

minimum gb energy = 1.3359012312379461 eV
minimum distance =  2.25173546837454 Angstroms
sigma value = 9


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

Energy: 1.4593392140194659
Energy: 1.5164287032182637
Energy: 1.4593392140203472
Energy: 1.516428703219145
Energy: 1.4593392140177035
Energy: 1.5164287032182637
Energy: 1.4925881318017464
Energy: 1.4649397920777683
Energy: 1.4925881318009053
Energy: 1.4649397920786493
Energy: 1.4925881318026277
Energy: 1.4649397920786493
Energy: 1.4814913753943648
Energy: 1.429699325613399
Energy: 1.4814913753952461
Energy: 1.429699325612518
Energy: 1.4814913753961272
Energy: 1.429699325613399
Energy: 1.3971425472554984
Energy: 1.550450746104779
Energy: 1.3971425472563792
Energy: 1.550450746104779
Energy: 1.3971425472563792
Energy: 1.5504507461038979
Energy: 1.4547984939365677
Energy: 1.4235270255987666
Energy: 1.4547984939356866
Energy: 1.4235270255987666
Energy: 1.4547984939356866
Energy: 1.4235270255987666
Energy: 1.4714278098356581
Energy: 1.4263546136710978
Energy: 1.4714278098356581
Energy: 1.4263546136710978
Energy: 1.471427809834777
Energy: 1.426354613671979
Energy: 1.3948826859451613
Energy: 1.5071324085090438
Energy: 1.3948826859460424
Energy: 1.507132408509925
Energy: 1.39488268594428
Energy: 1.5071324085090438
Energy: 1.3997155133178212
Energy: 1.4880170278733833
Energy: 1.3997155133195838
Energy: 1.4880170278733833
Energy: 1.3997155133178212
Energy: 1.488017027872502
Energy: 1.5626116099210225
Energy: 1.4273133757574028
Energy: 1.5626116099201413
Energy: 1.4273133757582839
Energy: 1.56261160991926
Energy: 1.4273133757582839
Energy: 1.3942737577047635
Energy: 1.4816016040148783
Energy: 1.3942737577038822
Energy: 1.4816016040157591
Energy: 1.3942737577056448
Energy: 1.4816016040148783
Energy: 1.4682802909861288
Energy: 1.4910658435646875
Energy: 1.4682802909861288
Energy: 1.4910658435655686
Energy: 1.4682802909843666
Energy: 1.4910658435638062
Energy: 1.5257808877789756
Energy: 1.427074529335333
Energy: 1.5257808877772532
Energy: 1.427074529335333
Energy: 1.525780887776372
Energy: 1.427074529336214
Energy: 1.403952340771393
Energy: 1.5067935757369617
Energy: 1.403952340770512
Energy: 1.5067935757369617
Energy: 1.403952340770512
Energy: 1.5067935757369617
Energy: 1.4575988421421096
Energy: 1.4714895319153334
Energy: 1.457598842143872
Energy: 1.4714895319144519
Energy: 1.4575988421429906
Energy: 1.4714895319153334
Energy: 1.5353854339308886
Energy: 1.4218393410465449
Energy: 1.535385433927364
Energy: 1.4218393410465449
Energy: 1.5353854339300075
Energy: 1.4218393410465449
Energy: 1.453232909177844
Energy: 1.527929575871085
Energy: 1.453232909177844
Energy: 1.527929575870204
Energy: 1.453232909177844
Energy: 1.527929575871085
Energy: 1.4513010962471617
Energy: 1.4927442445740746
Energy: 1.4513010962471617
Energy: 1.4927442445740746
Energy: 1.4513010962471617
Energy: 1.4927442445740746
Energy: 1.6077427632166863
Energy: 1.4291182540340606
Energy: 1.6077427632175674
Energy: 1.4291182540331793
Energy: 1.6077427632184484
Energy: 1.4291182540340606
Energy: 1.4104890584848795
Energy: 1.4820324824593705
Energy: 1.4104890584848795
Energy: 1.4820324824584894
Energy: 1.4104890584857603
Energy: 1.4820324824584894
Energy: 1.4602391173788158
Energy: 1.4663390925373863
Energy: 1.4602391173823408
Energy: 1.4663390925373863
Energy: 1.4602391173805784
Energy: 1.4663390925365052
Energy: 1.5575607558935265
Energy: 1.4228773360301108
Energy: 1.5575607558917641
Energy: 1.4228773360301108
Energy: 1.5575607558935265
Energy: 1.4228773360292295

