Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_849011491644_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315641880036
cohesive_energy=3.5402784385667436
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[0.0, 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: 0.013667490376944869
Energy: 0.7076580324563659
Energy: 0.01398859248041172
Energy: 0.013874932402721706
Energy: 0.7128277896007934
Energy: 0.01401238070360236
Energy: 0.707658032456052
Energy: 0.103671191867292
Energy: 0.10372829652124459
Energy: 1.102882506256713
Energy: 0.4087849706360907
Energy: 0.10368691835187828
Energy: 0.01398859248041172
Energy: 0.1037282965215585
Energy: 0.10467083162851282
Energy: 0.014011066897424014
Energy: 0.4099110649157128
Energy: 0.10465594226414247
Energy: 0.013874932402128783
Energy: 1.1028825062619445
Energy: 0.014011066897110116
Energy: 0.013868311748392531
Energy: 1.094139839518103
Energy: 0.0139723460875927
Energy: 0.7128277895998517
Energy: 0.4087849706357768
Energy: 0.4099110649157128
Energy: 1.0941398393466086
Energy: 0.7031572354101734
Energy: 0.4102792764296018
Energy: 0.01401238070360236
Energy: 0.10368691835125048
Energy: 0.10465594226414247
Energy: 0.0139723460875927
Energy: 0.4102792764296018
Energy: 0.01404872340807415

minimum gb energy = 0.013667490376944869 eV
minimum distance =  2.55080012546978 Angstroms
sigma value = 1


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

Energy: 1.2613934201679753
Energy: 1.3367071126299312
Energy: 1.183352353717307
Energy: 1.263506122092666
Energy: 1.497175657551286
Energy: 1.1786328210490045
Energy: 1.2364232939443291
Energy: 0.8465265595911882
Energy: 0.8455584254503798
Energy: 1.1322269553221136
Energy: 0.8465705516249803
Energy: 0.8320856112769999
Energy: 1.2826001504584836
Energy: 0.8580977808128922
Energy: 0.8320099497239529
Energy: 1.2840790711183196
Energy: 0.8578975744145658
Energy: 0.8123497297288599
Energy: 1.3770806124407533
Energy: 0.9427686861843506
Energy: 1.1327970703330283
Energy: 1.3786191354554904
Energy: 1.0794026879444472
Energy: 1.1217470541667978
Energy: 1.2245048525582936
Energy: 0.9280953440725433
Energy: 0.924886810844643
Energy: 1.2239912169197464
Energy: 0.9743943375819349
Energy: 0.9267962992975463
Energy: 1.1568794795347854
Energy: 0.8693174008664086
Energy: 0.8579305808553009
Energy: 1.1585636541731708
Energy: 0.9145720663839432
Energy: 0.8560158625472392
Energy: 1.151831336041573
Energy: 0.9770153459685694
Energy: 0.8754243965999663
Energy: 1.1534597997308835
Energy: 1.0592863658743628
Energy: 0.8574710422792984
Energy: 1.0734897712197247
Energy: 0.9720817395829362
Energy: 0.9796343037442854
Energy: 1.1245934323734064
Energy: 1.0771151954984057
Energy: 0.9556062992225075
Energy: 0.9142766137620703
Energy: 0.9033985111040409
Energy: 0.8886064003865087
Energy: 0.9145817745226076
Energy: 1.0948628671647587
Energy: 0.8931449297083415
Energy: 0.9727487920563811
Energy: 0.8507811449204387
Energy: 0.9035590466221189
Energy: 0.9741581767362054
Energy: 0.906774046162475
Energy: 0.8808481894484935
Energy: 1.1033651758925238
Energy: 1.0600670222561055
Energy: 1.0655878817576785
Energy: 1.2135565315381645
Energy: 1.2651186717653262
Energy: 1.1856193593229611
Energy: 0.8682099652595938
Energy: 0.8453507995395528
Energy: 0.8250005014595116
Energy: 0.868375531412114
Energy: 0.8230097074624245
Energy: 0.8315239652053554
Energy: 0.8578507041225029
Energy: 0.8125686574533405
Energy: 0.8480692703583528
Energy: 0.8559833844922292
Energy: 0.8726943893222653
Energy: 0.8322943530736039
Energy: 0.8864849787048393
Energy: 1.1212151114007205
Energy: 1.1208530874273739
Energy: 0.8689626046272395
Energy: 1.3792020223881338
Energy: 1.2924084816207073
Energy: 0.8871497628925937
Energy: 0.8339990328216204
Energy: 0.8319433929414598
Energy: 0.8872155581830943
Energy: 0.9609176693497058
Energy: 0.8811667339472723
Energy: 0.8825443976661936
Energy: 0.8671086965242902
Energy: 0.857307794051777
Energy: 0.8820517266234849
Energy: 0.9541551770410276
Energy: 0.8644371222497168
Energy: 1.0956380312484266
Energy: 1.0177095450686469
Energy: 1.0183500706155395
Energy: 1.0939517848188032
Energy: 1.1834290008865191
Energy: 0.93831563711855
Energy: 1.0222514540691312
Energy: 0.9089101326944878
Energy: 0.9117345183979336
Energy: 1.0226940639668833
Energy: 1.0767299242608728
Energy: 0.9095284561988931
Energy: 1.050862024355426
Energy: 0.8735190222161486
Energy: 0.8726817459231727
Energy: 1.0516422659209124
Energy: 1.0177559804165432
Energy: 0.87230401951622
Energy: 1.2375637005121554
Energy: 0.9218701915572605
Energy: 0.9234006424482517
Energy: 1.23874261790876
Energy: 1.0595954401502583
Energy: 0.9164250869515158
Energy: 1.2643652478269305
Energy: 1.1398487204935206
Energy: 1.0628966789346583
Energy: 1.2662454099868568
Energy: 1.1213970211855504
Energy: 1.0662838719580159
Energy: 1.2104863760733362
Energy: 0.879890351271171
Energy: 0.8537946778333244
Energy: 1.2124496671877427
Energy: 0.8827856873492861
Energy: 0.8331675608993956
Energy: 1.2370670541606192
Energy: 0.8810431790614687
Energy: 0.8808816535590143
Energy: 1.2332562253215822
Energy: 0.8875115629172373
Energy: 0.8455895156203485

minimum gb energy = 0.8123497297288599 eV
minimum distance =  2.39362502822939 Angstroms
sigma value = 33


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

Energy: 1.48934095868997
Energy: 1.2062199057041387
Energy: 1.129934332979121
Energy: 1.386194677137491
Energy: 1.2448733551151387
Energy: 1.206435158796345
Energy: 1.3696836050099486
Energy: 0.8741151573377
Energy: 0.901588348884586
Energy: 1.118205957759561
Energy: 0.8738644802628783
Energy: 0.9139358319974638
Energy: 1.2238036756646542
Energy: 0.9371886025601466
Energy: 0.8854498676363708
Energy: 1.2249369435072879
Energy: 0.869475676350714
Energy: 0.971624219712895
Energy: 1.23749858993636
Energy: 0.9678036761973493
Energy: 0.9505614882445138
Energy: 1.2362521384119038
Energy: 1.1024755722328061
Energy: 1.0805432872884433
Energy: 1.4021611701797312
Energy: 1.0047996928643297
Energy: 0.9655549985873424
Energy: 1.302207360775407
Energy: 1.0241907982109826
Energy: 0.9525400225359152
Energy: 1.256464403003557
Energy: 1.010920871227448
Energy: 1.002317155488092
Energy: 1.2438412613935557
Energy: 1.0280891358745639
Energy: 0.9722786342038573
Energy: 1.2577393093572358
Energy: 1.0306142074333764
Energy: 1.0025765978271928
Energy: 1.2491132795528677
Energy: 1.2156892322344879
Energy: 1.0025028909803966
Energy: 1.1957763779741681
Energy: 0.9743439426025969
Energy: 0.9743947397660723
Energy: 1.1892516579084957
Energy: 1.0209754244568905
Energy: 0.9810921388831281
Energy: 1.0021163703191878
Energy: 1.0031977996084154
Energy: 1.0076780388609483
Energy: 1.0009187811450913
Energy: 1.1056512457442087
Energy: 1.0203905733085845
Energy: 1.0457647055424717
Energy: 0.9953196535669873
Energy: 0.957672203393835
Energy: 1.0445655137372296
Energy: 1.0051484899668774
Energy: 0.9975908922263647
Energy: 1.1718348760645336
Energy: 1.1277567791356407
Energy: 1.1278768691721053
Energy: 1.0771656324069223
Energy: 1.3892540025871571
Energy: 1.1330324858814949
Energy: 0.9597740666608552
Energy: 0.825685425913955
Energy: 0.9374424708599843
Energy: 0.959427880138822
Energy: 1.2150126584595557
Energy: 0.9547492773687977
Energy: 0.9499857200857936
Energy: 0.9550135252407037
Energy: 0.979882453958245
Energy: 0.9501311511515634
Energy: 1.0072696648513608
Energy: 0.9550360520568401
Energy: 1.3646617345341074
Energy: 1.080644239949247
Energy: 1.0803777700036763
Energy: 1.3709748914765258
Energy: 1.2384431956501767
Energy: 1.0800939862845123
Energy: 1.0289479122861949
Energy: 1.0083752792739784
Energy: 1.0044143883005414
Energy: 1.0242711713822323
Energy: 1.0734177601786516
Energy: 1.0079546545410363
Energy: 1.0151618267368068
Energy: 0.9743640197555576
Energy: 0.9674541761515247
Energy: 1.0031076376160961
Energy: 1.240618035343875
Energy: 0.9685962375267405
Energy: 1.2814962272405712
Energy: 1.0068438917751963
Energy: 1.01321984456254
Energy: 1.1823241682729064
Energy: 1.1939176534244567
Energy: 0.9285578491823401
Energy: 1.0210715311690586
Energy: 1.0139676124550967
Energy: 1.0537093360436935
Energy: 1.0211199360667764
Energy: 1.1182350729919002
Energy: 0.9838260749582106
Energy: 1.1021648836821136
Energy: 0.9118132294173823
Energy: 1.010365591063284
Energy: 1.1041738123821643
Energy: 0.9892583809201908
Energy: 0.8969866200175575
Energy: 1.236842810490373
Energy: 0.9474451777948432
Energy: 0.9795058268504777
Energy: 1.2346516638415013
Energy: 0.9656124057701616
Energy: 0.9121933237219291
Energy: 1.3874308202261476
Energy: 1.1042284014937478
Energy: 1.2067930910652684
Energy: 1.4934469326927786
Energy: 1.115042446468182
Energy: 1.128026763855107
Energy: 1.2998466491939273
Energy: 0.8818722748795559
Energy: 0.8733740003077956
Energy: 1.3859772536516213
Energy: 0.8732831995654725
Energy: 0.8251545870116002
Energy: 1.2326012224029403
Energy: 0.8691860793251168
Energy: 0.9385139223006994
Energy: 1.1886097508438078
Energy: 0.9379573780981302
Energy: 0.8624167935910353
Energy: 1.2346492742622273
Energy: 1.5245153055531793
Energy: 1.5338339427113767
Energy: 1.236247083954278
Energy: 1.5221828134149873
Energy: 1.0805499166982193
Energy: 1.2336076894327124
Energy: 0.9664560324016405
Energy: 0.9525636256118786
Energy: 1.2985112958435419
Energy: 1.0147700976571477
Energy: 0.9866216522134695
Energy: 1.2606405589799967
Energy: 0.998554920196029
Energy: 1.0001480798815565
Energy: 1.2486641012180266
Energy: 1.0064072757308793
Energy: 0.9620108840206055
Energy: 1.2771015831781216
Energy: 1.1241915107333673
Energy: 1.1202144679480652
Energy: 1.2741520649378597
Energy: 1.1826461555559789
Energy: 1.1238617209824295
Energy: 1.239874436305157
Energy: 0.9621235957382283
Energy: 0.9608772969674587
Energy: 1.1911488325510622
Energy: 1.09881209979143
Energy: 1.0246877204102487
Energy: 1.0592429368561735
Energy: 0.9869632090992742
Energy: 0.9609725577957764
Energy: 1.060058774089438
Energy: 1.0583552354218575
Energy: 0.996199908629325
Energy: 1.0393910285241548
Energy: 1.005369839602964
Energy: 0.9959756557075913
Energy: 1.04023365364755
Energy: 1.0720418701893784
Energy: 1.017468730943423
Energy: 1.1460891108578013
Energy: 1.1282716637764838
Energy: 1.128151047922845
Energy: 1.3076075162565683
Energy: 1.385384572586466
Energy: 1.128098859869011
Energy: 0.9591587867972511
Energy: 0.8018067560168464
Energy: 0.8017898681441818
Energy: 0.9588987156166321
Energy: 1.2990310186120606
Energy: 0.9737230000060844
Energy: 0.9503449767007439
Energy: 0.9824240883479788
Energy: 0.9565363821324675
Energy: 0.9506011426374164
Energy: 1.0060204709653162
Energy: 0.9578481044116932
Energy: 1.3650091385128027
Energy: 1.080410125155891
Energy: 1.0802394306967813
Energy: 1.3648580858602697
Energy: 1.2378825309961428
Energy: 1.0820914244503854
Energy: 1.032037335167002
Energy: 0.9855547630956173
Energy: 0.9886516590417922
Energy: 1.0219285870382087
Energy: 1.0430125079335075
Energy: 0.985507264747145
Energy: 1.0087638749652366
Energy: 0.985306284777548
Energy: 0.9699347030874785
Energy: 1.0071076881486087
Energy: 1.2467049693006054
Energy: 0.9810312761725154
Energy: 1.199799551539537
Energy: 1.1339601723319064
Energy: 1.1346634816726087
Energy: 1.1293699395154517
Energy: 1.267546657077595
Energy: 1.1311975069361992
Energy: 1.0936810289054038
Energy: 1.0273826412505684
Energy: 1.0193873981197972
Energy: 1.0958862149647524
Energy: 1.0049505429104861
Energy: 1.03568685405972
Energy: 1.020925103944026
Energy: 1.0492894749622192
Energy: 0.8957965207784004
Energy: 1.0209499353190508
Energy: 0.9803214348359014
Energy: 0.9730512944109564
Energy: 1.2788117509831145
Energy: 0.9785490419052775
Energy: 0.9129110405151118
Energy: 1.101634140991409
Energy: 0.924085322793282
Energy: 1.02758564883075
Energy: 1.3085674202185642
Energy: 0.970141581994183
Energy: 0.8019135018195764
Energy: 1.2183245442858268
Energy: 0.9446798022310414
Energy: 0.8835109194570295

minimum gb energy = 0.8017898681441818 eV
minimum distance =  2.31387129831055 Angstroms
sigma value = 51


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

Energy: 1.2922855622750222
Energy: 1.4028707700725378
Energy: 1.393607146083787
Energy: 1.2946993762754617
Energy: 1.5381012223775221
Energy: 1.1008995482061668
Energy: 1.2251410448002604
Energy: 0.8979025754616689
Energy: 0.8955425139702892
Energy: 1.20268392480283
Energy: 0.8952216277038189
Energy: 0.8885925183526583
Energy: 1.2004432655662352
Energy: 0.8746346151699642
Energy: 0.8745565947518179
Energy: 1.2026342431128236
Energy: 0.8744216426847803
Energy: 0.8098036852392113
Energy: 1.167576149199528
Energy: 1.0170095645312531
Energy: 1.0171124910856968
Energy: 1.1680198351793425
Energy: 0.9944513815013816
Energy: 1.0428921668812914
Energy: 1.262703474175092
Energy: 0.9769712832859687
Energy: 0.977251377757146
Energy: 1.2626970911051218
Energy: 1.0403711835655378
Energy: 0.9309315712609381
Energy: 1.071978207000088
Energy: 0.9649485151395492
Energy: 0.959060810370344
Energy: 1.0710963198121033
Energy: 0.9943990825480543
Energy: 0.9791881450819397
Energy: 0.9999195822241521
Energy: 0.8825972139887523
Energy: 0.9763050431619513
Energy: 0.9999369949826562
Energy: 1.148852510141157
Energy: 0.966600929138731
Energy: 1.1177485044043403
Energy: 1.06778265984627
Energy: 1.0679762429505149
Energy: 1.1187354636180777
Energy: 1.0673339897849268
Energy: 1.067891861492584
Energy: 0.8743463004197387
Energy: 0.8884301735886754
Energy: 0.853094792393696
Energy: 0.874444106418616
Energy: 0.9470813339796639
Energy: 0.8098929421526694
Energy: 0.8959172440177594
Energy: 0.7797857237801834
Energy: 0.8526099100551926
Energy: 0.8959310862193143
Energy: 0.8226358485664444
Energy: 0.8953592314734348
Energy: 0.8885335646334995
Energy: 1.2487336384172705
Energy: 1.248653649867076
Energy: 0.8882368631750021
Energy: 1.24809271908815
Energy: 1.2485830115470598
Energy: 0.9427657312313263
Energy: 0.8608642174600131
Energy: 0.8528516109567046
Energy: 0.9427291546591493
Energy: 1.1679532550602358
Energy: 0.8894531922177128
Energy: 0.8927923349840222
Energy: 0.8888216808652776
Energy: 0.8423192108074095
Energy: 0.8937071532918458
Energy: 1.179824913869042
Energy: 0.8900467794275693
Energy: 1.0057308152380582
Energy: 1.0444304245948912
Energy: 1.0439693020287932
Energy: 1.032316061017657
Energy: 1.0719060330762806
Energy: 1.0436438340050056
Energy: 1.1086432092028313
Energy: 0.9082962484317404
Energy: 1.0038821420338635
Energy: 1.1102468651291815
Energy: 1.1099120264887279
Energy: 0.9511095845218555
Energy: 1.0400770886231825
Energy: 0.9214185022710732
Energy: 0.9262117532218274
Energy: 1.0401009868636628
Energy: 0.9544350224315621
Energy: 0.9860802898654781
Energy: 1.2145577519793829
Energy: 0.8896403721070706
Energy: 0.889731448477498
Energy: 1.0723361718556592
Energy: 0.8936972874989701
Energy: 0.8590715471117021
Energy: 1.318747209450005
Energy: 0.9214710589236186
Energy: 0.9073729550775921
Energy: 1.3146617469963147
Energy: 0.9426873826946326
Energy: 0.9071049190245024

minimum gb energy = 0.7797857237801834 eV
minimum distance =  2.37905567604435 Angstroms
sigma value = 19


