Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_380272712420_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.5402784386331616
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.91030724425088e-19, 2.5288755991056e-19, 2.99259358228422e-19, 3.36904100420886e-19, 3.6864161736379197e-19, 3.9597955726973396e-19, 4.19835967349994e-19, 4.4082287907876e-19, 4.593760845004799e-19, 4.758192232952219e-19, 4.90397428487988e-19, 5.033077678047599e-19, 5.1471045890893795e-19, 5.24735278107876e-19, 5.33491173412686e-19, 5.410710710681399e-19, 5.475550799059379e-19, 5.53012093521342e-19, 5.57504596803078e-19, 5.610854615800679e-19, 5.638011509746979e-19, 5.65694923756086e-19, 5.66806834340082e-19, 5.67170528436e-19, 5.6677799516067e-19, 5.655042647366399e-19, 5.63182710793974e-19, 5.59617867783324e-19, 5.54571011386224e-19, 5.47753749808554e-19, 5.388184107207359e-19, 5.273404173147599e-19, 5.12797460007942e-19, 4.945454637934139e-19, 4.717801360009079e-19, 4.4349851405754e-19, 4.0842846971591395e-19, 3.6495180457568995e-19, 3.1097928030613195e-19, 2.43793605335976e-19, 1.5981119118795419e-19, 5.42423308147236e-20, -7.94106031229028e-20, -2.50130213923446e-19, -4.70544857816094e-19, -7.588629518109299e-19, -1.1419770307096438e-18, -1.6608483423370797e-18, -2.38014554217138e-18, -3.40648387214544e-18, -4.925090972915999e-18, -7.279890080737499e-18, -1.1166866725419539e-17, -1.81677217235796e-17]
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: 0.013667490153580934
Energy: 0.01417048393895327
Energy: 0.697858716397935
Energy: 0.10380355940902145
Energy: 0.01417048393895327
Energy: 0.7108681375404521
Energy: 0.10380355940961437
Energy: 0.7108681375391966
Energy: 0.6978587164010042
Energy: 0.10380355940961437
Energy: 0.013667490153580934
Energy: 0.01417048393895327
Energy: 0.10380355940902145
Energy: 0.7108681375404521
Energy: 0.01417048393895327
Energy: 0.7108681375398244

minimum gb energy = 0.013667490153580934 eV
minimum distance =  2.48424380180406 Angstroms
sigma value = 1


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

Energy: 1.264138689307433
Energy: 0.8151585789475563
Energy: 0.9109376525890595
Energy: 0.9095426877488839
Energy: 0.9354451886505807
Energy: 0.8966673644024356
Energy: 0.8783120960599496
Energy: 0.8966673644024356
Energy: 0.9095742988174682
Energy: 0.9096325663589365
Energy: 1.3760347856399862
Energy: 0.9096325663589365
Energy: 0.873787108580318
Energy: 1.0427600453288524
Energy: 0.87798386339371
Energy: 1.042760045328091
Energy: 1.173519654675722
Energy: 0.8566254123358722
Energy: 0.8242625578425173
Energy: 0.8566254123373949
Energy: 0.9187068086889575
Energy: 1.178531375987634
Energy: 0.8459861745513597
Energy: 1.178531375987634
Energy: 0.8863014341702228
Energy: 0.9465650958121873
Energy: 1.1744281984306526
Energy: 0.9465650958114258
Energy: 0.879783475126941
Energy: 1.2027905166024633
Energy: 0.8964720917193308
Energy: 1.2027905166032247
Energy: 1.0076518295423793
Energy: 0.9905381889370554
Energy: 1.0111381166454276
Energy: 0.9905381889370554
Energy: 0.8942231388128291
Energy: 1.2410432577886403
Energy: 0.879910012559794
Energy: 1.2410432577886403
Energy: 1.0830236997163116
Energy: 0.9906902000822976
Energy: 1.0096540095515667
Energy: 0.9906902000822976
Energy: 0.8768311479259385
Energy: 1.079098911759999
Energy: 0.8995804478239946
Energy: 1.079098911759999
Energy: 0.8827228364975034
Energy: 0.9467490677159809
Energy: 1.2668921009123226
Energy: 0.9467490677159809
Energy: 0.9186154724775998
Energy: 1.1791189379921065
Energy: 0.8826375876911399
Energy: 1.1791189379898221
Energy: 1.2654370338893677
Energy: 0.8562215299625571
Energy: 0.82107876159719
Energy: 0.8562215299640799
Energy: 0.855428703567079
Energy: 1.0422058740421711
Energy: 0.8777897383928408
Energy: 1.0422058740429325
Energy: 0.9100728682621038
Energy: 0.9065499509785759
Energy: 1.4857737619884648
Energy: 0.9065499509785759
Energy: 0.8779407902201469
Energy: 0.8749941054443936
Energy: 0.9356788160841579
Energy: 0.8749941054443936
Energy: 1.3769030790247585
Energy: 0.9075323387427202
Energy: 0.9090278080150368
Energy: 0.9075323387427202
Energy: 0.9182007057816935
Energy: 1.0427088168987941
Energy: 0.8732724273227906
Energy: 1.0427088168980327
Energy: 0.8212331230127283
Energy: 0.8565711434162158
Energy: 1.1743091432368449
Energy: 0.8565711434162158
Energy: 0.8699095329405533
Energy: 1.2772309503772443
Energy: 0.9184293270564092
Energy: 1.2772309503772443
Energy: 1.1738169708072193
Energy: 0.9500981345452738
Energy: 0.8825703040296556
Energy: 0.9500981345460351
Energy: 0.8968354856535046
Energy: 1.2027945048032005
Energy: 0.8777392796013305
Energy: 1.2027945048032005
Energy: 1.0090530481574775
Energy: 0.9921424713955754
Energy: 1.0085053597119888
Energy: 0.9921424713955754
Energy: 0.881577650661024
Energy: 0.9916450619119314
Energy: 0.8962180160189646
Energy: 0.99164506191117
Energy: 1.008336063419924
Energy: 0.9925147036615175
Energy: 1.086358835661939
Energy: 0.992514703660756
Energy: 0.8972333165740881
Energy: 1.0211259271711555
Energy: 0.8876436918363104
Energy: 1.0211259271719169
Energy: 1.2707123128457716
Energy: 0.94691202983937
Energy: 0.8821794618831887
Energy: 0.94691202983937
Energy: 0.8827736368641832
Energy: 1.0047373017201728
Energy: 0.9184084062198263
Energy: 1.0047373017201728
Energy: 0.820670797553318
Energy: 0.8554968895783874
Energy: 1.2691247732788176
Energy: 0.8554968895776259
Energy: 0.8781142598772407
Energy: 1.0421464968542322
Energy: 0.8552764735181854
Energy: 1.0421464968542322
Energy: 1.4886076331593974
Energy: 0.8717679837146022
Energy: 0.910077238627607
Energy: 0.8717679837138407

minimum gb energy = 0.8151585789475563 eV
minimum distance =  2.28665387771819 Angstroms
sigma value = 1


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

Energy: 1.4330388998050134
Energy: 0.8508198329628728
Energy: 0.9577757986158827
Energy: 0.9587089102002296
Energy: 0.9884520025188732
Energy: 0.9394628035564896
Energy: 0.9224808601709924
Energy: 0.9394628035547534
Energy: 0.959727868161028
Energy: 0.9594954233499312
Energy: 1.314861904889592
Energy: 0.9594954233490632
Energy: 0.9202644430571301
Energy: 1.0654277819954066
Energy: 0.9229880492888441
Energy: 1.0654277819971425
Energy: 1.3146693221709906
Energy: 0.8996014313406224
Energy: 0.8608847352319321
Energy: 0.8996014312521141
Energy: 0.9702677001485909
Energy: 1.2876384832740286
Energy: 0.8889488661284431
Energy: 1.2876384832722922
Energy: 0.9401348732026616
Energy: 1.0040702889343365
Energy: 1.1006804801183687
Energy: 1.0040702889343365
Energy: 0.9223242991607111
Energy: 1.2189968358910839
Energy: 0.9460665228980722
Energy: 1.2189968358936882
Energy: 1.1005932757884633
Energy: 1.0476837422574876
Energy: 1.0076450441514508
Energy: 1.047683742256659
Energy: 0.9470111946153674
Energy: 1.0682781219697062
Energy: 0.922760643248346
Energy: 1.0682781218377921
Energy: 1.1966557739856174
Energy: 1.0037107212307748
Energy: 0.941449959974584
Energy: 1.0037107212316427
Energy: 0.9317640137956184
Energy: 1.1775236889418568
Energy: 0.9697771873157061
Energy: 1.17752368897741
Energy: 0.8617806463645357
Energy: 0.9007504987730743
Energy: 1.1961373123983219
Energy: 0.9007504987713382
Energy: 0.9225457677776103
Energy: 1.0652377133561246
Energy: 0.8973923727864209
Energy: 1.0652377133344217
Energy: 1.434743061253502
Energy: 0.9592373579478385
Energy: 0.9584378177767335
Energy: 0.9592373579469704
Energy: 0.9884931794082906
Energy: 0.9188132314686452
Energy: 0.9225830250448497
Energy: 0.9188132314686452
Energy: 0.9577106926054434
Energy: 0.9589477218570635
Energy: 1.3156090357651549
Energy: 0.9589477218587997
Energy: 0.9177557235766373
Energy: 1.0655429821393794
Energy: 0.9692711381967044
Energy: 1.0655429821662514
Energy: 1.3152192370073585
Energy: 0.8998083634003994
Energy: 0.8615579845029011
Energy: 0.8998083633995312
Energy: 0.9702615597421392
Energy: 1.2880263293086203
Energy: 0.8895637801281847
Energy: 1.2880263293094885
Energy: 0.9417582574505581
Energy: 1.0040900936975634
Energy: 1.1006585418097767
Energy: 1.0040900936966952
Energy: 0.9223414044998934
Energy: 1.1379873163219205
Energy: 0.946801024161162
Energy: 1.1379873163219205
Energy: 1.1014337908484448
Energy: 1.0481772042504818
Energy: 1.0120418332722703
Energy: 1.0481772042504818
Energy: 0.947287130520793
Energy: 1.0434377536795176
Energy: 0.9357692562639416
Energy: 1.0434377536821222
Energy: 1.1948890407523198
Energy: 1.0029907389905772
Energy: 0.9398710552658552
Energy: 1.0029907389879729
Energy: 0.9319858499932862
Energy: 1.0574700510376642
Energy: 0.9691727807998132
Energy: 1.0574700510359283
Energy: 0.861273235780317
Energy: 0.8619061797357126
Energy: 1.1992215271485507
Energy: 0.8619061797357126
Energy: 0.9225918245718747
Energy: 0.8621463817793762
Energy: 0.8976076503388352
Energy: 0.8621463817811124
Energy: 1.438867358105683
Energy: 0.9190280954072596
Energy: 0.9576138127855179
Energy: 0.9190280954072596

minimum gb energy = 0.8508198329628728 eV
minimum distance =  2.29017839994166 Angstroms
sigma value = 25