minimum gb energy = 1.3942737577038822 eV
minimum distance =  2.21550653853807 Angstroms
sigma value = 27


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

Energy: 1.4906200876836528
Energy: 1.417660372237445
Energy: 1.4906200876814246
Energy: 1.4176603722381882
Energy: 1.4906200876821674
Energy: 1.4176603722381882
Energy: 1.4788417305183625
Energy: 1.4256556729460823
Energy: 1.478841730519105
Energy: 1.4256556729453398
Energy: 1.478841730519105
Energy: 1.4256556729460823
Energy: 1.4784736331758686
Energy: 1.3453653874727383
Energy: 1.4784736331758686
Energy: 1.3453653874727383
Energy: 1.478473633175126
Energy: 1.3453653874727383
Energy: 1.3700688723440515
Energy: 1.406274150166518
Energy: 1.3700688723455372
Energy: 1.4062741501672607
Energy: 1.3700688723329102
Energy: 1.406274150166518
Energy: 1.3743467164582628
Energy: 1.4613032820368528
Energy: 1.3743467164597483
Energy: 1.4613032820368528
Energy: 1.3743467164582628
Energy: 1.4613032820368528
Energy: 1.4564707935579104
Energy: 1.4704494176364282
Energy: 1.4564707935571677
Energy: 1.470449417637171
Energy: 1.4564707935571677
Energy: 1.4704494176364282
Energy: 1.3717743141173142
Energy: 1.4985924442858796
Energy: 1.3717743141150858
Energy: 1.4985924442858796
Energy: 1.3717743141180567
Energy: 1.4985924442858796
Energy: 1.4069601654993706
Energy: 1.4616268202616882
Energy: 1.4069601654978852
Energy: 1.461626820262431
Energy: 1.4069601654993706
Energy: 1.461626820262431
Energy: 1.4409483796777216
Energy: 1.3737367492505295
Energy: 1.4409483796784643
Energy: 1.3737367492498203
Energy: 1.4409483796769789
Energy: 1.3737367492490777
Energy: 1.4766942303365729
Energy: 1.4153810106869502
Energy: 1.4766942303380586
Energy: 1.4153810106869502
Energy: 1.4766942303388013
Energy: 1.4153810106869502
Energy: 1.471224122375057
Energy: 1.471649904593111
Energy: 1.471224122378028
Energy: 1.4716499045938538
Energy: 1.4712241223757998
Energy: 1.4716499045938538
Energy: 1.4841187901441288
Energy: 1.3577576967117577
Energy: 1.4841187901426434
Energy: 1.3577576967110148
Energy: 1.484118790143386
Energy: 1.3577576967110148
Energy: 1.4614317683738933
Energy: 1.428763753118773
Energy: 1.4614317683761215
Energy: 1.4287637531180302
Energy: 1.4614317683753788
Energy: 1.4287637531172874
Energy: 1.370328674954903
Energy: 1.4428936939962331
Energy: 1.3703286749541603
Energy: 1.4428936939969759
Energy: 1.3703286749541603
Energy: 1.4428936939962331
Energy: 1.4375298061946116
Energy: 1.468040045541484
Energy: 1.4375298061923836
Energy: 1.468040045541484
Energy: 1.437529806193869
Energy: 1.4680400455429692
Energy: 1.4044536158630159
Energy: 1.4557198587850524
Energy: 1.4044536158645013
Energy: 1.4557198587857951
Energy: 1.4044536158637588
Energy: 1.4557198587850524
Energy: 1.3548578687748576
Energy: 1.476496681069649
Energy: 1.354857868773372
Energy: 1.476496681069649
Energy: 1.354857868773372
Energy: 1.476496681069649
Energy: 1.4248717677991674
Energy: 1.3552216577747092
Energy: 1.4248717677969391
Energy: 1.3552216577739664
Energy: 1.4248717677976819
Energy: 1.3552216577747092
Energy: 1.417918497180843
Energy: 1.3738595740535995
Energy: 1.4179184971801004
Energy: 1.373859574054342
Energy: 1.417918497180843
Energy: 1.373859574054342
Energy: 1.490620087689561
Energy: 1.4176603722396737
Energy: 1.4906200876888522
Energy: 1.417660372241902
Energy: 1.490620087689561
Energy: 1.4176603722404164
Energy: 1.4788417305243042
Energy: 1.4256556729393977
Energy: 1.4788417305250472
Energy: 1.4256556729408834
Energy: 1.4788417305272754
Energy: 1.4256556729401406
Energy: 1.4784736331728976
Energy: 1.34536538747051
Energy: 1.4784736331714121
Energy: 1.34536538747051
Energy: 1.478473633172155
Energy: 1.34536538747051
Energy: 1.3700688723418233
Energy: 1.406274150159124
Energy: 1.3700688723529648
Energy: 1.4062741501613525
Energy: 1.3700688723403378
Energy: 1.4062741501554104
Energy: 1.3743467164627192
Energy: 1.4613032820420522
Energy: 1.3743467164627192
Energy: 1.4613032820413094
Energy: 1.3743467164604912
Energy: 1.4613032820413094
Energy: 1.4564707935527113
Energy: 1.4704494176438558
Energy: 1.456470793553454
Energy: 1.4704494176438558
Energy: 1.4564707935541967
Energy: 1.4704494176431129