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

Energy: 1.2122743506283673
Energy: 1.0214580184344373
Energy: 0.9624573305470709
Energy: 1.070194305565275
Energy: 0.8471453215400425
Energy: 1.0769005143220598
Energy: 1.2601710160734216
Energy: 0.8514667550236991
Energy: 0.8512681278892107
Energy: 1.1509364807031754
Energy: 0.8517084229768931
Energy: 0.9430181939282976
Energy: 1.3339371525310748
Energy: 0.9808248925366083
Energy: 0.921784595953047
Energy: 1.1470253864526843
Energy: 0.8922354729713212
Energy: 1.048028733441933
Energy: 0.9885225435594939
Energy: 1.0323986953677469
Energy: 1.0246710867418307
Energy: 0.9877485951026612
Energy: 1.1540890570335698
Energy: 1.0363677761706769
Energy: 1.3351890657088934
Energy: 1.0091401688307908
Energy: 1.0452925381846823
Energy: 1.231619082003834
Energy: 0.9915793183170208
Energy: 1.0091719426237469
Energy: 1.0900564591314932
Energy: 0.8961301616324338
Energy: 1.0253275146441447
Energy: 1.093230604832022
Energy: 0.8964192443730175
Energy: 1.0624774544223543
Energy: 1.1342425821082447
Energy: 1.023633054776027
Energy: 1.0156622236232744
Energy: 1.137250335137655
Energy: 1.1272250193388385
Energy: 1.082778686836181
Energy: 1.0736454948370475
Energy: 0.9640775243052537
Energy: 0.9638687234649232
Energy: 1.1517758755889573
Energy: 1.069193289296388
Energy: 0.9637250695004006
Energy: 0.963641821894188
Energy: 0.7234687571452642
Energy: 0.7241137103054113
Energy: 0.9617001529552252
Energy: 1.1396275612065312
Energy: 0.7493847133456786
Energy: 0.963967647456473
Energy: 1.084021063733495
Energy: 0.9626888960284748
Energy: 0.9616747704850432
Energy: 1.196288405215389
Energy: 0.9644099059408422
Energy: 1.4187085741577752
Energy: 0.9865969897715943
Energy: 0.9488161871300816
Energy: 1.4154841984886561
Energy: 0.9884691942046792
Energy: 1.5320775980352261
Energy: 0.9737874366227987
Energy: 1.0556374213415731
Energy: 1.089874984617021
Energy: 1.081144145530676
Energy: 0.9916611233937718
Energy: 1.096219034607164
Energy: 0.8429989063088297
Energy: 0.9531305851285999
Energy: 1.047433734240623
Energy: 0.8429074182263228
Energy: 1.145143676022087
Energy: 1.073589502771986
Energy: 0.9769025388282626
Energy: 0.9517635485280087
Energy: 1.0605870375754802
Energy: 1.09670999625845
Energy: 1.0762141594164722
Energy: 0.9552181761911266
Energy: 1.1416485547167612
Energy: 0.9987578654013399
Energy: 0.9983969121002496
Energy: 1.2630483192040138
Energy: 0.9992213518629681
Energy: 0.9362026865921393
Energy: 1.0689103903216175
Energy: 0.919435606931171
Energy: 1.04128161008464
Energy: 1.2138711705347396
Energy: 0.9186994986006853
Energy: 0.9637057073501747
Energy: 1.1961155329762256
Energy: 0.8512489993663331
Energy: 0.9427509659138668
Energy: 1.214538120240606
Energy: 0.8515227031092975
Energy: 0.85157765455492
Energy: 0.9864211826763803
Energy: 0.9803465597229386
Energy: 0.9810505169201363
Energy: 0.986628773337096
Energy: 0.9814619699540952
Energy: 0.9815451078043044
Energy: 0.9864544084706889
Energy: 1.027760734578119
Energy: 1.0835847545958412
Energy: 0.9864597460898441
Energy: 1.0422027870310449
Energy: 1.0926483170036798
Energy: 1.147452254684368
Energy: 0.8427381974556696
Energy: 0.8902387264356437
Energy: 1.2664703619161433
Energy: 0.8427438627901849
Energy: 0.8627894235070871
Energy: 1.09602255382726
Energy: 1.0701029226833854
Energy: 1.0981000497971167
Energy: 1.0946835089093159
Energy: 1.0722155997768164
Energy: 1.0671822360127243
Energy: 1.137226901206927
Energy: 1.015003945183939
Energy: 1.1314696900881827
Energy: 1.134914218996859
Energy: 1.2102041726340753
Energy: 1.122534506918165
Energy: 0.9530971708973492
Energy: 0.9630118629822986
Energy: 0.9630917815952452
Energy: 1.1885455641689795
Energy: 1.0694634070195828
Energy: 0.9628403278325399
Energy: 0.9616127424882825
Energy: 0.9567138180169021
Energy: 0.991613646125689
Energy: 0.963912467656481
Energy: 1.14189807548917
Energy: 0.9620084434925851
Energy: 0.999984486342146
Energy: 0.9604243512635198
Energy: 1.0497518348486836
Energy: 1.002114738588667
Energy: 1.0881010192348086
Energy: 1.0007995946725272
Energy: 1.0969136900598555
Energy: 0.9864224311031202
Energy: 0.9479092578292161
Energy: 1.1346079062186456
Energy: 0.9879323844880317
Energy: 1.159334160884952
Energy: 1.129899675198697
Energy: 1.0804226281149465
Energy: 1.0564534838162223
Energy: 1.0897685454959327
Energy: 1.1736812248729502
Energy: 1.0526405032283177
Energy: 0.8426882667893171
Energy: 1.0763924585786637
Energy: 1.0467429185009307
Energy: 0.8427589050160411
Energy: 1.1133410788505178
Energy: 1.032639318178952
Energy: 1.1729181616220783
Energy: 0.8665174983541062
Energy: 0.9589625452520981
Energy: 1.0003409626412123
Energy: 1.02211463770281
Energy: 0.9804170282418716
Energy: 1.213718658562418
Energy: 0.9817649475481244
Energy: 0.9555187377395913
Energy: 1.0689874933312167
Energy: 0.9490772066695017
Energy: 1.0869393748390956

minimum gb energy = 0.7234687571452642 eV
minimum distance =  2.32809941267644 Angstroms
sigma value = 27


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

Energy: 0.9041349109641204
Energy: 1.2216085485165422
Energy: 1.3856278282593726
Energy: 0.9065328886394934
Energy: 1.5101649316220915
Energy: 1.4001316079864452
Energy: 1.1007009542945458
Energy: 0.8314725429616583
Energy: 0.8314180552753867
Energy: 0.9885681591019788
Energy: 0.8315433233015129
Energy: 0.8312052631361699
Energy: 0.8855131688502037
Energy: 0.7810930977793019
Energy: 0.7812492922156887
Energy: 0.8855111968836279
Energy: 0.782283382544623
Energy: 0.7812627966856834
Energy: 1.180314361799599
Energy: 1.0007713576816621
Energy: 1.0027263459347218
Energy: 1.301040187285113
Energy: 1.035372241698357
Energy: 1.0034256439975975
Energy: 0.9867910334873088
Energy: 0.8579196486384416
Energy: 0.7486455698320192
Energy: 0.9856181089912832
Energy: 0.9761797937736841
Energy: 0.7452131576441678
Energy: 0.8149024593244051
Energy: 0.8665762222070713
Energy: 0.8662924959243575
Energy: 0.8149501251273715
Energy: 0.906497905688912
Energy: 0.8414240391886506
Energy: 0.820751189964083
Energy: 0.689421772939246
Energy: 0.71703823503083
Energy: 0.8207589871409882
Energy: 0.8157581327814935
Energy: 0.8199676056784018
Energy: 0.8312476573693145
Energy: 1.089968425263655
Energy: 1.089878321747106
Energy: 0.8313053194294978
Energy: 1.2236859085098637
Energy: 1.0508663688931288
Energy: 0.9831157852716595
Energy: 0.9977916192814137
Energy: 0.7325510669260453
Energy: 0.98951848553514
Energy: 1.2531084521638776
Energy: 0.755905669072338
Energy: 0.7303372105139984
Energy: 0.8496804849292784
Energy: 0.8202019344255224
Energy: 0.8576214743212176
Energy: 0.8850403091763588
Energy: 0.8065392679490342
Energy: 0.8855110017818375
Energy: 0.8048272020209676
Energy: 0.806056518048709
Energy: 0.8858987954865679
Energy: 0.8208046683620209
Energy: 0.8059261217829546
Energy: 1.1007009542988866
Energy: 0.8314986489377301
Energy: 0.8323927487700494
Energy: 0.9766949958603446
Energy: 0.9057411761554036
Energy: 0.7614406875585701

minimum gb energy = 0.689421772939246 eV
minimum distance =  2.36076154620779 Angstroms
sigma value = 9


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

Energy: 1.4735999200798795
Energy: 1.4555628349964937
Energy: 1.2929563924707885
Energy: 1.4838786284952623
Energy: 1.6367683398734532
Energy: 1.2741396439613362
Energy: 0.9514134259607028
Energy: 0.6900433034327812
Energy: 0.6900678953291178
Energy: 0.8188623796657541
Energy: 0.6909816495504425
Energy: 0.7957414916610114
Energy: 0.7038037350196774
Energy: 0.6656241042409645
Energy: 0.6659055155868147
Energy: 0.7597803627302047
Energy: 0.6668067899655216
Energy: 0.6659813190322028
Energy: 0.9532512232458504
Energy: 0.7214702391614667
Energy: 0.784955840093814
Energy: 0.9595540844252075
Energy: 0.8181021588242668
Energy: 0.7957401187115805
Energy: 0.8081411596257685
Energy: 0.7655282576694055
Energy: 0.7019104391863786
Energy: 0.9383393378236083
Energy: 0.9682553208684482
Energy: 0.7427473919175452
Energy: 0.7190939534652738
Energy: 0.9768435631175597
Energy: 0.8453224014552488
Energy: 0.7188955473153282
Energy: 1.1234274265622488
Energy: 0.7022307945760817
Energy: 0.6873348037042337
Energy: 0.6346715794425608
Energy: 0.7044527859459205
Energy: 0.6883989282166191
Energy: 0.906655814062345
Energy: 0.6882700297446304
Energy: 0.698832645648752
Energy: 0.8522528300642137
Energy: 0.8762914339619189
Energy: 0.6993107379287995
Energy: 0.9331289739733754
Energy: 0.6992800092127259
Energy: 0.9453450837666105
Energy: 0.7047321881849086
Energy: 0.7976164598663662
Energy: 0.947288755594104
Energy: 0.8674842368593244
Energy: 0.8237509723496843
Energy: 1.1297991286514404
Energy: 0.7431038551873094
Energy: 0.7913464782210062
Energy: 1.122951651792701
Energy: 0.9735922937963801
Energy: 0.8866949624761189
Energy: 0.6660119210820841
Energy: 0.6991601796147515
Energy: 0.6990695065487919
Energy: 0.7832187800250806
Energy: 0.6991372490682516
Energy: 0.6989502997229914
Energy: 0.9441152363566616
Energy: 0.7198584141044422
Energy: 0.7196108052388217
Energy: 0.9450952741237705
Energy: 0.7198771755324308
Energy: 0.7755347043873879
Energy: 1.3093309445045214
Energy: 1.3107533066239632
Energy: 1.174567051442676
Energy: 1.301244727147522
Energy: 1.3107779428081756
Energy: 1.148137742325018
Energy: 1.0155407475684963
Energy: 0.7344700909540642
Energy: 0.7340313300722396
Energy: 0.9953255616642775
Energy: 0.8663792956572551
Energy: 0.7814999184817144
Energy: 0.8050948743559362
Energy: 0.717487121884834
Energy: 0.7210248011898549
Energy: 0.8046286069332391
Energy: 0.7359843781919136
Energy: 0.8752307537207372
Energy: 0.6725603008330597
Energy: 0.6842630498383434
Energy: 0.6542051029754139
Energy: 0.6719137477015567
Energy: 0.6934286507257894
Energy: 0.6714128468114211
Energy: 0.6892313649287314
Energy: 0.7665303285286049
Energy: 0.7194784495203413
Energy: 0.6894737812433132
Energy: 1.1188184649419715
Energy: 0.6897181497856553
Energy: 0.8098939422169545
Energy: 1.1391090852622754
Energy: 0.792424535376272
Energy: 0.8105384537066394
Energy: 1.2970057969351791
Energy: 0.7853643913732734
Energy: 0.6863391136843898
Energy: 0.6662099730342039
Energy: 0.6762983516433764
Energy: 0.6865756283764025
Energy: 0.7141353814891582
Energy: 0.7055677627115808
Energy: 0.7006058276098984
Energy: 0.6958916335486506
Energy: 0.695405037946396
Energy: 0.7014529651555158
Energy: 0.6850442159040779
Energy: 0.6955284823194633
Energy: 0.7036962791602314
Energy: 0.6832508896712208
Energy: 0.6834016612833235
Energy: 0.6997767314622944
Energy: 0.6867794095430793
Energy: 0.693820756478964
Energy: 1.4485937338674149
Energy: 0.6899510073940306
Energy: 0.7330942794896728
Energy: 1.4502756365626384
Energy: 0.8085573956731633
Energy: 1.132703130020393
Energy: 1.1579310609003253
Energy: 0.6892740316292362
Energy: 0.6895942316690551
Energy: 1.0228571729267188
Energy: 0.6888029686806428
Energy: 0.7935190783806422
Energy: 0.8045829217393278
Energy: 0.666301455910741
Energy: 0.6661267957190731
Energy: 0.8053691200775688
Energy: 0.666114438402043
Energy: 0.6664248520787359
Energy: 0.9199670146078647
Energy: 0.8157778814112995
Energy: 0.8509356727798413
Energy: 0.9351603243295881
Energy: 0.8031033545711028
Energy: 0.8743255728933196
Energy: 0.8668374092721721
Energy: 0.6994081480471578
Energy: 0.7471940259755565
Energy: 0.9344089413601004
Energy: 0.8512447111238268
Energy: 0.766203461827991
Energy: 1.3358062889016586
Energy: 1.0245410215805328
Energy: 1.0103968686772078
Energy: 1.335841942591055
Energy: 1.1203288716945472
Energy: 1.275671020673278
Energy: 0.7195694613013115
Energy: 0.883085579887824
Energy: 0.7401264643396246
Energy: 0.7197983907333455
Energy: 0.959951312875955
Energy: 0.7197485036714285
Energy: 0.6993104290393191
Energy: 0.7614851788425833
Energy: 0.6996686605127656
Energy: 0.6991424385655314
Energy: 0.8769770071994484
Energy: 0.6996601355738371
Energy: 1.0653380178866378
Energy: 0.8966735166811421
Energy: 0.8640906740007894
Energy: 0.9723096438911948
Energy: 0.9543568659879607
Energy: 0.8610904330370034
Energy: 0.6658374125762258
Energy: 0.7203615278368226
Energy: 0.7921252680199954
Energy: 0.6659793297326979
Energy: 0.9386540026071905
Energy: 0.8770076172661074
Energy: 1.1281686034816454
Energy: 0.8037959032744596
Energy: 0.8038815606974821
Energy: 1.1299284897076898
Energy: 0.8037077693873305
Energy: 1.027196795243116
Energy: 0.9706363808455345
Energy: 0.704055606219239
Energy: 0.7038595757565824
Energy: 0.9440857143178345
Energy: 0.7043479342889097
Energy: 0.7038352631063596
Energy: 1.2829801423328362
Energy: 0.7199437072160786
Energy: 0.7199257276469551
Energy: 1.2910758565180351
Energy: 0.7200278341661694
Energy: 0.9961872734971348
Energy: 0.9174439851456673
Energy: 0.7192934281344586
Energy: 0.7193891838698706
Energy: 0.9723949143953172
Energy: 0.8571749824268733
Energy: 0.836672964879076
Energy: 0.8180854642517775
Energy: 0.7172884736005072
Energy: 0.8064822102229645
Energy: 0.8180934318846285
Energy: 0.7324927516356886
Energy: 0.7991502969755233
Energy: 0.6658806912121976
Energy: 0.7215134220663875
Energy: 0.6980114841386637
Energy: 0.6671545245645966
Energy: 0.7615606002803869
Energy: 0.666184125649668
Energy: 0.6899445361525589
Energy: 0.7282289507811517
Energy: 0.8004986428784853
Energy: 0.6900076461557012
Energy: 0.6931906161727398
Energy: 0.6917416754325423
Energy: 1.6510447685198801
Energy: 1.1867405465562637
Energy: 1.1461240619287758
Energy: 1.651139476909765
Energy: 1.2860025509379336
Energy: 1.4534033377948736
Energy: 0.6880922195438045
Energy: 0.7180787679946653
Energy: 0.7183791267922399
Energy: 0.7916111122067098
Energy: 0.6930304151648929
Energy: 0.7055509428185949
Energy: 0.685193049467672
Energy: 0.6813641264469439
Energy: 0.6603071385469911
Energy: 0.6846758960128662
Energy: 0.703616663859928
Energy: 0.6792197773235583
Energy: 0.7021268331282268
Energy: 0.6791690291893501
Energy: 0.679715083198925
Energy: 0.7023087782298972
Energy: 0.6847525998255778
Energy: 0.6797817069053849
Energy: 1.157702582323618
Energy: 0.6896800173793354
Energy: 0.6899124901291528
Energy: 1.1605311397784155
Energy: 0.68899807428437
Energy: 0.7735789465222036

minimum gb energy = 0.6346715794425608 eV
minimum distance =  2.35494319985938 Angstroms
sigma value = 57


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

Energy: 0.4056859714463922
Energy: 0.405113933015159
Energy: 0.3632278277958815
Energy: 0.29929155771186766
Energy: 0.9244803798868632
Energy: 0.40866557220880284
Energy: 0.4065583179129117
Energy: 0.6079729031730058
Energy: 0.6237907249426844
Energy: 0.5794544424274085
Energy: 0.5778934144096365
Energy: 0.5347278047269511
Energy: 0.5832689223111687
Energy: 0.5496906549231969
Energy: 0.545278057384586
Energy: 0.5896772282448622
Energy: 0.5449734406757962
Energy: 0.5493744173482249
Energy: 1.3798588783697083
Energy: 0.5624794024645856
Energy: 0.5587283601056928
Energy: 1.4274780113811365
Energy: 0.6083949525594623
Energy: 0.5625349320467133
Energy: 0.5759185225739225
Energy: 0.2979972953922926
Energy: 0.3275464880203036
Energy: 0.5953366031846496
Energy: 0.29761958382048476
Energy: 0.5664588299514627
Energy: 0.5447694016227959
Energy: 0.29752475846645987
Energy: 0.29770214550155755
Energy: 0.5552046490891683
Energy: 0.29748695288464677
Energy: 0.326866546161583
Energy: 0.540127086362509
Energy: 0.5363800270372108
Energy: 0.5646987589692796
Energy: 0.541283832364714
Energy: 0.5639821027724256
Energy: 0.5609823282463952
Energy: 1.178714874592315
Energy: 1.2230825701384613
Energy: 1.2225748084448467
Energy: 1.3818242709808441
Energy: 1.5342574598605625
Energy: 1.2099697128945623
Energy: 0.5812074628438793
Energy: 0.6025523407940317
Energy: 0.5637317900472518
Energy: 0.6146122445784695
Energy: 0.5816867170263159
Energy: 0.5647244278847234
Energy: 0.29737972079292596
Energy: 0.5571923282643341
Energy: 0.328327291359053
Energy: 0.29747815624983986
Energy: 0.6183349855223843
Energy: 0.36624871417459537
Energy: 0.29740017436347915
Energy: 0.5777087807368358
Energy: 0.5663117173905914
Energy: 0.2975694682036178
Energy: 0.575460975094223
Energy: 0.3271712715859812
Energy: 0.5832935304293874
Energy: 0.5803847795946944
Energy: 0.5804374480674496
Energy: 0.5910057849751995
Energy: 0.5434413764362079
Energy: 0.5671834490658594
Energy: 1.388856108665
Energy: 1.218967206404074
Energy: 1.2148459480932712
Energy: 1.3970643419167046
Energy: 1.1852129205452828
Energy: 1.2179684047920727
Energy: 0.5796268662235451
Energy: 0.55954020607267
Energy: 0.5638418465655263
Energy: 0.580606256341978
Energy: 0.5616056835775038
Energy: 0.5931735350837061
Energy: 0.5741339611228229
Energy: 0.29726279593820965
Energy: 0.29740157900560815
Energy: 0.6210153507175075
Energy: 0.297370945089047
Energy: 0.2977483924272495
Energy: 0.5429345949146446
Energy: 0.564475011128567
Energy: 0.5577404495379895
Energy: 0.5610410505246823
Energy: 0.2976643044069852
Energy: 0.5634612917683484
Energy: 0.5348425772984304
Energy: 0.5448484263261361
Energy: 0.5606461133025951
Energy: 0.5497334238901442
Energy: 0.5487180179496349
Energy: 0.542938363475192
Energy: 0.588735127785901
Energy: 0.5899391536989695
Energy: 0.5395638794405587
Energy: 0.5901584703615664
Energy: 1.5387790350197994
Energy: 0.5449527570883969
Energy: 0.4064229024948762
Energy: 0.6138559156764716
Energy: 0.6400640151996309
Energy: 0.29763610827592846
Energy: 0.6094157485770182
Energy: 0.5859977775533467

minimum gb energy = 0.29726279593820965 eV
minimum distance =  2.42242426492341 Angstroms
sigma value = 11