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

Energy: 1.358345819603187
Energy: 0.888452715123132
Energy: 1.0126431163240464
Energy: 1.0124475260412404
Energy: 1.0483298297386157
Energy: 0.9844875545306028
Energy: 0.9724073199924277
Energy: 0.9844875545306028
Energy: 1.012180643901786
Energy: 1.012800775466117
Energy: 1.2302851122619827
Energy: 1.012800775466117
Energy: 0.9657908119444426
Energy: 1.0867805413372
Energy: 0.9727940334276981
Energy: 1.0867805413382092
Energy: 1.2322824272562616
Energy: 0.9052287152912915
Energy: 0.9048364175007713
Energy: 0.9052287152438608
Energy: 1.027196988414664
Energy: 1.3028099534782205
Energy: 0.9361388928466683
Energy: 1.3028099534782205
Energy: 1.015646485781417
Energy: 1.0705944092291975
Energy: 1.0146936410022003
Energy: 1.0705944092291975
Energy: 0.9724342152765499
Energy: 1.3360270861974584
Energy: 1.0034899991326316
Energy: 1.3360270861974584
Energy: 1.0154712845998688
Energy: 1.0688603089215436
Energy: 1.1072146689010962
Energy: 1.0688603089215436
Energy: 1.0274659644938933
Energy: 1.1687174859926872
Energy: 0.9903474243681829
Energy: 1.1687174859936964
Energy: 1.3627861667673156
Energy: 0.9469710192840581
Energy: 0.903614950743043
Energy: 0.9469710192840581
Energy: 0.9444743354383629
Energy: 1.0869199627066173
Energy: 0.9724082990959377
Energy: 1.0869199627066173
Energy: 1.0119229312422633
Energy: 1.012209700162895
Energy: 1.3605255673086794
Energy: 1.012209700162895
Energy: 0.9726200130665644
Energy: 0.9661106317470396
Energy: 1.0472465851562354
Energy: 0.966110631749058
Energy: 1.2310661505204725
Energy: 1.0124809045811356
Energy: 1.013700789455303
Energy: 1.0124809045821448
Energy: 1.0727445679091503
Energy: 0.9853900461546867
Energy: 0.9656206173158972
Energy: 0.9853900461546867
Energy: 0.9050647579755323
Energy: 0.9049192350431474
Energy: 1.232762640981628
Energy: 0.9049192350421382
Energy: 0.9359157143568095
Energy: 1.303281657043187
Energy: 1.027597234305323
Energy: 1.303281657042178
Energy: 1.0147710837510087
Energy: 1.1121456116680735
Energy: 1.0165159099322467
Energy: 1.1121456116680735
Energy: 1.0045607323650654
Energy: 1.0709574551232444
Energy: 0.9739736555921783
Energy: 1.0709574551232444
Energy: 1.1028055832953185
Energy: 1.0679176147758382
Energy: 1.0146295857102543
Energy: 1.0679176147758382
Energy: 0.9874836313222252
Energy: 1.0831635519806895
Energy: 1.0265796078723244
Energy: 1.0831635519796805
Energy: 0.9049780006844137
Energy: 0.9476943499639847
Energy: 1.361346068422282
Energy: 0.9476943499639847
Energy: 0.9725444246926863
Energy: 0.9490456186293146
Energy: 0.9440362470498644
Energy: 0.9490456186303237
Energy: 1.358781340856424
Energy: 0.964985480507219
Energy: 1.0124650121181575
Energy: 0.964985480507219

minimum gb energy = 0.888452715123132 eV
minimum distance =  2.29346096559698 Angstroms
sigma value = 9


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

Energy: 1.2474170236019542
Energy: 0.9221144613541434
Energy: 1.070086185854338
Energy: 1.0695979284062613
Energy: 1.1116020553852186
Energy: 1.0253973693519778
Energy: 1.0247420181426068
Energy: 1.0253973693519778
Energy: 1.0700913107804801
Energy: 1.06959103706084
Energy: 1.4687871742536531
Energy: 1.06959103706084
Energy: 1.012275957912934
Energy: 1.105074007771549
Energy: 1.0248487160739368
Energy: 1.105074007771549
Energy: 1.118713586251323
Energy: 0.9536116624198413
Energy: 0.9532009643813378
Energy: 0.95361166239218
Energy: 1.0921628596461566
Energy: 1.2943862860895736
Energy: 0.9844781281001992
Energy: 1.2943862860895736
Energy: 0.9902133017350881
Energy: 1.1750705471634857
Energy: 1.1210816276223516
Energy: 1.1750705471623093
Energy: 1.05272690050394
Energy: 1.291122425481445
Energy: 1.0914817507941375
Energy: 1.291122425481445
Energy: 0.9516760928579892
Energy: 0.9532247235339292
Energy: 1.2509672869190056
Energy: 0.9532247235351331
Energy: 1.0245327213453759
Energy: 1.1046389221862134
Energy: 0.9904533304617462
Energy: 1.1046389221862134
Energy: 1.2502456542702949
Energy: 1.0695166103843838
Energy: 1.0766233317597997
Energy: 1.06951661038318
Energy: 1.1112643624827865
Energy: 1.012619072548773
Energy: 1.0247968278301414
Energy: 1.0126190725475692
Energy: 1.0707216820908168
Energy: 1.0697696304149613
Energy: 1.4699461195381358
Energy: 1.0697696304149613
Energy: 1.012678971205912
Energy: 1.0248715941088948
Energy: 1.1487369642244067
Energy: 1.0248715941076911
Energy: 1.1188407299867253
Energy: 0.9533406291397232
Energy: 0.9526651522912584
Energy: 0.9533406291613652
Energy: 1.0916404904244252
Energy: 0.9980942475910062
Energy: 0.952052371940523
Energy: 0.9980942475910062
Energy: 0.9900958834815858
Energy: 1.1763835676945689
Energy: 1.1205073242500083
Energy: 1.176383567693365
Energy: 0.9901501758189043
Energy: 1.1404281709807849
Energy: 1.0911474274823632
Energy: 1.1404281709807849
Energy: 0.9509931767759472
Energy: 0.952867887867984
Energy: 1.2514980400684341
Energy: 0.952867887867984
Energy: 1.0246599009928004
Energy: 0.9997736419279151
Energy: 0.990236758853203
Energy: 0.9997736419291189
Energy: 1.2475565371445467
Energy: 1.0121870784850897
Energy: 1.0700276204737482
Energy: 1.0121870784850897

minimum gb energy = 0.9221144613541434 eV
minimum distance =  2.29593025834667 Angstroms
sigma value = 25


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

Energy: 1.0871566014591822
Energy: 0.9435692992683691
Energy: 1.1382034457833412
Energy: 1.1281000834645438
Energy: 1.1839386140861352
Energy: 1.0167734486318534
Energy: 1.0735989400543486
Energy: 1.0167734486318534
Energy: 1.1282574626766886
Energy: 1.1283650943712626
Energy: 1.3365003774832531
Energy: 1.1283650943697738
Energy: 1.0609688828996777
Energy: 1.0177259146744786
Energy: 1.0736413616102027
Energy: 1.0177259146744786
Energy: 1.0092134445563965
Energy: 1.1324645115177447
Energy: 1.0136609301657733
Energy: 1.1324645115177447
Energy: 1.1884345667785237
Energy: 1.0534472393493117
Energy: 0.9621759870055746
Energy: 1.053447239346334
Energy: 1.0896591356376395
Energy: 1.1060115602303628
Energy: 1.011457633552252
Energy: 1.1060115602303628
Energy: 1.0749372777806494
Energy: 1.0916209626257032
Energy: 1.073593594665381
Energy: 1.0916209626257032
Energy: 1.13764995547623
Energy: 1.1792916918843013
Energy: 1.5932799582018498
Energy: 1.1792916918843013
Energy: 1.07358266457895
Energy: 1.0178859481050169
Energy: 1.1841762858522005
Energy: 1.0178859481050169
Energy: 1.3376568066527283
Energy: 1.1283415964435368
Energy: 1.1299248965581195
Energy: 1.128341596442082
Energy: 1.1876034103213595
Energy: 1.018028317506968
Energy: 1.1298106149672893
Energy: 1.0180283175054792
Energy: 1.0802219232743853
Energy: 1.107067712422375
Energy: 1.009668748221267
Energy: 1.1070677115324754
Energy: 1.0134679593461136
Energy: 1.1059333200059516
Energy: 1.189849517579809
Energy: 1.1059333200044628
Energy: 1.010328695864686
Energy: 1.091042616143764
Energy: 1.1516468439554983
Energy: 1.0910426161452529
Energy: 1.0736241428299134
Energy: 1.091795042185857
Energy: 1.0907763666075292
Energy: 1.091795042185857
Energy: 1.1851267342866918
Energy: 1.1796372686977437
Energy: 1.137985621857383
Energy: 1.1796372686977437

minimum gb energy = 0.9435692992683691 eV
minimum distance =  2.29547403902885 Angstroms
sigma value = 17