minimum gb energy = 1.34536538747051 eV
minimum distance =  2.21121034899394 Angstroms
sigma value = 19


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

Energy: 1.3739094067661637
Energy: 1.4546621706009362
Energy: 1.3739094067661637
Energy: 1.4546621706015774
Energy: 1.3739094067668047
Energy: 1.4546621706009362
Energy: 1.413695616812635
Energy: 1.326399605806362
Energy: 1.413695616812635
Energy: 1.326399605806362
Energy: 1.413695616813917
Energy: 1.3263996058070033
Energy: 1.4192607698244262
Energy: 1.2901110408605398
Energy: 1.455121774481424
Energy: 1.2901110408598988
Energy: 1.4278272836154622
Energy: 1.2901110408605398
Energy: 1.3052263336578462
Energy: 1.4097852604824919
Energy: 1.3052263336597696
Energy: 1.4097852604824919
Energy: 1.3052263336591285
Energy: 1.409785260483133
Energy: 1.3140384549673336
Energy: 1.3654174792720308
Energy: 1.31403845496541
Energy: 1.365417479272672
Energy: 1.3140384549666924
Energy: 1.365417479272672
Energy: 1.4366666774940362
Energy: 1.3289602047373903
Energy: 1.4366666774940362
Energy: 1.3289602047373903
Energy: 1.4366666774933952
Energy: 1.3289602047373903
Energy: 1.2807199041179242
Energy: 1.3571090358926226
Energy: 1.2807199041185653
Energy: 1.3571090358919813
Energy: 1.2807199041185653
Energy: 1.3571090358919813
Energy: 1.3298462939861817
Energy: 1.4166009329869929
Energy: 1.3298462939861817
Energy: 1.416600932986352
Energy: 1.3298462939861817
Energy: 1.416600932986352
Energy: 1.4954081608663814
Energy: 1.2898610014492975
Energy: 1.4954081608657404
Energy: 1.2898610014492975
Energy: 1.4954081608657404
Energy: 1.2898610014492975
Energy: 1.331609996656129
Energy: 1.3777047738311974
Energy: 1.331609996656129
Energy: 1.3777047738311974
Energy: 1.3316099966542057
Energy: 1.3777047738311974
Energy: 1.3051649041460696
Energy: 1.444253009945359
Energy: 1.3051649041473519
Energy: 1.4442530099466413
Energy: 1.3051649041454283
Energy: 1.4442530099466413
Energy: 1.433824704486743
Energy: 1.3060185130584712
Energy: 1.433824704491231
Energy: 1.3060185130584712
Energy: 1.4338247044893075
Energy: 1.3060185130584712
Energy: 1.3245244529978253
Energy: 1.3445379019057673
Energy: 1.324524452997184
Energy: 1.344537901905126
Energy: 1.324524452996543
Energy: 1.3445379019057673
Energy: 1.3212140577023017
Energy: 1.4163800985820438
Energy: 1.321214057702943
Energy: 1.4163800985814028
Energy: 1.3212140577023017
Energy: 1.416380098582685
Energy: 1.4415197388361114
Energy: 1.2891596875412843