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

Energy: 1.214065911914049
Energy: 1.4222000484124242
Energy: 1.2143657980203981
Energy: 1.2160639003871367
Energy: 1.651884939337294
Energy: 1.404092890116955
Energy: 0.7558500146099475
Energy: 0.5322099520556355
Energy: 0.5694927723650337
Energy: 0.5651939724305938
Energy: 0.5360158584915687
Energy: 0.6089576537914764
Energy: 0.5397897063436066
Energy: 0.5601686546319898
Energy: 0.5535556408201879
Energy: 0.5403946498324878
Energy: 0.5652126924112825
Energy: 0.5567180586542668
Energy: 0.5393461767360898
Energy: 0.587121279518484
Energy: 0.6137428180828731
Energy: 0.5406280006992152
Energy: 0.536723026811642
Energy: 0.5505905380673407
Energy: 0.5316725544353553
Energy: 0.7183071578792037
Energy: 0.7305342801238957
Energy: 0.5317615074762743
Energy: 1.0202769954755642
Energy: 0.6032431328997463
Energy: 0.8577388967801499
Energy: 1.2400041894419562
Energy: 1.2280424766520162
Energy: 0.8577539615908479
Energy: 1.332430313526304
Energy: 0.9832499532793346
Energy: 0.7435100196868621
Energy: 0.6679644773852861
Energy: 0.6608248020707739
Energy: 0.5359930381355839
Energy: 0.7426852633017733
Energy: 0.5697698315132386
Energy: 0.609870625771664
Energy: 0.6783434639503525
Energy: 0.7010126255817851
Energy: 0.6120114627516227
Energy: 0.6755600879179435
Energy: 0.7846517254175293
Energy: 0.7586008686345274
Energy: 0.6138437162279767
Energy: 0.6240774577538624
Energy: 0.5360225004229242
Energy: 0.6169355547479382
Energy: 0.6236861003686999
Energy: 1.0526133229090622
Energy: 0.6158495659174502
Energy: 0.6742695115695155
Energy: 1.0747066260626876
Energy: 0.7883831361909065
Energy: 1.0397865062837346
Energy: 1.179629491351192
Energy: 0.6263687063964962
Energy: 0.6473675438545263
Energy: 1.0210221355809317
Energy: 0.9804330946913309
Energy: 0.6663653862316906
Energy: 0.85512862720341
Energy: 0.520353700592723
Energy: 0.7491340491448093
Energy: 0.8514715173491236
Energy: 0.5242535652013592
Energy: 0.7807519133737509
Energy: 0.7658531057843616
Energy: 0.8361107519243364
Energy: 0.7810689565948921
Energy: 0.7677159262115137
Energy: 0.8773467311078371
Energy: 0.766020654849637
Energy: 0.7205983931230888
Energy: 0.686495652027409
Energy: 0.6872056039517922
Energy: 0.7205254350883734
Energy: 0.8763477679990217
Energy: 0.7482114619569263
Energy: 1.16691919380175
Energy: 1.0066331129285702
Energy: 0.9907435741442138
Energy: 1.191353786376845
Energy: 1.0449260277368406
Energy: 1.23492548786132
Energy: 1.038405607811641
Energy: 0.7189733204104437
Energy: 0.6920970211230194
Energy: 1.0395155779440073
Energy: 0.9492457445592594
Energy: 0.8987988165376596
Energy: 0.899537030120771
Energy: 1.0759719276840243
Energy: 1.0334786267167833
Energy: 0.9243884950747062
Energy: 1.1184778483087867
Energy: 1.0888330341057129
Energy: 1.058246379023783
Energy: 0.7501059845816299
Energy: 0.7471361491999937
Energy: 0.9096117390103922
Energy: 0.7325711734765394
Energy: 0.7097762707997439
Energy: 0.9948980847790679
Energy: 0.7329261403872221
Energy: 0.7451835413797987
Energy: 0.7127125891465053
Energy: 0.7365536539980481
Energy: 0.722181430021809
Energy: 0.7556068239899325
Energy: 0.9314925727006126
Energy: 1.0107313139691403
Energy: 0.7521053066801212
Energy: 0.9116956072637304
Energy: 0.9496919335341603
Energy: 0.9905088386185038
Energy: 0.6851789898283269
Energy: 0.6580899852200542
Energy: 0.7777513469703806
Energy: 0.9851130052286767
Energy: 0.7606685779597373
Energy: 1.3735196957963962
Energy: 1.0842235248765317
Energy: 1.1324435087500244
Energy: 1.3582753491770987
Energy: 1.2358762681358886
Energy: 1.3594498525835863
Energy: 0.6150619654176601
Energy: 0.6553414741751882
Energy: 0.6549678015578372
Energy: 0.6156403465225996
Energy: 0.7963125875715248
Energy: 0.6258388640001605
Energy: 0.6328508241661394
Energy: 0.7090983252901595
Energy: 0.6295020720281055
Energy: 0.6343364155819198
Energy: 0.6989732458261629
Energy: 0.6293746874533842
Energy: 0.6278680730629956
Energy: 0.5516459679578333
Energy: 0.5502752069337967
Energy: 0.628834358457396
Energy: 0.5368479848358048
Energy: 0.7236621769154654
Energy: 1.2994223794651387
Energy: 0.5328925981782213
Energy: 0.5815210409777446
Energy: 1.1508845243853885
Energy: 0.7582689908120015
Energy: 0.552220352888614

minimum gb energy = 0.520353700592723 eV
minimum distance =  2.38071167356968 Angstroms
sigma value = 41


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

Energy: 1.1772017106926884
Energy: 1.316784463688801
Energy: 1.3181876947773061
Energy: 1.1788340398947619
Energy: 1.5839817405276744
Energy: 1.0542465561432126
Energy: 0.9071704097258494
Energy: 0.5888356411344364
Energy: 0.6291422406511428
Energy: 0.6269589153874724
Energy: 0.5887731033795307
Energy: 0.6290885607936313
Energy: 0.5982809517786042
Energy: 0.6195905176290992
Energy: 0.6247920084278518
Energy: 0.5976024290754707
Energy: 0.6302250190419079
Energy: 0.6247919428250355
Energy: 0.5961070229923859
Energy: 0.6314636459447279
Energy: 0.6907920722502108
Energy: 0.595319668358621
Energy: 0.5946608354589279
Energy: 0.700780823625493
Energy: 0.5932228667360249
Energy: 0.777662553169644
Energy: 0.7859659365332119
Energy: 0.5931689406517293
Energy: 0.8514750933956677
Energy: 0.727796390314605
Energy: 1.020807364562599
Energy: 1.3080539885105509
Energy: 1.2173635823094886
Energy: 1.021111783679527
Energy: 1.3467443106918802
Energy: 1.221565248748204
Energy: 0.8992430420092172
Energy: 0.7196905386573209
Energy: 0.6830491571786443
Energy: 0.5948886954067388
Energy: 0.7221393267912624
Energy: 0.6773857113155548
Energy: 0.7030064898017758
Energy: 0.7996405843283148
Energy: 0.8153630629845309
Energy: 0.7027949403507707
Energy: 0.7973621239484369
Energy: 0.708552037604075
Energy: 0.8986775035161497
Energy: 0.6843211598628999
Energy: 0.7016467030876602
Energy: 0.6829769836872978
Energy: 0.6838769183727047
Energy: 0.7015077178357991
Energy: 0.9369719037991997
Energy: 0.992927203844272
Energy: 0.992748973397595
Energy: 0.9325042222400332
Energy: 0.9931288560021398
Energy: 0.9927520029511596
Energy: 0.8589212451122114
Energy: 0.5910720785254641
Energy: 0.615946886836805
Energy: 0.8586695706113204
Energy: 0.5898879997276008
Energy: 0.724661210794872
Energy: 1.04592386647602
Energy: 0.562228761886677
Energy: 0.6413566302905566
Energy: 1.0455818706531472
Energy: 0.5647495839874929
Energy: 0.6858824300435575
Energy: 0.7446028057145314
Energy: 1.0327300058176152
Energy: 0.9763639540330916
Energy: 0.7445167158802257
Energy: 1.129078344947826
Energy: 0.9078149569907967
Energy: 0.6835702280484177
Energy: 0.7397117755749489
Energy: 0.7607234405145383
Energy: 0.6840564098067158
Energy: 0.6125116689550335
Energy: 0.7552763936097266
Energy: 0.7957189577123912
Energy: 0.9782421077795493
Energy: 0.9466430562354282
Energy: 0.7998936083989607
Energy: 0.8882310132139674
Energy: 0.9071182761267159
Energy: 0.8775371826713148
Energy: 0.5950310733592267
Energy: 0.631889513654874
Energy: 0.8775220045239738
Energy: 0.5950326321893278
Energy: 0.6323640641463523
Energy: 1.1704291629830723
Energy: 0.9879784138851753
Energy: 1.3395122916820918
Energy: 1.1724290392941357
Energy: 0.98527175341976
Energy: 0.9806746803751527
Energy: 1.197261971344126
Energy: 0.5888150708393945
Energy: 0.6298835121596114
Energy: 1.1040583044379195
Energy: 0.5888169292495242
Energy: 0.7625384910903504
Energy: 0.5949593580075802
Energy: 0.6179145264203864
Energy: 0.6179608721859636
Energy: 0.5948115068064596
Energy: 0.59527174385088
Energy: 0.6917291523859465
Energy: 0.6408241961863997
Energy: 0.6437988851452648
Energy: 0.6397439162912606
Energy: 0.6297147603556928
Energy: 0.617693695363043
Energy: 0.6188311418728131
Energy: 0.5915660008764392
Energy: 0.7330305591398069
Energy: 0.6904983604628746
Energy: 0.5915821625562664
Energy: 0.626964829283557
Energy: 0.6781322426072453
Energy: 1.6503005397856225
Energy: 1.1601227539585748
Energy: 1.3146568639952423
Energy: 1.5175775197785817
Energy: 1.3731183626202637
Energy: 1.0956538044589172
Energy: 0.8982365177575115
Energy: 0.7544508998836168
Energy: 0.7547096339999585
Energy: 0.5919749571331546
Energy: 0.8598181625861543
Energy: 0.6779849864160998
Energy: 0.70242644745759
Energy: 0.7810683319570519
Energy: 0.9154379840849336
Energy: 0.7024175406860088
Energy: 0.7813920342330026
Energy: 0.6773767653549705
Energy: 0.8990339009610582
Energy: 0.6856087149433826
Energy: 0.7017058431362921
Energy: 0.5948788898298645
Energy: 0.685831559073042
Energy: 0.6183590841652764
Energy: 0.8592240104821962
Energy: 0.7142088768178793
Energy: 0.6156946542827836
Energy: 0.8586374300727713
Energy: 0.7140872279123999
Energy: 0.6163617051028352
Energy: 0.9321409411781895
Energy: 0.9929331328016431
Energy: 0.9930499530321264
Energy: 0.9322640679741201
Energy: 0.8170483760392383
Energy: 0.6159675318365018
Energy: 1.1854123844112094
Energy: 0.6578296080177922
Energy: 0.6953789426751911
Energy: 1.1660811574999794
Energy: 0.5638933606582345
Energy: 0.6863347553346902
Energy: 1.0926082020541388
Energy: 1.127782255390563
Energy: 1.0340728243539168
Energy: 1.1272108812930812
Energy: 1.1506927739389634
Energy: 1.1462979488590654
Energy: 0.6842722403016022
Energy: 0.7197811493632464
Energy: 0.7608844886895705
Energy: 0.6843750561706464
Energy: 0.7127878248852154
Energy: 0.6983411553830053
Energy: 0.7593221056400246
Energy: 0.9037855977619598
Energy: 0.7457596544066811
Energy: 0.7600807689939655
Energy: 0.8548112595863618
Energy: 0.7603325209322245
Energy: 0.8573292536122732
Energy: 0.617305648629379
Energy: 0.6437534200171254
Energy: 0.8572779941021982
Energy: 0.5948365848451072
Energy: 0.637472543559199
Energy: 1.163312601246553
Energy: 0.5900811720330037
Energy: 0.5583067165520105
Energy: 1.0613917022190977
Energy: 0.8960088398885173
Energy: 0.5576342958536481

minimum gb energy = 0.5576342958536481 eV
minimum distance =  2.39288865907228 Angstroms
sigma value = 33


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

Energy: 0.8107662275373884
Energy: 1.1065471445267205
Energy: 1.2563144685065433
Energy: 0.8127166901179105
Energy: 1.4253938270010285
Energy: 1.1055784380790177
Energy: 1.0454012822700194
Energy: 0.6529757849608684
Energy: 0.6876898325350761
Energy: 0.6772373983690778
Energy: 0.6549020645516067
Energy: 0.6331474997884424
Energy: 0.7094405357683488
Energy: 0.693007869959962
Energy: 0.6929420088594863
Energy: 0.710512506933435
Energy: 0.6922952312062481
Energy: 0.6941791083961165
Energy: 0.7090623567788669
Energy: 0.7127845632056804
Energy: 0.6424124982863858
Energy: 0.7100346211056481
Energy: 0.6678149838138289
Energy: 0.6925201623674884
Energy: 0.7051949686719756
Energy: 0.9486727327551411
Energy: 0.6938363404203846
Energy: 0.705151430234081
Energy: 1.0369681193360303
Energy: 0.6841153163464982
Energy: 0.7644330779530069
Energy: 0.9408938457775162
Energy: 0.9363737655407329
Energy: 0.764811325761782
Energy: 1.1330300950566665
Energy: 0.9357168736339256
Energy: 0.9531378064560725
Energy: 0.7103184663091751
Energy: 0.7546702584726073
Energy: 0.6666929497080455
Energy: 0.6719397928579199
Energy: 0.7577130976139558
Energy: 0.799538279400849
Energy: 0.9725135554054298
Energy: 0.6459275296072854
Energy: 0.8010555879822434
Energy: 0.967612885570729
Energy: 0.6953886854598124
Energy: 0.7018480275179747
Energy: 0.6194297164864885
Energy: 0.6169502423165313
Energy: 0.7128520172270161
Energy: 0.6180671286556344
Energy: 0.6167098278736033
Energy: 1.1315728363277617
Energy: 0.8666957889611977
Energy: 0.8663140032090982
Energy: 1.1902737502699097
Energy: 0.8661300231771881
Energy: 0.8630119897752588
Energy: 1.055630431515192
Energy: 0.6916128198291814
Energy: 0.6922557006656251
Energy: 0.6667904806015509
Energy: 0.6673106999738269
Energy: 0.6980785991986159
Energy: 0.9060701305692667
Energy: 0.6203142949365641
Energy: 0.7603567885943746
Energy: 0.9071651837213885
Energy: 0.6226183780643132
Energy: 0.7559460239908612
Energy: 0.9017421985044421
Energy: 1.1068324617654726
Energy: 1.1004485101519024
Energy: 0.9017811173506466
Energy: 1.1122647090013562
Energy: 1.1004996198712664
Energy: 0.6654281639348734
Energy: 0.6439669394251961
Energy: 0.6421854178205396
Energy: 0.6665168029952823
Energy: 0.6621151508526499
Energy: 0.6382263403418714
Energy: 0.6484262255652865
Energy: 0.7764772127820395
Energy: 0.731899317693056
Energy: 0.7403121001806287
Energy: 0.7404587654402279
Energy: 0.6731195418380492
Energy: 0.6532779743549956
Energy: 0.6863203979727498
Energy: 0.6888337019226545
Energy: 0.6648900991149133
Energy: 0.6674020841674068
Energy: 0.6875921060739052
Energy: 1.1292195737622086
Energy: 0.9205903606789679
Energy: 0.8762615473679527
Energy: 1.1313716418692887
Energy: 0.9229376202216772
Energy: 0.8607957231231744
Energy: 1.03890359104139
Energy: 0.7050063530188401
Energy: 0.7532136567112915
Energy: 1.0398302342407277
Energy: 0.7048416740396326
Energy: 0.7630519151980993
Energy: 0.6666359369529011
Energy: 0.7572272389463649
Energy: 0.6953627778814809
Energy: 0.6674447960532957
Energy: 0.8005041493272601
Energy: 0.758007813285755
Energy: 0.8420140041553796
Energy: 0.7565309974987947
Energy: 0.6955964010415635
Energy: 0.8430464179995131
Energy: 0.7086485392930577
Energy: 0.6182592265381259
Energy: 0.6172504116734299
Energy: 0.6877128703104433
Energy: 0.6173994748637747
Energy: 0.6176485848380227
Energy: 0.7163445925575237
Energy: 0.6190118179751449
Energy: 0.8669291584041572
Energy: 0.938762173011596
Energy: 0.9400056290744095
Energy: 0.866667078691213
Energy: 0.9808077950074463
Energy: 0.9600350998810346
Energy: 1.0027773116217298
Energy: 0.6541543640784594
Energy: 0.6879267756849841
Energy: 1.0040418547832255
Energy: 0.6607891769822847
Energy: 0.6110506167679348
Energy: 0.7988563878966255
Energy: 1.2795837223153785
Energy: 1.1153815125735438
Energy: 1.4668928196320368
Energy: 0.9065427516872275
Energy: 1.1039589149496798
Energy: 1.0458285614548033
Energy: 0.6535650643694498
Energy: 0.6833963846637741
Energy: 0.6592926520883641
Energy: 0.6559406306153751
Energy: 0.633961892067599
Energy: 0.7092217722993478
Energy: 0.6946065101333732
Energy: 0.6931301784912878
Energy: 0.6666482323924797
Energy: 0.6944309030124414
Energy: 0.6447404590728366
Energy: 0.7090814016876151
Energy: 0.6435317896704127
Energy: 0.6441466183707834
Energy: 0.7101813800249189
Energy: 0.6682036081312308
Energy: 0.6926999599012774
Energy: 0.7748372548725087
Energy: 0.6924306673463251
Energy: 0.6931287448568417
Energy: 0.7749711070551129
Energy: 1.0550331030105555
Energy: 0.6876108863434431
Energy: 1.4906501468837559
Energy: 0.9364011016689355
Energy: 0.9349245628369631
Energy: 1.4841944649223557
Energy: 1.1325263270546406
Energy: 0.9472142888452056
Energy: 0.9508662399490732
Energy: 0.6181232267450583
Energy: 0.6924106406106401
Energy: 0.6671681380800196
Energy: 0.6881199759799014
Energy: 0.7585246005644392
Energy: 0.800117509972723
Energy: 0.985025847284882
Energy: 0.6449682443157986
Energy: 0.8007011837191914
Energy: 0.9677528611930325
Energy: 0.7805271190538458
Energy: 0.7024706468658888
Energy: 0.6175503812487995
Energy: 0.6186887191269763
Energy: 0.7132211432393155
Energy: 0.6253626128669096
Energy: 0.6177296687480026
Energy: 1.0547204838363453
Energy: 0.8629212365757686
Energy: 0.8630934475470248
Energy: 0.6684731203524706
Energy: 0.8631488254510183
Energy: 0.6924114277979246
Energy: 1.0548301898965617
Energy: 0.8821553016586468
Energy: 0.8628573348635565
Energy: 0.6684192556092078
Energy: 0.8670990327633947
Energy: 0.6958608253761636
Energy: 0.7027916095264007
Energy: 0.6202412431213217
Energy: 0.6978401765626171
Energy: 0.7037778239604252
Energy: 0.6221552922418353
Energy: 0.6907319578607916
Energy: 0.9056965375940882
Energy: 1.440643411416817
Energy: 1.1016132657437951
Energy: 0.9058833829223168
Energy: 1.4405562584981335
Energy: 1.1031233738314448
Energy: 0.6660088202321499
Energy: 0.6452381950148893
Energy: 0.6433005925377839
Energy: 0.6664949699510958
Energy: 0.6874340869580503
Energy: 0.6382120426880746
Energy: 0.6504125029238335
Energy: 0.7220112386208513
Energy: 0.7231218954864813
Energy: 0.6334244702389872
Energy: 0.7353875987028344
Energy: 0.7328655144990777
Energy: 0.6662320510193296
Energy: 0.6918311933239933
Energy: 0.6870221930115579
Energy: 0.6673803025381729
Energy: 0.667876775943365
Energy: 0.6923890668557134
Energy: 1.129397347734473
Energy: 0.9208142970177783
Energy: 0.7913553685434891
Energy: 1.1315462594974588
Energy: 0.9217392734590641
Energy: 0.8598622928687287
Energy: 1.0851007564293889
Energy: 0.7054851444871587
Energy: 0.7298510242089562
Energy: 1.0367590013176349
Energy: 0.7054898973307454
Energy: 0.6948361604127689
Energy: 0.6653972231863854
Energy: 0.7559670297150719
Energy: 0.6961567816977663
Energy: 0.6663966496641947
Energy: 0.7154873544271186
Energy: 0.75630086232036
Energy: 0.8276288637309741
Energy: 0.7582517701698585
Energy: 0.6949691006576177
Energy: 0.8282543912964714
Energy: 0.8000421466718391
Energy: 0.619902282070943
Energy: 0.6166444141310544
Energy: 0.7550930769012663
Energy: 0.617205262315873
Energy: 0.617539358191054
Energy: 0.7167448920663687
Energy: 0.6177707892159743
Energy: 0.8878829747096901
Energy: 0.938590797023891
Energy: 1.2085185053975853
Energy: 0.8899419406525667
Energy: 0.9876698775903937
Energy: 0.8873021276590731
Energy: 1.0036667371742298
Energy: 0.662627557240295
Energy: 0.6880523026629178
Energy: 0.9763651300805121
Energy: 0.6671571824769202
Energy: 0.7728779523160237
Energy: 1.4649627124733409
Energy: 0.913902778233079
Energy: 1.1031098986697658
Energy: 1.1124573785999943
Energy: 0.9181266088942365
Energy: 1.1029328636773494

minimum gb energy = 0.6110506167679348 eV
minimum distance =  2.40164209215974 Angstroms
sigma value = 67


