Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.8667457550764093
cohesive_energy=4.280654192612446
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.0131732019160894
Energy: 0.01366345561936282
Energy: 2.7052316510460446
Energy: 0.01366345561936282
Energy: 0.01366345561936282
Energy: 0.013963347079505974
Energy: 0.3914352778611393
Energy: 0.013963347079505974
Energy: 2.7052316510460446
Energy: 0.39143527786210897
Energy: 0.013541750537635054
Energy: 0.39143527786210897
Energy: 0.01366345561936282
Energy: 0.013963347079505974
Energy: 0.3914352778611393
Energy: 0.013963347079505974

minimum gb energy = 0.0131732019160894 eV
minimum distance =  2.4795091134604 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.797920770509337
Energy: 1.2538802413618926
Energy: 1.1562633866336123
Energy: 1.2538802413618926
Energy: 1.821956188754072
Energy: 1.1187066608758003
Energy: 1.2021377271217522
Energy: 1.1187066608758003
Energy: 1.9796596395321575
Energy: 1.159246829289729
Energy: 1.1504599601485028
Energy: 1.1592468292885194
Energy: 1.5920454809369238
Energy: 1.1241531755959489
Energy: 1.2270285704958648
Energy: 1.124153175598368
Energy: 1.5924867347113123
Energy: 1.1247606628599636
Energy: 1.642663692692712
Energy: 1.1247606628599636
Energy: 1.8478971959239756
Energy: 1.1237863358010345
Energy: 1.1244713450954986
Energy: 1.1237863358022444
Energy: 1.3705000869834978
Energy: 1.2156945227677527
Energy: 1.1240409934637792
Energy: 1.2156945227689624
Energy: 1.1248312680295522
Energy: 1.119038075128547
Energy: 1.6431253314214969
Energy: 1.119038075128547
Energy: 1.3847469991247146
Energy: 1.1201406590198861
Energy: 1.5988351115127961
Energy: 1.1201406590223053
Energy: 1.9179680615865242
Energy: 1.1193025927703877
Energy: 1.4553479415170643
Energy: 1.1193025927691778
Energy: 1.1608543477710884
Energy: 1.2165705518876953
Energy: 1.4907116525566453
Energy: 1.2165705518901146
Energy: 1.1363619341084932
Energy: 1.1365380303145236
Energy: 2.0089803051039077
Energy: 1.1365380303133141
Energy: 1.3864555320009757
Energy: 1.215102224908626
Energy: 1.6011652864068915
Energy: 1.2151022249098355
Energy: 1.1772181054457698
Energy: 1.1190046949694263
Energy: 1.604532102875016
Energy: 1.1190046949694263
Energy: 1.1916942025575874
Energy: 1.1195742228741146
Energy: 1.8429272887828527
Energy: 1.1195742228741146
Energy: 1.1767643975570854
Energy: 1.1208275193385677
Energy: 1.844145431850341
Energy: 1.1208275193397772
Energy: 1.1774960179039695
Energy: 1.1247713958291714
Energy: 1.6010065745670217
Energy: 1.1247713958291714
Energy: 1.3867644312075162
Energy: 1.2155633281503657
Energy: 1.598337440905329
Energy: 1.2155633281503657
Energy: 1.1368137540480556
Energy: 1.1363897713044613
Energy: 2.011021972479386
Energy: 1.136389771302042
Energy: 1.1597596095819023
Energy: 1.2162497811043633
Energy: 1.3875314116449606
Energy: 1.2162497811055728
Energy: 1.9152062653576967
Energy: 1.1240414166090837
Energy: 1.377929008826889
Energy: 1.124041416611503
Energy: 1.3870121438349092
Energy: 1.1244791089161474
Energy: 1.5991401724356928
Energy: 1.1244791089137283
Energy: 1.2546680638531826
Energy: 1.1196413097583409
Energy: 1.3838106699280952
Energy: 1.1196413097559217
Energy: 1.61623364172475
Energy: 1.215891818053081
Energy: 1.1236398999235233
Energy: 1.2158918180518714
Energy: 1.848210172679062
Energy: 1.1238101410867172
Energy: 1.1647674689000103
Energy: 1.1238101410855077
Energy: 1.5920758352017008
Energy: 1.1236033773514302
Energy: 1.6449516019684998
Energy: 1.1236033773490108
Energy: 1.5956387187263228
Energy: 1.1241326801350386
Energy: 1.166531257646076
Energy: 1.1241326801302
Energy: 2.1054056429786487
Energy: 1.159499900976229
Energy: 1.1438998953531232
Energy: 1.1594999009738096
Energy: 1.8249123906035407
Energy: 1.118744720190804
Energy: 1.1595544171690848
Energy: 1.118744720190804
Energy: 1.796527879771723
Energy: 1.1385071393446127
Energy: 1.1610499786286876
Energy: 1.1385071393482415
Energy: 1.8221249746592785
Energy: 1.1190404296452598
Energy: 1.227900488545601
Energy: 1.1190404296452598
Energy: 1.8571608440497174
Energy: 1.1330937186981016
Energy: 1.138133156605143
Energy: 1.1330937186981016
Energy: 1.5996273039962288
Energy: 1.1240590571904419
Energy: 1.2282711671301545
Energy: 1.1240590571916516

minimum gb energy = 1.1187066608758003 eV
minimum distance =  2.37215099216648 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.9530372909050315
Energy: 1.856167620631779
Energy: 1.2502262243438902
Energy: 1.856167620631779
Energy: 1.6921160761065062
Energy: 1.2759811807637607
Energy: 1.3264586396076898
Energy: 1.2759811807637607
Energy: 1.7120064069809318
Energy: 1.212938079582634
Energy: 1.235883975421708
Energy: 1.212938079582634
Energy: 1.1707293807913774
Energy: 1.184829802397374
Energy: 1.3268855690679195
Energy: 1.184829802397374
Energy: 1.1706694251397594
Energy: 1.185058778355738
Energy: 1.791220123287764
Energy: 1.1850587783571171
Energy: 1.7112636560085404
Energy: 1.1852843121192957
Energy: 1.184123841918058
Energy: 1.1852843121192957
Energy: 1.2511230255843795
Energy: 1.2761251122539201
Energy: 1.1839821253153482
Energy: 1.2761251122539201
Energy: 1.1837675914544694
Energy: 1.1843751846837287
Energy: 1.7919662124569051
Energy: 1.1843751846837287
Energy: 1.225950240953814
Energy: 1.2751541778211721
Energy: 1.7121138811838228
Energy: 1.2751541778211721
Energy: 1.261644741169966
Energy: 1.1716118095745125
Energy: 1.170597601143992
Energy: 1.1716118095745125
Energy: 1.2254200944302653
Energy: 1.293593776130248
Energy: 1.7130889692763644
Energy: 1.293593776130248
Energy: 1.185360542311519
Energy: 1.1839287122951894
Energy: 2.243843188038828
Energy: 1.1839287122951894
Energy: 1.2621763736858687
Energy: 1.1712004754794494
Energy: 1.6911085866317734
Energy: 1.1712004754794494
Energy: 1.2621763736872478
Energy: 1.1712020659509943
Energy: 1.6910838266344888
Energy: 1.1712020659509943
Energy: 1.1845091238676269
Energy: 1.1839472264321187
Energy: 2.243809763331132
Energy: 1.1839472264321187
Energy: 1.2252529709180207
Energy: 1.2935607490390748
Energy: 1.71303679781765
Energy: 1.2935607490376955
Energy: 1.261644741167208
Energy: 1.1716791677039604
Energy: 1.1707509382260206
Energy: 1.171679167702581
Energy: 1.2259801989921277
Energy: 1.2750647661883379
Energy: 1.7121255608133805
Energy: 1.2750647661883379
Energy: 1.1837732654789916
Energy: 1.1843788784034044
Energy: 1.791966212454147
Energy: 1.1843788784020253
Energy: 1.2511301400502919
Energy: 1.276264193526884
Energy: 1.1840450617218627
Energy: 1.276264193526884
Energy: 1.7112339884345509
Energy: 1.1852349721200957
Energy: 1.184136351900189
Energy: 1.1852349721214748
Energy: 1.170626209564349
Energy: 1.1852245849006293
Energy: 1.7912201232822476
Energy: 1.1852245848992502
Energy: 1.1707630468034547
Energy: 1.18485234584054
Energy: 1.3268855690734047
Energy: 1.18485234584054
Energy: 1.7119616747958983
Energy: 1.2128787512267072
Energy: 1.2351947337574374
Energy: 1.2128787512267072
Energy: 1.6920198942349947
Energy: 1.2759845181265024
Energy: 1.3264586396090692
Energy: 1.2759845181278813
Energy: 1.9530372909050315
Energy: 1.856167620631779
Energy: 1.25022622470507
Energy: 1.856167620631779
Energy: 1.692116076103748
Energy: 1.2759811807637607
Energy: 1.3264586396076898
Energy: 1.2759811807637607
Energy: 1.7120064069809318
Energy: 1.212938079582634
Energy: 1.235883975421708
Energy: 1.212938079582634
Energy: 1.1707293807899986
Energy: 1.184829802397374
Energy: 1.3268855690679195
Energy: 1.184829802397374