Energy: 1.4415197388354704
Energy: 1.2891596875419256
Energy: 1.4415197388361114
Energy: 1.2891596875425668
Energy: 1.4248999787855012
Energy: 1.288607626727878
Energy: 1.4248999787855012
Energy: 1.288607626727878
Energy: 1.4248999787855012
Energy: 1.288607626727237
Energy: 1.3170704168374592
Energy: 1.4149325952487353
Energy: 1.3170704168381004
Energy: 1.4149325952487353
Energy: 1.3170704168374592
Energy: 1.4149325952487353
Energy: 1.3987002845150733
Energy: 1.382494547420241
Energy: 1.3987002845157146
Energy: 1.3824945474208823
Energy: 1.3987002845163556
Energy: 1.3824945474208823
Energy: 1.4336116920119624
Energy: 1.3267590159295475
Energy: 1.433611692011321
Energy: 1.3267590159295475
Energy: 1.433611692011321
Energy: 1.3267590159301887
Energy: 1.3130414446705014
Energy: 1.4401933419914252
Energy: 1.3130414446692193
Energy: 1.4401933419914252
Energy: 1.3130414446692193
Energy: 1.4401933419914252
Energy: 1.2764858990528436
Energy: 1.429540595815287
Energy: 1.2764858990541257
Energy: 1.4295405958146459
Energy: 1.2764858990534846
Energy: 1.429540595815287
Energy: 1.4921215838290942
Energy: 1.3043376170527632
Energy: 1.4921215838290942
Energy: 1.3043376170527632
Energy: 1.492121583828453
Energy: 1.3043376170527632
Energy: 1.3693709153030653
Energy: 1.3694742784265765
Energy: 1.3693709153037066
Energy: 1.3694742784265765
Energy: 1.3693709153037066
Energy: 1.3694742784265765
Energy: 1.367662575076498
Energy: 1.45539924096086
Energy: 1.36766257507778
Energy: 1.45539924096086
Energy: 1.3676625750758569
Energy: 1.4553992409595777
Energy: 1.4363981134190142
Energy: 1.3042713780718989
Energy: 1.4363981134164494
Energy: 1.3042713780718989
Energy: 1.4363981134190142
Energy: 1.30427137807254
Energy: 1.34659429257906
Energy: 1.3290112307577537
Energy: 1.3465942925803422
Energy: 1.3290112307577537
Energy: 1.346594292579701
Energy: 1.3290112307571127
Energy: 1.28796010539428
Energy: 1.4208556772087855
Energy: 1.2879601053936387
Energy: 1.4208556772081444
Energy: 1.28796010539428
Energy: 1.4208556772087855
Energy: 1.4167805113375564
Energy: 1.3264234249111355
Energy: 1.4167805113362741
Energy: 1.3264234249111355
Energy: 1.4167805113362741
Energy: 1.3264234249111355
Energy: 1.4280360698956527
Energy: 1.3261743424921935
Energy: 1.4280360698950116
Energy: 1.3261743424909112
Energy: 1.4280360698956527
Energy: 1.3261743424915522

minimum gb energy = 1.2764858990528436 eV
minimum distance =  2.20557446388402 Angstroms
sigma value = 101