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

Energy: 0.9853523015967987
Energy: 0.6783218588143379
Energy: 0.6756431764842508
Energy: 0.9875270764035395
Energy: 1.4110024295884989
Energy: 0.6754686287686511
Energy: 0.9820873170059646
Energy: 0.7592662687508804
Energy: 0.7036348668894407
Energy: 0.9004514578003094
Energy: 0.7592804214819954
Energy: 0.7036544494111797
Energy: 0.8107963870171643
Energy: 0.6609844857952748
Energy: 0.6921114146413563
Energy: 0.8109460142257209
Energy: 0.6608430368753926
Energy: 0.6942282675870095
Energy: 0.7440602402716566
Energy: 0.6920080892121501
Energy: 0.6907236063809965
Energy: 0.74426951492269
Energy: 0.687146590602594
Energy: 0.6868853544512021
Energy: 0.7246136557692272
Energy: 0.6882689349885265
Energy: 0.6882449115337035
Energy: 0.7248897900332708
Energy: 0.6792420459740479
Energy: 0.7256078633445049
Energy: 0.7257573541531448
Energy: 0.8275436208542976
Energy: 0.7258359332970113
Energy: 0.7257633798655126
Energy: 0.8294196471423662
Energy: 0.7258993908357262
Energy: 0.8185938140716335
Energy: 0.7210349618170541
Energy: 0.6791998889031773
Energy: 0.8158262529582374
Energy: 0.7262748649801454
Energy: 0.6784260355360052

minimum gb energy = 0.6608430368753926 eV
minimum distance =  2.42503265023247 Angstroms
sigma value = 3


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

Energy: 1.2894361180044631
Energy: 1.089745552375118
Energy: 1.0877561530322435
Energy: 1.2522305684406168
Energy: 1.3561223145167327
Energy: 1.1231593286796184
Energy: 1.0932017469322917
Energy: 0.8194499163707568
Energy: 0.8883673020239713
Energy: 0.9458754434202777
Energy: 0.9251393525090491
Energy: 0.8648943838065268
Energy: 0.9738692272987687
Energy: 0.9242256028336008
Energy: 0.8600931008646
Energy: 0.9862687915859787
Energy: 1.0991947947506422
Energy: 0.8860470674678937
Energy: 0.8367819764097606
Energy: 0.8373959931467191
Energy: 0.8777325352137041
Energy: 0.8422694854552244
Energy: 1.0480405454478627
Energy: 0.862602558354602
Energy: 0.8251445586739764
Energy: 0.8810928230430182
Energy: 0.8833322988182969
Energy: 0.8282848335488153
Energy: 0.9883857898402431
Energy: 0.8777051676124847
Energy: 0.909270323472505
Energy: 0.9853929266717988
Energy: 0.8931329411981022
Energy: 0.933421896705858
Energy: 0.9231998237809603
Energy: 0.8805275095761507
Energy: 0.9816360128732737
Energy: 0.9333743282025657
Energy: 0.9412188850809465
Energy: 0.9728672469764532
Energy: 0.9273027013991911
Energy: 0.8397527744469546
Energy: 1.208355424131412
Energy: 1.321061106341977
Energy: 1.0192548845819358
Energy: 1.2099241809520087
Energy: 1.1329888768139222
Energy: 1.023015888689652
Energy: 0.9779614009723324
Energy: 0.8668650446854158
Energy: 0.9374646544410242
Energy: 0.8581770551327632
Energy: 0.961538535255516
Energy: 0.8672336215581481
Energy: 1.1881789967788265
Energy: 0.8689326529328553
Energy: 0.8744710939402637
Energy: 1.20342168656746
Energy: 1.246200825119895
Energy: 1.1113253393392262
Energy: 0.9619071538263452
Energy: 0.8812357140728574
Energy: 0.8883482266079653
Energy: 0.9367048860137841
Energy: 0.8295687963364607
Energy: 0.8768864091142785
Energy: 0.9330451939540553
Energy: 0.8916951807269438
Energy: 0.883121498343474
Energy: 0.8963369619339374
Energy: 0.8571916358617613
Energy: 0.8857709015953483
Energy: 0.9958507419273601
Energy: 0.822756442580465
Energy: 0.8933024665816832
Energy: 0.9797156558130808
Energy: 0.8274323364566016
Energy: 0.8780183804101642
Energy: 0.946050605614691
Energy: 0.8263834723553534
Energy: 0.8202255981407354
Energy: 0.9481342494838811
Energy: 0.8209745352516963
Energy: 0.8370067213402285
Energy: 1.0662692134874432
Energy: 0.8915061922195398
Energy: 0.9412664572933195
Energy: 1.0677300877836364
Energy: 0.9076298999885744
Energy: 0.8789955063138263
Energy: 1.0255903684405367
Energy: 0.8644215177458106
Energy: 0.8567881187566891
Energy: 1.0185142194618824
Energy: 0.9063509922184155
Energy: 0.8841920970710525
Energy: 1.107283993438015
Energy: 0.9973845744400679
Energy: 0.988125186129183
Energy: 1.0995458483866276
Energy: 1.365720573075773
Energy: 1.1048339453945815
Energy: 1.0168921895350385
Energy: 0.8572358983212937
Energy: 0.8889883970434569
Energy: 1.0202984060842184
Energy: 0.984496282706548
Energy: 0.9157673036409013
Energy: 1.2506972286569924
Energy: 0.9414588112667901
Energy: 0.8958298203953928
Energy: 1.2015340460449278
Energy: 0.9489586387657793
Energy: 0.8741712934309475
Energy: 1.1297279969398653
Energy: 0.8902177984576333
Energy: 0.8876472113715685
Energy: 1.0179051399011008
Energy: 0.8997134352894411
Energy: 0.8587075955852803
Energy: 0.9207943363636092
Energy: 0.8318726887936989
Energy: 0.847501281986383
Energy: 0.9723334611632943
Energy: 0.8281898138381442
Energy: 0.8850286285736952
Energy: 0.9605917609889015
Energy: 0.9598854250937213
Energy: 0.8973082336158629
Energy: 0.9583376984297685
Energy: 0.9636461184700572
Energy: 0.8979436572332092
Energy: 0.8311733215790315
Energy: 0.892676109811017
Energy: 0.8674799888888775
Energy: 0.8325089416894883
Energy: 0.8473034742023428
Energy: 0.8588901856933471
Energy: 1.0281758437150963
Energy: 0.8838942676511261
Energy: 0.8514652767767955
Energy: 1.0286747114751271
Energy: 1.1702346373409245
Energy: 1.0252916349227625
Energy: 0.9665332632233973
Energy: 1.0029633723307498
Energy: 0.8752534767278451
Energy: 0.960690804264465
Energy: 0.8596871784483529
Energy: 0.8716741216621217
Energy: 1.2555602580776766
Energy: 1.05976579637023
Energy: 1.0670749911493052
Energy: 1.167356672609941
Energy: 1.0786276057923792
Energy: 0.9980014906017339
Energy: 0.9666396935440214
Energy: 1.022966336009189
Energy: 0.9997472569783734
Energy: 0.9650109996873465
Energy: 1.0468858390522713
Energy: 0.9562473158218217
Energy: 0.9656630200736523
Energy: 0.9342322014496467
Energy: 0.8808940459836375
Energy: 0.9594356254527491
Energy: 1.0234982383125717
Energy: 0.878638842251652
Energy: 0.8998664711706561
Energy: 0.8679595220386448
Energy: 0.8454657385677103
Energy: 0.9007414402213851
Energy: 1.0947288468167182
Energy: 0.9019647370089711
Energy: 0.8195881585275125
Energy: 0.8495307526354277
Energy: 0.8228373540780045
Energy: 0.8336657211262366
Energy: 0.9190161986965532
Energy: 0.8328162166572425
Energy: 0.9047872975726743
Energy: 1.003112609589794
Energy: 0.8757795549218791
Energy: 0.9029017522452129
Energy: 1.0442362229533757
Energy: 0.8905430504764664
Energy: 0.9071495821776592
Energy: 0.9690842216972805
Energy: 0.9275088570437231
Energy: 0.9062053501530284
Energy: 0.9013881802947981
Energy: 0.886405032432248
Energy: 1.2080637789407995
Energy: 0.9830003845197877
Energy: 0.9809247220092527
Energy: 1.1834883228683912
Energy: 0.9766933641177402
Energy: 0.9157090984454967
Energy: 0.8990882777790892
Energy: 0.9816677562540149
Energy: 0.9591050671400324
Energy: 1.2506069909201605
Energy: 1.0525358614771199
Energy: 0.9439478282792365
Energy: 1.0618158394181263
Energy: 0.9272882266297823
Energy: 0.9017387086739045
Energy: 0.911006849631588
Energy: 0.9190483349854766
Energy: 0.8967783330466954
Energy: 1.134644381357693
Energy: 0.8648637063316811
Energy: 0.8600429453389553
Energy: 1.1318129419147982
Energy: 1.2462817913854554
Energy: 1.116202367595982
Energy: 0.9209053163836242
Energy: 0.8757969160551865
Energy: 0.8968064510096582
Energy: 0.9147985678238012
Energy: 0.8762611064900608
Energy: 0.887002229592422
Energy: 0.9997420325447556
Energy: 0.8260988919321474
Energy: 0.9296583134741184
Energy: 1.0007078504614368
Energy: 0.9057743019583521
Energy: 0.9205858072065181
Energy: 0.948439586316388
Energy: 0.8144936826958901
Energy: 0.8133243049241734
Energy: 0.9294777534267851
Energy: 0.817741978086104
Energy: 0.840907849866873
Energy: 1.0641441396606786
Energy: 0.8740701683118021
Energy: 0.8911611222122193
Energy: 1.0661115258104121
Energy: 0.8796502501173221
Energy: 0.8834519333427481
Energy: 1.0259736115349751
Energy: 0.9429504089540689
Energy: 0.8670768002906117
Energy: 1.0178971487302682
Energy: 0.9009183168143228
Energy: 0.867699250453503
Energy: 1.0274770512471467
Energy: 0.8987609352563024
Energy: 0.9018929368473043
Energy: 1.0210207840953738
Energy: 1.0742466723430515
Energy: 1.0635805330187884
Energy: 1.15171298164761
Energy: 0.917072315477204
Energy: 0.9144235775197194
Energy: 1.1661225468883727
Energy: 1.189699904197558
Energy: 1.0023218778909209
Energy: 0.9482219448800169
Energy: 0.9067555714641875
Energy: 0.8745069069711621
Energy: 0.9568716528983815
Energy: 1.0196235726962823
Energy: 0.8576853514647516
Energy: 1.134219277429254
Energy: 1.0104667297189167
Energy: 0.9077613334606428
Energy: 1.1358396258418362
Energy: 0.9631482697141114
Energy: 0.8765697152388633
Energy: 0.8470392213950101
Energy: 0.832776923903729
Energy: 0.8413814052380291
Energy: 0.8445606480581771
Energy: 0.8270649571632261
Energy: 0.8141253032028294
Energy: 0.9611539547315894
Energy: 0.9457271015277757
Energy: 0.899150893055404
Energy: 0.9703066373799851
Energy: 0.9486094593261616
Energy: 0.8995521263267117
Energy: 0.8295841718876242
Energy: 0.8928500989622221
Energy: 0.8920676453825891
Energy: 0.8318007709306683
Energy: 0.8617826317146882
Energy: 0.8977515278918768
Energy: 0.9096769106458681
Energy: 0.8497915393443324
Energy: 0.898429283455853
Energy: 0.9129675668719881
Energy: 1.1336208854785252
Energy: 0.9186182459315988
Energy: 1.041831558895836
Energy: 0.9314474731090174
Energy: 0.8478546504241287
Energy: 1.1019232722342778
Energy: 0.9272016029857513
Energy: 0.9280471985728727
Energy: 1.0928715954927242
Energy: 0.8766708095465755
Energy: 0.7772786215402645
Energy: 0.9325790663587772
Energy: 0.9513557195817677
Energy: 0.857666168501517

minimum gb energy = 0.7772786215402645 eV
minimum distance =  2.34995058296317 Angstroms
sigma value = 81


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

Energy: 1.5136162436442344
Energy: 1.0858301581486756
Energy: 1.0376950314929
Energy: 1.4630553784428313
Energy: 1.041416340181194
Energy: 1.086730233013418
Energy: 0.8903334041940528
Energy: 1.0066236550351042
Energy: 0.9908737482627287
Energy: 0.8291676508119087
Energy: 0.9968490929922363
Energy: 0.9389694964839841
Energy: 0.9515516671071538
Energy: 0.851892555128928
Energy: 0.8494086742434089
Energy: 0.9990975816856057
Energy: 1.0343103154144972
Energy: 0.9283099101163176
Energy: 0.8525113935773875
Energy: 0.8503240018994572
Energy: 0.9335807194777842
Energy: 0.84916169982701
Energy: 0.9118386171323013
Energy: 0.845269593053294
Energy: 0.8851570175561949
Energy: 0.8889952338411106
Energy: 0.8894791087381912
Energy: 0.8674939255410709
Energy: 0.8964439543175285
Energy: 0.8946433543984667
Energy: 0.9855119273559644
Energy: 0.9432947943387701
Energy: 0.945483823051961
Energy: 0.9925254035605541
Energy: 0.9454556643772976
Energy: 0.9741083254800061
Energy: 1.1527697877223795
Energy: 0.867031821021195
Energy: 0.8668990181558861
Energy: 1.0959480420684566
Energy: 0.8670312518390131
Energy: 0.8900266476753924
Energy: 1.2321269643716977
Energy: 1.1126722401275513
Energy: 1.1267023189252607
Energy: 1.2334954814727113
Energy: 1.1406251809744512
Energy: 0.8661540480043265
Energy: 1.160424735005449
Energy: 0.863998702121366
Energy: 0.8582175226840458
Energy: 1.1721166048624816
Energy: 0.9093480409804372
Energy: 0.9283365322696729
Energy: 1.0832734585709718
Energy: 0.9844975733004894
Energy: 0.9814951128303078
Energy: 1.0754930012826938
Energy: 1.2225627289362115
Energy: 0.9815757754137204
Energy: 0.9475188799030548
Energy: 0.894184681186644
Energy: 0.8942022125879666
Energy: 0.9514979421960108
Energy: 0.8360770414605123
Energy: 0.9307472821506619
Energy: 0.8923097604875483
Energy: 0.9475883791869502
Energy: 0.9210314243502299
Energy: 0.8966789334082909
Energy: 1.0010593779123875
Energy: 0.9174312085744599
Energy: 1.0320048514944726
Energy: 0.8380363586602283
Energy: 0.915106037847649
Energy: 1.0332754447479007
Energy: 0.8371635826108033
Energy: 0.8533785797896206
Energy: 0.8986167357627634
Energy: 0.8884943824732541
Energy: 0.8857310862779577
Energy: 0.8891051667999118
Energy: 0.8986156472144028
Energy: 0.8956328326207502
Energy: 1.2180536200129275
Energy: 0.9713644119075816
Energy: 0.9652377309075523
Energy: 1.2117439146604099
Energy: 0.9976325335988413
Energy: 0.9651609526423205
Energy: 0.8544150098459928
Energy: 0.9020626503143723
Energy: 0.9063859470054586
Energy: 0.8529297279818805
Energy: 1.0119117678148353
Energy: 0.9140962221049009
Energy: 1.0353906011234657
Energy: 0.82152647537955
Energy: 0.807432814582297
Energy: 1.0357873745723563
Energy: 1.2337652781602466
Energy: 0.8314639312610437
Energy: 0.7974906976190229
Energy: 0.8461040498065572
Energy: 0.8730335881650095
Energy: 0.7979686924692938
Energy: 0.8458709935339672
Energy: 0.8688414459497328
Energy: 0.800196595174399
Energy: 0.9321595537895901
Energy: 0.9355747855730895
Energy: 0.9390406499268542
Energy: 0.9866125081491105
Energy: 0.9416150033156799
Energy: 0.9945771066786241
Energy: 0.9008245417654608
Energy: 0.9009318569357632
Energy: 0.8709214261217044
Energy: 0.9146835076220696
Energy: 0.9019890908573975
Energy: 0.7974399236209778
Energy: 0.8057697357953647
Energy: 0.8215340456394176
Energy: 0.7980222163267029
Energy: 0.8062211960637087
Energy: 0.8775489577653794
Energy: 0.9622278022669335
Energy: 0.8542497536144974
Energy: 0.850149986758096
Energy: 0.9597472234826819
Energy: 1.0349706852659144
Energy: 0.8970644521100911
Energy: 0.8954404188730866
Energy: 0.9028708109527614
Energy: 0.9004785140481391
Energy: 0.8945771467178029
Energy: 0.8390978677570953
Energy: 0.904538222196131
Energy: 0.9890592703295201
Energy: 0.9873483829190921
Energy: 0.9686606920379544
Energy: 0.9491418104622262
Energy: 1.202300361715342
Energy: 0.9564769961757534
Energy: 1.065867101331143
Energy: 0.9073156428377539
Energy: 0.8972715369645828
Energy: 1.0649591786658812
Energy: 0.8711948704549812
Energy: 0.9210580504442792
Energy: 1.2353250648642347
Energy: 1.0003158073472715
Energy: 1.016324140290906
Energy: 1.2245217204602326
Energy: 1.002224415499548
Energy: 0.9140947950658032
Energy: 1.2489299689060618
Energy: 0.9169996119806689
Energy: 0.8692448805991038
Energy: 1.2038966081122868
Energy: 0.9253944083102893
Energy: 0.8584582244968576
Energy: 1.0855402336988111
Energy: 0.8666074234947988
Energy: 0.9688376225616173
Energy: 1.0757279742699586
Energy: 0.8346535633663353
Energy: 0.9306641864282579
Energy: 1.029874786494373
Energy: 0.9843538967460418
Energy: 0.9842799294210599
Energy: 1.016739190021529
Energy: 1.0012493238059157
Energy: 0.9817513566238084
Energy: 1.0369034318417476
Energy: 0.9182756220495776
Energy: 0.8668217126847871
Energy: 1.0232429272306443
Energy: 0.9142948268367406
Energy: 0.9377037700049341
Energy: 1.032953532258667
Energy: 1.0317438420207663
Energy: 1.0441203739444314
Energy: 1.0333110165945925
Energy: 1.0935158080029788
Energy: 0.8560946529175338
Energy: 1.0083828905969463
Energy: 0.908466668406745
Energy: 0.8656058317588201
Energy: 0.9163567078605237
Energy: 0.907988196716364
Energy: 0.8988551024653697
Energy: 0.9007588068429453
Energy: 0.8889984529502
Energy: 0.8910473680016364
Energy: 0.9588372625659566
Energy: 0.8960518961934265
Energy: 0.8846496781882393
Energy: 0.8425045706737454
Energy: 0.9177443112598903
Energy: 0.9404491767164805
Energy: 0.8344055266818335
Energy: 1.0773240643828021
Energy: 0.9428220249385021
Energy: 0.8475667268466858
Energy: 0.8926109628426128
Energy: 0.9274279730767921
Energy: 0.8513566525232052
Energy: 0.9369688944890541
Energy: 0.8360542830150719
Energy: 1.025103185048492
Energy: 0.8081607922358527
Energy: 0.8147930433728261
Energy: 1.0686019985244977
Energy: 1.2362628728646803
Energy: 1.0287337455104604
Energy: 0.9876027711302902
Energy: 0.9687284579719527
Energy: 0.9475892343087999
Energy: 0.8438458571179355
Energy: 1.157022569383631
Energy: 0.8788466940705024
Energy: 1.5106315919646747
Energy: 1.0692747599856316
Energy: 1.0429512318081515
Energy: 1.4649724068396512
Energy: 1.0783402250678424
Energy: 1.091789007868085

minimum gb energy = 0.7974399236209778 eV
minimum distance =  2.38215946296856 Angstroms
sigma value = 43