minimum gb energy = 1.170597601143992 eV
minimum distance =  2.36654881273485 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.7010885459682499
Energy: 1.2916952702422053
Energy: 1.3006879829966316
Energy: 1.2916952702422053
Energy: 1.7981578496845518
Energy: 1.261651662894993
Energy: 1.388656294057893
Energy: 1.2616516628933898
Energy: 1.8434859871031062
Energy: 1.2791989347491861
Energy: 1.279790908265307
Energy: 1.2791989347491861
Energy: 1.5873396538962339
Energy: 1.2474882957932132
Energy: 1.3889652286801002
Energy: 1.2474882957932132
Energy: 1.5872721585414304
Energy: 1.2474185008198038
Energy: 1.5755459878780729
Energy: 1.2474185008198038
Energy: 1.839569091407999
Energy: 1.262815214753036
Energy: 1.2617417621672278
Energy: 1.2628152147514327
Energy: 1.3138600389755966
Energy: 1.248627543423823
Energy: 1.2621242887473583
Energy: 1.2486275434222198
Energy: 1.249324342952873
Energy: 1.2847316500146027
Energy: 1.8960445936757222
Energy: 1.2847316500146027
Energy: 1.3360524808042629
Energy: 1.3782076828453473
Energy: 1.578440205781325
Energy: 1.3782076828453473
Energy: 1.3274684822543665
Energy: 1.2467910749237479
Energy: 1.6964620643324773
Energy: 1.2467910749221447
Energy: 1.3322203997089208
Energy: 1.3765838726498942
Energy: 1.8089604347110009
Energy: 1.3765838726514976
Energy: 1.338570330566669
Energy: 1.283570260627097
Energy: 1.8079156317850522
Energy: 1.2835702606287
Energy: 1.3274920949453168
Energy: 1.2472356017500201
Energy: 1.5852067648309365
Energy: 1.2472356017500201
Energy: 1.32765948370072
Energy: 1.3766072636521147
Energy: 1.5770061420138266
Energy: 1.3766072636521147
Energy: 1.2830985903383567
Energy: 1.2843709337543705
Energy: 2.06479335283726
Energy: 1.2843709337527671
Energy: 1.3135717721858846
Energy: 1.2485603735910578
Energy: 1.282984385645911
Energy: 1.2485603735894546
Energy: 2.232050424726781
Energy: 1.26262403029547
Energy: 1.2618185029580649
Energy: 1.2626240302970733
Energy: 1.5775801673263061
Energy: 1.2474508158384223
Energy: 1.5765669510431113
Energy: 1.2474508158384223
Energy: 1.4339488292810938
Energy: 1.2476226998798559
Energy: 1.3887390317529718
Energy: 1.2476226998798559
Energy: 1.548473326940079
Energy: 1.2620628173007467
Energy: 1.2753467448037359
Energy: 1.2620628173007467
Energy: 1.7977797551351404
Energy: 1.261801229311532
Energy: 1.2751649285252438
Energy: 1.261801229311532
Energy: 1.700962655213473
Energy: 1.2443868070676394
Energy: 1.3294702773215052
Energy: 1.2443868070676394
Energy: 1.7984780398205789
Energy: 1.378860775204372
Energy: 1.3885106186726792
Energy: 1.3788607752059754
Energy: 1.843713323424758
Energy: 1.2783237779717518
Energy: 1.277937880188898
Energy: 1.2783237779701486
Energy: 1.5874162025696033
Energy: 1.247387554618149
Energy: 1.278119233776478
Energy: 1.2473875546165458

minimum gb energy = 1.2443868070676394 eV
minimum distance =  2.38193329016144 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.3136259469623328
Energy: 1.3132656082445748
Energy: 1.4243210931714736
Energy: 1.313265608244379
Energy: 1.361054906177157
Energy: 1.331956198931955
Energy: 1.332655643734738
Energy: 1.3319561989313904
Energy: 1.3786753337595972
Energy: 1.3733233795516637
Energy: 1.3730021070106835
Energy: 1.3733233795518591
Energy: 1.332085943341092
Energy: 1.3318237458700342
Energy: 1.3326416233988665
Energy: 1.3318237458704254
Energy: 1.3320915714058739
Energy: 1.3319346663266276
Energy: 1.3785544428759104
Energy: 1.3319346663266276
Energy: 2.164818221326706
Energy: 1.3317472566571666
Energy: 1.3319440781848546
Energy: 1.3317472566567754
Energy: 1.3728796118818585
Energy: 1.3319370371965658
Energy: 1.3326886205195454
Energy: 1.331937037197522
Energy: 1.3734368033617648
Energy: 1.3731640751243281
Energy: 1.9877477121827236
Energy: 1.3731640751239371
Energy: 1.5345933934711562
Energy: 1.331859834209708
Energy: 1.3127016369111484
Energy: 1.331859834209708
Energy: 1.5030287863828073
Energy: 1.313195954284488
Energy: 1.3130193048778
Energy: 1.3131959542848575
Energy: 1.3320776018942428
Energy: 1.4783629037141497
Energy: 1.988459295155117
Energy: 1.4783629037145407
Energy: 1.3740320406599305
Energy: 1.3134362214800246
Energy: 1.3792413844652174
Energy: 1.3134362214805895
Energy: 1.535617925679955
Energy: 1.337128382212533
Energy: 1.3324582063896986
Energy: 1.3371283822123374
Energy: 1.372847414943806
Energy: 1.4458070028661978
Energy: 1.372875126141076
Energy: 1.4458070028663934
Energy: 1.3324587447358225
Energy: 1.3371214753503327
Energy: 1.5356179256811069
Energy: 1.337121475349376
Energy: 1.3790762793778053
Energy: 1.313593650557022
Energy: 1.3740139447243647
Energy: 1.313593650557022
Energy: 1.9884471809677684
Energy: 1.4784287378365253
Energy: 1.3320105447558461
Energy: 1.4784287378359604
Energy: 1.3130058231547204
Energy: 1.313269373676869
Energy: 1.5030287863843503
Energy: 1.313269373676869
Energy: 1.312779435593306
Energy: 1.3319006844024424
Energy: 1.5345933934715472
Energy: 1.3319006844026378
Energy: 1.9877061838779317
Energy: 1.3731629083940493
Energy: 1.3734298726558738
Energy: 1.3731629083936798
Energy: 1.3325378815122515
Energy: 1.3319005969891247
Energy: 1.372916323599369
Energy: 1.331900596989516

minimum gb energy = 1.3127016369111484 eV
minimum distance =  2.35040068105793 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.4325822641621735
Energy: 1.6957558700127642
Energy: 1.5045581991592039
Energy: 1.6957558700122803
Energy: 1.8159247022334715
Energy: 1.503680629887756
Energy: 1.4407012144076465
Energy: 1.503680629887756
Energy: 1.5523723501242528
Energy: 1.4250858612204624
Energy: 1.4241264333766164
Energy: 1.425085861219038
Energy: 1.3796745064763878
Energy: 1.4792678816397327
Energy: 1.3978991056696835
Energy: 1.4792678816404314
Energy: 1.4791063409075536
Energy: 1.504230630665153
Energy: 1.8607352329059936
Energy: 1.5042306306639703
Energy: 1.8663999999626217
Energy: 1.420519162074343
Energy: 1.4200949600386032
Energy: 1.420519162073402
Energy: 1.5362969000451476
Energy: 1.478963340886699
Energy: 1.4202658582341257
Energy: 1.478963340886941
Energy: 1.5487559346144377
Energy: 1.490967366336075
Energy: 1.8585939199094343
Energy: 1.4909673663370158
Energy: 1.4902772660143573
Energy: 1.4200122234483588
Energy: 1.419664730787225
Energy: 1.4200122234490573
Energy: 1.5517364872104373
Energy: 1.4199870162825101
Energy: 1.4201492769102564
Energy: 1.419987016281784
Energy: 1.4336246645358863
Energy: 1.4796609396040115
Energy: 1.827486815475032
Energy: 1.4796609396049518
Energy: 1.4791988453361735
Energy: 1.420448075668035
Energy: 1.4244245772187303
Energy: 1.4204480756675784
Energy: 1.8010343203601127
Energy: 1.4249807042059357
Energy: 1.4245725073541597
Energy: 1.4249807042056937
Energy: 1.7995598720433612
Energy: 1.5051940466445888
Energy: 1.633198425404076
Energy: 1.5051940466441323
Energy: 1.6546377311224656
Energy: 1.5043551492800766
Energy: 1.58462069775373
Energy: 1.5043551492800766
Energy: 1.7772723332499805
Energy: 1.4101561126501363
Energy: 1.3974190740949697
Energy: 1.4101561126501363
Energy: 1.4790493226382073
Energy: 1.420007202172601
Energy: 1.4245831191767082
Energy: 1.4200072021730845

minimum gb energy = 1.3796745064763878 eV
minimum distance =  2.34755814117788 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.9320539781408719
Energy: 1.676543024004607
Energy: 1.5545212275214488
Energy: 1.676543024004607
Energy: 1.6916255804636777
Energy: 1.540367178764244
Energy: 1.5316216594712602
Energy: 1.5403671787655835
Energy: 1.6350400089107169
Energy: 1.507234946968836
Energy: 1.4767565914474923
Energy: 1.507234946968836
Energy: 1.4800495650132364
Energy: 1.4729737829520055
Energy: 1.503698716093456
Energy: 1.472973782950666
Energy: 1.515248302457825
Energy: 1.5363901439713996
Energy: 1.6952271316762264
Energy: 1.5363901439713996
Energy: 1.7101187102587112
Energy: 1.643229168112966
Energy: 1.4977307373963842
Energy: 1.6432291681169846
Energy: 1.5721411152307572
Energy: 1.4760289597839258
Energy: 1.6861175351732962
Energy: 1.4760289597852654
Energy: 1.5147584768773275
Energy: 1.4726503744337949
Energy: 1.7579337118019998
Energy: 1.4726503744337949
Energy: 1.4885001080348002
Energy: 1.52361849050575
Energy: 1.45285342612991
Energy: 1.52361849050575
Energy: 1.7293337688374624
Energy: 1.5593577632515139
Energy: 1.5223001367714692
Energy: 1.5593577632515139
Energy: 1.503190037994022
Energy: 1.5009321855910231
Energy: 1.7107653889277765
Energy: 1.5009321855910231
Energy: 1.5044791361418217
Energy: 1.5234314602735248
Energy: 1.5349127277537995
Energy: 1.5234314602735248
Energy: 1.7313216026767968
Energy: 1.5376876669011026
Energy: 1.552206621783046
Energy: 1.5376876668997628
Energy: 1.508246732935803
Energy: 1.5011709892917684
Energy: 1.538084972737749
Energy: 1.5011709892917684
Energy: 1.5004361100455321
Energy: 1.5887236179398263
Energy: 1.7581860492536383
Energy: 1.5887236179425055
Energy: 1.7768865086506815
Energy: 1.5233537182158976
Energy: 1.4534122435363965
Energy: 1.5233537182172374
Energy: 1.5007604653996283
Energy: 1.5221233225852977
Energy: 1.5222178496800023
Energy: 1.5221233225839585
Energy: 1.489451610459388
Energy: 1.5512329719583366
Energy: 1.697316353839002
Energy: 1.5512329719583366
Energy: 1.5720868126639185
Energy: 1.5010314118115584
Energy: 1.5976000412364983
Energy: 1.5010314118115584
Energy: 1.8208322322316242
Energy: 1.558059072598258
Energy: 1.6813023332348302
Energy: 1.5580590725995975
Energy: 1.471909025331154
Energy: 1.560917679104456
Energy: 1.7395081301293112
Energy: 1.5609176791031165
Energy: 1.4721722913173891
Energy: 1.5225500818184732
Energy: 1.5073862671333718
Energy: 1.5225500818198128
Energy: 1.7290941690269683
Energy: 1.507657247395314
Energy: 1.5073305516949935
Energy: 1.507657247395314
Energy: 1.6786995125635598
Energy: 1.4562818625026568
Energy: 1.651859931834233
Energy: 1.4562818625039964
Energy: 1.6806321979879006
Energy: 1.4567371820754726
Energy: 1.6520115591825053
Energy: 1.456737182074133
Energy: 1.7142419310367087
Energy: 1.508379122570705
Energy: 1.5071259279102172
Energy: 1.508379122570705
Energy: 1.4727598862910556
Energy: 1.5231218564177578
Energy: 1.5074295219975862
Energy: 1.5231218564177578
Energy: 1.4749918194372884
Energy: 1.4721779744189518
Energy: 1.7695319058153198
Energy: 1.4721779744176124
Energy: 1.6129553390272124
Energy: 1.5580501970065672
Energy: 1.6802325391432378
Energy: 1.5580501970052278
Energy: 1.5511412008834855
Energy: 1.5011607431327036
Energy: 1.4971014503203934
Energy: 1.501160743131364