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

Energy: 1.2833349498144224
Energy: 1.4194381588023766
Energy: 1.2833349498155497
Energy: 1.419438158801813
Energy: 1.2833349498149862
Energy: 1.419438158801813
Energy: 1.363227286708368
Energy: 1.274908519919431
Energy: 1.3632272867089317
Energy: 1.2749085199199945
Energy: 1.363227286710622
Energy: 1.254051490443562
Energy: 1.3732655887161216
Energy: 1.2491385780560178
Energy: 1.3732655887155578
Energy: 1.2491385780560178
Energy: 1.3732655887161216
Energy: 1.2491385780565816
Energy: 1.2095210339570641
Energy: 1.4160728434360106
Energy: 1.2095210339576274
Energy: 1.416072843437701
Energy: 1.2095210339553735
Energy: 1.3750428947896425
Energy: 1.2398777133895642
Energy: 1.2955310564547906
Energy: 1.2398777133878736
Energy: 1.2955310564547906
Energy: 1.2398777133878736
Energy: 1.2955310564547906
Energy: 1.3848627557701274
Energy: 1.2364666938015483
Energy: 1.3848627557684365
Energy: 1.2364666938015483
Energy: 1.384862755769
Energy: 1.2364666938015483
Energy: 1.2464246238403578
Energy: 1.3330033346006522
Energy: 1.246424623844303
Energy: 1.3330033346000887
Energy: 1.2464246238403578
Energy: 1.3330033346000887
Energy: 1.2085937224314678
Energy: 1.333299286468844
Energy: 1.2085937224309042
Energy: 1.4742179354252123
Energy: 1.2085937224309042
Energy: 1.3711775939152726
Energy: 1.3619209122479605
Energy: 1.2374039004659363
Energy: 1.3619209122507785
Energy: 1.2374039004659363
Energy: 1.361920912250215
Energy: 1.2374039004653727
Energy: 1.2963752869126466
Energy: 1.315624378555749
Energy: 1.2963752869137737
Energy: 1.315624378555749
Energy: 1.2963752869143372
Energy: 1.3156243785563124
Energy: 1.2078607416992053
Energy: 1.5230939162508732
Energy: 1.2078607417003324
Energy: 1.5230939162508732
Energy: 1.2078607417003324
Energy: 1.5230939162508732
Energy: 1.346439880477758
Energy: 1.2723257041974463
Energy: 1.346439880477758
Energy: 1.2755035594389186
Energy: 1.3464398804743765
Energy: 1.2552388164632422
Energy: 1.3736795496042637
Energy: 1.2493124326073475
Energy: 1.3736795496025729
Energy: 1.2493124326073475
Energy: 1.3736795496042637
Energy: 1.2493124326073475
Energy: 1.2863648236503866
Energy: 1.4074895296510561
Energy: 1.2863648236503866
Energy: 1.4074895296510561
Energy: 1.286364823651514
Energy: 1.4074895296521834
Energy: 1.2850520549565636
Energy: 1.3072514354929723
Energy: 1.285052054956
Energy: 1.3072514354929723
Energy: 1.2850520549571272
Energy: 1.3072514354924087
Energy: 1.3727492884400998
Energy: 1.2519119373652503
Energy: 1.3727492884395363
Energy: 1.2519119373652503
Energy: 1.3727492884395363
Energy: 1.2519119373652503
Energy: 1.2077290703963426
Energy: 1.3249780186191478
Energy: 1.2077290703923975
Energy: 1.324978018617457
Energy: 1.2077290703969061
Energy: 1.3249780186163298
Energy: 1.2042104430433072
Energy: 1.3551366152787416
Energy: 1.2042104430359806
Energy: 1.3551366152776143
Energy: 1.2042104430404894
Energy: 1.355136615278178
Energy: 1.3604145067247102
Energy: 1.2373876394377457
Energy: 1.3604145067230196
Energy: 1.2373876394377457
Energy: 1.360414506725274
Energy: 1.2373876394377457
Energy: 1.2540785748941534