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

Energy: 1.5222192902155598
Energy: 1.1769360004748968
Energy: 1.2774925218266096
Energy: 1.2796881427597602
Energy: 1.0378435209897114
Energy: 1.0155223241467024
Energy: 1.215376801661019
Energy: 1.01552232440376
Energy: 1.0579166143596779
Energy: 1.0635706580511752
Energy: 1.380193242762255
Energy: 1.0635706580503321
Energy: 1.0146836454662223
Energy: 1.0834507041660386
Energy: 1.2158635820519412
Energy: 1.0834507041660386
Energy: 1.139972970517567
Energy: 1.2489703956519222
Energy: 1.0374618064163907
Energy: 1.2489703956519222
Energy: 1.2160356423031948
Energy: 1.1426291517772207
Energy: 1.099592174777506
Energy: 1.1426291517772207
Energy: 1.2405142271295044
Energy: 1.0652798872383828
Energy: 1.0650456279845573
Energy: 1.0652798872375395
Energy: 1.2681194947954717
Energy: 1.0647001881398606
Energy: 1.062738037690572
Energy: 1.0647001881398606
Energy: 1.2794417710473192
Energy: 1.2789503161513947
Energy: 1.3818656963170648
Energy: 1.2789503161505513
Energy: 1.205280997525324
Energy: 1.136732403104033
Energy: 1.213865021986559
Energy: 1.136732403104033
Energy: 1.1385156277021036
Energy: 1.1663074496831463
Energy: 1.0541012562603769
Energy: 1.1663074496764008
Energy: 1.2701587142183222
Energy: 1.1341462687619872
Energy: 0.9967150550688162
Energy: 1.1341462687619872
Energy: 1.0761562242594571
Energy: 1.1338411139496798
Energy: 0.9957257545471168
Energy: 1.1338411139496798
Energy: 1.237557059217986
Energy: 1.04059320135777
Energy: 1.05358833811751
Energy: 1.0405932013594565
Energy: 1.2739435140729052
Energy: 1.2672776333418532
Energy: 1.3138574405947931
Energy: 1.2672776333393234
Energy: 1.2803773800076264
Energy: 1.2241837908237132
Energy: 1.5508030257274856
Energy: 1.2241837908245563
Energy: 1.438705486765272
Energy: 1.0648015573396832
Energy: 1.0644138555757185
Energy: 1.0648015573396832
Energy: 1.3685873819163197
Energy: 1.0645164733020105
Energy: 1.0574590783891071
Energy: 1.0645164733020105
Energy: 1.2138863784501017
Energy: 1.1219793981388293
Energy: 1.139291921460619
Energy: 1.1219793981295545
Energy: 1.037057070283417
Energy: 1.3218008216939356
Energy: 1.1266872691077092
Energy: 1.3218008216939356
Energy: 1.0155774162275975
Energy: 1.0174031829292998
Energy: 1.268974881644915
Energy: 1.0174031829183383
Energy: 1.0634118820678506
Energy: 1.0708985505327635
Energy: 1.2357827172602147
Energy: 1.0708985505327635
Energy: 1.2153745581565567
Energy: 1.1500425950109696
Energy: 1.2315888621137987
Energy: 1.1500425950118127
Energy: 1.3811380920042777
Energy: 1.2792268474222397
Energy: 1.2802813637465975
Energy: 1.2792268474213964
Energy: 0.997243634354036
Energy: 1.1499503383874383
Energy: 1.1741075587018917
Energy: 1.1499503383874383
Energy: 0.9956856922349848
Energy: 0.9969595435924964
Energy: 1.1403054075238948
Energy: 0.9969595435916532
Energy: 1.0330155996460937
Energy: 0.9959343104790095
Energy: 1.2698002569092792
Energy: 0.9959343104790095
Energy: 0.9954093134712877
Energy: 0.9967311490490888
Energy: 1.238291768727211
Energy: 0.9967311490415002
Energy: 1.055662775826762
Energy: 1.0143178092797722
Energy: 1.1728375274287615
Energy: 1.0143178092797722
Energy: 1.5232699126042617
Energy: 1.2801721790227674
Energy: 1.2748983854509324
Energy: 1.2801721790236107

minimum gb energy = 0.9954093134712877 eV
minimum distance =  2.28640026912689 Angstroms
sigma value = 53


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

Energy: 1.3594578780915092
Energy: 0.9167257139208281
Energy: 1.1730032525575382
Energy: 1.1723037384022827
Energy: 1.2945710827074006
Energy: 1.1434026855239168
Energy: 1.1189329004666093
Energy: 1.1434026855200343
Energy: 1.1681400602415524
Energy: 1.4373520786967608
Energy: 1.126965332532058
Energy: 1.4373520786967608
Energy: 1.0992156140990852
Energy: 1.1437993578358532
Energy: 1.1189850838673716
Energy: 1.143799357822265
Energy: 1.132484081103327
Energy: 0.9729729804445891
Energy: 0.8966142383438125
Energy: 0.9729729804445891
Energy: 1.0965743680844464
Energy: 1.4589643030379107
Energy: 0.8968151434189066
Energy: 1.4589643030398518
Energy: 1.3640796026570983
Energy: 1.195294396331174
Energy: 1.171122626715013
Energy: 1.195294396331174
Energy: 1.2908831963881833
Energy: 1.3844549098648757
Energy: 1.214579507258616
Energy: 1.3844549098648757
Energy: 1.1690232714137516
Energy: 1.437456243565154
Energy: 1.1287690728261095
Energy: 1.4374562435670952
Energy: 1.0970054769110587
Energy: 1.1444022206114377
Energy: 1.1187893414683474
Energy: 1.1444022206114377
Energy: 1.1315125387598575
Energy: 1.183436715186283
Energy: 0.8968758273908038
Energy: 1.183436715186283
Energy: 1.1177850491678918
Energy: 1.183369509990677
Energy: 0.8992671843103817
Energy: 1.183369509990677
Energy: 1.2908280035138013
Energy: 1.143664221371704
Energy: 1.193573699111164
Energy: 1.143664221371704

minimum gb energy = 0.8966142383438125 eV
minimum distance =  2.27193813787806 Angstroms
sigma value = 9


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

Energy: 1.316941021275064
Energy: 1.285954122436625
Energy: 1.3809288583189496
Energy: 1.380933450279594
Energy: 1.227011693802067
Energy: 1.253279728686563
Energy: 1.4100554916435277
Energy: 1.253279728686563
Energy: 1.0086349465177071
Energy: 1.0114205534333212
Energy: 1.226803822921402
Energy: 1.0114205534318843
Energy: 1.0119692994147278
Energy: 1.039948872016489
Energy: 1.4027164220670583
Energy: 1.039948872016489
Energy: 1.0103772731411385
Energy: 1.0084914228128488
Energy: 1.3759065968184756
Energy: 1.008491422813567
Energy: 1.113282141214496
Energy: 1.2523083522795369
Energy: 1.3749943102056181
Energy: 1.2523083522795369
Energy: 1.4948276275139778
Energy: 1.339143648628625
Energy: 1.3816203434585232
Energy: 1.339143648628625
Energy: 1.4942933918287509
Energy: 1.3041374716661818
Energy: 1.3477957098603333
Energy: 1.3041374716669
Energy: 1.097704583566628
Energy: 1.3495844196241913
Energy: 1.0565782656058418
Energy: 1.3495844196234728
Energy: 0.9767786471484214
Energy: 1.0596603351341682
Energy: 1.2881900369152928
Energy: 1.059639123392162
Energy: 1.1369304676511989
Energy: 1.1385969846329622
Energy: 1.357700405065157
Energy: 1.1385969846329622
Energy: 1.1648182377948468
Energy: 1.2198404014158153
Energy: 1.3215926809695584
Energy: 1.219840401415097
Energy: 1.4955372432421796
Energy: 1.1328828361138608
Energy: 1.2893941458917282
Energy: 1.132882836113142
Energy: 1.4800799033704186
Energy: 1.1380455364739572
Energy: 1.162169095937651
Energy: 1.1380455364739572
Energy: 1.2881440309604792
Energy: 1.1515889129615828
Energy: 1.060462644585214
Energy: 1.1515889129615828
Energy: 1.135679866517724
Energy: 1.3353818364622798
Energy: 1.0939407505003562
Energy: 1.3353818364622798
Energy: 1.299099194235709
Energy: 1.2933016984165935
Energy: 1.1936547986721184
Energy: 1.293301698402943
Energy: 1.3797284392511509
Energy: 1.3797085152222748
Energy: 1.3177147589358018
Energy: 1.379708515219401
Energy: 1.3675841663607475
Energy: 1.3054545828993642
Energy: 1.2198445584405997
Energy: 1.3054545829000828
Energy: 1.2263487512018272
Energy: 1.011188898918089
Energy: 1.0085887306725976
Energy: 1.011188898916652
Energy: 1.402888422664636
Energy: 1.008915741949301
Energy: 1.0117940980971698
Energy: 1.0089157419550487
Energy: 1.3775845012196486
Energy: 1.0083620604441947
Energy: 1.0082819781067138
Energy: 1.0083620604456318
Energy: 1.376193429004397
Energy: 1.251414469447075
Energy: 1.0666395652877187
Energy: 1.2514144694463565
Energy: 1.3781087380213346
Energy: 1.3182846632836547
Energy: 1.4974847728928742
Energy: 1.3182846632836547
Energy: 1.3492232472252705
Energy: 1.3038594628797022
Energy: 1.500939535968232
Energy: 1.3038594628804208
Energy: 1.0585634491421017
Energy: 1.352260931013405
Energy: 1.1060052002042042
Energy: 1.3522609310126863
Energy: 1.2869780494824061
Energy: 1.1229673631892327
Energy: 0.9766853549383139
Energy: 1.1229673631906696
Energy: 1.4740626027654762
Energy: 1.1327015669221954
Energy: 1.1377591426899294
Energy: 1.1327015669214768
Energy: 1.3191777900084443
Energy: 1.229928230288543
Energy: 1.1644904302342114
Energy: 1.229928230288543
Energy: 1.2683355236136875
Energy: 1.1320367397940323
Energy: 1.411955777669079
Energy: 1.1320367397925952
Energy: 1.1623470069431674
Energy: 1.1390143386469047
Energy: 1.229004722007236
Energy: 1.1390143386461866
Energy: 1.1062744714167727
Energy: 1.1250467412519347
Energy: 1.2870156500230105
Energy: 1.1250467412519347
Energy: 1.0619968531481203
Energy: 1.171097222108558
Energy: 1.1384116294632476
Energy: 1.1710972221092764
Energy: 1.1880872919597139
Energy: 1.3417761524931353
Energy: 1.2170302053520088
Energy: 1.3417761524931353
Energy: 1.3198233146131242
Energy: 1.3800363068904398
Energy: 1.3794386087769144
Energy: 1.3800363068904398

minimum gb energy = 0.9766853549383139 eV
minimum distance =  2.28330388786324 Angstroms
sigma value = 73