minimum gb energy = 1.45285342612991 eV
minimum distance =  2.33020469598025 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.5324124734418527
Energy: 1.5316310900460486
Energy: 1.6922566623769237
Energy: 1.5316310900448225
Energy: 1.51610124215779
Energy: 1.5664828669090929
Energy: 1.5318752889403842
Energy: 1.566482866910004
Energy: 1.5323988805916453
Energy: 1.4871249875886665
Energy: 1.4876812966017858
Energy: 1.487124987588351
Energy: 1.4876869688300782
Energy: 1.4868729264604847
Energy: 1.5322488566744294
Energy: 1.4868729264595384
Energy: 1.531890314017391
Energy: 1.5665114796167199
Energy: 1.516088029652511
Energy: 1.5665114796164048
Energy: 1.6922566618677
Energy: 1.531631090046364
Energy: 1.5324124734418527
Energy: 1.5316310900448225
Energy: 1.5318752889403842
Energy: 1.5664828669096884
Energy: 1.5161012421574744
Energy: 1.5664828669090929
Energy: 1.4876812966014703
Energy: 1.487124987588351
Energy: 1.5323988805978133
Energy: 1.487124987588351
Energy: 1.532248856667631
Energy: 1.4868729264604847
Energy: 1.4876869688300782
Energy: 1.4868729264608003
Energy: 1.516088029653422
Energy: 1.5665114796157735
Energy: 1.531890314017391
Energy: 1.566511479616089
Energy: 1.5324124734418527
Energy: 1.531631090045418
Energy: 1.6922566612179148
Energy: 1.531631090044507
Energy: 1.5161012421583857
Energy: 1.5664828669096884
Energy: 1.5318752889403842
Energy: 1.5664828669094084
Energy: 1.5323988806138282
Energy: 1.4871249875886665
Energy: 1.4876812966021011
Energy: 1.487124987588351

minimum gb energy = 1.4868729264595384 eV
minimum distance =  2.42612219673937 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.7330797885981752
Energy: 1.7777614601498437
Energy: 1.7474091679733734
Energy: 1.7777614601498437
Energy: 1.9214568527043603
Energy: 1.6849467872624926
Energy: 1.6675372772028356
Energy: 1.6849467872613513
Energy: 1.6318487923226928
Energy: 1.5759103508229841
Energy: 1.5745093245365236
Energy: 1.5759103508218426
Energy: 1.56906572262444
Energy: 1.604719509599867
Energy: 1.667731761417225
Energy: 1.6047195095987257
Energy: 1.6289953051593105
Energy: 1.5574086089629546
Energy: 1.9376805315710486
Energy: 1.5574086089652375
Energy: 1.8741649572945183
Energy: 1.6774472105443967
Energy: 1.7311104885682493
Energy: 1.6774472105443967
Energy: 1.6386792469776776
Energy: 1.6626756323889584
Energy: 1.9359542221990336
Energy: 1.6626756323889584
Energy: 1.5569767912254266
Energy: 1.5901945473283128
Energy: 1.6284964574409535
Energy: 1.5901945473294543
Energy: 1.6318966704323206
Energy: 1.5759404427863426
Energy: 1.5973393422447755
Energy: 1.5759404427863426
Energy: 1.7229217292009997
Energy: 1.5759627448399183
Energy: 1.6445235085259753
Energy: 1.5759627448433422
Energy: 1.5647555637965413
Energy: 1.6897559601119876
Energy: 1.8459831778834654
Energy: 1.6897559601131291
Energy: 1.9026686266146828
Energy: 1.6543361665589165
Energy: 1.5813601557703594
Energy: 1.654336166560058
Energy: 1.6493644903431341
Energy: 1.5698685976013758
Energy: 1.5716220738912794
Energy: 1.5698685976013758
Energy: 1.621173757103153
Energy: 1.714901131947439
Energy: 1.7453899582298773
Energy: 1.7149011319497218
Energy: 1.6131914450253007
Energy: 1.5886414025598343
Energy: 1.5796017772623638
Energy: 1.5886414025609759
Energy: 1.8626559183146487
Energy: 1.5702564178125007
Energy: 1.5759492184479478
Energy: 1.5702564178102179
Energy: 1.7430062855796316
Energy: 1.6418104993933218
Energy: 1.9540960992691245
Energy: 1.6418104993921805
Energy: 1.567842554446228
Energy: 1.6854521110531209
Energy: 1.6415987255922058
Energy: 1.685452111056545
Energy: 1.7959016734549753
Energy: 1.7446217257135073
Energy: 1.6135440930177711
Energy: 1.7446217257135073
Energy: 1.6044972537424829
Energy: 1.6843182396091556
Energy: 1.6004333190137285
Energy: 1.6843182396091556
Energy: 1.5656428706114005
Energy: 1.5906961645142905
Energy: 1.6469410108259628
Energy: 1.5906961645165731
Energy: 1.7765346921817085
Energy: 1.5625622082826531
Energy: 1.7085937348930018
Energy: 1.5625622082815118
Energy: 1.6843998460025382
Energy: 1.674042988855428
Energy: 1.7093014460154594
Energy: 1.674042988855428
Energy: 1.6251022585510224
Energy: 1.6893014299209406
Energy: 1.8345478672145457
Energy: 1.6893014299220819
Energy: 1.585795773398759
Energy: 1.5936510593346553
Energy: 1.5876280293803662
Energy: 1.5936510593357966
Energy: 1.7026763756899108
Energy: 1.624183219605323
Energy: 1.5860841710455826
Energy: 1.62418321960304
Energy: 1.9620004410196163
Energy: 1.555371148879133
Energy: 1.78902794625807
Energy: 1.5553711488825572
Energy: 1.7068145949613827
Energy: 1.554433467249656
Energy: 1.7887862037393183
Energy: 1.554433467249656
Energy: 1.8041221438512913
Energy: 1.6241736199613226
Energy: 1.6067547539989289
Energy: 1.624173619960181
Energy: 1.587923700903694
Energy: 1.7066260114377085
Energy: 1.5864071908144255
Energy: 1.7066260114399914
Energy: 1.6217940547335898
Energy: 1.6893876633631615
Energy: 1.8193529727414666
Energy: 1.6893876633654443
Energy: 1.6843082637500235
Energy: 1.56292128432187
Energy: 1.707550812413918
Energy: 1.5629212843207287
Energy: 1.9300891907616757
Energy: 1.5619372530588247
Energy: 1.7075635826957807
Energy: 1.5619372530588247
Energy: 1.5863426535130571
Energy: 1.5954069208778177
Energy: 1.6467797455773188
Energy: 1.5954069208789592
Energy: 1.5841734300487764
Energy: 1.6838311754071802
Energy: 1.6027275491150763
Energy: 1.6838311754014732