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

Energy: 1.3630083678900264
Energy: 1.0459862417801038
Energy: 0.9614122359150516
Energy: 1.3648851192074658
Energy: 1.1316137272898288
Energy: 0.8567205910299611
Energy: 0.8321088292068338
Energy: 0.8244313059820442
Energy: 0.8670123032385225
Energy: 0.9167167353284684
Energy: 0.8245422275818264
Energy: 0.8872363283106007
Energy: 0.93709184334356
Energy: 0.8139831903558564
Energy: 0.8137785942633785
Energy: 0.9368265880550944
Energy: 0.855673733014466
Energy: 0.8774227618731042
Energy: 0.8064132952953698
Energy: 0.7800422055466367
Energy: 0.7873176091270577
Energy: 0.806195183444462
Energy: 0.9347673018236828
Energy: 0.7906320896460259
Energy: 0.7713042188517539
Energy: 0.8259783073911114
Energy: 0.837808721144878
Energy: 0.7627278699917103
Energy: 0.8028101290711374
Energy: 0.8377027257781272
Energy: 0.9296979255975772
Energy: 0.8020369966440989
Energy: 0.8377818354040132
Energy: 0.9297556636964993
Energy: 0.7672814506226358
Energy: 0.8377117831172899
Energy: 0.7517628680939853
Energy: 0.815462311360568
Energy: 0.8154307112231354
Energy: 0.7521461496377508
Energy: 0.8155100549176919
Energy: 0.8105696574670896
Energy: 1.1487072147454294
Energy: 0.8326858048166402
Energy: 0.8916664563161166
Energy: 1.1494311121919119
Energy: 0.8283021187409664
Energy: 0.838885815425612
Energy: 0.824114109244693
Energy: 0.8120783214375051
Energy: 0.812912844428563
Energy: 0.8240894475497746
Energy: 1.0697021641652589
Energy: 0.813551417959677
Energy: 1.208448004734349
Energy: 0.9042538071230284
Energy: 0.903699843391969
Energy: 1.2119845570822811
Energy: 0.9856178764697973
Energy: 0.9037774881268477
Energy: 1.0093986433247804
Energy: 0.9672317572289797
Energy: 0.9052952546821875
Energy: 1.0094508369334496
Energy: 0.8095858148144667
Energy: 0.941559818907334
Energy: 1.0096450967346948
Energy: 0.8609154374345425
Energy: 0.8383048811982015
Energy: 0.7414033711369185
Energy: 1.0538944553970917
Energy: 0.8630905079494591
Energy: 1.1610598192238009
Energy: 0.900056963688874
Energy: 0.8617042403482075
Energy: 0.8381877726981537
Energy: 0.8998771388552137
Energy: 0.8617796596102325
Energy: 0.9538362775199339
Energy: 0.8292858244844284
Energy: 0.8404264112376252
Energy: 0.7607781609691123
Energy: 0.8459997758419096
Energy: 0.8460995477515285
Energy: 0.8934486012562396
Energy: 0.8966047198327415
Energy: 0.8540336043745228
Energy: 0.8936738438761538
Energy: 0.9998436858333876
Energy: 0.8534828262533766
Energy: 0.7917607512948743
Energy: 0.8487131366909707
Energy: 0.8074488214672426
Energy: 0.7921544291837777
Energy: 0.8147604423665955
Energy: 0.7591672518061274
Energy: 0.7706196632786949
Energy: 0.8483480554873055
Energy: 0.8490635650283346
Energy: 0.7709083261598683
Energy: 0.9976268445417884
Energy: 0.8488557493958234
Energy: 0.8954240305784589
Energy: 0.8425712245213381
Energy: 0.8151198134140961
Energy: 0.9949013246835045
Energy: 0.9106375090138285
Energy: 0.8432054905697437
Energy: 1.1297198363814036
Energy: 1.0127093492048018
Energy: 0.8492377826484419
Energy: 0.9872935288305692
Energy: 1.0125467695370252
Energy: 0.804844349024641
Energy: 0.9660663953646871
Energy: 1.0380733758293663
Energy: 0.9150557690906215
Energy: 0.8685247369256264
Energy: 1.0584329716166396
Energy: 0.9029048144979902
Energy: 1.0164995159592163
Energy: 0.9294136846057734
Energy: 0.8469723045404343
Energy: 1.0176136789131804
Energy: 0.9066623966547354
Energy: 0.8185944371788134
Energy: 1.0068475555695964
Energy: 0.8633585096967984
Energy: 0.8632534382658826
Energy: 1.0067087995174462
Energy: 1.2182670589511115
Energy: 0.8647480223652285
Energy: 0.9076376519018329
Energy: 0.7745418699996266
Energy: 0.845529296101087
Energy: 0.9080554058183807
Energy: 0.8856114274726091
Energy: 0.8461884697689942
Energy: 1.0828156406413885
Energy: 0.9927611587756898
Energy: 0.8701083771868708
Energy: 1.0609230770294313
Energy: 0.9791878298909311
Energy: 0.7882537727420481
Energy: 0.9175546497301488
Energy: 0.771960795816375
Energy: 0.7695282241198707
Energy: 0.9177398203510689
Energy: 0.7723468337579231
Energy: 0.795713884786505
Energy: 0.9259423367037423
Energy: 0.7510778983587733
Energy: 0.817795258710754
Energy: 0.8542129645982054
Energy: 0.7513780222192172
Energy: 0.8397011683437264
Energy: 0.838184818210011
Energy: 0.8371245129650148
Energy: 0.8503364634837415
Energy: 0.838222363581348
Energy: 0.9419964699519168
Energy: 0.8465553591359163
Energy: 0.8617766489702677
Energy: 0.8336394945510007
Energy: 0.7991408848480275
Energy: 0.862333878931434
Energy: 0.8237936136699874
Energy: 0.8026856813941752
Energy: 1.0092866615336378
Energy: 0.8394451077115447
Energy: 0.8402846026729024
Energy: 1.0058687989160007
Energy: 1.148696290997082
Energy: 0.8386945765575239
Energy: 1.0264555884977897
Energy: 0.8242105451842007
Energy: 0.8475672379072122
Energy: 1.0266388479599748
Energy: 0.7614731465007771
Energy: 0.8121962618005907
Energy: 1.3544769598147532
Energy: 1.1835045570659115
Energy: 0.9435284397510476
Energy: 1.3548780963920288
Energy: 1.1238837495988063
Energy: 0.9437252066591073

minimum gb energy = 0.7414033711369185 eV
minimum distance =  2.33024321912143 Angstroms
sigma value = 57


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

Energy: 1.1127648418840417
Energy: 0.8763226305468262
Energy: 0.8763275980722244
Energy: 1.1145057257044912
Energy: 1.1761778085303916
Energy: 0.876870064386561
Energy: 0.7277154392584314
Energy: 0.7925585888995527
Energy: 0.8308462926042006
Energy: 0.7921490502146313
Energy: 0.7925432109334114
Energy: 0.8297044447000129
Energy: 0.9763645998449689
Energy: 0.838803539960155
Energy: 0.7305774566065859
Energy: 0.9766915601797235
Energy: 0.8392401954543924
Energy: 0.770715705684432
Energy: 0.79461232862167
Energy: 0.8240740105947555
Energy: 0.7919346939465691
Energy: 0.7920074136544389
Energy: 0.813995727079136
Energy: 0.7915763428294696
Energy: 0.8499436242491955
Energy: 0.8098547646637712
Energy: 0.8085371335540814
Energy: 0.8502822757001215
Energy: 0.8066884114753933
Energy: 0.7838267600236559
Energy: 0.9382125116822736
Energy: 0.8333887200169264
Energy: 0.8064254610898539
Energy: 0.9895281457210876
Energy: 0.7789091394343324
Energy: 0.8061721425293574
Energy: 0.8427138941296046
Energy: 0.7899287086426111
Energy: 0.7899655441124187
Energy: 0.8411971200330173
Energy: 0.7929794367408445
Energy: 0.7899552597896923
Energy: 1.0256156228172884
Energy: 0.7899025584522154
Energy: 0.8985267053347775
Energy: 1.0266953939022652
Energy: 0.9075693523553946
Energy: 0.8293344910286977
Energy: 0.8412616212499155
Energy: 0.8302667528642713
Energy: 0.8299447820474791
Energy: 0.8410004630097637
Energy: 0.9178651345949024
Energy: 0.8301113857092245
Energy: 1.1418336735586165
Energy: 0.8281714657391883
Energy: 0.827860563140025
Energy: 1.1419540536545112
Energy: 1.1439779581068588
Energy: 0.7973128159334577
Energy: 0.9181198389600391
Energy: 0.786127052035272
Energy: 0.8321726106134282
Energy: 0.9181220038654931
Energy: 0.7720803021770752
Energy: 0.8306386626268599
Energy: 0.7290147959947121
Energy: 0.9173548949220919
Energy: 0.8320384202794118
Energy: 0.7304410444173352
Energy: 0.9175096829605704
Energy: 0.8433311070502584
Energy: 0.7317445358762485
Energy: 0.788065578173639
Energy: 0.8439225192307311
Energy: 0.7290466511983659
Energy: 0.7926653160087986
Energy: 0.8442318198425365
Energy: 0.9174615292775159
Energy: 0.7917191684229323
Energy: 0.8234111730789178
Energy: 0.9174230893529935
Energy: 0.7928204253153208
Energy: 0.8299141372535311
Energy: 0.918800613353535
Energy: 0.802583516138912
Energy: 0.8287178391196233
Energy: 0.918698816102507
Energy: 1.0571665381072277
Energy: 0.8280265563878075
Energy: 0.7644767585262973
Energy: 0.7797421544251887
Energy: 0.7797092954711673
Energy: 0.7654848971599477
Energy: 0.8381446204723536
Energy: 0.789373566979499
Energy: 0.8396096476691828
Energy: 0.8247255811671652
Energy: 0.8246036567130619
Energy: 0.7673059369627611
Energy: 0.9994029845811787
Energy: 0.8239019430524783
Energy: 0.8404646672286306
Energy: 0.7858339877113422
Energy: 0.8484797091358887
Energy: 0.8433546834866278
Energy: 0.7652446070387391
Energy: 0.8241863371190404
Energy: 0.8427264639354496
Energy: 0.7869919396748243
Energy: 0.8513515619988662
Energy: 0.8428381000696551
Energy: 0.7870053870721121
Energy: 0.8284519282998982
Energy: 0.842710155171517
Energy: 0.9652838623332692
Energy: 0.8462996032544506
Energy: 0.7723368857331386
Energy: 1.0122781700448766
Energy: 0.8466348172571608
Energy: 0.7712706905824703
Energy: 0.8323419851552097
Energy: 0.8325140994570039
Energy: 0.7714439909776518
Energy: 0.7930662561088268
Energy: 0.8379895603341
Energy: 1.2035661237872246
Energy: 0.8270610738089826
Energy: 0.8569179458871914
Energy: 1.2040408678193752
Energy: 1.236233815237934
Energy: 0.8568807208316176
Energy: 0.9173263251325638
Energy: 0.7917627057312896
Energy: 0.832272735126228
Energy: 0.9174017172956191
Energy: 0.9177340091208906
Energy: 0.8307078095408482
Energy: 0.7321415198339448
Energy: 0.9601432592894199
Energy: 0.8440366260483627
Energy: 0.8113012499600448
Energy: 0.917483614614404
Energy: 0.8442892899875641

minimum gb energy = 0.7277154392584314 eV
minimum distance =  2.40100985066385 Angstroms
sigma value = 17


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

Energy: 1.2055371350111859
Energy: 0.8838332167787205
Energy: 0.8841849459191341
Energy: 1.207581628887944
Energy: 1.115709149708497
Energy: 0.7446181077376205
Energy: 0.7424101961874942
Energy: 0.7985574032762269
Energy: 0.8221825337937165
Energy: 0.897892036579159
Energy: 0.8078328894150849
Energy: 0.790768443650327
Energy: 0.9831296811154928
Energy: 0.8031355274585661
Energy: 0.7609748788096561
Energy: 0.9844308840561571
Energy: 0.8033519245833982
Energy: 0.7152941267538534
Energy: 0.8136068550040638
Energy: 0.8030268588082579
Energy: 0.7589709032697083
Energy: 0.8136594938590517
Energy: 0.6814210868413771
Energy: 0.8135504286013638
Energy: 0.8146920225085117
Energy: 0.7521071704079235
Energy: 0.7519950037491893
Energy: 0.8139868791766484
Energy: 0.8330261868650567
Energy: 0.7396001872641246
Energy: 1.0256583525425012
Energy: 0.6955951751782985
Energy: 0.7553061484737612
Energy: 1.0354852616003052
Energy: 0.6953363531991981
Energy: 0.6736594663645356
Energy: 0.7578190777817765
Energy: 0.6919365489775264
Energy: 0.691951983756604
Energy: 0.7583135551414423
Energy: 0.6956543610509759
Energy: 0.7085419460200373
Energy: 0.9801789465950596
Energy: 0.7175970168798599
Energy: 0.7795299107468338
Energy: 0.9817915700444406
Energy: 0.8437989662965293
Energy: 0.7799248644709195
Energy: 0.6943161777337417
Energy: 0.7195187228049088
Energy: 0.7660511183830973
Energy: 0.6956754866342042
Energy: 0.7476289823965415
Energy: 0.692089857350335
Energy: 0.6949604353226726
Energy: 0.7196783813533214
Energy: 0.7195778303250324
Energy: 0.6949319053738597
Energy: 0.7195012833224994
Energy: 0.7197847517687184
Energy: 0.9402221095672141
Energy: 0.7396169747978375
Energy: 0.7524592669024162
Energy: 0.9260461415809994
Energy: 0.8670143394812742
Energy: 0.752817080017628
Energy: 0.8496236252502043
Energy: 0.7817272602069041
Energy: 0.7817244215025797
Energy: 0.8441942960857705
Energy: 0.7817716054412871
Energy: 0.7815784408158994
Energy: 0.854875638942395
Energy: 0.9035092111501273
Energy: 0.8052188242558854
Energy: 0.7655555058221432
Energy: 0.9714575757930158
Energy: 0.8170869564580127
Energy: 0.836632718537916
Energy: 0.8105728248618651
Energy: 0.8119247975790451
Energy: 0.8368249404241821
Energy: 0.8981324910917536
Energy: 0.8398656243438535
Energy: 1.069540931351157
Energy: 0.8949990444329589
Energy: 0.7828700517749481
Energy: 1.0697588239161921
Energy: 0.7829557830337086
Energy: 0.7838656391588928
Energy: 1.0217842490240887
Energy: 0.807177527917952
Energy: 0.7684946202069834
Energy: 1.0230681135462054
Energy: 0.8078926408655582
Energy: 0.8047178330568201
Energy: 0.9690778313767824
Energy: 0.8846266343547259
Energy: 0.8509123356258133
Energy: 0.9261534120446061
Energy: 0.8859618753004569
Energy: 0.8509959701396382

minimum gb energy = 0.6736594663645356 eV
minimum distance =  2.37930489607963 Angstroms
sigma value = 17