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

Energy: 1.3815479182463222
Energy: 1.2055068758965217
Energy: 1.295442427324504
Energy: 1.295134994581017
Energy: 1.3798012628861205
Energy: 1.3392422358493716
Energy: 1.4555088793625521
Energy: 1.3392422358493716
Energy: 1.043393077041315
Energy: 1.2474372583152133
Energy: 1.1820379207748306
Energy: 1.2474372583152133
Energy: 1.0736266094363205
Energy: 1.0817144226095834
Energy: 1.4205729325644147
Energy: 1.0817144226095834
Energy: 1.0703532445816228
Energy: 1.0513396569980347
Energy: 1.4234924512537102
Energy: 1.0513396569980347
Energy: 1.1426392543011077
Energy: 1.2552168826969619
Energy: 1.415507292915711
Energy: 1.2552168826981018
Energy: 1.6637444078747794
Energy: 1.4798869964388224
Energy: 1.3505013376605028
Energy: 1.4798869964388224
Energy: 1.5996251221390563
Energy: 1.2418314966201878
Energy: 1.308204757537439
Energy: 1.2418314966213277
Energy: 1.1754876244735575
Energy: 1.2977187763998355
Energy: 1.2044054769593773
Energy: 1.2977187764009754
Energy: 1.0462044481503414
Energy: 1.2164421953239688
Energy: 1.2842641373330481
Energy: 1.2164421953239688
Energy: 1.1873504797734806
Energy: 1.073083076514135
Energy: 1.2849134777597064
Energy: 1.073083076514135
Energy: 1.1434125330859501
Energy: 1.0748855206859207
Energy: 1.2495978990310643
Energy: 1.0748855206859207
Energy: 1.227369639448402
Energy: 1.17423835949675
Energy: 1.1646620787456115
Energy: 1.17423835949675
Energy: 1.1819056669638055
Energy: 1.2301222473682187
Energy: 1.1157812616631821
Energy: 1.2301222473682187
Energy: 1.2831563111953286
Energy: 1.2032955643707237
Energy: 1.075641403072641
Energy: 1.2032955643707237
Energy: 1.3896002598316393
Energy: 1.3144464013675576
Energy: 1.1115899602715062
Energy: 1.3144464013664177
Energy: 1.3703097274888774
Energy: 1.2136330950408258
Energy: 1.1579640589262172
Energy: 1.2136330950408258
Energy: 1.3165615516620117
Energy: 1.353689232289143
Energy: 1.6601470747351343
Energy: 1.353689232289143
Energy: 1.224581269629471
Energy: 1.210909807894199
Energy: 1.4744533169953389
Energy: 1.210909807895339
Energy: 1.1286990294034398
Energy: 1.2213799076260947
Energy: 1.1638833963772157
Energy: 1.2213799076260947
Energy: 1.1723297271690154
Energy: 1.213759628495361
Energy: 1.0469081357483425
Energy: 1.213759628495361
Energy: 1.382721823953206
Energy: 1.2457177687281804
Energy: 1.279033267216126
Energy: 1.2457177687281804

minimum gb energy = 1.043393077041315 eV
minimum distance =  2.27562902542306 Angstroms
sigma value = 7


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

Energy: 1.6744902273478532
Energy: 1.2657538061248101
Energy: 1.3790707745403024
Energy: 1.3423226260835044
Energy: 1.27699058269284
Energy: 1.1958311400535018
Energy: 1.3762890833226913
Energy: 1.1958311400502777
Energy: 1.029869956178051
Energy: 1.2028082794847719
Energy: 1.1428527952860428
Energy: 1.2028082794839656
Energy: 1.0552675825714128
Energy: 1.0949745100229216
Energy: 1.3633816155697274
Energy: 1.0949745100221155
Energy: 1.1269396160802274
Energy: 1.1142775719810276
Energy: 1.2867174893244118
Energy: 1.1142775719810276
Energy: 1.1412946533600927
Energy: 1.2013443026423374
Energy: 1.2868865654978385
Energy: 1.2013443026423374
Energy: 1.485077451122725
Energy: 1.291670339714838
Energy: 1.1669812811062699
Energy: 1.2916703397132259
Energy: 1.4138685951693333
Energy: 1.1038957507178566
Energy: 1.1628315652825245
Energy: 1.1038957507178566
Energy: 1.350253620357728
Energy: 1.033288833393715
Energy: 1.0325502483405726
Energy: 1.033288833392909
Energy: 1.2870391654769995
Energy: 1.2455119876806333
Energy: 1.037467140785309
Energy: 1.2455119876814396
Energy: 1.37967941401289
Energy: 1.3122918921364988
Energy: 1.2156330271258626
Energy: 1.3122918921364988
Energy: 1.3892862195671771
Energy: 1.305078342351338
Energy: 1.4804486200840479
Energy: 1.3050783423521441
Energy: 1.21172185020049
Energy: 1.2198379809782736
Energy: 1.1939784852463766
Energy: 1.2198379809766617
Energy: 1.161091172264384
Energy: 1.169264470683285
Energy: 1.0502695099444175
Energy: 1.169264470683285
Energy: 1.2151431561166224
Energy: 1.1430347038022284
Energy: 1.0941675467204686
Energy: 1.1430347038030346
Energy: 1.5791606018335218
Energy: 1.1664727795977683
Energy: 1.2725948983528397
Energy: 1.1664727795969623
Energy: 1.4955209542765175
Energy: 1.1422450776638942
Energy: 1.4282940715900028
Energy: 1.1422450776647
Energy: 1.1084570450286884
Energy: 1.3945914815488254
Energy: 1.1413988028990756
Energy: 1.3945914815472134
Energy: 1.0840864018023064
Energy: 1.0846911662638135
Energy: 1.3534740025621206
Energy: 1.0846911666448797
Energy: 1.1400138064804484
Energy: 1.119086708932981
Energy: 1.4083013908596609
Energy: 1.119086708934593
Energy: 1.1813936023316742
Energy: 1.468990163836691
Energy: 1.2899364563032318
Energy: 1.468990163836691
Energy: 1.463567732163495
Energy: 1.3149361256253
Energy: 1.3715663155444449
Energy: 1.314936125623688
Energy: 1.4627178367736517
Energy: 1.1206064402607219
Energy: 1.1452374152738645
Energy: 1.1206064402607219
Energy: 1.3498294896323921
Energy: 1.0798245971565834
Energy: 1.0456037265916776
Energy: 1.0798245971565834
Energy: 1.2881655548023188
Energy: 1.368082596324845
Energy: 1.0314043948642586
Energy: 1.3680825963256509
Energy: 1.3128219598466286
Energy: 1.1958519053492502
Energy: 1.1213489127217517
Energy: 1.1958519053500563
Energy: 1.374871978925021
Energy: 1.345724422562106
Energy: 1.4771840855668614
Energy: 1.345724422562106
Energy: 1.189758732477905
Energy: 1.1892359902217997
Energy: 1.2351123358277605
Energy: 1.1892359902217997
Energy: 1.1013228382464548
Energy: 1.1910321251004816
Energy: 1.137576767782292
Energy: 1.1910321250996754
Energy: 1.1428160601026933
Energy: 1.1664296868118367
Energy: 1.050977890209075
Energy: 1.1664296868102246
Energy: 1.6198960296320897
Energy: 1.2793969169081072
Energy: 1.3322064000698408
Energy: 1.2793969169105253

minimum gb energy = 1.029869956178051 eV
minimum distance =  2.24769560827085 Angstroms
sigma value = 29


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

Energy: 0.9049501504726019
Energy: 0.9065328396428304
Energy: 1.1733513536208673
Energy: 1.2386805616229601
Energy: 0.9088481287138452
Energy: 1.016577687553265
Energy: 1.132166005942553
Energy: 1.0165776875513308
Energy: 1.3359826100506467
Energy: 1.2406205995770117
Energy: 1.0910180075257816
Energy: 1.2406205995764812
Energy: 1.0990028929561075
Energy: 0.9247773600278155
Energy: 1.1317936429005473
Energy: 0.9247773600272541
Energy: 1.0999265625790777
Energy: 1.0982703816858823
Energy: 0.9089745572572898
Energy: 1.098270381686163
Energy: 1.1316883872703594
Energy: 1.1781508409539474
Energy: 0.9089136241186
Energy: 1.1781508409539474
Energy: 0.9117431817433211
Energy: 0.9901600667979942
Energy: 1.3368180707353303
Energy: 0.9901600667977134
Energy: 1.1315903604205297
Energy: 0.9259699489300832
Energy: 0.9385793082810479
Energy: 0.9259699489339204
Energy: 0.9089358980151128
Energy: 0.9285725166398472
Energy: 1.0946796067521378
Energy: 0.928572516640128

minimum gb energy = 0.9049501504726019 eV
minimum distance =  2.3220920679263 Angstroms
sigma value = 5