Energy: 1.2912777923029621
Energy: 1.2540785748941534
Energy: 1.2912777923029621
Energy: 1.2540785748941534
Energy: 1.2912777923023986
Energy: 1.2234549764767835
Energy: 1.5077610633018086
Energy: 1.22345497647622
Energy: 1.5077610633023721
Energy: 1.2234549764767835
Energy: 1.5077610633023721
Energy: 1.390720492370669
Energy: 1.2353349339169113
Energy: 1.390720492373487
Energy: 1.2353349339174748
Energy: 1.3907204923712326
Energy: 1.2353349339197293
Energy: 1.3971013346837218
Energy: 1.2353724935629218
Energy: 1.3971013346842853
Energy: 1.2353724935629218
Energy: 1.3971013346859762
Energy: 1.2353724935617945
Energy: 1.209768882363093
Energy: 1.4181556974627194
Energy: 1.2097688823642203
Energy: 1.418155697462156
Energy: 1.209768882361966
Energy: 1.4181556974632832
Energy: 1.346348345126215
Energy: 1.2930264331662547
Energy: 1.3463483451273424
Energy: 1.2930264331662547
Energy: 1.346348345127906
Energy: 1.2930264331656913
Energy: 1.3726304340363642
Energy: 1.2519415172391954
Energy: 1.3726304340352369
Energy: 1.2519415172386317
Energy: 1.3726304340352369
Energy: 1.2519415172391954
Energy: 1.2827211402217564
Energy: 1.387807043616764
Energy: 1.2827211402217564
Energy: 1.3878070436173275
Energy: 1.2827211402211927
Energy: 1.3878070436173275
Energy: 1.283325910912834
Energy: 1.319008785565758
Energy: 1.2833259109133976
Energy: 1.319008785564631
Energy: 1.2833259109133976
Energy: 1.319008785564631
Energy: 1.417748616510126
Energy: 1.2493700789117175
Energy: 1.4177486165084354
Energy: 1.2493700789117175
Energy: 1.4177486165095625
Energy: 1.2493700789111537
Energy: 1.2042851416128602
Energy: 1.3176070766801948
Energy: 1.2042851416111693
Energy: 1.3176070766768133
Energy: 1.2042851416117328
Energy: 1.3176070766779404
Energy: 1.2075161140835062
Energy: 1.3823288548326265
Energy: 1.2075161140835062
Energy: 1.38232885483319
Energy: 1.2075161140823791
Energy: 1.3823288548326265
Energy: 1.4245509079071792
Energy: 1.2353183741598623
Energy: 1.424550907907743
Energy: 1.2353183741598623
Energy: 1.4245509079094336
Energy: 1.2353183741598623
Energy: 1.3950850804600765
Energy: 1.23555404930591
Energy: 1.3950850804600765
Energy: 1.2355540493064736
Energy: 1.395085080459513
Energy: 1.2355540493064736

minimum gb energy = 1.2042104430359806 eV
minimum distance =  2.2334551609582 Angstroms
sigma value = 33


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

Energy: 0.020254209733668597
Energy: 0.8979445087835927
Energy: 0.02025420973413687
Energy: 0.8979445087840611
Energy: 0.020254209733668597
Energy: 0.8979445087835927
Energy: 0.02102691933029739
Energy: 0.43627572778630624
Energy: 0.02102691933029739
Energy: 0.4362757277854218
Energy: 0.021026919330765666
Energy: 0.43627572778589
Energy: 0.8979626700842192
Energy: 0.43767264253872357
Energy: 0.8979647798688531
Energy: 0.4376726425369026
Energy: 0.8979624664086269
Energy: 0.43767264253185556
Energy: 0.02102691933211845
Energy: 0.43627572778589
Energy: 0.021026919333471235
Energy: 0.43627572778589
Energy: 0.021026919333471235
Energy: 0.4362757277849535

minimum gb energy = 0.020254209733668597 eV
minimum distance =  2.48313075554831 Angstroms
sigma value = 1