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

Energy: 1.2505726654490334
Energy: 0.8501517716917553
Energy: 0.7186753084035981
Energy: 1.2527408222437255
Energy: 1.019978539654409
Energy: 0.781736573114304
Energy: 0.9851128549911452
Energy: 0.8046128650803654
Energy: 0.7977829037753102
Energy: 0.9576756664332639
Energy: 0.9179061691402239
Energy: 0.8157878837202982
Energy: 0.9176553674709467
Energy: 0.711184590638468
Energy: 0.7572098523249009
Energy: 0.9192948895556008
Energy: 0.8029393527525269
Energy: 0.7265878746114737
Energy: 0.7867562878255889
Energy: 0.7577606680718183
Energy: 0.7261968822123845
Energy: 0.7874361085281375
Energy: 0.6385254943496073
Energy: 0.6932462725362446
Energy: 0.7836033473359654
Energy: 0.6974068039479768
Energy: 0.7273885439456241
Energy: 0.7838649831637049
Energy: 0.8912986631346372
Energy: 0.7286395589505281
Energy: 1.0951855236907087
Energy: 0.6649843278819403
Energy: 0.6755399669692169
Energy: 1.098084148266126
Energy: 0.6647442599904553
Energy: 0.7111218115354198
Energy: 0.6767806238349954
Energy: 0.7059055000705221
Energy: 0.6633582974191122
Energy: 0.6766725443337661
Energy: 0.6660338522466861
Energy: 0.6738359232037
Energy: 0.9019079491032167
Energy: 0.6525602445994723
Energy: 0.6855156516771003
Energy: 0.7689753042444061
Energy: 0.6484130409899536
Energy: 0.7083567436360798
Energy: 0.6247509839487413
Energy: 0.7077583277002593
Energy: 0.6863427866921519
Energy: 0.625905571482287
Energy: 0.7811438939299996
Energy: 0.6246734973856763
Energy: 0.6297517638778404
Energy: 0.687015582392149
Energy: 0.6894142148785233
Energy: 0.626197182823135
Energy: 0.6810893935425635
Energy: 0.7082786832027832
Energy: 0.819877783039614
Energy: 0.6267980277425413
Energy: 0.725081161865674
Energy: 0.796611210695348
Energy: 0.6265707144748449
Energy: 0.6653805075015072
Energy: 0.8171596945884817
Energy: 0.6247602360760114
Energy: 0.6246820351299622
Energy: 0.818380631423211
Energy: 0.6285417788769735
Energy: 0.6861300326203702
Energy: 0.7225969598261781
Energy: 0.658070547984309
Energy: 0.6851243926674352
Energy: 0.6811561791000964
Energy: 0.8983153493735271
Energy: 0.6858500140701873
Energy: 0.6642164595497458
Energy: 0.6752544258879573
Energy: 0.6650792590818092
Energy: 0.6639594984379174
Energy: 0.6798644784255127
Energy: 0.6639643415366174
Energy: 0.6646919600511297
Energy: 0.7246210637654061
Energy: 0.785001074323337
Energy: 0.6648635246665261
Energy: 0.9345122780903031
Energy: 0.735761049790549
Energy: 0.8774827340983726
Energy: 0.824882144000784
Energy: 0.7074989901351612
Energy: 0.7915642008578926
Energy: 0.8306039232961633
Energy: 0.7283621209709901
Energy: 0.6761300370076547
Energy: 0.7582805863487464
Energy: 0.7583197663777005
Energy: 0.6769044719398777
Energy: 0.7581914510464299
Energy: 0.6970168085350544
Energy: 0.6765440424926209
Energy: 0.8235864364866923
Energy: 0.790426879830792
Energy: 0.6771628880695647
Energy: 0.9238644318308089
Energy: 0.7049879662950387
Energy: 0.9133418809181667
Energy: 0.758282014175182
Energy: 0.7061800919094878
Energy: 0.9145881825171578
Energy: 0.8146887421971588
Energy: 0.7982450210821412
Energy: 1.0508170316805407
Energy: 0.7859944958382893
Energy: 0.7551993136845481
Energy: 1.0506661841420095
Energy: 0.9502882737407671
Energy: 0.8410299380751988
Energy: 0.9581937791487142
Energy: 0.8899691585971606
Energy: 0.7737312447179076
Energy: 0.9592636209547654
Energy: 0.8905035336719357
Energy: 0.7746485149180584
Energy: 0.8605820017784551
Energy: 0.838116306757638
Energy: 0.8209982706460006
Energy: 0.8250726733670694
Energy: 0.9147250746082004
Energy: 0.726955981147125
Energy: 0.7423464455486111
Energy: 0.7870985730874173
Energy: 0.7739923511579464
Energy: 0.7396755563749025
Energy: 0.8075131555774802
Energy: 0.8206673753399605
Energy: 0.9333341822847703
Energy: 0.7639405379362851
Energy: 0.7912715904619615
Energy: 0.9327367453745241
Energy: 0.6433034477164993
Energy: 0.791099831630762
Energy: 0.7577018032792223
Energy: 0.7111668242394155
Energy: 0.7573022896005119
Energy: 0.7577255107311773
Energy: 0.711592981714751
Energy: 0.7266945128510807
Energy: 0.7827748724334895
Energy: 0.6969955991600099
Energy: 0.6959052142850314
Energy: 0.7838643180691643
Energy: 0.8100025558593548
Energy: 0.7822823072491595
Energy: 1.0970757945246072
Energy: 0.7178628112818132
Energy: 0.7352185324438996
Energy: 0.7117314286323321
Energy: 0.8618193119017291
Energy: 0.7110934408689036
Energy: 0.9000814247351975
Energy: 0.6635783931081092
Energy: 0.6638831099842395
Energy: 0.7868787707243329
Energy: 0.665412792067989
Energy: 0.6639975078411587
Energy: 0.8866614106578743
Energy: 0.7163028163947294
Energy: 0.7144295284422928
Energy: 0.8875606298799327
Energy: 0.705702998884057
Energy: 0.678961231238538
Energy: 0.6271405320933277
Energy: 0.7023576801552479
Energy: 0.7077084917008922
Energy: 0.6271904901835147
Energy: 0.7022960090284186
Energy: 0.7413349735482834
Energy: 0.6302046505741522
Energy: 0.6851903183717561
Energy: 0.6974224108368189
Energy: 0.6312602458183001
Energy: 0.7329150769953205
Energy: 0.6472072268921635
Energy: 0.945891449478425
Energy: 0.7097602861585045
Energy: 0.6557149152609523
Energy: 0.9457945491246063
Energy: 0.6264149099664678
Energy: 0.6551100529157922
Energy: 0.7808035474713148
Energy: 0.6291844263282225
Energy: 0.6246220806753118
Energy: 0.7814633007851144
Energy: 0.6251012581253069
Energy: 0.6244390309150948
Energy: 1.039297105865141
Energy: 0.6500597246818808
Energy: 0.6824780432478375
Energy: 1.0413757911721708
Energy: 0.6272378699603454
Energy: 0.7400120668012417
Energy: 0.6698304186397379
Energy: 0.6753650266190293
Energy: 0.674600694865682
Energy: 0.6703017160378495
Energy: 0.677368893293527
Energy: 0.6756939546387655
Energy: 0.6638229177817271
Energy: 0.7071430128533468
Energy: 0.7352400350713485
Energy: 0.663828241226782
Energy: 0.706844340631929
Energy: 0.6645218958504138
Energy: 0.8879025139121146
Energy: 0.7204862709786153
Energy: 0.7200318330034235
Energy: 0.8881391806333087
Energy: 0.7167570461447967
Energy: 0.7256755553816404
Energy: 0.6825939694466099
Energy: 0.7579943586136939
Energy: 0.7833342235666584
Energy: 0.6702203773475707
Energy: 0.7593173339911309
Energy: 0.7580464425661239
Energy: 1.174301006126837
Energy: 0.8598629601814122
Energy: 0.7582430866237488
Energy: 0.9485706007273087
Energy: 0.9223939054251924
Energy: 0.7879973237167057
Energy: 0.9267448758896808
Energy: 0.7805882629755212
Energy: 0.7699618941450584
Energy: 0.9282296099949403
Energy: 0.8465835568342848
Energy: 0.8190813435327579
Energy: 0.8574656583196999
Energy: 0.735158873374543
Energy: 0.8085344671351171
Energy: 0.8538730122687713
Energy: 0.7351628521717188
Energy: 0.7583388961930408
Energy: 0.9560175511965658
Energy: 0.6753764646480994
Energy: 0.7904207517112873
Energy: 0.956978173966518
Energy: 0.7779598609491695
Energy: 0.7737470075462534
Energy: 0.7414415951148224
Energy: 0.8497388771608563
Energy: 0.7743801714321934
Energy: 0.7420918260132858
Energy: 0.871556838245409
Energy: 0.8206621581867758

minimum gb energy = 0.6244390309150948 eV
minimum distance =  2.36458192633789 Angstroms
sigma value = 57


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

Energy: 1.1278841607384882
Energy: 0.8053334547040432
Energy: 0.6906902968878792
Energy: 1.1293288962494517
Energy: 1.0467911047581762
Energy: 0.7390859226483736
Energy: 0.9164568074034958
Energy: 0.7543662616321113
Energy: 0.7579362540248052
Energy: 0.9102881941636832
Energy: 0.8631732816328115
Energy: 0.775961281122516
Energy: 0.858614386047381
Energy: 0.6696997505740395
Energy: 0.6820176295096956
Energy: 0.8599996212196145
Energy: 0.7432744957803918
Energy: 0.693878966918641
Energy: 0.7531900399884933
Energy: 0.6717837298634989
Energy: 0.6940931350149737
Energy: 0.7519757941848909
Energy: 0.7355011098258804
Energy: 0.668925002433972
Energy: 0.6745020961679852
Energy: 0.6601181494584585
Energy: 0.6930923069432594
Energy: 0.675174371601578
Energy: 0.8403579214409267
Energy: 0.6941938115224622
Energy: 1.0210202189742559
Energy: 0.639201622593982
Energy: 0.6425734161493823
Energy: 1.0234742342041683
Energy: 0.6390856116418625
Energy: 0.6706238707219166
Energy: 0.8113866269812526
Energy: 0.6791140902276821
Energy: 0.6843408351871115
Energy: 0.8126266277194544
Energy: 0.6775372348514631
Energy: 0.7249906263549257
Energy: 0.822455296369471
Energy: 0.649242115287846
Energy: 0.6594395215927951
Energy: 0.7807642777225597
Energy: 0.6485030607491751
Energy: 0.6689436612099066
Energy: 0.5951726190361943
Energy: 0.7570578763282775
Energy: 0.5932626080964125
Energy: 0.5961266811035996
Energy: 0.7959064353105971
Energy: 0.5929515605829947
Energy: 0.5972744019510783
Energy: 0.6866332421057816
Energy: 0.6628482580191953
Energy: 0.597541918552394
Energy: 0.6663763189508459
Energy: 0.6655235385417733
Energy: 0.9383416545874161
Energy: 0.5737458023681549
Energy: 0.6814217692960549
Energy: 0.8002736489182343
Energy: 0.5850928998222131
Energy: 0.6688799255425518
Energy: 0.7888843621332801
Energy: 0.5783570240184358
Energy: 0.5719298247961114
Energy: 0.7728995569501654
Energy: 0.5759265848236043
Energy: 0.664168411444621
Energy: 0.5753592065764943
Energy: 0.6644427585519369
Energy: 0.6460637275565465
Energy: 0.576713240252478
Energy: 0.6411258421908154
Energy: 0.7334309425284095
Energy: 0.5726575223808164
Energy: 0.652277545804528
Energy: 0.6391247037116286
Energy: 0.5735565559900995
Energy: 0.7757139825309722
Energy: 0.5718754574940269
Energy: 0.5732034163685599
Energy: 0.6476604396538691
Energy: 0.6596235110116355
Energy: 0.5734206617288873
Energy: 0.624641453598027
Energy: 0.6474663907132938
Energy: 0.8075414393376402
Energy: 0.5950125671305359
Energy: 0.6466251268107915
Energy: 0.7027568335376314
Energy: 0.6051516672013966
Energy: 0.6222357801364993
Energy: 0.7166130627254182
Energy: 0.601710722851884
Energy: 0.592749785331091
Energy: 0.7160965550585613
Energy: 0.5987664557250656
Energy: 0.6462669700292161
Energy: 0.6585392239486808
Energy: 0.613947694518344
Energy: 0.6418115149567215
Energy: 0.6585418575640655
Energy: 0.8290320954396653
Energy: 0.6452792046953457
Energy: 0.6394676715557098
Energy: 0.6295511634797007
Energy: 0.6391049416258684
Energy: 0.6407056860024196
Energy: 0.7538678255526426
Energy: 0.6391556130332978
Energy: 0.8128871174895761
Energy: 0.6972229130908437
Energy: 0.7039468327397342
Energy: 0.8144475256738781
Energy: 0.6598866414119926
Energy: 0.711084245461136
Energy: 0.863361647935321
Energy: 0.7882343864037744
Energy: 0.7081933414456045
Energy: 0.7481841663362856
Energy: 0.7881915816760549
Energy: 0.6847945730249712
Energy: 0.6768208589688925
Energy: 0.7265820258523837
Energy: 0.6392394598302482
Energy: 0.6762063308065696
Energy: 0.7352660183795603
Energy: 0.6660594302129372
Energy: 0.6962358301662518
Energy: 0.7837265628196416
Energy: 0.7261994885741373
Energy: 0.693551727776628
Energy: 0.8642325421184905
Energy: 0.7510494977236022
Energy: 0.8620044937295648
Energy: 0.6595426156951798
Energy: 0.6890657157043657
Energy: 0.8634546675337498
Energy: 0.769934541452221
Energy: 0.7804654961977417
Energy: 0.8617876872746258
Energy: 0.6943367470177787
Energy: 0.6944263408384646
Energy: 0.8626545581443708
Energy: 0.6943450281812099
Energy: 0.7512118452207079
Energy: 0.9061040932807883
Energy: 0.7351734026468073
Energy: 0.7278693614031037
Energy: 0.9046390397072199
Energy: 0.8991973536408273
Energy: 0.7810332559948261
Energy: 1.1300222062438057
Energy: 0.7790873901406662
Energy: 0.6938027987161121
Energy: 0.9164576393287501
Energy: 0.860935210745191
Energy: 0.7184030769440573

minimum gb energy = 0.5718754574940269 eV
minimum distance =  2.37953341456062 Angstroms
sigma value = 43


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

Energy: 1.0488356149751927
Energy: 0.7046281739033363
Energy: 0.6515601701547243
Energy: 1.0505190442477688
Energy: 0.7733905353158688
Energy: 0.614402900270371
Energy: 0.7707853333890307
Energy: 0.6482933302435032
Energy: 0.6391246563399362
Energy: 0.7578534442396753
Energy: 0.6490171125340253
Energy: 0.5656112322913752
Energy: 0.7329757000879639
Energy: 0.5682283055594392
Energy: 0.5735093729458439
Energy: 0.7343549711289432
Energy: 0.6246735890957492
Energy: 0.5581622308901499
Energy: 0.6499877885939974
Energy: 0.5736100474503733
Energy: 0.5582514736814198
Energy: 0.6499267271358357
Energy: 0.6223043797036923
Energy: 0.5898350467516933
Energy: 0.637906092397634
Energy: 0.5650314478148569
Energy: 0.5565501170627772
Energy: 0.637950270315365
Energy: 0.7047175231310112
Energy: 0.5559635160225709
Energy: 0.9722939592181007
Energy: 0.5639814617357968
Energy: 0.5564440513818142
Energy: 0.9741696006125952
Energy: 0.5638831520190983
Energy: 0.5337015664936112
Energy: 0.6999020363411754
Energy: 0.5918664516271995
Energy: 0.5916989019978426
Energy: 0.7012807987165811
Energy: 0.5962323785895515
Energy: 0.6031867430282405
Energy: 0.674026258350011
Energy: 0.5652468829818168
Energy: 0.5489843874654574
Energy: 0.675001060920215
Energy: 0.5401542085496999
Energy: 0.54895041654812
Energy: 0.5266484614530544
Energy: 0.5489735352144524
Energy: 0.5242656778395351
Energy: 0.5281084438378885
Energy: 0.6657303982045459
Energy: 0.5243528045116821
Energy: 0.5854759272119078
Energy: 0.5435377024949413
Energy: 0.5366043334943436
Energy: 0.5244593720844649
Energy: 0.5809588742726959
Energy: 0.5334845186001791
Energy: 0.7607800265220621
Energy: 0.4994264898344404
Energy: 0.5803955486402673
Energy: 0.571367924393399
Energy: 0.49936938381401746
Energy: 0.537812399579162
Energy: 0.6707889992213606
Energy: 0.49984326283707053
Energy: 0.49961722863463265
Energy: 0.6626890616207769
Energy: 0.5020939358925118
Energy: 0.5774058806162236
Energy: 0.6486408315311265
Energy: 0.5369205987573759
Energy: 0.5609755969389738
Energy: 0.6500001722526242
Energy: 0.5537461007169061
Energy: 0.560632396288394
Energy: 0.4851371898971209
Energy: 0.6798154547455935
Energy: 0.48517346866476097
Energy: 0.48652427733962483
Energy: 0.6535839295737875
Energy: 0.48536772698372593
Energy: 0.48742842545635784
Energy: 0.5522810340570757
Energy: 0.5330606499050075
Energy: 0.48758324930678654
Energy: 0.5526167374157673
Energy: 0.5452009953211823
Energy: 0.5430934882532426
Energy: 0.4794349165927331
Energy: 0.4792378096132956
Energy: 0.543785597435618
Energy: 0.47932906759806126
Energy: 0.5540744506800312
Energy: 0.6651707552970755
Energy: 0.4802651787974908
Energy: 0.48022653950499167
Energy: 0.6624212918798744
Energy: 0.4802255142957428
Energy: 0.5612164815803138
Energy: 0.639525848502701
Energy: 0.5877096077244001
Energy: 0.5852921627737135
Energy: 0.5645014353706561
Energy: 0.6925311278576136
Energy: 0.5007086575287949
Energy: 0.47838128275073943
Energy: 0.5952419241842313
Energy: 0.47846563369316714
Energy: 0.4791569106320383
Energy: 0.6543492158780263
Energy: 0.47847941361676427
Energy: 0.6414411698267101
Energy: 0.5842927348685591
Energy: 0.5890681963646779
Energy: 0.6430097349272265
Energy: 0.5364194751229543
Energy: 0.5503783488919023
Energy: 0.654857997620837
Energy: 0.48792922958654517
Energy: 0.4877477296765478
Energy: 0.6689239726988264
Energy: 0.4879029020159553
Energy: 0.5535554684866684
Energy: 0.5417466401767554
Energy: 0.485479798815778
Energy: 0.48554780185674046
Energy: 0.5423133415967085
Energy: 0.4855448070595074
Energy: 0.5575533926789743
Energy: 0.5843220811409426
Energy: 0.5374157240923721
Energy: 0.5334374976757291
Energy: 0.5019612301398276
Energy: 0.6422739040900151
Energy: 0.5322679335847635
Energy: 0.49983098918004015
Energy: 0.6646526055521009
Energy: 0.49954122454504907
Energy: 0.5013172276013239
Energy: 0.65979822958767
Energy: 0.4995386166805754
Energy: 0.6580296393054719
Energy: 0.5390227377816529
Energy: 0.5438467092216629
Energy: 0.6594230628216902
Energy: 0.5563376404904978
Energy: 0.5436686099340808
Energy: 0.6736910512074193
Energy: 0.5246390254254621
Energy: 0.5246212647075771
Energy: 0.6753223548669955
Energy: 0.5251749710766264
Energy: 0.529260215621265
Energy: 0.7936087664391903
Energy: 0.523838224491345
Energy: 0.5636142539175687
Energy: 0.5675739770665293
Energy: 0.5238250259182842
Energy: 0.5443355297288666
Energy: 0.5534774599353784
Energy: 0.5608951721585465
Energy: 0.5625389277270901
Energy: 0.5666071099524413
Energy: 0.6436744751104334
Energy: 0.5547143972205224
Energy: 0.5672448599583687
Energy: 0.5611254549642981
Energy: 0.5650241072657732
Energy: 0.5679130197258633
Energy: 0.6782094574868123
Energy: 0.5653442795122557
Energy: 0.6966202473368618
Energy: 0.5821225489522336
Energy: 0.561567789406862
Energy: 0.6979298113508473
Energy: 0.5537704913594529
Energy: 0.561191426689857
Energy: 0.7110626792935067
Energy: 0.6761070641310856
Energy: 0.6761114801858873
Energy: 0.7113468146076312
Energy: 0.6805007123890153
Energy: 0.6899853001011018
Energy: 1.0114394544385799
Energy: 0.6330370771246548
Energy: 0.562687474392882
Energy: 1.013117994199385
Energy: 0.6333844763345127
Energy: 0.5491968915430027
Energy: 0.654580768413021
Energy: 0.6330554243039949
Energy: 0.6237127391754387
Energy: 0.6548008962689886
Energy: 0.7317301914698514
Energy: 0.6248155933915156
Energy: 0.7115992820070421
Energy: 0.5937230092779918
Energy: 0.5780345062436741
Energy: 0.7132663600012287
Energy: 0.6503798050893375
Energy: 0.634143162904506
Energy: 0.8849021355517832
Energy: 0.5820548839726518
Energy: 0.584786500701028
Energy: 0.7349819626300484
Energy: 0.6352266401806588
Energy: 0.5903219525908187
Energy: 0.7707853376852801
Energy: 0.6326740604268344
Energy: 0.6232012451396822
Energy: 0.7580149865356843
Energy: 0.6699874163904315
Energy: 0.6234988035119898

minimum gb energy = 0.47838128275073943 eV
minimum distance =  2.35173306955748 Angstroms
sigma value = 81