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

Energy: 1.3153571132976394
Energy: 0.9620520017087136
Energy: 1.2495958519248536
Energy: 1.2120164533048552
Energy: 1.298516335411437
Energy: 0.9397053408441399
Energy: 1.1064776970989272
Energy: 0.9397053408418556
Energy: 1.1054620051026396
Energy: 1.0087637807055794
Energy: 1.0926764684063242
Energy: 1.0087637807055794
Energy: 1.0169397977963552
Energy: 0.9379031383109291
Energy: 1.2695499600654054
Energy: 0.9379031383094064
Energy: 1.1630868312035874
Energy: 0.9672499007291064
Energy: 1.4583782466639363
Energy: 0.967249900728345
Energy: 0.9596215451780153
Energy: 0.9634473346907336
Energy: 1.4285642232544542
Energy: 0.9634473346892108
Energy: 0.9370509103637732
Energy: 0.9370942178880496
Energy: 1.3369030216498108
Energy: 0.9370942178895725
Energy: 0.9593412382654071
Energy: 0.9403091017994186
Energy: 1.322152067144274
Energy: 0.9403091017994186
Energy: 1.2932184060504681
Energy: 1.111208801138837
Energy: 1.3481397103221593
Energy: 1.1112088011380759
Energy: 1.1527013257155574
Energy: 0.9321515214958767
Energy: 0.9729650488976902
Energy: 0.9321515214966382
Energy: 1.3035875396284398
Energy: 0.9316027299019433
Energy: 0.9325049829908973
Energy: 0.9316027299019433
Energy: 1.2998765792177995
Energy: 0.9349687884458291
Energy: 0.9309848150101325
Energy: 0.9349687884450677
Energy: 1.3489366458521992
Energy: 1.1965580730055168
Energy: 1.2149692422017593
Energy: 1.1965580730055168
Energy: 1.2980727642345304
Energy: 1.3303037235204818
Energy: 1.1781793610848799
Energy: 1.3303037235204818
Energy: 1.0201416910733592
Energy: 1.0824324204712592
Energy: 1.1751272927735719
Energy: 1.082432420470498
Energy: 1.0045582566705145
Energy: 0.9208704192744234
Energy: 1.3007300876370285
Energy: 0.9208704192736621
Energy: 1.1480506219884472
Energy: 1.0257046464738293
Energy: 1.6000086188251506
Energy: 1.0257046464738293
Energy: 1.2355686083843338
Energy: 0.9226248133727947
Energy: 1.304728441382638
Energy: 0.9226248133727947
Energy: 1.1532100974615136
Energy: 0.9980974348696318
Energy: 1.0438529947187916
Energy: 0.9980974348643021
Energy: 1.2605503717927784
Energy: 1.0833185632724496
Energy: 1.0140246539691102
Energy: 1.0833185632739724
Energy: 1.4052033646894442
Energy: 0.944202172945908
Energy: 1.0419321111360158
Energy: 0.9442021729474307
Energy: 1.515162790294096
Energy: 1.0235988288556854
Energy: 1.1425811437011801
Energy: 1.0235988288564468
Energy: 1.3342561486384092
Energy: 0.9416572059905095
Energy: 0.9428238418737004
Energy: 0.9416572059905095
Energy: 1.3267861876814466
Energy: 0.9441151117010166
Energy: 0.9582140776142904
Energy: 0.9441151117017779
Energy: 1.3006803333806682
Energy: 1.0928791381649414
Energy: 1.2978457459643433
Energy: 1.0928791381657026
Energy: 1.0519105448822448
Energy: 0.928810971598841
Energy: 1.15254958406629
Energy: 0.9288109715996025
Energy: 0.9302669790579132
Energy: 0.9283768162917546
Energy: 1.318961872805916
Energy: 0.9283768162932773
Energy: 0.9511878083140989
Energy: 0.9286314011653715
Energy: 1.2434395339559885
Energy: 0.9286314011668942
Energy: 1.13439397175071
Energy: 1.04838847238402
Energy: 1.3192411201760161
Energy: 1.0483884723855428
Energy: 1.1739544446507324
Energy: 1.1903649980082713
Energy: 1.2161802994658235
Energy: 1.1903649980090325
Energy: 1.174474549002131
Energy: 0.939677073659791
Energy: 0.9420808685517995
Energy: 0.9396770736582682
Energy: 1.274216299096576
Energy: 0.9388021028743947
Energy: 0.9418104193060185
Energy: 0.9388021028743947
Energy: 1.6959471275319202
Energy: 0.967574436378911
Energy: 1.0363547759865328
Energy: 0.9675744363766269

minimum gb energy = 0.9208704192736621 eV
minimum distance =  2.28769688565378 Angstroms
sigma value = 1


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

Energy: 1.424542157414596
Energy: 0.937340120751652
Energy: 1.0142887758117092
Energy: 0.9447703986117797
Energy: 1.2576678715203593
Energy: 0.9078775656055138
Energy: 1.1254893791494567
Energy: 0.9078775656076193
Energy: 1.1170877116116846
Energy: 1.0005205418936263
Energy: 1.1241704750710715
Energy: 1.0005205418936263
Energy: 1.0051771400259073
Energy: 1.120474300580883
Energy: 1.177579747137139
Energy: 1.120474300580883
Energy: 1.169052238706029
Energy: 0.9860643053644365
Energy: 1.4666711308086358
Energy: 0.9860643053644365
Energy: 0.9848450064577879
Energy: 0.9392239122799627
Energy: 1.4670745773332183
Energy: 0.9392239122799627
Energy: 0.9099927903069562
Energy: 0.9105795251961487
Energy: 1.3759305057246136
Energy: 0.9105795251961487
Energy: 0.9222294270327563
Energy: 0.9140443703726284
Energy: 1.4304963774231474
Energy: 0.9140443703736811
Energy: 1.1657668070475444
Energy: 0.9771984598323912
Energy: 1.3700512510934997
Energy: 0.9771984598323912
Energy: 1.1986570076232719
Energy: 1.085417652834369
Energy: 0.9878027314492354
Energy: 1.0854176528333164
Energy: 1.1722605649093776
Energy: 0.8884531831261847
Energy: 0.9872011261909627
Energy: 0.8884531831261847
Energy: 1.304180445771431
Energy: 0.8822696378992632
Energy: 0.9905367171698302
Energy: 0.8822696378992632
Energy: 1.2993500139433276
Energy: 0.8903825677556673
Energy: 1.0160345375987567
Energy: 0.8903825677546144
Energy: 1.2299632014551891
Energy: 0.8775330540917353
Energy: 1.2024146485964498
Energy: 0.8775330540906826
Energy: 1.008810848798287
Energy: 1.096547820130159
Energy: 1.2004052795337432
Energy: 1.0965478201291063
Energy: 1.0192412322874753
Energy: 0.9117370205902027
Energy: 1.4088892092422205
Energy: 0.9117370205902027
Energy: 1.3986564942393458
Energy: 0.9925541970987943
Energy: 1.6891822511446215
Energy: 0.9925541970977416
Energy: 0.9774734670299429
Energy: 0.9133712403929971
Energy: 1.4690287947223997
Energy: 0.9133712403919445
Energy: 0.9371083698350947
Energy: 0.9116791635948159
Energy: 1.3697255559748
Energy: 0.9116791635937632
Energy: 1.099674680444856
Energy: 0.9121539154925804
Energy: 1.4299725405955233
Energy: 0.9121539154915277
Energy: 1.2167755848440545
Energy: 0.9787434118456089
Energy: 1.3807512636921806
Energy: 0.9787434118466377
Energy: 1.2360681028876324
Energy: 0.90719564257373
Energy: 0.90729533974393
Energy: 0.90719564257373
Energy: 1.2877635675144041
Energy: 0.9063162371792463
Energy: 0.9063369498981321
Energy: 0.9063162371781935
Energy: 1.4279234670494674
Energy: 0.9420997629435922
Energy: 0.9442513118768597
Energy: 0.942099762928854

minimum gb energy = 0.8775330540906826 eV
minimum distance =  2.28927341401964 Angstroms
sigma value = 17


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

Energy: 1.3775804210086264
Energy: 0.8840976606101426
Energy: 1.21393717999956
Energy: 0.9304690248874934
Energy: 1.4444007784524022
Energy: 0.8868280208150386
Energy: 1.0318821038470143
Energy: 0.886828020822196
Energy: 1.1578269397670402
Energy: 0.8851293858270348
Energy: 1.0329844576333167
Energy: 0.8851293858237814
Energy: 1.131279010256038
Energy: 0.8763693121150338
Energy: 1.1182771666894602
Energy: 0.8763693121150338
Energy: 1.027888917185539
Energy: 0.87616248522062
Energy: 1.2727500942413326
Energy: 0.87616248522062
Energy: 0.8982242879573912
Energy: 0.8950694066653636
Energy: 1.4213800509705197
Energy: 0.8950694066647129
Energy: 0.8767345817611389
Energy: 0.8756281273665383
Energy: 1.2846486161249233
Energy: 0.8756281273665383
Energy: 0.8807398636536408
Energy: 0.8780535927279652
Energy: 1.3810391025241076
Energy: 0.8780535927279652
Energy: 1.2496462930789949
Energy: 0.878451161818851
Energy: 1.2896753611228702
Energy: 0.8784511618240565
Energy: 1.0098711989943132
Energy: 0.8890947646847667
Energy: 1.0365591728207906
Energy: 0.8890947646847667
Energy: 1.325199855627762
Energy: 0.9387935288316684
Energy: 0.8915356231829602
Energy: 0.9387935288167026
Energy: 1.4317142130744638
Energy: 0.9066947330157612
Energy: 1.0675830764386902
Energy: 0.9066947330164119
Energy: 1.5508667348656195
Energy: 0.9257865866020435
Energy: 0.9494735908321567
Energy: 0.9257865866020435
Energy: 1.3460887330678242
Energy: 0.8853845745362108
Energy: 0.8871607732174326
Energy: 0.8853845745349094
Energy: 1.1658039051663813
Energy: 0.8877683221081951
Energy: 0.8901150680551254
Energy: 0.8877683221075443
Energy: 1.3552267727439975
Energy: 0.9265783352687998
Energy: 1.2919771362671497
Energy: 0.9265783352707518
Energy: 0.8877360622475821
Energy: 0.8901309119471033
Energy: 1.2542117748634507
Energy: 0.8901309119471033
Energy: 0.8886223038198557
Energy: 0.8863945250106136
Energy: 1.3223338284088946
Energy: 0.8863945250112641
Energy: 0.8947546447326222
Energy: 0.8879131505635177
Energy: 1.4769356825337492
Energy: 0.8879131505635177
Energy: 0.9603907514700013
Energy: 0.9372333868724273
Energy: 1.378186321352839
Energy: 0.937233386873078
Energy: 1.0300711769244402
Energy: 0.8869246062124205
Energy: 1.4293573175076886
Energy: 0.8869246062117698
Energy: 1.0285263120811943
Energy: 1.1275294080708747
Energy: 1.1559634195465003
Energy: 1.1275294080708747
Energy: 1.1764423992411221
Energy: 0.8756310693424164
Energy: 1.155087456610517
Energy: 0.8756310693430078
Energy: 1.2713962855466976
Energy: 0.8766467919188389
Energy: 1.0284301176786932
Energy: 0.8766467919188389
Energy: 1.4176878411337939
Energy: 0.8795963015147874
Energy: 0.8950045088405846
Energy: 0.8795963015154381
Energy: 1.2870330464090736
Energy: 0.8771974645206154
Energy: 0.8791625564675057
Energy: 0.8771974645232181
Energy: 1.3796133582847634
Energy: 0.878354060485883
Energy: 0.8837558334351191
Energy: 0.8783540604852323
Energy: 1.2856761545811985
Energy: 0.8772025262481168
Energy: 1.249246083824163
Energy: 0.8772025262487675
Energy: 1.0331389338957861
Energy: 1.1266083192844605
Energy: 1.0120940560525507
Energy: 1.1266083192838097
Energy: 0.8928658730630045
Energy: 0.8847720765669546
Energy: 1.3278916819094453
Energy: 0.8847720765617492
Energy: 1.066742075784018
Energy: 0.9249779692066963
Energy: 1.5086002012157909
Energy: 0.924977969207347
Energy: 0.9516470823916743
Energy: 0.9255379999451963
Energy: 1.4811665699914693
Energy: 0.9255379999451963
Energy: 0.8851406461394566
Energy: 0.8852341551517989
Energy: 1.3217934059153558
Energy: 0.8852341551524496
Energy: 0.8934767594946057
Energy: 0.8871953109176618
Energy: 1.1318865506675544
Energy: 0.8871953109176618
Energy: 1.2923637331122886
Energy: 0.9254454077909209
Energy: 1.3531196402530599
Energy: 0.9254454077902703
Energy: 1.2536393065633304
Energy: 0.8892240914707523
Energy: 0.8867762705713642
Energy: 0.8892240914720536
Energy: 1.3212639691508334
Energy: 0.8852533769962112
Energy: 0.8858036837400525
Energy: 0.8852533769962112
Energy: 1.4792430931032083
Energy: 0.8888463757812373
Energy: 0.9329716551653628
Energy: 0.8888463757825387

minimum gb energy = 0.8756281273665383 eV
minimum distance =  2.29692570082233 Angstroms
sigma value = 89