minimum gb energy = 1.554433467249656 eV
minimum distance =  2.33166428529383 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.80083497415208
Energy: 1.685390860857175
Energy: 1.8247387890730686
Energy: 1.685390860857525
Energy: 1.7500935872330878
Energy: 1.663790284406679
Energy: 1.694057438508385
Energy: 1.6637902844068642
Energy: 1.6175273947991673
Energy: 1.6157778351826602
Energy: 1.5650184823452957
Energy: 1.6157778351824954
Energy: 1.6168161561153802
Energy: 1.555734086826334
Energy: 1.6818296628292533
Energy: 1.5557340868265193
Energy: 1.7449829686159337
Energy: 1.5563379331834972
Energy: 1.789402678422083
Energy: 1.5563379331831473
Energy: 2.0513861279486867
Energy: 1.705456491748685
Energy: 1.542791519843206
Energy: 1.7054564917481503
Energy: 1.6201388641642192
Energy: 1.6986079988580576
Energy: 1.8298778610458606
Energy: 1.698607998858428
Energy: 1.5574565929797906
Energy: 1.5559654841580248
Energy: 1.7033035766861162
Energy: 1.5559654841576545
Energy: 1.864561429293921
Energy: 1.6173917832014417
Energy: 1.6699309780433482
Energy: 1.6173917832014417
Energy: 1.5657328977001208
Energy: 1.6163382665710013
Energy: 1.669327241548381
Energy: 1.616338266570631
Energy: 1.561810563154819
Energy: 1.5575121890225394
Energy: 2.0462980500385903
Energy: 1.5575121890232593
Energy: 1.8660391462097177
Energy: 1.5574861790700727
Energy: 1.7902234366635763
Energy: 1.5574861790700727
Energy: 1.7457284139884093
Energy: 1.5598026433464318
Energy: 1.5466343974493768
Energy: 1.559802643346617
Energy: 1.620935041831889
Energy: 1.6947449674709503
Energy: 1.9244290787288785
Energy: 1.6947449674723907
Energy: 1.6171845082916938
Energy: 1.558780043060798
Energy: 1.5855063059260146
Energy: 1.558780043061333
Energy: 1.71397345860882
Energy: 1.6183956877736885
Energy: 1.5688819817605948
Energy: 1.6183956877735237
Energy: 1.7500670554892135
Energy: 1.5454125423960985
Energy: 1.9170246423396415
Energy: 1.5454125423960985
Energy: 1.7509434684118463
Energy: 1.5466639171080594
Energy: 1.9163851411997643
Energy: 1.5466639171069685
Energy: 1.9078689212890225
Energy: 1.6160887700209399
Energy: 1.5856866333126005
Energy: 1.616088770020384
Energy: 1.6180365898697804
Energy: 1.5589742180777093
Energy: 1.5686724918978954
Energy: 1.5589742180778945
Energy: 1.6670291540656141
Energy: 1.6588982679784627
Energy: 1.922704342814003
Energy: 1.6588982679793682
Energy: 1.7460855210130695
Energy: 1.5590224276031537
Energy: 1.5469676513614594
Energy: 1.5590224276038742

minimum gb energy = 1.542791519843206 eV
minimum distance =  2.33141353216784 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.897511542504211
Energy: 1.6852489008000935
Energy: 1.8362054878350529
Energy: 1.6852489008000935
Energy: 1.8428833834266967
Energy: 1.649546332973001
Energy: 1.6248862763584688
Energy: 1.6495463329742812
Energy: 1.6251760766895709
Energy: 1.576221944194132
Energy: 1.5782261819140624
Energy: 1.5762219441954128
Energy: 1.6475053298120468
Energy: 1.5271298387109753
Energy: 1.6230895847695401
Energy: 1.5271298387122558
Energy: 1.738113980495334
Energy: 1.5765107078214864
Energy: 1.5288221373322022
Energy: 1.5765107078214864
Energy: 2.1444392608267355
Energy: 1.5280532559835716
Energy: 1.528437743354528
Energy: 1.5280532559835716
Energy: 1.6062639891807042
Energy: 1.6593640322673535
Energy: 1.93578238585877
Energy: 1.659364032268634
Energy: 1.5285344823372993
Energy: 1.5285672853825016
Energy: 1.7391107826794159
Energy: 1.5285672853825016
Energy: 1.8931158298027968
Energy: 1.5800326671449576
Energy: 1.5864939494148385
Energy: 1.580032667143677
Energy: 1.5845921237894673
Energy: 1.528414607832598
Energy: 1.6479327569281297
Energy: 1.5284146078313174
Energy: 1.5865968482979922
Energy: 1.579975980823968
Energy: 1.6945866709252906
Energy: 1.5799759808226874
Energy: 1.9910129499875555
Energy: 1.528761911124883
Energy: 1.810290990747394
Energy: 1.5287619111236024
Energy: 1.9908730612499423
Energy: 1.530547022996291
Energy: 1.8148174902331944
Energy: 1.5305470229950107
Energy: 1.588114271307362
Energy: 1.585882713032717
Energy: 1.9678544595157887
Energy: 1.585882713032717
Energy: 1.5871333472670441
Energy: 1.5329490864779647
Energy: 1.645819504161442
Energy: 1.5329490864766844
Energy: 1.8931697565235734
Energy: 1.6863452696662462
Energy: 1.6256914277871197
Energy: 1.6863452696662462
Energy: 1.5292941022255562
Energy: 1.5316262961392735
Energy: 1.7400845604542963
Energy: 1.5316262961392735
Energy: 1.5321851939337183
Energy: 1.5787559410312884
Energy: 1.9220732090625094
Energy: 1.5787559410300076
Energy: 2.1431897815944483
Energy: 1.53258128711112
Energy: 1.5292248790263296
Energy: 1.5325812871098392
Energy: 1.7391522518230886
Energy: 1.5799325461113893
Energy: 1.5309943076156163
Energy: 1.5799325461113893
Energy: 1.6466536887658505
Energy: 1.622529193173481
Energy: 1.6229942696013937
Energy: 1.622529193173481
Energy: 1.646243260892558
Energy: 1.5783614849164238
Energy: 1.581247945903333
Energy: 1.5783614849177043
Energy: 1.8405446766773932
Energy: 1.6281946528593285
Energy: 1.623233032904882
Energy: 1.6281946528593285
Energy: 1.8104834411569242
Energy: 1.5284659172924688
Energy: 1.990729252279602
Energy: 1.5284659172912178
Energy: 1.8148176516512935
Energy: 1.525873295423665
Energy: 1.658603091687771
Energy: 1.525873295423665
Energy: 1.694880388203514
Energy: 1.5786835528562335
Energy: 1.5805990416605176
Energy: 1.5786835528575136
Energy: 1.6495004741773511
Energy: 1.5260477635774823
Energy: 1.5844118537224188
Energy: 1.5260477635774823
Energy: 1.7381380759976846
Energy: 1.5793112322866196
Energy: 1.8932252992122296
Energy: 1.5793112322853393
Energy: 1.739205697344711
Energy: 1.526764866151353
Energy: 1.525633745521424
Energy: 1.526764866151353
Energy: 1.9168507597790603
Energy: 1.7006661735729327
Energy: 1.9168418570891586
Energy: 1.7006661735729327
Energy: 1.5256606122804102
Energy: 1.5269282732774763
Energy: 1.739205697344711
Energy: 1.5269282732774763

minimum gb energy = 1.525633745521424 eV
minimum distance =  2.34586089063959 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.4046258007311416
Energy: 1.450268865779364
Energy: 1.8490853335914266
Energy: 1.4502688657802318
Energy: 1.9338142541390893
Energy: 1.4961719292593239
Energy: 1.449623647423149
Energy: 1.4961719292589024
Energy: 1.8656064189517887
Energy: 1.4504583912113682
Energy: 1.4498139221166897
Energy: 1.450458391210922
Energy: 1.9829084273187807
Energy: 1.4514788615418228
Energy: 1.4432825530079965
Energy: 1.4514788615418228
Energy: 1.985891584802379
Energy: 1.4433262900745638
Energy: 1.44287888458171
Energy: 1.4433262900741177
Energy: 1.7433079951102817
Energy: 1.4446861219958271
Energy: 1.449992921620648
Energy: 1.444686121996273
Energy: 1.6078272862306398
Energy: 1.450639953662074
Energy: 1.8207068377794886
Energy: 1.450639953662074
Energy: 1.391253200072447
Energy: 1.4440594634304649
Energy: 2.2427639891492257
Energy: 1.4440594634300439
Energy: 2.0204510454648505
Energy: 1.4882373904044766
Energy: 1.488492188542498
Energy: 1.4882373904044766

minimum gb energy = 1.391253200072447 eV
minimum distance =  2.39928915619758 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.662205719206645
Energy: 1.4827103613057342
Energy: 2.235559435680446
Energy: 1.4827103613045245
Energy: 1.8324053587231648
Energy: 1.4754621655990596
Energy: 1.630193763061645
Energy: 1.4754621655966402
Energy: 1.5449139651038435
Energy: 1.6223035418477763
Energy: 1.540248543190228
Energy: 1.6223035418477763
Energy: 1.5476557531877138
Energy: 1.5250776250047529
Energy: 1.6452256353725807
Energy: 1.5250776250059073
Energy: 1.4973579494326394
Energy: 1.6286393940367716
Energy: 1.4929459817476076
Energy: 1.628639394035562
Energy: 1.6105170789229062
Energy: 1.637930457225771
Energy: 1.4930529525097316
Energy: 1.6379304572245614
Energy: 1.6235685570613891
Energy: 1.6148311679882594
Energy: 1.7185692903778407
Energy: 1.6148311679906786
Energy: 1.6264514785908528
Energy: 1.6279905956621434
Energy: 1.8267145951766997
Energy: 1.6279905956609335
Energy: 1.887118059664462
Energy: 1.4803037879439145
Energy: 1.6171962791468848
Energy: 1.4803037879439145
Energy: 1.6383552118433602
Energy: 1.480317623614564
Energy: 1.6201474169757488
Energy: 1.480317623614564
Energy: 1.5294589886153724
Energy: 1.6071629758269506
Energy: 1.7059003737456364
Energy: 1.60716297582816
Energy: 1.5308761060804277
Energy: 1.60966047894644
Energy: 1.5202563160880576
Energy: 1.6096604789476494
Energy: 1.682140312654299
Energy: 1.569602537829665
Energy: 1.507457727365639
Energy: 1.5696025378260365
Energy: 1.520037602763522
Energy: 1.6250592677699334
Energy: 1.506680481792856
Energy: 1.6250592677699334
Energy: 1.5108063983544184
Energy: 1.56877116752944
Energy: 1.6688520654674477
Energy: 1.5687711675306495
Energy: 1.968069800928171
Energy: 1.4792161882245611
Energy: 1.6165386112497275
Energy: 1.4792161882257704
Energy: 1.8131477255017605
Energy: 1.4805100919654377
Energy: 1.775366650645647
Energy: 1.4805100919654377
Energy: 1.5436807244272874
Energy: 1.604335707003186
Energy: 1.8314200971078924
Energy: 1.6043357070007669
Energy: 1.6280087620539707
Energy: 1.4957755580014478
Energy: 1.5490788322006768
Energy: 1.4957755580026573
Energy: 1.5273800250985616
Energy: 1.6089872998923684
Energy: 1.4964161897851609
Energy: 1.6089872998947878
Energy: 1.5252388995237613
Energy: 1.52585195871215
Energy: 1.564177427246491
Energy: 1.5258519587097308
Energy: 1.654563205396983
Energy: 1.6082803427166013
Energy: 1.5132480502255632
Energy: 1.6082803427141819
Energy: 1.54516887732118
Energy: 1.6499346263287604
Energy: 1.5168479122395708
Energy: 1.6499346263287604
Energy: 1.7667596569425523
Energy: 1.4830135308485541
Energy: 1.8199186233550275
Energy: 1.4830135308509729
Energy: 1.7631588647234362
Energy: 1.5045971893117456
Energy: 2.0763304692030213
Energy: 1.5045971893117456
Energy: 1.532894487458129
Energy: 1.6244439245074382
Energy: 1.5131817485019927
Energy: 1.6244439245062285
Energy: 1.6165795094982787
Energy: 1.6342099091229005
Energy: 1.5166406314002974
Energy: 1.6342099091229005
Energy: 1.5253159688221052
Energy: 1.5234685259764051
Energy: 1.7313583685249723
Energy: 1.523468525973986
Energy: 1.5258625581314995
Energy: 1.6225881358531242
Energy: 1.4934928479331413
Energy: 1.6225881358519152
Energy: 1.6871285449858142
Energy: 1.7051321665159174
Energy: 1.5395894945116262
Energy: 1.7051321665171268
Energy: 1.6225118790649307
Energy: 1.621016039025642
Energy: 1.7133914069419376
Energy: 1.6210160390244326
Energy: 1.6524454420881292
Energy: 1.4803299463894222
Energy: 1.9020937584866262
Energy: 1.4803299463894222
Energy: 2.1191674900396515
Energy: 1.556506745983694
Energy: 1.6158279480259516
Energy: 1.5565067459824846