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

Energy: 0.2300067099882
Energy: 0.2618453766139864
Energy: 0.03592018789064593
Energy: 0.03738867531714758
Energy: 0.4242770810158616
Energy: 0.23017720691442864
Energy: 0.2627995233942616
Energy: 0.5280134370516543
Energy: 0.4243943394802661
Energy: 0.42797592312717736
Energy: 0.4263974221407968
Energy: 0.5311138372002535
Energy: 0.8161870861577691
Energy: 0.035874307659473186
Energy: 0.0359372854680157
Energy: 0.8212348709493138
Energy: 0.03579862626196566
Energy: 0.03605212708144005
Energy: 0.4241651384238103
Energy: 0.03586852810144504
Energy: 0.03607080048502488
Energy: 0.5104491625369216
Energy: 0.03595883878832607
Energy: 0.06805585226879435
Energy: 0.06758408216367735
Energy: 0.45496555654010884
Energy: 0.4534180829377083
Energy: 0.06847081978252684
Energy: 0.8157361228104708
Energy: 0.4551246032004535
Energy: 0.03657017298125046
Energy: 0.6067393191389343
Energy: 0.03600241560970574
Energy: 0.03758920298797112
Energy: 0.4208365804649375
Energy: 0.03584009456731201
Energy: 0.4229405710957308
Energy: 0.4206169965728978
Energy: 0.5310853099724866
Energy: 0.4232822738043802
Energy: 0.4248983653142934
Energy: 0.42692181960655795
Energy: 0.456817927310184
Energy: 0.03584993699526964
Energy: 0.03596013779888179
Energy: 0.4533188784420199
Energy: 0.035868205832098564
Energy: 0.0359087978028331
Energy: 0.42750632426501234
Energy: 0.03591455392019054
Energy: 0.0694099096840003
Energy: 0.42935258721206027
Energy: 0.035900528209456245
Energy: 0.06921223533640274
Energy: 0.23026403433266437
Energy: 0.4534508778109052
Energy: 0.4534965832200727
Energy: 0.036021845960599035
Energy: 0.8195767639554117
Energy: 0.4537120584200742

minimum gb energy = 0.03579862626196566 eV
minimum distance =  2.50188140733341 Angstroms
sigma value = 3


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

Energy: 1.096247287108224
Energy: 0.6259259058976683
Energy: 0.6626768806318157
Energy: 1.0891374914416962
Energy: 0.6005309790599264
Energy: 0.603505454663931
Energy: 0.6522913713078335
Energy: 0.6339882102361274
Energy: 0.6314788884116124
Energy: 0.6544283896338072
Energy: 0.6539978180595548
Energy: 0.6433162760855502
Energy: 0.6833686960091525
Energy: 0.7640537520944966
Energy: 0.6030171121559789
Energy: 0.6836114350415116
Energy: 0.6039918010593901
Energy: 0.6570549724045183
Energy: 0.6454166872718707
Energy: 0.6031781032878684
Energy: 0.6032816223017484
Energy: 0.6466819580719843
Energy: 0.5454293013202476
Energy: 0.620990407802637
Energy: 0.5356582135293944
Energy: 0.6313204637145301
Energy: 0.6432579728168221
Energy: 0.5338739753802844
Energy: 0.6538751993509743
Energy: 0.6452658121696327
Energy: 1.0402460276203946
Energy: 0.6990739412270838
Energy: 0.6125494114407511
Energy: 0.6211667123219163
Energy: 0.6149508118461443
Energy: 0.5807562109344035
Energy: 0.6249916314684496
Energy: 0.6156947347421006
Energy: 0.6130996778905383
Energy: 0.624873845120591
Energy: 0.6067862250383483
Energy: 0.5984979221274983
Energy: 0.6454863960947042
Energy: 0.584877134845834
Energy: 0.5845583602394439
Energy: 0.6455867331332242
Energy: 0.5558713645346933
Energy: 0.5736709879297838
Energy: 0.6500349499422013
Energy: 0.5841453806375742
Energy: 0.6236983378933008
Energy: 0.6509624405744193
Energy: 0.5149770008336556
Energy: 0.6189536364146427
Energy: 0.6039628748768499
Energy: 0.5410649285998826
Energy: 0.5587219597174645
Energy: 0.6038863806147448
Energy: 0.5579386918152298
Energy: 0.5395788332180744
Energy: 0.6153741786525717
Energy: 0.5945921928945319
Energy: 0.5881034736962104
Energy: 0.5619336800508861
Energy: 0.605118037246475
Energy: 0.5620644665795798
Energy: 0.5051828400987652
Energy: 0.5957105203578501
Energy: 0.6046692618749514
Energy: 0.505929675912293
Energy: 0.6157662778480716
Energy: 0.5032145545634606
Energy: 0.5465187392884605
Energy: 0.548574527771314
Energy: 0.5663849029755191
Energy: 0.5461203684392492
Energy: 0.5484236466948523
Energy: 0.5369783069383112
Energy: 0.7007819932757764
Energy: 0.5517468301955659
Energy: 0.5712591907035104
Energy: 0.6280967640694255
Energy: 0.4974308518078684
Energy: 0.5697212982469204
Energy: 0.5978359211157578
Energy: 0.5099759019150786
Energy: 0.5099729835989572
Energy: 0.5989578715096335
Energy: 0.5124218635415951
Energy: 0.5097511949193233
Energy: 0.6089977223568548
Energy: 0.5549532835586363
Energy: 0.5515034037525907
Energy: 0.5959301324223699
Energy: 0.607085394108713
Energy: 0.5521228073209963
Energy: 0.4853750093357019
Energy: 0.5579102213570206
Energy: 0.5630976447207671
Energy: 0.48561107866421155
Energy: 0.5595409303708426
Energy: 0.4854102560697003
Energy: 0.5117657328632038
Energy: 0.5494724432153337
Energy: 0.5557442523384336
Energy: 0.511542033864685
Energy: 0.5494525541712565
Energy: 0.593619460847354
Energy: 0.8028092522607284
Energy: 0.6109492126516954
Energy: 0.549629435756181
Energy: 0.8039399279594159
Energy: 0.604821141273634
Energy: 0.5564423989504309
Energy: 0.5999278314969504
Energy: 0.49789239147509107
Energy: 0.48704506715204576
Energy: 0.6013597732759914
Energy: 0.5012763398222482
Energy: 0.4853544093393819
Energy: 0.5997249859340816
Energy: 0.5549654608214872
Energy: 0.5540986117792717
Energy: 0.6001012129978714
Energy: 0.5647602347401716
Energy: 0.5561840884646806
Energy: 0.5126744509138337
Energy: 0.5502590954067814
Energy: 0.522623975224958
Energy: 0.5136367629745495
Energy: 0.6270708572316448
Energy: 0.5099573180563363
Energy: 0.48377507046917784
Energy: 0.5931717628534868
Energy: 0.5955399543475073
Energy: 0.49257055559581553
Energy: 0.7073704025835347
Energy: 0.5969324739809981
Energy: 0.9064977801054215
Energy: 0.5462490048405061
Energy: 0.5246707726170983
Energy: 0.907127394479115
Energy: 0.5462544319076245
Energy: 0.534318812376787
Energy: 0.5806888933882894
Energy: 0.5044327040758212
Energy: 0.5057086612460748
Energy: 0.5813295076908177
Energy: 0.5050543103595483
Energy: 0.5032904630340925
Energy: 0.6362284842674302
Energy: 0.5759056115473669
Energy: 0.57591071544653
Energy: 0.605405781970347
Energy: 0.5513937239838297
Energy: 0.587828740265143
Energy: 0.5793144844831823
Energy: 0.5758228208571539
Energy: 0.5524028048311524
Energy: 0.5804133725144396
Energy: 0.6307407194593312
Energy: 0.5588010573785004
Energy: 0.5160511136644065
Energy: 0.651262251410619
Energy: 0.6529544537491442
Energy: 0.5162516282122299
Energy: 0.6522717636480616
Energy: 0.6498124242185778
Energy: 0.9908686624001154
Energy: 0.6481804764384357
Energy: 0.5800451994486117
Energy: 0.5664196723991333
Energy: 0.6480325002826676
Energy: 0.5535184535761122
Energy: 0.5552475903416259
Energy: 0.6298659590429807
Energy: 0.5986613212584277
Energy: 0.5551047009680954
Energy: 0.6316583814421441
Energy: 0.6016099291870822
Energy: 0.6250072869740384
Energy: 0.5913822657448113
Energy: 0.5915135085190828
Energy: 0.6249143591385805
Energy: 0.5594046984672281
Energy: 0.5963602414630124
Energy: 0.6881669032132471
Energy: 0.5932221006710564
Energy: 0.6366620619063587
Energy: 0.6886640965998249
Energy: 0.5143431875696225
Energy: 0.6608005350014207
Energy: 0.5488719779852643
Energy: 0.6249751669332778
Energy: 0.6245744758109958
Energy: 0.5488796589080291
Energy: 0.6259311206713651
Energy: 0.5989035365399037

minimum gb energy = 0.48377507046917784 eV
minimum distance =  2.3617212217861 Angstroms
sigma value = 67


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

Energy: 1.075494683904046
Energy: 0.7399328758010736
Energy: 0.7900197156377499
Energy: 1.077001651995407
Energy: 0.9174792206248411
Energy: 0.7761601587348168
Energy: 0.7146190151867794
Energy: 0.747035343645231
Energy: 0.7400023108338006
Energy: 0.7753486234177502
Energy: 0.7791207111823982
Energy: 0.760852667140065
Energy: 0.8377298839236302
Energy: 0.726712523405899
Energy: 0.7562298389838159
Energy: 0.7786361988209529
Energy: 0.7236960957601798
Energy: 0.7555121226999755
Energy: 0.7293739857882173
Energy: 0.7581397788567538
Energy: 0.7584255413665218
Energy: 0.7306913344780821
Energy: 0.7009567425279918
Energy: 0.760431860317987
Energy: 0.6792286281974259
Energy: 0.7457896905121852
Energy: 0.7608057034621171
Energy: 0.6796343469183775
Energy: 0.7770913492965372
Energy: 0.7622017520705557
Energy: 1.0097454341685246
Energy: 0.768846360697919
Energy: 0.7485960337884675
Energy: 1.0131604188235648
Energy: 0.7696708097145196
Energy: 0.7424674554245083
Energy: 0.6830554784903599
Energy: 0.7235396444204796
Energy: 0.7131568122079439
Energy: 0.6810810008062064
Energy: 0.7269826761416793
Energy: 0.722508724703032
Energy: 0.7335006346427695
Energy: 0.7100582048301192
Energy: 0.6630947891881367
Energy: 0.7339543510102231
Energy: 0.6959399442776367
Energy: 0.7206494304986673
Energy: 0.7567209514339869
Energy: 0.7766438842441231
Energy: 0.7334462718579475
Energy: 0.7504866736684407
Energy: 0.6364775729120487
Energy: 0.7708309486780595
Energy: 0.7449707121486128
Energy: 0.6401462249806443
Energy: 0.6386927919003275
Energy: 0.7458447575967749
Energy: 0.6529052507452914
Energy: 0.6462688256306607
Energy: 0.7522098329063105
Energy: 0.7849994648977044
Energy: 0.7443904960825977
Energy: 0.6960697841365273
Energy: 0.7540122101058634
Energy: 0.7452777475604151
Energy: 0.6222893325952777
Energy: 0.7121855847442348
Energy: 0.7354784347554437
Energy: 0.6226057214392798
Energy: 0.7538853705961328
Energy: 0.6159020536851448
Energy: 0.6202287496819819
Energy: 0.7254419180443612
Energy: 0.674778129641014
Energy: 0.620170274883917
Energy: 0.721698054019531
Energy: 0.6161997886463371
Energy: 0.9040701155214595
Energy: 0.7517631992499044
Energy: 0.7229027261574483
Energy: 0.7902854396401722
Energy: 0.7314833489752317
Energy: 0.7223301233331746
Energy: 0.7309672075667273
Energy: 0.6199804333531619
Energy: 0.6154911625104224
Energy: 0.7322242577474339
Energy: 0.6173188994886253
Energy: 0.6762884436246306
Energy: 0.7385840096950993
Energy: 0.7220250736648463
Energy: 0.718965732083828
Energy: 0.7344309225963211
Energy: 0.6766873121577557
Energy: 0.7167992313003838
Energy: 0.6562011033982924
Energy: 0.6931263890292116
Energy: 0.6611909342282383
Energy: 0.6570296514950236
Energy: 0.6977290935648526
Energy: 0.65605494802328
Energy: 0.6374685972635562
Energy: 0.7618568332982733
Energy: 0.7544627345351452
Energy: 0.6357019339197456
Energy: 0.7802297716179944
Energy: 0.7217874111818204
Energy: 0.9519994969822628
Energy: 0.7922421931273039
Energy: 0.7307661861802225
Energy: 0.9278790296345704
Energy: 0.8069774152031208
Energy: 0.7644593942911793
Energy: 0.6355607814210719
Energy: 0.6849876140932846
Energy: 0.7292776423866935
Energy: 0.6358911865758801
Energy: 0.6836530317897277
Energy: 0.7327753475326764
Energy: 0.7521087651766115
Energy: 0.7835143135260785
Energy: 0.7637816631474433
Energy: 0.7534876287142946
Energy: 0.7119526943166533
Energy: 0.7566351548181905
Energy: 0.8376618404097496
Energy: 0.7022266226597852
Energy: 0.7519642244529655
Energy: 0.778810538226363
Energy: 0.7024819036953086
Energy: 0.7594090097480558
Energy: 0.7250659760806936
Energy: 0.7626335711353673
Energy: 0.7413197079563535
Energy: 0.7145676779340764
Energy: 0.758349888096195
Energy: 0.760864924191541

minimum gb energy = 0.6154911625104224 eV
minimum distance =  2.33896440385083 Angstroms
sigma value = 33


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

Energy: 1.209625450091182
Energy: 0.9556302255822673
Energy: 1.0162317082507664
Energy: 1.211863292381518
Energy: 1.0683743051107548
Energy: 0.911039554230414
Energy: 0.7786608711486364
Energy: 0.8116148288859264
Energy: 0.8121208532958633
Energy: 0.8740202489542518
Energy: 0.8760477308180937
Energy: 0.8364484954001138
Energy: 0.9098768448837685
Energy: 0.8546563998931851
Energy: 0.853458423112307
Energy: 0.9114079977630422
Energy: 0.8555318426208637
Energy: 0.8889031674930206
Energy: 0.7672071731509056
Energy: 0.8737917776862776
Energy: 0.877584155452263
Energy: 0.7684989401513646
Energy: 0.7530092747327308
Energy: 0.8602398898208341
Energy: 0.7477607991673393
Energy: 0.84035242221538
Energy: 0.8397629776656739
Energy: 0.7388763948145499
Energy: 0.9260420111662742
Energy: 0.8392053442625355
Energy: 1.1203713255449708
Energy: 0.919451199883594
Energy: 0.8671892470346394
Energy: 1.1219279098577195
Energy: 0.9203475906689126
Energy: 0.8219138331267929
Energy: 0.7486777647509715
Energy: 0.8665932218633331
Energy: 0.845146156207053
Energy: 0.7485181900055374
Energy: 0.8643709274186753
Energy: 0.7716879524231232
Energy: 0.770718002541594
Energy: 0.8307820449698424
Energy: 0.8284845380993846
Energy: 0.7716745496253851
Energy: 0.8264088635787084
Energy: 0.7692216921090248
Energy: 0.8263620780735083
Energy: 0.8657648390915116
Energy: 0.8392962099508157
Energy: 0.8419095844322161
Energy: 0.6959216638848564
Energy: 0.8295543962589473
Energy: 0.8071068313557516
Energy: 0.7015795099538742
Energy: 0.69713031949425
Energy: 0.8081256854727152
Energy: 0.6982445372722996
Energy: 0.767476683639098
Energy: 0.9688829290098386
Energy: 0.7758598890007625
Energy: 0.8217638054036437
Energy: 0.7984489124753812
Energy: 0.7542376739943267
Energy: 0.808790607640277
Energy: 0.6988282723918079
Energy: 0.811274804934691
Energy: 0.8268335238800307
Energy: 0.6988149193017377
Energy: 0.9057882031236051
Energy: 0.6991728932841383
Energy: 0.6966628762045355
Energy: 0.8255758138256309
Energy: 0.8560924137558359
Energy: 0.696926185833612
Energy: 0.882204987773534
Energy: 0.7134814651481614
Energy: 1.034102647582204
Energy: 0.870651343272519
Energy: 0.8539725731006946
Energy: 0.8393297986442654
Energy: 0.8521909818105503
Energy: 0.8144806789007936
Energy: 0.7508139940722184
Energy: 0.7791430531978518
Energy: 0.7759222571010921
Energy: 0.7511140517021994
Energy: 0.7498319054952974
Energy: 0.7892728977032394
Energy: 0.797392800860313
Energy: 0.8664970414475152
Energy: 0.8536171255598125
Energy: 0.855348848943478
Energy: 0.71349738250567
Energy: 0.8504345467543702
Energy: 0.909584749041235
Energy: 0.829728492723133
Energy: 0.8312189813015444
Energy: 0.9086745105928294
Energy: 0.8300740062491097
Energy: 0.8673322661392119
Energy: 0.8740472016200822
Energy: 0.8318493281518479
Energy: 0.811856067553499
Energy: 0.8741108606097339
Energy: 0.8315719179294037
Energy: 0.82422480627713
Energy: 1.2107057031760022
Energy: 0.8821107840726783
Energy: 0.8847325142095304
Energy: 1.2119541079889016
Energy: 0.8812068007556466
Energy: 0.8277777702759405
Energy: 0.7786332640397146
Energy: 0.8115751244996363
Energy: 0.8114302894366876
Energy: 0.7815975626971713
Energy: 0.8758367094310144
Energy: 0.8121108514253949
Energy: 0.8960494413359756
Energy: 0.8546325918776602
Energy: 0.8526844780646765
Energy: 0.8974293913579081
Energy: 0.8155979333913418
Energy: 0.8524027554771225
Energy: 0.8856141374861864
Energy: 0.8545534491921001
Energy: 0.8533878634627147
Energy: 0.8412730555421114
Energy: 0.8555297515260744
Energy: 0.852839278569832
Energy: 0.7478298770562326
Energy: 0.8115499708869451
Energy: 0.8400714254900857
Energy: 0.7498350986726646
Energy: 0.9252262313412581
Energy: 0.8395965393186704
Energy: 1.1199940092873084
Energy: 0.9185426773574884
Energy: 0.9227323750852086
Energy: 1.120817147093302
Energy: 0.9182524155450993
Energy: 0.821690034757439
Energy: 0.7486724691211558
Energy: 0.8603824389822646
Energy: 0.8457573642047219
Energy: 0.7487761552199403
Energy: 0.8644908713841558
Energy: 0.8641716906127505
Energy: 0.7690719591828389
Energy: 0.8063814616836377
Energy: 0.8112209658557797
Energy: 0.7701387408780969
Energy: 0.8057761241045772
Energy: 0.809689380421781
Energy: 0.844732990822221
Energy: 0.8247525588624043
Energy: 0.8274064823632081
Energy: 0.8455487376720277
Energy: 0.69891603929156
Energy: 0.8252539880120613
Energy: 0.8062526578422587
Energy: 0.697021274931964
Energy: 0.7145898497580574
Energy: 0.8069119619604951
Energy: 0.6993187675743221
Energy: 0.7669831991482366
Energy: 0.9725796479573573
Energy: 0.7545430894548674
Energy: 0.8093811486351725
Energy: 0.9688649849816213
Energy: 0.7569514081964334
Energy: 0.808664740554062
Energy: 0.6985732963616479
Energy: 0.8124542983249207
Energy: 0.8270730443024825
Energy: 0.6984429617614942
Energy: 0.9034472288467081
Energy: 0.6986101165962002
Energy: 0.6965224492576357
Energy: 0.8177855515106583
Energy: 0.7136812016809716
Energy: 0.69647149403201
Energy: 0.8300115963110758
Energy: 0.7139489343225226
Energy: 0.8284366834548743
Energy: 0.8665052451376292
Energy: 0.8268518049323982
Energy: 0.77825720014985
Energy: 0.8530923104180732
Energy: 0.814827030989872
Energy: 0.8473658249566546
Energy: 0.7702621103077305
Energy: 0.7672358292209908
Energy: 0.8311603410441262
Energy: 0.7691295282702599
Energy: 0.7909382102431125
Energy: 0.8332578444546515
Energy: 0.7136054807274075
Energy: 0.8504135532997785
Energy: 0.8344586238322687
Energy: 0.7134263125021726
Energy: 0.850536651451527
Energy: 0.9077782207056516
Energy: 0.8353821158530923
Energy: 0.8298434100301598
Energy: 0.9074904768220711
Energy: 0.9245285799544006
Energy: 0.8274683117964932
Energy: 0.875112791584429
Energy: 0.8299159846100733
Energy: 0.8358803543425518
Energy: 0.8737460403743437
Energy: 0.8297466880687947
Energy: 0.8400395244532073
Energy: 1.212669158673021
Energy: 0.8821748889410395
Energy: 0.8969208972368783
Energy: 1.0365629532288683
Energy: 0.8814673236019465
Energy: 0.8281459382218844

minimum gb energy = 0.6959216638848564 eV
minimum distance =  2.36066505820151 Angstroms
sigma value = 41