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

Energy: 1.4478409416906113
Energy: 0.8401017681644052
Energy: 0.8112961281073978
Energy: 0.810154943432681
Energy: 1.346145583916289
Energy: 1.1566803362874747
Energy: 1.0801639412613235
Energy: 1.1566803362874747
Energy: 0.8008915968148327
Energy: 0.8928809976121087
Energy: 1.0872603476264042
Energy: 0.8928809976121087
Energy: 0.8016646481422769
Energy: 1.084039402198162
Energy: 1.0892561278177195
Energy: 1.084039402198162
Energy: 0.8657501534711689
Energy: 0.8082240707745456
Energy: 1.120844032618178
Energy: 0.808224070772843
Energy: 0.8102293098989038
Energy: 0.8118094492863922
Energy: 1.1235881462146005
Energy: 0.8118094492863922
Energy: 0.8060169795163683
Energy: 0.8065264659009371
Energy: 1.0891228547925365
Energy: 0.8065264659009371
Energy: 0.8101912874089203
Energy: 0.8107573371659537
Energy: 1.4507656004327025
Energy: 0.8107573371659537
Energy: 1.078627405199574
Energy: 1.1583005611262716
Energy: 1.3481001955314582
Energy: 1.1583005611262716
Energy: 1.133854585796687
Energy: 0.8946322411265396
Energy: 1.0898746234601369
Energy: 0.8946322411265396
Energy: 1.0893699336101121
Energy: 0.8965875934846805
Energy: 0.7994203612596467
Energy: 0.8965875934846805
Energy: 1.1244228110926795
Energy: 1.085919547681941
Energy: 0.8688317845683039
Energy: 1.085919547681941
Energy: 1.1240018003656356
Energy: 0.8092161247631218
Energy: 0.8098332101467058
Energy: 0.8092161247614192
Energy: 1.3525988232114585
Energy: 0.8064738479558928
Energy: 0.8049735714733601
Energy: 0.8064738479575955
Energy: 1.34585850988138
Energy: 0.808785622465029
Energy: 0.8093686918706262
Energy: 0.808785622465029

minimum gb energy = 0.7994203612596467 eV
minimum distance =  2.31748887039258 Angstroms
sigma value = 13


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

Energy: 1.281695606157445
Energy: 0.7863857157542293
Energy: 1.1324740629078487
Energy: 0.7766694656854694
Energy: 1.393068817463503
Energy: 0.7755505665553014
Energy: 0.9258863232910677
Energy: 0.7755505665545879
Energy: 1.2830593824572138
Energy: 0.7717056363351343
Energy: 0.9202899728365217
Energy: 0.7717056363536876
Energy: 1.0121731653567303
Energy: 0.8335934521649213
Energy: 1.1037675219167145
Energy: 0.8335934521642077
Energy: 1.1828459509000067
Energy: 0.8313877188049968
Energy: 1.1805859398487704
Energy: 0.8313877188042832
Energy: 0.9237858322722722
Energy: 1.0515104928575807
Energy: 1.1746336607419243
Energy: 1.0515104928582943
Energy: 0.9228237538573537
Energy: 0.7739369853632971
Energy: 1.421059024506513
Energy: 0.7739369853647243
Energy: 0.9337358511515883
Energy: 0.9278635988996161
Energy: 1.4426898603906888
Energy: 0.9278635989003297
Energy: 0.7824646522265066
Energy: 0.7751028508350742
Energy: 1.4145257231605592
Energy: 0.7751028508365013
Energy: 0.7746988454967401
Energy: 0.7729749119412771
Energy: 1.4135294391704207
Energy: 0.7729749119398499
Energy: 0.7724834401034651
Energy: 0.7788083714220183
Energy: 1.2822109261576013
Energy: 0.7788083714184504
Energy: 1.1744998055294809
Energy: 1.0859011071874178
Energy: 1.4140349273904254
Energy: 1.0859011071859905
Energy: 1.1776341146260698
Energy: 1.0495854787727208
Energy: 1.1692188829815657
Energy: 1.0495854787748617
Energy: 1.2398384853631843
Energy: 0.7717879583506703
Energy: 1.013363172879356
Energy: 0.7717879583499566
Energy: 1.3823299874260284
Energy: 0.7744767083906494
Energy: 1.1519381703135483
Energy: 0.7744767083899359
Energy: 1.3805168244870272
Energy: 0.7750583223372638
Energy: 0.7823848917513854
Energy: 0.7750583223351231
Energy: 1.3181269790654495
Energy: 0.7734933828897904
Energy: 0.7750744111560837
Energy: 0.7734933828897904
Energy: 1.2833057040886906
Energy: 0.7972975280841997
Energy: 0.7926231668953474
Energy: 0.7972975280834861
Energy: 1.43465596892934
Energy: 0.7745836312474162
Energy: 0.9431194341706977
Energy: 0.7745836312467026
Energy: 1.360064725268302
Energy: 0.7711694665880927
Energy: 0.8940181625001931
Energy: 0.7711694665902336
Energy: 1.0102491814298902
Energy: 0.7775638110976651
Energy: 0.9375773943467365
Energy: 0.7775638110983787
Energy: 1.2681504984779657
Energy: 1.0993685541053686
Energy: 1.1730010473496868
Energy: 1.0993685541053686
Energy: 0.9258183294114455
Energy: 1.0509828610617569
Energy: 1.1807022301635204
Energy: 1.0509828610617569
Energy: 0.7742132952502806
Energy: 0.7716151804183908
Energy: 1.4170001167348256
Energy: 0.7716151804212452
Energy: 0.928508652346897
Energy: 0.7946593603610534
Energy: 1.3828234618853903
Energy: 0.7946593603603398
Energy: 0.7886218378915701
Energy: 0.7936489176098978
Energy: 1.3793615162807473
Energy: 0.7936489176106113
Energy: 0.7724182215860442
Energy: 0.7725751977362821
Energy: 1.410460413349728
Energy: 0.7725751977362821
Energy: 0.7722698624045103
Energy: 0.7763023184162844
Energy: 1.284574108350763
Energy: 0.7763023184191388
Energy: 1.1686673589484804
Energy: 1.0861766386595708
Energy: 1.434730474517367
Energy: 1.0861766386560028
Energy: 0.8928693325539984
Energy: 1.0497029850464301
Energy: 1.1713402179271717
Energy: 1.0497029850485708
Energy: 1.2331238612330944
Energy: 0.8304554120334814
Energy: 1.0113192022891118
Energy: 0.8304554120320542
Energy: 1.3796020476118622
Energy: 0.7749315001193655
Energy: 1.1725164418271279
Energy: 0.7749315001179384
Energy: 1.3824592283336419
Energy: 0.7744121912760744
Energy: 0.7724496430381695
Energy: 0.774412191276788
Energy: 1.4114708262412543
Energy: 0.7718866223721248
Energy: 0.7726286023912858
Energy: 0.7718866223742656
Energy: 1.4762961782873327
Energy: 0.7735348344421645
Energy: 0.8066839139749106
Energy: 0.7735348344421645

minimum gb energy = 0.7711694665880927 eV
minimum distance =  2.30745445930426 Angstroms
sigma value = 37


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

Energy: 1.1154492919230576
Energy: 0.747045200757189
Energy: 0.708040766612655
Energy: 0.7060108910132742
Energy: 1.442579387602366
Energy: 0.7046735622931812
Energy: 0.9366033689876578
Energy: 0.7046735622907259
Energy: 1.164966215273094
Energy: 1.005136252552858
Energy: 0.9420714572120976
Energy: 1.005136252552858
Energy: 1.121814396430112
Energy: 0.7943683427822571
Energy: 0.942862667130029
Energy: 0.7943683427810294
Energy: 1.1714574833307645
Energy: 0.7954601070899577
Energy: 0.9136891025338744
Energy: 0.7954601070899577
Energy: 0.9371333183632082
Energy: 0.7055225354402919
Energy: 1.0830484647317962
Energy: 0.7055225354390642
Energy: 0.7060848205242549
Energy: 0.7040091235599089
Energy: 1.3039450043377045
Energy: 0.7040091235599089
Energy: 0.7673804544474334
Energy: 0.7049046105515573
Energy: 1.3920301263687047
Energy: 0.704904610552785
Energy: 0.7054516557577126
Energy: 0.7078027586882955
Energy: 1.3060324650897341
Energy: 0.7078027586882955
Energy: 0.7055921540404706
Energy: 0.7054278190211588
Energy: 1.313333907074847
Energy: 0.7054278190223865
Energy: 0.7080407654897838
Energy: 0.7060108917311442
Energy: 1.1154492919230576
Energy: 0.747045200757189
Energy: 0.9366033689876578
Energy: 0.7046735622931812
Energy: 1.442579387602366
Energy: 0.7046735622931812
Energy: 0.9420714572120976
Energy: 1.005136252552858
Energy: 1.1649662152743219
Energy: 1.005136252552858
Energy: 0.9428626622496414
Energy: 0.7943683427798017
Energy: 1.121814396430112
Energy: 0.7943683427810294
Energy: 0.9136891025326468
Energy: 0.7954601070899577
Energy: 1.1714574833295366
Energy: 0.7954601070899577
Energy: 1.0830484647317962
Energy: 0.7055225354366088
Energy: 0.9371333183619804
Energy: 0.7055225354390642
Energy: 1.3039450043389325
Energy: 0.7040091235611365
Energy: 0.7060848205242549
Energy: 0.7040091235599089
Energy: 1.3920301263687047
Energy: 0.704904610552785
Energy: 0.7673804544462057
Energy: 0.7049046105515573
Energy: 1.3060324650885065
Energy: 0.7078027586882955
Energy: 0.7054516557577126
Energy: 0.7078027586882955
Energy: 1.3133339070760746
Energy: 0.7054278190211588
Energy: 0.7055921540404706
Energy: 0.7054278190211588

minimum gb energy = 0.7040091235599089 eV
minimum distance =  2.31509809211405 Angstroms
sigma value = 25