minimum gb energy = 1.4754621655966402 eV
minimum distance =  2.3337269504829 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.5224179741945933
Energy: 1.572708367085646
Energy: 1.9120786869817339
Energy: 1.572708367085646
Energy: 1.4519310665127845
Energy: 1.601073599588781
Energy: 1.5110799484310822
Energy: 1.6010735995904537
Energy: 1.637322166561632
Energy: 1.6205061640844147
Energy: 1.7047785327146372
Energy: 1.6205061640844147
Energy: 1.5046134029738587
Energy: 1.6112656843529711
Energy: 1.5480044836173876
Energy: 1.6112656843529711
Energy: 1.4618943663945494
Energy: 1.564553968369986
Energy: 1.45136991273237
Energy: 1.564553968369986
Energy: 1.4523142574565977
Energy: 1.450827848922621
Energy: 1.4515122834014833
Energy: 1.450827848925966
Energy: 1.5469756356955202
Energy: 1.621072380569694
Energy: 1.653618900483202
Energy: 1.6210723805713665
Energy: 1.546717012467152
Energy: 1.6117164907405195
Energy: 1.6391469514066204
Energy: 1.6117164907388466
Energy: 1.7564709486076986
Energy: 1.5649966076070412
Energy: 1.4717640366937768
Energy: 1.5649966076070412
Energy: 1.7564709486076986
Energy: 1.5651836952019946
Energy: 1.471773154290531
Energy: 1.5651836952019946
Energy: 1.5468616256280863
Energy: 1.6117909899336513
Energy: 1.6391469514066204
Energy: 1.6117909899353235
Energy: 1.5470984547803663
Energy: 1.621076470256745
Energy: 1.6536189004815294
Energy: 1.621076470256745
Energy: 1.4522085346777602
Energy: 1.4508313719183772
Energy: 1.4517701749163903
Energy: 1.4508313719200496
Energy: 1.4616878375838958
Energy: 1.564502635191611
Energy: 1.4513847258133945
Energy: 1.564502635191611
Energy: 1.504624985939445
Energy: 1.6105724866819369
Energy: 1.5479795749533654
Energy: 1.6105724866802644
Energy: 1.63732216655996
Energy: 1.6228085177644507
Energy: 1.704776790128926
Energy: 1.6228085177644507
Energy: 1.4520224032179871
Energy: 1.6008153981052482
Energy: 1.511075028338946
Energy: 1.6008153981052482
Energy: 1.5224179741929207
Energy: 1.5727083670873183
Energy: 1.9120786868580097
Energy: 1.5727083670873183
Energy: 1.4519310665127845
Energy: 1.6010735995904537
Energy: 1.5110799484310822
Energy: 1.601073599588781
Energy: 1.637322166561632
Energy: 1.6205061640844147
Energy: 1.7047785327146372
Energy: 1.6205061640844147
Energy: 1.5046134029721863
Energy: 1.6112656843529711
Energy: 1.5480044836173876
Energy: 1.6112656843529711
Energy: 1.4618943663945494
Energy: 1.564553968369986
Energy: 1.45136991273237
Energy: 1.564553968369986
Energy: 1.4523142574565977
Energy: 1.450827848922621
Energy: 1.4515122833998106
Energy: 1.450827848922621
Energy: 1.5469756356938478
Energy: 1.6210723805713665
Energy: 1.653618900483202
Energy: 1.6210723805713665

minimum gb energy = 1.450827848922621 eV
minimum distance =  2.32776529085193 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.7342137459913287
Energy: 1.4774063717540957
Energy: 2.1956564566035226
Energy: 1.4774063717561634
Energy: 1.7460967721640972
Energy: 1.503320538134906
Energy: 1.669759360567336
Energy: 1.5033205381338721
Energy: 1.5107153027456406
Energy: 1.5922813308539048
Energy: 1.5223772970154401
Energy: 1.5922813308539048
Energy: 1.5299861024859829
Energy: 1.4792796780912514
Energy: 1.700581674824296
Energy: 1.4792796780891841
Energy: 1.498339062887359
Energy: 1.6035516040202489
Energy: 1.5013026686866724
Energy: 1.6035516040192153
Energy: 1.5375977552376978
Energy: 1.5024829893622833
Energy: 1.5002826980998114
Energy: 1.5024829893612497
Energy: 1.498339738481275
Energy: 1.6130552338808448
Energy: 1.4992364903689568
Energy: 1.6130552338818787
Energy: 1.495537893740208
Energy: 1.6132829178722554
Energy: 1.5087758248630616
Energy: 1.6132829178753567
Energy: 1.5533465679274887
Energy: 1.466317377368974
Energy: 1.6612053801914184
Energy: 1.466317377374142
Energy: 1.5328921166221745
Energy: 1.4684760236529408
Energy: 1.6625404859462554
Energy: 1.4684760236539744
Energy: 1.5666826749229774
Energy: 1.470443999583749
Energy: 1.5085092968374803
Energy: 1.4704439995847827
Energy: 1.56288219931313
Energy: 1.4695656805063693
Energy: 1.5401637968562047
Energy: 1.4695656805094706
Energy: 1.5314882869594848
Energy: 1.5986036052274648
Energy: 1.5114194487286017
Energy: 1.598603605226431
Energy: 1.479485339007231
Energy: 1.604287596100093
Energy: 1.5095026397736049
Energy: 1.6042875961011267
Energy: 1.4788080844094809
Energy: 1.6196270346481196
Energy: 1.5178181481189015
Energy: 1.6196270346491537
Energy: 1.4798260065693536
Energy: 1.6097331742922818
Energy: 1.488162043915258
Energy: 1.609733174295383
Energy: 1.6835364409566307
Energy: 1.4601007442543985
Energy: 1.5178750855165604
Energy: 1.4601007442543985
Energy: 1.5584957129909085
Energy: 1.5991332536168061
Energy: 1.7794111113463285
Energy: 1.59913325361784
Energy: 1.6829596601706578
Energy: 1.4984080126443617
Energy: 1.6627707563252474
Energy: 1.498408012642294
Energy: 1.9681705885478207
Energy: 1.4672048842726448
Energy: 1.6132182185446926
Energy: 1.4672048842778136
Energy: 1.5265444357220475
Energy: 1.5382877689276104
Energy: 1.6784742598668443
Energy: 1.5382877689265764
Energy: 1.5267291496797173
Energy: 1.5948571541280672
Energy: 1.4832757389180022
Energy: 1.5948571541301344
Energy: 1.5740163505295306
Energy: 1.5014991371143058
Energy: 1.5056768538043996
Energy: 1.5014991371153397
Energy: 1.4808955899754321
Energy: 1.6081942009251529
Energy: 1.493249449933686
Energy: 1.6081942009231327
Energy: 1.4773219423890724
Energy: 1.6211571262166116
Energy: 1.5736560845119971
Energy: 1.6211571262166116
Energy: 1.530262969296788
Energy: 1.6012185338406195
Energy: 1.5007897434218076
Energy: 1.6012185338375182
Energy: 1.481007884659875
Energy: 1.5963207716726946
Energy: 1.5631986093428074
Energy: 1.5963207716768295
Energy: 1.6661100627275518
Energy: 1.4526674523797016
Energy: 1.5712066849236492
Energy: 1.4526674523807355
Energy: 1.6634540299994856
Energy: 1.4510324402446355
Energy: 1.5660983317536075
Energy: 1.4510324402415344
Energy: 1.5097844938576335
Energy: 1.5973978065684697
Energy: 1.5004879658572872
Energy: 1.597397806566402
Energy: 1.514940075734122
Energy: 1.5986782098681793
Energy: 1.5632871983367802
Energy: 1.5986782098681793
Energy: 1.4805394140420285
Energy: 1.6188103334565838
Energy: 1.5061451516690676
Energy: 1.6188103334565838
Energy: 1.477528838982142
Energy: 1.6063657030472256
Energy: 1.466093889522259
Energy: 1.6063657030451581
Energy: 1.5745520845199465
Energy: 1.5983857983733303
Energy: 1.4833521453448817
Energy: 1.598385798374364
Energy: 1.4944859128369314
Energy: 1.5986595923788698
Energy: 1.5126618493435018
Energy: 1.5986595923799034
Energy: 1.6090475619845497
Energy: 1.4495893304739365
Energy: 1.6662290429572328
Energy: 1.4495893304729028
Energy: 2.034657657385115
Energy: 1.4703056998612571
Energy: 1.5646997024143487
Energy: 1.47030569985919
Energy: 1.6827954304090518
Energy: 1.4675435391284586
Energy: 1.6297816884487517
Energy: 1.4675435391274245

minimum gb energy = 1.4495893304729028 eV
minimum distance =  2.35198205151541 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.643638692624661
Energy: 1.4960770158159726
Energy: 1.8744172507277899
Energy: 1.4960770158159726
Energy: 1.4728704284978644
Energy: 1.4728369708518227
Energy: 1.5194054013588758
Energy: 1.4728369708523759
Energy: 1.5647518949259978
Energy: 1.4836856511143661
Energy: 1.4203772833727548
Energy: 1.4836856511143661
Energy: 1.4506334416143616
Energy: 1.4456521149201822
Energy: 1.5881848582044087
Energy: 1.4456521149196289
Energy: 1.4732001018293264
Energy: 1.5273207586968574
Energy: 1.438955499339251
Energy: 1.5273207586968574
Energy: 1.4455237250107218
Energy: 1.6810677964257428
Energy: 1.4456066686333684
Energy: 1.6810677964260194
Energy: 1.444495714069326
Energy: 1.4900218656275916
Energy: 1.440477994536788
Energy: 1.4900218656281448
Energy: 1.4454759813993778
Energy: 1.445380769295509
Energy: 1.6060844398771603
Energy: 1.445380769296062
Energy: 1.5657526030618425
Energy: 1.5292062220597025
Energy: 1.3846174854504056
Energy: 1.529206222059979
Energy: 1.4452653996293727
Energy: 1.5072833634043117
Energy: 1.3856456453333663
Energy: 1.507283363404834
Energy: 1.5241763125610521
Energy: 1.4491691563476532
Energy: 1.6028178899526073
Energy: 1.4491691563476532
Energy: 1.523883867213429
Energy: 1.3854139477595542
Energy: 1.6058548753759667
Energy: 1.3854139477598
Energy: 1.567573851748808
Energy: 1.5383905157220246
Energy: 1.3845748967099085
Energy: 1.538390515722301
Energy: 1.5646041925687302
Energy: 1.446515983467347
Energy: 1.3854239479962267
Energy: 1.4465159834667938
Energy: 1.4444565383804029
Energy: 1.5344109407591435
Energy: 1.5041226946646815
Energy: 1.534410940758867

minimum gb energy = 1.3845748967099085 eV
minimum distance =  2.3238840480116 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.492169410036771
Energy: 1.432052276893413
Energy: 1.8019830774915622
Energy: 1.432052276893413
Energy: 1.4301144298290367
Energy: 1.356879158774931
Energy: 1.3924271408200115
Energy: 1.3568791587760645
Energy: 1.4716861498167586
Energy: 1.419280945679996
Energy: 1.469806033102708
Energy: 1.419280945679996
Energy: 1.4212364430558302
Energy: 1.472752461785102
Energy: 1.4286746774699504
Energy: 1.472752461785102
Energy: 1.3737018357448194
Energy: 1.4378762761289332
Energy: 1.4046432766279968
Energy: 1.4378762761277994
Energy: 1.4564546163394498
Energy: 1.441137755122152
Energy: 1.4271988370558018
Energy: 1.441137755122152
Energy: 1.3878998624255616
Energy: 1.4185074436465732
Energy: 1.4015218590101737
Energy: 1.4185074436465732
Energy: 1.385588051510468
Energy: 1.4301559372199923
Energy: 1.3832571912525802
Energy: 1.4301559372199923
Energy: 1.4021589650852626
Energy: 1.4378865090814767
Energy: 1.3595024816727264
Energy: 1.43788650908261
Energy: 1.5163777572404096
Energy: 1.4376786610080312
Energy: 1.4700413831410812
Energy: 1.4376786610080312
Energy: 1.4278126758906382
Energy: 1.4500360694927268
Energy: 1.4660558892066593
Energy: 1.4500360694938603
Energy: 1.4355394755041313
Energy: 1.489622112550061
Energy: 1.3839067635019653
Energy: 1.489622112550061
Energy: 1.4721353817542682
Energy: 1.4252841960823592
Energy: 1.4465933482831526
Energy: 1.4252841960812255
Energy: 1.521232746299196
Energy: 1.3603356992998832
Energy: 1.53893314037903
Energy: 1.3603356992987494
Energy: 1.443697163139671
Energy: 1.4504475241432244
Energy: 1.4706340551523969
Energy: 1.4504475241432244
Energy: 1.435168538444495
Energy: 1.4859013758394148
Energy: 1.4689717503753719
Energy: 1.4859013758405486
Energy: 1.47267308441718
Energy: 1.4378485982120162
Energy: 1.3603037555249466
Energy: 1.4378485982108824
Energy: 1.4052999945298323
Energy: 1.4380109098635034
Energy: 1.4621332058692333
Energy: 1.4380109098635034
Energy: 1.3871221382283339
Energy: 1.4547509374966818
Energy: 1.385073657341217
Energy: 1.4547509374966818
Energy: 1.3850062369698348
Energy: 1.4547602643003703
Energy: 1.3871216871511445
Energy: 1.4547602643026376
Energy: 1.4621196400473155
Energy: 1.437892486769829
Energy: 1.4053045721692925
Energy: 1.4378924867686955
Energy: 1.3601684195290793
Energy: 1.438016295808899
Energy: 1.4726730844239821
Energy: 1.4380162958100327
Energy: 1.468971750374238
Energy: 1.4859037706663727
Energy: 1.4353070222506006
Energy: 1.4859037706652392
Energy: 1.4706340551523969
Energy: 1.4504310547816994
Energy: 1.4277089185826892
Energy: 1.4504310547816994
Energy: 1.5387663480233071
Energy: 1.360008120604344
Energy: 1.5210436081790062
Energy: 1.360008120604344
Energy: 1.4478274036553607
Energy: 1.425860251633574
Energy: 1.472135381755402
Energy: 1.4258602516347079
Energy: 1.3835586266936
Energy: 1.4901278821859383
Energy: 1.4355153538841416
Energy: 1.4901278821859383
Energy: 1.4660558892055258
Energy: 1.4498133625268272
Energy: 1.4435806996382492
Energy: 1.4498133625268272
Energy: 1.4700480975962789
Energy: 1.4376735957971492
Energy: 1.516476865394749
Energy: 1.4376735957971492
Energy: 1.3594928235917627
Energy: 1.437858647028938
Energy: 1.4021602154439978
Energy: 1.437858647028938
Energy: 1.3830402410766585
Energy: 1.430145168861302
Energy: 1.3853000919759233
Energy: 1.430145168861302
Energy: 1.4015334438470426
Energy: 1.4184673454116037
Energy: 1.387919549625926
Energy: 1.4184673454116037
Energy: 1.4272136218244382
Energy: 1.4412713573645985
Energy: 1.4563741273357376
Energy: 1.441271357363465
Energy: 1.404690621114143
Energy: 1.43787961155928
Energy: 1.3739285955230713
Energy: 1.43787961155928
Energy: 1.4287149913500004
Energy: 1.4726257389616582
Energy: 1.4212205339459412
Energy: 1.4726257389616582

minimum gb energy = 1.356879158774931 eV
minimum distance =  2.34156654817789 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.5093157621473738
Energy: 1.37741790479627
Energy: 1.721155412001282
Energy: 1.3774179047960706
Energy: 1.351568941461181
Energy: 1.3420225492286346
Energy: 1.3807164310629993
Energy: 1.3420225492294104
Energy: 1.4355038322508018
Energy: 1.3325603862568087
Energy: 1.4429066171472038
Energy: 1.3325603862562325
Energy: 1.386775154345044
Energy: 1.3978590174804395
Energy: 1.3803724138110418
Energy: 1.3978590174798629
Energy: 1.3887478292789495
Energy: 1.333022526269252
Energy: 1.440832123600339
Energy: 1.333022526270028
Energy: 1.4301089322195046
Energy: 1.358554634824013
Energy: 1.3920562575113615
Energy: 1.3585546348232371
Energy: 1.3430635008340108
Energy: 1.3332461720224122
Energy: 1.373957223548514
Energy: 1.3332461720212376
Energy: 1.3443573942472729
Energy: 1.4410385089753495
Energy: 1.385102367614563
Energy: 1.4410385089743742
Energy: 1.3699287693558653
Energy: 1.3330113810993525
Energy: 1.3865890289104703
Energy: 1.3330113810989757
Energy: 1.4311113465896763
Energy: 1.358854850658581
Energy: 1.3918938884735548
Energy: 1.358854850658958
Energy: 1.3442976605721044
Energy: 1.3327830054785632
Energy: 1.4053446013130277
Energy: 1.3327830054785632
Energy: 1.3448380487018745
Energy: 1.3563624260856277
Energy: 1.4664026711857885
Energy: 1.3563624260856277
Energy: 1.43640985613872
Energy: 1.3319994131350967
Energy: 1.3821736934353495
Energy: 1.331999413134698
Energy: 1.343159016830363
Energy: 1.3310787709353469
Energy: 1.3804586264219945
Energy: 1.3310787709353469
Energy: 1.3937719171039222
Energy: 1.3740799860567825
Energy: 1.4404703630836977
Energy: 1.3740799860577577
Energy: 1.3951355412224362
Energy: 1.3087103231869956
Energy: 1.3681872496982908
Energy: 1.3087103231867963
Energy: 1.436037564851059
Energy: 1.3309216754626574
Energy: 1.3821957564330214
Energy: 1.3309216754624578
Energy: 1.3870584570354627
Energy: 1.331283263567308
Energy: 1.3807655101280452
Energy: 1.3312832635680836
Energy: 1.3446238322389221
Energy: 1.3317159258115985
Energy: 1.4406497414251431
Energy: 1.3317159258108229
Energy: 1.344729720169375
Energy: 1.3570423003238932
Energy: 1.4408160170814037
Energy: 1.3570423003240926