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

Energy: 1.33253102142348
Energy: 0.6670483587644213
Energy: 0.6358093344082157
Energy: 0.6337404063780315
Energy: 1.4957377828206402
Energy: 0.6300565217197045
Energy: 0.8178558296701204
Energy: 0.6300565217197045
Energy: 1.2459016502353375
Energy: 0.6310808965883323
Energy: 0.8158253741230629
Energy: 0.6310808965816216
Energy: 0.9386751034402245
Energy: 0.6299033023178552
Energy: 1.1288646058842169
Energy: 0.6299033023207312
Energy: 1.2565005092652446
Energy: 0.921259969328208
Energy: 1.1323058894401035
Energy: 0.9212599693272494
Energy: 0.9979641418830307
Energy: 0.6994044210409222
Energy: 1.1295991283865336
Energy: 0.6994044210418809
Energy: 0.9914771490260442
Energy: 0.9211531108549722
Energy: 1.2555783816558068
Energy: 0.9211531108549722
Energy: 1.0221783973611422
Energy: 0.6299930237189877
Energy: 1.1374968700951236
Energy: 0.6299930237189877
Energy: 0.8230373006003113
Energy: 0.6313083287376593
Energy: 1.374248714747447
Energy: 0.6313083287367006
Energy: 0.8243098126923428
Energy: 0.6303858935778204
Energy: 1.256738444122375
Energy: 0.6303858935778204
Energy: 0.6305770511767211
Energy: 0.630419689773277
Energy: 1.1342109944251073
Energy: 0.6304196897713596
Energy: 0.6338579807585019
Energy: 0.6301964155937227
Energy: 1.3730462817265878
Energy: 0.6301964155937227
Energy: 0.6299037803682677
Energy: 0.6323571116983365
Energy: 1.4986538377546375
Energy: 0.6323571116983365
Energy: 0.8202212886664777
Energy: 0.6365837033246844
Energy: 1.3345564409376534
Energy: 0.636583703322767
Energy: 0.8168460561578741
Energy: 0.6292986270748969
Energy: 1.255156390918531
Energy: 0.6292986270758557
Energy: 0.8192974690281638
Energy: 0.6316145271631156
Energy: 1.24852820887334
Energy: 0.6316145271631156
Energy: 1.1336574692632058
Energy: 0.926131657441149
Energy: 1.2527200924926978
Energy: 0.926131657441149
Energy: 0.7838988923957139
Energy: 0.9222630273921273
Energy: 1.2535987757423863
Energy: 0.9222630273921273
Energy: 1.1296457591172817
Energy: 0.7013536423538186
Energy: 0.9963765475034033
Energy: 0.7013536423547774
Energy: 1.3722659905624413
Energy: 0.9001977930521059
Energy: 0.9971551958456084
Energy: 0.9001977930511471
Energy: 1.1357904773638792
Energy: 0.6308265309064204
Energy: 0.8236599744151009
Energy: 0.6308265306860127
Energy: 1.3734252421257251
Energy: 0.6309405262824028
Energy: 0.6302079755245585
Energy: 0.6309405262890698
Energy: 1.3726755276386589
Energy: 0.6321899997086501
Energy: 0.8281847720112959
Energy: 0.6321899997086501
Energy: 1.136889422769158
Energy: 0.6295632804597825
Energy: 0.6302054027817972
Energy: 0.6295632804597825
Energy: 1.5157711176362314
Energy: 0.6289906804088251
Energy: 0.6299057461175922
Energy: 0.6289906804088251
Energy: 1.2473431650679645
Energy: 0.6312750200744995
Energy: 0.6303389963441229
Energy: 0.6312750200754583

minimum gb energy = 0.6289906804088251 eV
minimum distance =  2.31135270123945 Angstroms
sigma value = 41


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

Energy: 1.4686686757949832
Energy: 0.6041149044845353
Energy: 0.5809987717129808
Energy: 0.5796500411690694
Energy: 1.5385344442201452
Energy: 0.5728903895249319
Energy: 0.7303703199768697
Energy: 0.5728903895249319
Energy: 1.3124275586996679
Energy: 0.5745741997242196
Energy: 0.701567978170511
Energy: 0.5745741997454047
Energy: 1.133293827762531
Energy: 0.5751158532140207
Energy: 1.0088571436664935
Energy: 0.5751158532132349
Energy: 1.3185359996157593
Energy: 0.824143050409417
Energy: 0.9908863749709474
Energy: 0.824143050409417
Energy: 1.0963450985140935
Energy: 0.828927780840903
Energy: 0.9897131350302016
Energy: 0.828927780840903
Energy: 1.101404008614053
Energy: 1.0251915125280746
Energy: 1.2090593394355975
Energy: 1.0251915125280746
Energy: 1.107493262896875
Energy: 1.027230540886371
Energy: 0.9772939860559855
Energy: 1.027230540885585
Energy: 0.8259006128894156
Energy: 1.0178762524166802
Energy: 1.2048442157780708
Energy: 1.0178762524174665
Energy: 0.8762496515800681
Energy: 0.8240201779425501
Energy: 1.4196769087957253
Energy: 0.8240201779394064
Energy: 0.7006828081150743
Energy: 0.5735636807396698
Energy: 1.3010136988277659
Energy: 0.573563680719235
Energy: 0.6970519585718528
Energy: 0.5738577228468054
Energy: 1.420668058012125
Energy: 0.5738577228452336
Energy: 0.7425510400206066
Energy: 0.5748132380338555
Energy: 1.4215254075372032
Energy: 0.5748132380314978
Energy: 0.5726296966474945
Energy: 0.5791165338195617
Energy: 1.3011919668333953
Energy: 0.5791165338195617
Energy: 0.5742751694706804
Energy: 0.5731881403772614
Energy: 1.3197902950970382
Energy: 0.5731881403764755
Energy: 0.5720489792692323
Energy: 0.5763626263784715
Energy: 1.314665268947165
Energy: 0.5763626263768996
Energy: 0.7365313756090357
Energy: 0.576239453968156
Energy: 1.3191358195801317
Energy: 0.576239453968156
Energy: 0.6961168214290598
Energy: 0.5724114649959372
Energy: 1.3173594096161911
Energy: 0.5724114649951513
Energy: 0.7340943274448845
Energy: 0.5780128968558953
Energy: 1.1256578258569494
Energy: 0.5780128968566812
Energy: 1.0018284968317372
Energy: 0.8267062449246121
Energy: 1.1246707763564856
Energy: 0.8267062449230402
Energy: 0.9770284674194324
Energy: 0.830708833125164
Energy: 1.2091555047042952
Energy: 0.8307088330984416
Energy: 0.993093293011836
Energy: 0.8298358218714852
Energy: 1.117726122751444
Energy: 0.8298358218730572
Energy: 1.2052512003033322
Energy: 1.0641100051922874
Energy: 1.095899588504972
Energy: 1.0641100051922874
Energy: 0.9774287770761614
Energy: 0.8305928380195926
Energy: 0.9940547794607406
Energy: 0.8305928380195926
Energy: 1.210967757588483
Energy: 1.0220741651848548
Energy: 0.8192841921319739
Energy: 1.0220741651848548
Energy: 1.2063940657655698
Energy: 0.572932109887744
Energy: 0.9906510571803193
Energy: 0.5729321094658651
Energy: 1.2090448465781298
Energy: 0.5754499036073744
Energy: 0.7437547744660189
Energy: 0.5754499036097321
Energy: 1.4248884804468074
Energy: 0.5736782113317604
Energy: 0.6952333797381972
Energy: 0.5736782113317604
Energy: 1.222839063273018
Energy: 0.5781327506433921
Energy: 0.7519828463450399
Energy: 0.5781327506433921
Energy: 1.2199479778802342
Energy: 0.5770076184108035
Energy: 0.5719129821919836
Energy: 0.5770076184115894
Energy: 1.4214293868413117
Energy: 0.5724155595834479
Energy: 0.573596648799051
Energy: 0.5724155595834479
Energy: 1.398350573411376
Energy: 0.5785891033974625
Energy: 0.5720741240384503
Energy: 0.5785891033958906

minimum gb energy = 0.5719129821919836 eV
minimum distance =  2.31596676166179 Angstroms
sigma value = 15


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

Energy: 1.2696572494574567
Energy: 0.5542955541883342
Energy: 0.5351357683779299
Energy: 0.5339380849683467
Energy: 1.462958433766294
Energy: 0.5284039755239591
Energy: 0.6374575418421403
Energy: 0.5284039755246249
Energy: 1.3594850921521862
Energy: 0.5297698003085993
Energy: 0.6379070484387923
Energy: 0.529769800309931
Energy: 1.2713225279692388
Energy: 0.5318219049941324
Energy: 0.89604743545036
Energy: 0.5318219049941324
Energy: 1.3656031079311206
Energy: 0.7482900561109421
Energy: 0.8694453062435988
Energy: 0.7482900561102763
Energy: 1.1692287566968371
Energy: 0.7562518445084803
Energy: 0.885823546379763
Energy: 0.7562518445071487
Energy: 0.9996509899542072
Energy: 0.755454867750921
Energy: 1.0822883388754623
Energy: 0.7554548677495893
Energy: 1.180336919202398
Energy: 0.9741570746324458
Energy: 0.8644552198460728
Energy: 0.9741570746331116
Energy: 0.9813903872152413
Energy: 0.9661830323136281
Energy: 1.0756748225806076
Energy: 0.9661830323122966
Energy: 0.9806265297835943
Energy: 0.9719939314663693
Energy: 1.2644086919841584
Energy: 0.9719939314663693
Energy: 0.8768922983544788
Energy: 0.7556366699277717
Energy: 1.1318482367089817
Energy: 0.7556366699284375
Energy: 0.7362671947467337
Energy: 0.9256619176944725
Energy: 1.2642485603940183
Energy: 0.925661917689146
Energy: 0.8871863080895186
Energy: 0.7500118581480223
Energy: 1.2635687498265316
Energy: 0.7500118581486881
Energy: 0.6672648085624613
Energy: 0.5312517718997433
Energy: 1.1328581045206645
Energy: 0.5312517719017408
Energy: 0.6319264197385994
Energy: 0.5304683849970212
Energy: 1.4525319396838987
Energy: 0.5304683849923605
Energy: 0.6777458801072007
Energy: 0.5312710392278172
Energy: 1.2661615040596617
Energy: 0.5312710392191614
Energy: 0.5450024066834354
Energy: 0.5335475334456414
Energy: 1.2716097620541091
Energy: 0.5335475334483046
Energy: 0.5270648932947345
Energy: 0.5280266108754601
Energy: 1.4563953586959024
Energy: 0.5280266108741285
Energy: 0.5426641564524571
Energy: 0.5312340193506652
Energy: 1.2103731629495134
Energy: 0.531234019355326
Energy: 0.6488078514160169
Energy: 0.5318571427262793
Energy: 1.364477638548712
Energy: 0.5318571427309401
Energy: 0.6295145432292344
Energy: 0.5289361895860152
Energy: 1.3663859765401052
Energy: 0.5289361895993314
Energy: 0.6521391831419666
Energy: 0.5347625647618002
Energy: 1.1772763457790882
Energy: 0.5347625647624661
Energy: 0.8970344451085492
Energy: 0.7489132113508385
Energy: 1.1681054147234975
Energy: 0.7489132113508385
Energy: 0.8655785629946954
Energy: 0.750973912887737
Energy: 1.267251932783592
Energy: 0.750973912887737
Energy: 0.9042269517345317
Energy: 0.7535905339795449
Energy: 0.9936181779837371
Energy: 0.7535905339782133
Energy: 1.075655469206309
Energy: 0.9696113802846088
Energy: 1.2662253840589952
Energy: 0.969611380283943
Energy: 0.8695791957579663
Energy: 0.9681977879013387
Energy: 1.077522301678332
Energy: 0.9681977879006729
Energy: 1.0881129731790207
Energy: 0.9754483708521949
Energy: 0.9939049885579663
Energy: 0.9754483708535265
Energy: 1.0789361406139644
Energy: 0.748415360207725
Energy: 1.0804291425796844
Energy: 0.7484153602010668
Energy: 1.0761149938992323
Energy: 0.7496369949361209
Energy: 0.865244909579138
Energy: 0.7496369949354551
Energy: 1.273414475003191
Energy: 0.7477291759252225
Energy: 0.7357039495849245
Energy: 0.747729175894595
Energy: 1.1335168005644436
Energy: 0.5298846496704345
Energy: 0.9065976293054652
Energy: 0.5298846496711003
Energy: 1.2649251431672128
Energy: 0.531443177358057
Energy: 0.6374236790402747
Energy: 0.5314431773593885
Energy: 1.3676006717608216
Energy: 0.5283408248159573
Energy: 0.653995416945317
Energy: 0.5283408248146259
Energy: 1.415305591854959
Energy: 0.5375505056352384
Energy: 0.6586419862529438
Energy: 0.5375505057829887
Energy: 1.4516721892183633
Energy: 0.5290319693366216
Energy: 0.5334189921211322
Energy: 0.5290319693359558
Energy: 1.3576263651711158
Energy: 0.529570429337639
Energy: 0.5326475003454388
Energy: 0.529570429337639

minimum gb energy = 0.5270648932947345 eV
minimum distance =  2.31443819574225 Angstroms
sigma value = 85


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

Energy: 1.3571473423867026
Energy: 0.5225769968493039
Energy: 0.4759287860206664
Energy: 0.47610809598934306
Energy: 1.4621132969369486
Energy: 0.47710558764784533
Energy: 0.5721184732809613
Energy: 0.47710558764784533
Energy: 1.2101496383730947
Energy: 0.47763658217821553
Energy: 0.5653836344336715
Energy: 0.47763658217821553
Energy: 1.1128002245278368
Energy: 0.4769143998667857
Energy: 0.7992282964583554
Energy: 0.47691439986505324
Energy: 1.3828355184303776
Energy: 0.6741140020010871
Energy: 0.7965652970632339
Energy: 0.6741140020010871
Energy: 1.0397876351091404
Energy: 0.6750350149549709
Energy: 0.8010613404029521
Energy: 0.6750350149543933
Energy: 1.0455144224102546
Energy: 0.4762303417006692
Energy: 0.9593425839664745
Energy: 0.47623034777805917
Energy: 1.217954278896817
Energy: 0.8774874441108328
Energy: 0.7654794765641483
Energy: 0.8774874441102554
Energy: 1.0435741461576302
Energy: 0.8830054000043782
Energy: 0.9612203879503336
Energy: 0.8830054000049556
Energy: 1.042557075375261
Energy: 0.896756858523658
Energy: 1.1277902460215348
Energy: 0.8967568585242355
Energy: 0.9674944785247767
Energy: 0.8651169837102367
Energy: 0.9955782125057445
Energy: 0.8651169837102367
Energy: 0.8906861100224178
Energy: 0.8782883558810464
Energy: 1.12847009149605
Energy: 0.8782883558816238
Energy: 0.9590941097923528
Energy: 0.8793707352762548
Energy: 1.126295580128779
Energy: 0.8793707352768322
Energy: 0.7700149270814002
Energy: 0.4766966006156128
Energy: 0.995595386743034
Energy: 0.4766966006087095
Energy: 0.6533797913026348
Energy: 0.6749815775974377
Energy: 1.296956693334187
Energy: 0.6749815775974377
Energy: 0.7686879481523792
Energy: 0.6768758378383004
Energy: 1.1261317331886807
Energy: 0.6768758378383004
Energy: 0.5661606599743318
Energy: 0.4785967378241974
Energy: 1.1293326737194138
Energy: 0.47859673782535234
Energy: 0.5651545380484506
Energy: 0.47614465885561713
Energy: 1.4628752550230353
Energy: 0.4761446588544623
Energy: 0.6008430614390909
Energy: 0.4754965452384904
Energy: 1.2950084148771046
Energy: 0.47549654524426505
Energy: 0.4756343294065914
Energy: 0.4759001845084267
Energy: 1.298905008355458
Energy: 0.47590018450727184
Energy: 0.476505550937286
Energy: 0.47598484170822064
Energy: 1.460842801495048
Energy: 0.47598484170822064
Energy: 0.4774810873498636
Energy: 0.4754774557988112
Energy: 1.2087918287880948
Energy: 0.47547745579996614
Energy: 0.5670138782692435
Energy: 0.4790650136859664
Energy: 1.380869102236355
Energy: 0.4790650136848114
Energy: 0.5673465957777948
Energy: 0.4760482429993944
Energy: 1.3846462504243031
Energy: 0.4760482429993944
Energy: 0.5673389939966539
Energy: 0.47894201292722294
Energy: 1.1112987807020271
Energy: 0.4789420129283778
Energy: 0.791858127512903
Energy: 0.674793620792669
Energy: 1.378216283867088
Energy: 0.6747936207932465
Energy: 0.79648169784487
Energy: 0.6750853409724054
Energy: 1.2106593130082894
Energy: 0.6750853409718279
Energy: 0.9593579615423059
Energy: 0.47636349689384144
Energy: 1.113671804759432
Energy: 0.4763634968563326
Energy: 0.9609173358789496
Energy: 0.8760291417380056
Energy: 1.2201180242008502
Energy: 0.8760291417380056
Energy: 0.9590294975776433
Energy: 0.88147449248332
Energy: 1.041522985858567
Energy: 0.88147449248332
Energy: 1.1323066268756985
Energy: 0.8819145032771445
Energy: 0.8785508005749022
Energy: 0.8819145032765671
Energy: 1.0121241086741133
Energy: 0.8817907897980817
Energy: 1.1334699904880012
Energy: 0.8817907897980817
Energy: 1.1267642840524656
Energy: 0.8820852951224896
Energy: 0.8890752499527108
Energy: 0.882085295123067
Energy: 1.2950520104887298
Energy: 0.8763108728000807
Energy: 0.8888440852407529
Energy: 0.8763108728006581
Energy: 0.9935036548819783
Energy: 0.6763027034786676
Energy: 0.8976977096540589
Energy: 0.676302703479245
Energy: 1.294590237143808
Energy: 0.6753875352659992
Energy: 0.7691985259451343
Energy: 0.6753875352659992
Energy: 1.2945425626172604
Energy: 0.6751865953573505
Energy: 0.7714273483923104
Energy: 0.6751865953561956
Energy: 1.2362047079163354
Energy: 0.47816477903911253
Energy: 0.5660101467004007
Energy: 0.47816477903853505
Energy: 1.4594862465732052
Energy: 0.4763884505282899
Energy: 0.566484047511669
Energy: 0.4763884505288673
Energy: 1.296074134723063
Energy: 0.480091117758344
Energy: 0.5664646882279464
Energy: 0.480091117758344
Energy: 1.1382929763555971
Energy: 0.4756582426060443
Energy: 0.47585562718654717
Energy: 0.4756582426037344
Energy: 1.3828993745500497
Energy: 0.4754513268896074
Energy: 0.4760651135523913
Energy: 0.4754513268901849
Energy: 1.2126056093580673
Energy: 0.47596721974770456
Energy: 0.4754619531068341
Energy: 0.47596721974770456

minimum gb energy = 0.4754513268896074 eV
minimum distance =  2.31115224948836 Angstroms
sigma value = 113


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

Energy: 0.01546299995068571
Energy: 0.016212753680959483
Energy: 1.1095339954335561
Energy: 0.4948324317672256
Energy: 0.01617287194547895
Energy: 0.11151448769291923
Energy: 0.7216081942648891
Energy: 0.1115144876933385
Energy: 0.016070198427066494
Energy: 0.11005206350680437
Energy: 0.7201367844996486
Energy: 0.11005206350680437
Energy: 0.01716750145858462
Energy: 0.11139828124014184
Energy: 0.7224776229902868
Energy: 0.11139828124014184
Energy: 0.721304515963058
Energy: 0.1119264338897819
Energy: 0.7225096976468793
Energy: 0.11192643389020117
Energy: 0.015969615318696995
Energy: 0.109871543063533
Energy: 0.7202952814771006
Energy: 0.109871543063533

minimum gb energy = 0.01546299995068571 eV
minimum distance =  2.52121293084795 Angstroms
sigma value = 1