minimum gb energy = 1.3087103231867963 eV
minimum distance =  2.33024247276818 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.4397275108292058
Energy: 1.247349984113628
Energy: 1.5282280681547307
Energy: 1.247349984113628
Energy: 1.2972647550836123
Energy: 1.28678239868311
Energy: 1.317188460726878
Energy: 1.2867823986815867
Energy: 1.3062947623335583
Energy: 1.2249693281665477
Energy: 1.3898367279727257
Energy: 1.2249693281665477
Energy: 1.2583182179678885
Energy: 1.2447466764899167
Energy: 1.2934204120016948
Energy: 1.2447466764914397
Energy: 1.3333923865578432
Energy: 1.2027654719783527
Energy: 1.3077479762978592
Energy: 1.2027654719783527
Energy: 1.2577917487758001
Energy: 1.2529207344545865
Energy: 1.2871728703816592
Energy: 1.2529207344545865
Energy: 1.2594452032734984
Energy: 1.202815424352078
Energy: 1.3177308716818696
Energy: 1.2028154243536011
Energy: 1.2716977883501681
Energy: 1.2129050739933827
Energy: 1.3369969425019577
Energy: 1.2129050739918599
Energy: 1.2790820589767729
Energy: 1.2029559482167003
Energy: 1.2744557323854866
Energy: 1.2029559482167003
Energy: 1.2845287928417988
Energy: 1.260321186525855
Energy: 1.2762327101997202
Energy: 1.2603211865273782
Energy: 1.2520679075922365
Energy: 1.2027846012410457
Energy: 1.3010524226312679
Energy: 1.2027846012410457
Energy: 1.2705162283836537
Energy: 1.2128491069270368
Energy: 1.3394009653540064
Energy: 1.2128491069270368
Energy: 1.265245716892848
Energy: 1.2004598503049086
Energy: 1.2610781190429867
Energy: 1.2004598503049086
Energy: 1.3155729372067717
Energy: 1.213182657901791
Energy: 1.2441747800153002
Energy: 1.213182657901791
Energy: 1.277452884918736
Energy: 1.2002276846256794
Energy: 1.3126940294619496
Energy: 1.2002276846241564
Energy: 1.2578396828188867
Energy: 1.200179400785919
Energy: 1.2985796214633543
Energy: 1.200179400784396
Energy: 1.3008107193848235
Energy: 1.226190260154135
Energy: 1.2780638238587454
Energy: 1.226190260154135
Energy: 1.2532973921131145
Energy: 1.2834058581828536
Energy: 1.2636633594264242
Energy: 1.2834058581828536
Energy: 1.319031079663723
Energy: 1.2491762909316613
Energy: 1.3008447630318607
Energy: 1.2491762909316613
Energy: 1.2971929971819314
Energy: 1.2459637328635649
Energy: 1.2574152406410024
Energy: 1.2459637328635649
Energy: 1.301523561216722
Energy: 1.226225366141797
Energy: 1.2783390511699566
Energy: 1.2262253661402738
Energy: 1.3235919384230732
Energy: 1.2203986992259064
Energy: 1.2636951391471294
Energy: 1.2203986992274294
Energy: 1.2561131525819025
Energy: 1.2019483181215205
Energy: 1.3012719193705717
Energy: 1.2019483181215205
Energy: 1.2581921362691018
Energy: 1.2012825340507034
Energy: 1.3282466628045437
Energy: 1.2012825340507034
Energy: 1.255006499964424
Energy: 1.2002826203995285
Energy: 1.261218986424654
Energy: 1.2002826204010515
Energy: 1.346918400931283
Energy: 1.2158633752119876
Energy: 1.2441674772513787
Energy: 1.2158633752119876

minimum gb energy = 1.200179400784396 eV
minimum distance =  2.33727844474445 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.3570338811308102
Energy: 1.1635971080650573
Energy: 1.3762964868694167
Energy: 1.1635971080650573
Energy: 1.222885557416218
Energy: 1.1764166946521293
Energy: 1.207451697163413
Energy: 1.1764166946521293
Energy: 1.2015993837474765
Energy: 1.1265997462602637
Energy: 1.3159134084605904
Energy: 1.1265997462590154
Energy: 1.1962626604774906
Energy: 1.1776727290106905
Energy: 1.1923239961178471
Energy: 1.177672729011939
Energy: 1.2831227140137078
Energy: 1.1142479534946832
Energy: 1.1978637683487
Energy: 1.1142479534946832
Energy: 1.1996592294891226
Energy: 1.1412876752849648
Energy: 1.1661308054762223
Energy: 1.1412876752849648
Energy: 1.2191883480133068
Energy: 1.0989266268126954
Energy: 1.2548241329791605
Energy: 1.0989266268139442
Energy: 1.1822925853742634
Energy: 1.1196727300221803
Energy: 1.1655819695015328
Energy: 1.1196727300234293
Energy: 1.2363966372245059
Energy: 1.0991657770445606
Energy: 1.1906560388140217
Energy: 1.0991657770445606
Energy: 1.2269291142625214
Energy: 1.147208712307668
Energy: 1.20395608856504
Energy: 1.1472087123101653
Energy: 1.1952725182398918
Energy: 1.1015684330394835
Energy: 1.2185585107875998
Energy: 1.1015684330394835
Energy: 1.180868616512993
Energy: 1.1360351300427656
Energy: 1.1915228299564373
Energy: 1.136035130040268
Energy: 1.2288119406794635
Energy: 1.101351295349156
Energy: 1.1846978564392159
Energy: 1.101351295351653
Energy: 1.2275867302210206
Energy: 1.1081478840446424
Energy: 1.1739419053038949
Energy: 1.1081478840446424
Energy: 1.1814565363440066
Energy: 1.1014856211533275
Energy: 1.1986133810577217
Energy: 1.1014856211533275
Energy: 1.1592719953062307
Energy: 1.1052733337099654
Energy: 1.2071819714894498
Energy: 1.1052733337099654
Energy: 1.26980217299484
Energy: 1.1014864852627466
Energy: 1.19031400942979
Energy: 1.1014864852627466
Energy: 1.194964267996174
Energy: 1.1005943220722472
Energy: 1.17056640511084
Energy: 1.1005943220709986
Energy: 1.1884906911594182
Energy: 1.1156757684291116
Energy: 1.1983111955166088
Energy: 1.1156757684253658
Energy: 1.1732840072735131
Energy: 1.1652085028257322
Energy: 1.2260907631707076
Energy: 1.1652085028244836
Energy: 1.1989150251858876
Energy: 1.1272387050540116
Energy: 1.1754404259139521
Energy: 1.1272387050552604
Energy: 1.225463663892067
Energy: 1.1883479612785215
Energy: 1.1983941022841125
Energy: 1.1883479612785215
Energy: 1.2369153055981081
Energy: 1.1643568742934312
Energy: 1.1968003503203664
Energy: 1.1643568742934312
Energy: 1.226135879186978
Energy: 1.1832538873298615
Energy: 1.2179183424579934
Energy: 1.1832538873323586
Energy: 1.2031270324363479
Energy: 1.127112281186348
Energy: 1.1768110320576042
Energy: 1.1271122811850995
Energy: 1.1938780444492754
Energy: 1.1288788151249176
Energy: 1.2053455718952957
Energy: 1.1288788151249176
Energy: 1.188432020746892
Energy: 1.115563465732599
Energy: 1.1977986480686642
Energy: 1.1155634657338478
Energy: 1.1736296291274262
Energy: 1.1125662647281762
Energy: 1.2272106232489446
Energy: 1.1125662647256787
Energy: 1.2141850669558856
Energy: 1.1016145464662714
Energy: 1.191069894627853
Energy: 1.101614546463774
Energy: 1.2111939077059317
Energy: 1.0982716038602283
Energy: 1.17059588276901
Energy: 1.0982716038602283
Energy: 1.181478785167119
Energy: 1.1018423465348886
Energy: 1.1863028185228948
Energy: 1.10184234653364
Energy: 1.1587005171263445
Energy: 1.104960705389983
Energy: 1.205863434473406
Energy: 1.1049607053912316

minimum gb energy = 1.0982716038602283 eV
minimum distance =  2.33737939841601 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.2431133083897057
Energy: 1.0779479426895402
Energy: 1.2595518810220572
Energy: 1.0779479426905978
Energy: 1.1488296649025826
Energy: 1.1353524298388997
Energy: 1.137493033503601
Energy: 1.135352429842073
Energy: 1.1100329446941708
Energy: 1.0590501043425518
Energy: 1.201610852311101
Energy: 1.0590501043404363
Energy: 1.114554496208857
Energy: 1.0924058181655365
Energy: 1.1372694257933718
Energy: 1.0924058181697676
Energy: 1.1700365241733337
Energy: 1.035395380092523
Energy: 1.113854165177049
Energy: 1.035395380095696
Energy: 1.110394824750282
Energy: 1.0757892318826372
Energy: 1.1112608504714838
Energy: 1.0757892318836948
Energy: 1.1267416723004604
Energy: 1.0263739935123184
Energy: 1.1977666454737015
Energy: 1.0263739935102028
Energy: 1.093279829086122
Energy: 1.048201911848305
Energy: 1.1212075398052188
Energy: 1.0482019118504204
Energy: 1.1760093770611713
Energy: 1.0169716198116765
Energy: 1.1098710326799257
Energy: 1.016971619812734
Energy: 1.1141664291529672
Energy: 1.0328087338099003
Energy: 1.121128187187959
Energy: 1.0328087338109582
Energy: 1.1316830994508795
Energy: 1.016837745117114
Energy: 1.1784939904030602
Energy: 1.0168377451181718
Energy: 1.116003268242529
Energy: 1.0502092026474636
Energy: 1.1397638281451186
Energy: 1.0502092026464056
Energy: 1.1529838777563712
Energy: 1.0188098328037316
Energy: 1.1286817215797231
Energy: 1.0188098328037316
Energy: 1.1340908627629884
Energy: 1.04559442703264
Energy: 1.1026284651704006
Energy: 1.0455944270336976
Energy: 1.1163431061856177
Energy: 1.0191087763184845
Energy: 1.1352087020780934
Energy: 1.019108776319542
Energy: 1.0978797192598784
Energy: 1.0448390004904713
Energy: 1.140244478526208
Energy: 1.0448390004862402
Energy: 1.1388284634649055
Energy: 1.0189749180668195
Energy: 1.1228714438517384
Energy: 1.0189749180647039
Energy: 1.1432292907526436
Energy: 1.0248420847228774
Energy: 1.0888569178019887
Energy: 1.0248420847218196
Energy: 1.066894334790061
Energy: 1.0189537063471599
Energy: 1.1165505246394811
Energy: 1.0189537063492755
Energy: 1.0976341634471356
Energy: 1.0291168920409783
Energy: 1.1047892946718272
Energy: 1.029116892042036
Energy: 1.1661190304755393
Energy: 1.0286497667803172
Energy: 1.0815980961010987
Energy: 1.0286497667824328
Energy: 1.137395524553725
Energy: 1.0908828465994813
Energy: 1.1008364863717712
Energy: 1.0908828465984235
Energy: 1.088829088110023
Energy: 1.0360516150107686
Energy: 1.1134252573248118
Energy: 1.0360516150118264
Energy: 1.1198209106867798
Energy: 1.1139984976563688
Energy: 1.1322171957064906
Energy: 1.1139984976563688
Energy: 1.1170724449597547
Energy: 1.0581809314853805
Energy: 1.1195786994807946
Energy: 1.0581809314864383
Energy: 1.1609949562872013
Energy: 1.1138662538625386
Energy: 1.1348967028726284
Energy: 1.1138662538635964
Energy: 1.1439239913823962
Energy: 1.078726657241765
Energy: 1.1133183671268745
Energy: 1.0787266572428227
Energy: 1.127357440910259
Energy: 1.12096971566701
Energy: 1.13203346584235
Energy: 1.12096971566701
Energy: 1.1108561053208041
Energy: 1.0583114011338508
Energy: 1.117938552412577
Energy: 1.058311401137024
Energy: 1.1482614284029689
Energy: 1.0554332675498912
Energy: 1.1355525081120426
Energy: 1.0554332675498912
Energy: 1.0888786263869652
Energy: 1.0359801801598056
Energy: 1.11309263810268
Energy: 1.035980180154517
Energy: 1.0852418171467957
Energy: 1.0446231461292002
Energy: 1.108205679224199
Energy: 1.044623146130258
Energy: 1.1230730956555077
Energy: 1.028606895750668
Energy: 1.0814791403017512
Energy: 1.0286068957485526
Energy: 1.1285699640597733
Energy: 1.0277408082161033
Energy: 1.0984987396998962
Energy: 1.0277408082192767
Energy: 1.0667330319700883
Energy: 1.0188346070240808
Energy: 1.1250129944791656
Energy: 1.0188346070261964
Energy: 1.0958177537138762
Energy: 1.0293573723219833
Energy: 1.1218053981160643
Energy: 1.0293573723219833
Energy: 1.1277128848052724
Energy: 1.0187005009482568
Energy: 1.1064904636176425
Energy: 1.0187005009450836

minimum gb energy = 1.016837745117114 eV
minimum distance =  2.34359398047423 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.2993250277382282
Energy: 1.0272563629056581
Energy: 1.0937588121189552
Energy: 1.0272563629047409
Energy: 1.0556916653864374
Energy: 1.006741782735974
Energy: 1.0581282627326705
Energy: 1.0067417827377876
Energy: 1.0006021002292491
Energy: 1.0214213198145219
Energy: 1.1870338943068541
Energy: 1.0214213198145219
Energy: 1.0467195056759502
Energy: 0.9956767031550321
Energy: 1.054629929114351
Energy: 0.9956767031559495
Energy: 1.160005567766674
Energy: 0.9718317879697239
Energy: 1.0067372074204732
Energy: 0.9718317879688064
Energy: 1.034816823641757
Energy: 0.8703091387602993
Energy: 1.0060831955755318
Energy: 0.8703091387602993
Energy: 1.02942298696123
Energy: 0.9701735430166311
Energy: 1.1228303426533919
Energy: 0.9701735430166311
Energy: 1.0205125965820827
Energy: 0.9902954029682404
Energy: 1.0294934451452014
Energy: 0.9902954029691577
Energy: 1.1518382506290898
Energy: 0.9388087424351905
Energy: 1.0528808648744146
Energy: 0.9388087424351905
Energy: 1.036537051893442
Energy: 0.8793539543273343
Energy: 1.0202192986415006
Energy: 0.8793539543291691
Energy: 1.0220672448962314
Energy: 0.9386775374195333
Energy: 1.1231617862000502
Energy: 0.9386775374167812
Energy: 1.0407765246107286
Energy: 0.9342920762852479
Energy: 1.0342314183555572
Energy: 0.9342920762852479
Energy: 1.0949743283237832
Energy: 0.9403494119758605
Energy: 1.0409683215838477
Energy: 0.9403494119767779
Energy: 1.058573063936786
Energy: 0.9636616905813106
Energy: 1.0378709441181122
Energy: 0.9636616905831455
Energy: 1.032880982172809
Energy: 0.9399433548079174
Energy: 1.0849066590360197
Energy: 0.9399433548097521
Energy: 1.0353445771752074
Energy: 0.9612762970273354
Energy: 1.0370400976891274
Energy: 0.961276297026418
Energy: 1.0561184732685622
Energy: 0.9400954733609194
Energy: 1.0380927334675853
Energy: 0.9400954733609194
Energy: 1.0575849840580582
Energy: 0.9628600881356367
Energy: 1.0375351180066836
Energy: 0.9628600881356367
Energy: 1.046109529667459
Energy: 0.9400297542585067
Energy: 1.0685919005541602
Energy: 0.9400297542585067
Energy: 0.9964496438328806
Energy: 0.9348002664840942
Energy: 1.0579612453726246
Energy: 0.9348002664831768
Energy: 1.0303548602129002
Energy: 0.9391312920232763
Energy: 0.9971074831048679
Energy: 0.9391312920241937
Energy: 1.0258055319599948
Energy: 0.9346022838077028
Energy: 0.9974206072260328
Energy: 0.9346022838077028
Energy: 1.0155812998448313
Energy: 0.9387660783703656
Energy: 1.052163899926922
Energy: 0.9387660783694483
Energy: 0.9988960212031832
Energy: 0.9953568766689996
Energy: 1.043035526951361
Energy: 0.9953568766689996
Energy: 1.0268254498760678
Energy: 0.9705899321286869
Energy: 1.017282254308686
Energy: 0.9705899321296043
Energy: 1.033054557550695
Energy: 0.9836385258057095
Energy: 1.0063097270655772
Energy: 0.983638525806627
Energy: 1.0564292973569167
Energy: 0.9721808597175826
Energy: 1.0058879922531112
Energy: 0.9721808597175826
Energy: 1.0252582018212513
Energy: 1.0157635823351048
Energy: 1.0301580490228557
Energy: 1.0157635823341873
Energy: 1.0026943074685082
Energy: 1.0221589502109796
Energy: 1.0602961784899245
Energy: 1.0221589502118968
Energy: 1.0550939584045531
Energy: 1.0024044252770279
Energy: 1.0300792569643613
Energy: 1.0024044252751931
Energy: 1.10810052263059
Energy: 1.0281444640273738
Energy: 1.0067025441361155
Energy: 1.0281444640273738
Energy: 1.0752908384554054
Energy: 1.0181102649324991
Energy: 1.0303014680641756
Energy: 1.0181102649334166
Energy: 1.0004674288359983
Energy: 1.0223451763782756
Energy: 1.0610172334632448
Energy: 1.0223451763773583
Energy: 1.0467087054397308
Energy: 0.9960918540872995
Energy: 1.058527476699404
Energy: 0.9960918540872995
Energy: 1.0564585549263121
Energy: 0.972198965041947
Energy: 1.0077327647279246
Energy: 0.9721989650410297
Energy: 1.0405638868252267
Energy: 0.9416518440792032
Energy: 1.0343157266861562
Energy: 0.9416518440801208
Energy: 1.0278511075925305
Energy: 0.9704030509466549
Energy: 1.0173139684325494
Energy: 0.9704030509475724
Energy: 1.022965958699397
Energy: 0.9281991621364266
Energy: 1.0094065097663785
Energy: 0.928199162137344
Energy: 1.015719799691193
Energy: 0.9387418011819526
Energy: 1.0538535143547885
Energy: 0.9387418011819526
Energy: 1.0048352703172492
Energy: 0.9268798753833923
Energy: 1.0415673482942007
Energy: 0.9268798753824748
Energy: 1.02112421213284
Energy: 0.9390378551534145
Energy: 0.9973237736068501
Energy: 0.9390378551534145
Energy: 1.040294764523467
Energy: 0.9344097334426109
Energy: 1.0357176388535034
Energy: 0.9344097334426109
Energy: 1.0461264398169285
Energy: 0.9259499258495777
Energy: 1.0411590176090535
Energy: 0.9259499258504952

minimum gb energy = 0.8703091387602993 eV
minimum distance =  2.34662399249155 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.014912515380905702
Energy: 0.015064003423658795
Energy: 1.6889452833789738
Energy: 0.015064003423658795
Energy: 0.01622047624967749
Energy: 0.8019029151063551
Energy: 0.01622047624967749
Energy: 0.8019029151070213
Energy: 1.688945283379679
Energy: 0.015064003423658795
Energy: 0.014912515380905702
Energy: 0.015064003423658795
Energy: 0.016220476248972247
Energy: 0.8019029151070213
Energy: 0.01622047624967749
Energy: 0.8019029151070213
Energy: 0.014912515380905702
Energy: 0.015064003423658795
Energy: 1.6889452833789738
Energy: 0.015064003423658795
Energy: 0.01622047624967749
Energy: 0.8019029151056498
Energy: 0.01622047624967749
Energy: 0.8019029151070213

minimum gb energy = 0.014912515380905702 eV
minimum distance =  2.47011882954265 Angstroms
sigma value = 1