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

Energy: 1.120925583733466
Energy: 1.10454751800121
Energy: 1.1080811539695306
Energy: 1.122972610279673
Energy: 1.33743932539527
Energy: 1.1113208314084282
Energy: 0.8906215050229622
Energy: 0.951268002796091
Energy: 0.9520634574211605
Energy: 0.9885495204016185
Energy: 0.9759548662528973
Energy: 0.9791519954464235
Energy: 0.9676678970683099
Energy: 0.9882375532822515
Energy: 0.9872824912432023
Energy: 0.9673676060843932
Energy: 0.9653341691134417
Energy: 0.9402096737356562
Energy: 0.9832476094204203
Energy: 0.9652792831526922
Energy: 0.9655067231730858
Energy: 0.9461593957534374
Energy: 0.9152162663891524
Energy: 0.8302936115995134
Energy: 0.8417960001777768
Energy: 0.9769793360401051
Energy: 0.9793495153948962
Energy: 0.8416637532769697
Energy: 1.0313762036989003
Energy: 0.9755438044544934
Energy: 1.040035646484761
Energy: 1.0256584498635757
Energy: 1.0257248380976711
Energy: 1.0410885225335342
Energy: 1.0172604836183092
Energy: 1.0277227147956816
Energy: 0.8413080260516633
Energy: 0.9409047203337914
Energy: 0.9794985324979564
Energy: 0.8405679823552448
Energy: 0.948688017834056
Energy: 0.8413871088531635
Energy: 0.8218676989852665
Energy: 0.9452559233508857
Energy: 0.8733448399221624
Energy: 0.8229864556607244
Energy: 0.9426584502166104
Energy: 0.8220371542424235
Energy: 0.9475104047379824
Energy: 0.8795916391888939
Energy: 0.9425227316468603
Energy: 0.9436915071413626
Energy: 0.8651765499502272
Energy: 0.9420587457478936
Energy: 0.9038428824948352
Energy: 0.8333042804340363
Energy: 0.8587762973811013
Energy: 0.9044309619227598
Energy: 0.829889345975816
Energy: 0.9174443133260892
Energy: 0.9354825071198681
Energy: 0.8571726331190733
Energy: 0.985651343530123
Energy: 0.9369103417635458
Energy: 0.7884389622339406
Energy: 0.8690542615188291
Energy: 1.019598830413239
Energy: 0.9467443248372546
Energy: 0.9513464330569925
Energy: 1.0207365794302148
Energy: 1.0426757537149671
Energy: 0.9085555176040878
Energy: 0.978091018926154
Energy: 0.9163122366701927
Energy: 0.9618121225461715
Energy: 0.9790309949744963
Energy: 0.9177789756891547
Energy: 0.9096872332942237
Energy: 1.125391468524472
Energy: 0.9893097027298668
Energy: 1.1004299491769451
Energy: 1.1253341419264404
Energy: 0.976538738566292
Energy: 1.096159237950796

minimum gb energy = 0.7884389622339406 eV
minimum distance =  2.32068502104967 Angstroms
sigma value = 11


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

Energy: 1.3849952961957435
Energy: 1.436934395331521
Energy: 1.3371266111675943
Energy: 1.3865161015725358
Energy: 1.4378939738377146
Energy: 1.1434635952854673
Energy: 1.0798523264681021
Energy: 0.9476684619993739
Energy: 0.9448075370908139
Energy: 1.1368095156551525
Energy: 0.9588785032028788
Energy: 0.9936232196800325
Energy: 1.1679153948822418
Energy: 1.1020046075683412
Energy: 1.1021973271907735
Energy: 1.169205606464332
Energy: 1.043620787363771
Energy: 1.103310383607918
Energy: 1.107938752332541
Energy: 1.0490554403837433
Energy: 1.0282203454394068
Energy: 1.0773529282309442
Energy: 0.9471588373924364
Energy: 1.057305372341169
Energy: 0.96558936738292
Energy: 0.9582311773192955
Energy: 0.9891606265501253
Energy: 0.9658134250372196
Energy: 0.9592065661926371
Energy: 0.9960742285632329
Energy: 1.079012241600378
Energy: 0.9618461390577814
Energy: 1.0187222046938393
Energy: 1.0605876142538175
Energy: 0.9361960979363647
Energy: 1.0164366395316657
Energy: 0.9480168648236855
Energy: 1.0129912454410346
Energy: 1.0186025101989236
Energy: 0.9482548549012879
Energy: 1.0351393914819695
Energy: 1.0189638270806414
Energy: 0.9575063675550548
Energy: 1.0191027902431764
Energy: 0.9889634717186819
Energy: 0.9577357177789136
Energy: 0.9661451472047756
Energy: 0.9811958369207552
Energy: 1.0418296478776652
Energy: 1.084651259655449
Energy: 1.0913722400638117
Energy: 0.9742680576912369
Energy: 1.0734930244107364
Energy: 1.1322458689147956
Energy: 0.9190364408092361
Energy: 1.094289938280544
Energy: 1.0914176138241867
Energy: 1.0271351977571561
Energy: 1.1396379976892987
Energy: 1.1320582987879628
Energy: 0.9847534660334727
Energy: 0.9894782360895701
Energy: 1.0232337097724646
Energy: 0.9817192721674924
Energy: 0.9605742436552662
Energy: 0.9468133802062376
Energy: 1.0955519715777269
Energy: 1.2885062106835592
Energy: 1.2315303938828153
Energy: 1.095828276677903
Energy: 1.0960311623265047
Energy: 1.2362654486879017
Energy: 0.937976367097751
Energy: 0.9994734898931253
Energy: 0.9813781797597643
Energy: 0.9381734269348456
Energy: 1.1202977546496373
Energy: 0.9933313349239576
Energy: 1.1828509491574941
Energy: 1.1063911406932012
Energy: 1.08618563359981
Energy: 1.0931055434499284
Energy: 1.09924334465647
Energy: 1.0930739456006384
Energy: 0.9258507115349409
Energy: 1.0458233329524071
Energy: 1.059849498800453
Energy: 0.9259495129129126
Energy: 1.0420007641807676
Energy: 1.058126557318613
Energy: 0.936914127757296
Energy: 1.0045200500475095
Energy: 1.0128386864170724
Energy: 0.9073873007509606
Energy: 0.9875517189463251
Energy: 0.9769213107917815
Energy: 0.9198433957221663
Energy: 1.0140082999375013
Energy: 1.023066831639678
Energy: 0.9200910936701019
Energy: 0.994359137968122
Energy: 1.017469538929593
Energy: 1.1195472209479218
Energy: 0.9997518131776488
Energy: 1.0379320199483333
Energy: 1.1213330444499578
Energy: 1.0015526790473774
Energy: 1.0099292596151659
Energy: 0.9594301249419457
Energy: 1.0046779149796707
Energy: 0.9968075141215106
Energy: 0.9589760314341474
Energy: 1.0346806573289786
Energy: 1.0118358028805439
Energy: 1.0712216038439009
Energy: 1.1305730437384585
Energy: 1.1305472279077455
Energy: 1.07229220983113
Energy: 1.0852429551025213
Energy: 1.0663489171602503
Energy: 1.019580629904775
Energy: 1.08984621327682
Energy: 1.015736751428175
Energy: 1.0107429985022975
Energy: 0.9254713329322366
Energy: 0.9930199709205826
Energy: 0.9561635916506935
Energy: 1.0078050067864623
Energy: 0.9909025650321029
Energy: 0.9237393016467238
Energy: 1.0208866658238143
Energy: 0.9929006808707529
Energy: 1.3157142432390048
Energy: 1.116628540284544
Energy: 1.2197578344101783
Energy: 1.0844312410699195
Energy: 1.112305757854318
Energy: 1.219761627906297
Energy: 1.026916276589143
Energy: 0.9539423509191484
Energy: 0.9965954404007512
Energy: 1.0361512618219622
Energy: 0.9341761591890535
Energy: 0.9869155533457631
Energy: 1.0120373076678628
Energy: 1.0497196214368099
Energy: 1.0321187093732396
Energy: 1.0131593214016466
Energy: 1.0647005533290492
Energy: 1.014266479359056
Energy: 1.0377767834221687
Energy: 1.009803789307892
Energy: 1.0172031778354798
Energy: 0.9917096594433612
Energy: 0.9118395267122273
Energy: 1.0108310199326627
Energy: 1.0663255063288948
Energy: 0.9111372340723493
Energy: 0.9326455592227647
Energy: 1.0351132797542841
Energy: 0.9079011406272663
Energy: 1.0089171547799876
Energy: 1.017351191061888
Energy: 0.9947955786353444
Energy: 1.0448246997783326
Energy: 0.98584992947691
Energy: 0.9288842214683248
Energy: 1.0492826047159727
Energy: 1.1020506207611485
Energy: 1.0724787374851388
Energy: 1.062761591602149
Energy: 1.101684522796642
Energy: 1.0951664424524306
Energy: 1.0651353635515934
Energy: 1.1241754292018493
Energy: 0.9264036285908263
Energy: 0.9928322970857064
Energy: 1.1374985185897426
Energy: 0.9260405339521098
Energy: 1.006222264131733
Energy: 1.3877387559353778
Energy: 1.1714012158179241
Energy: 1.3069183598511849
Energy: 1.2464215850747207
Energy: 1.1035991638598748
Energy: 1.3164055932579188

minimum gb energy = 0.9073873007509606 eV
minimum distance =  2.31273774067171 Angstroms
sigma value = 57


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

Energy: 1.2473273399881246
Energy: 1.0784654991215663
Energy: 1.0765203560372216
Energy: 1.2498611957621564
Energy: 1.4580861678991826
Energy: 1.0787283697856975
Energy: 0.8969198155556418
Energy: 1.0556745348991574
Energy: 1.0584207730131112
Energy: 1.0323651823709097
Energy: 1.1046723193114
Energy: 1.0342578784010865
Energy: 0.9996258154431127
Energy: 1.0097263373062106
Energy: 1.0114681900549853
Energy: 1.0001194838360583
Energy: 1.0885641663416716
Energy: 0.995424909689248
Energy: 1.0005120188534806
Energy: 1.0281202233456075
Energy: 0.979941296365141
Energy: 1.0011077535861932
Energy: 1.0091085298529905
Energy: 0.9799555007657158
Energy: 0.9221380239954025
Energy: 1.0528047509460878
Energy: 1.051734335838784
Energy: 0.9225391542596398
Energy: 1.0503732252407516
Energy: 1.053651279136188
Energy: 1.0945699237107334
Energy: 1.0472267790359466
Energy: 1.044185056377144
Energy: 1.01248987238322
Energy: 1.062944246414077
Energy: 1.0437109283021584
Energy: 0.9882501357565932
Energy: 0.9308894506182745
Energy: 1.0066251900987384
Energy: 0.9894477991162247
Energy: 0.9331761918072096
Energy: 1.0363829335709454
Energy: 1.0317584760553757
Energy: 0.9815769629768054
Energy: 1.0261893069725236
Energy: 1.0330436474722617
Energy: 0.9936845361165803
Energy: 1.022113973199455
Energy: 1.107134755220768
Energy: 0.9925537878690505
Energy: 1.0751975286962494
Energy: 1.0723834449153116
Energy: 0.9935030545496499
Energy: 1.0722428861007978
Energy: 1.1072231691711725
Energy: 0.9923813138178813
Energy: 1.0740372804785403
Energy: 1.0161461565186345
Energy: 1.0006946913357189
Energy: 1.0723404487358266
Energy: 1.0323327712111354
Energy: 1.0154713523942607
Energy: 1.026510612409691
Energy: 1.0333620278918594
Energy: 0.9958941846546874
Energy: 0.9689029712303298
Energy: 0.9945011219910138
Energy: 1.0940650751028091
Energy: 1.0407224359790588
Energy: 0.9956218554246797
Energy: 1.0903779823857902
Energy: 0.9925381650109845
Energy: 0.9932837653096211
Energy: 1.012910852723969
Energy: 1.0121380498104087
Energy: 0.9945364891590943
Energy: 1.106192404468709
Energy: 1.0112590632958687
Energy: 1.0934147391660305
Energy: 1.064954513322819
Energy: 1.0598477832420785
Energy: 1.0941321156131965
Energy: 1.0070502883497767
Energy: 1.0618230803212694
Energy: 1.0052711344894414
Energy: 1.0015736519514793
Energy: 1.052357541812734
Energy: 1.0057011896349497
Energy: 0.9319389349691313
Energy: 1.054579788160805
Energy: 0.9890771929813843
Energy: 0.931778844166976
Energy: 1.0059614531232606
Energy: 0.9893972819743316
Energy: 0.9930305368135278
Energy: 0.9894945191780286
Energy: 0.8967821903569708
Energy: 1.0339332079120314
Energy: 1.0331781787937664
Energy: 0.897215534067848
Energy: 0.9974438657528801
Energy: 1.0125516041736438

minimum gb energy = 0.8967821903569708 eV
minimum distance =  2.36229618708635 Angstroms
sigma value = 9


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

Energy: 1.476507122665667
Energy: 1.5286365907012427
Energy: 1.3099554562652818
Energy: 1.3485582024466212
Energy: 1.6827685625693796
Energy: 1.313518505945077
Energy: 1.0685646310725299
Energy: 1.0558758708390872
Energy: 1.0491827548656487
Energy: 1.1520965402917172
Energy: 1.068256089163852
Energy: 1.0086552974909062
Energy: 1.1164108116597824
Energy: 1.0525740567484496
Energy: 1.1793473660910125
Energy: 1.1169348422746892
Energy: 1.0876916077282348
Energy: 1.1887516850180582
Energy: 1.0394191899523433
Energy: 1.0328586797297334
Energy: 1.0316650054127268
Energy: 1.0415531284598243
Energy: 1.0368693673157032
Energy: 1.0399670726789565
Energy: 1.0270575347315054
Energy: 0.9914014172789604
Energy: 0.9939103858547859
Energy: 1.0284689619158387
Energy: 0.9918812695978144
Energy: 0.9975316353933081
Energy: 0.9876062394093421
Energy: 1.0099438296564482
Energy: 0.9902176839629737
Energy: 0.9888781805620641
Energy: 1.0477773717880874
Energy: 0.994575590721475
Energy: 1.1497578945751863
Energy: 1.079592772249477
Energy: 1.2927118033597504
Energy: 1.1508093204980858
Energy: 1.1346795148253384
Energy: 1.2923825949963088
Energy: 1.0632097745937026
Energy: 0.9915725075903936
Energy: 0.9912749265325067
Energy: 1.0511928664246641
Energy: 1.0340233248359691
Energy: 0.99167713238166
Energy: 1.1546881398053546
Energy: 1.027602031782172
Energy: 1.1121008809652293
Energy: 1.2019796321008307
Energy: 1.053002872792223
Energy: 1.1895000780713292
Energy: 1.151875342796226
Energy: 1.1127543901519157
Energy: 1.0026360757391866
Energy: 1.102905212346651
Energy: 1.011735256749942
Energy: 0.9942554224386106
Energy: 1.035134247440067
Energy: 1.0058910143462383
Energy: 1.0025713365142197
Energy: 1.012065016348624
Energy: 1.0145145274062397
Energy: 0.9804208684033455
Energy: 1.0108510806035749
Energy: 1.0071735375289945
Energy: 1.0045761987926811
Energy: 1.0100846305749263
Energy: 0.9931978284605218
Energy: 0.9991990104212246
Energy: 1.1378044104258298
Energy: 1.0479232022446885
Energy: 1.0395366902649308
Energy: 1.0667044305534892
Energy: 1.0466409172672935
Energy: 1.0662622220257723
Energy: 1.185024339528618
Energy: 1.0553774277971295
Energy: 1.0487877779671966
Energy: 1.179202024213783
Energy: 1.077549911814698
Energy: 1.0496124996839635
Energy: 1.0283328105198808
Energy: 1.008591189005942
Energy: 0.9924298524941054
Energy: 1.0365627881928527
Energy: 1.0103787258632986
Energy: 1.032442379904039
Energy: 1.1678781435873475
Energy: 1.2260969948373548
Energy: 1.2585721071884595
Energy: 1.168313248387023
Energy: 1.2034289639814966
Energy: 1.4010656312066156
Energy: 1.0361530608993361
Energy: 1.0220610523811466
Energy: 1.0318162271538094
Energy: 1.0366493666132095
Energy: 1.1464019506973746
Energy: 1.0310763116689934
Energy: 1.0685798516706073
Energy: 1.041690871755066
Energy: 1.041159836528447
Energy: 1.0699660047961428
Energy: 1.038002001070967
Energy: 1.0423977857287547
Energy: 1.0489801480296232
Energy: 1.0584957924106437
Energy: 1.0544258550027754
Energy: 1.0502194359201977
Energy: 1.0285311455232768
Energy: 1.083316532701117
Energy: 1.0747861460253787
Energy: 1.047123648896611
Energy: 1.0556703500520117
Energy: 1.0714096430648778
Energy: 1.0479398396920931
Energy: 1.0518026098255264
Energy: 1.0352125288176448
Energy: 1.0170355324480826
Energy: 1.020405714535707
Energy: 1.0394951310506608
Energy: 1.0154219254088865
Energy: 1.0080332273655555

minimum gb energy = 0.9804208684033455 eV
minimum distance =  2.33027371434652 Angstroms
sigma value = 27


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

Energy: 1.2847272891407664
Energy: 1.2138236321659732
Energy: 1.1319529739732994
Energy: 1.1970651516098907
Energy: 1.3433336241174567
Energy: 1.2080287543974673
Energy: 1.0737543889971328
Energy: 1.20407945982649
Energy: 1.1275840185732915
Energy: 1.1491160436574936
Energy: 1.2009107134775099
Energy: 1.1550481776889865
Energy: 1.568144460614906
Energy: 1.1174370731186323
Energy: 1.0635802920936344
Energy: 1.440469641779854
Energy: 0.9697504114629759
Energy: 1.5271791678661168
Energy: 1.2065931270382446
Energy: 1.0369404082876972
Energy: 1.0829715499724575
Energy: 1.1854409701389774
Energy: 1.1338760242510528
Energy: 1.0810248707517578
Energy: 0.9802922328576178
Energy: 1.1748224486108352
Energy: 1.1648169381562454
Energy: 0.9721971911930505
Energy: 1.1841497228320612
Energy: 1.1603474419644004
Energy: 1.179428409777816
Energy: 1.0245196835424388
Energy: 1.0247930999419543
Energy: 1.0195257239092952
Energy: 1.1161700440374882
Energy: 1.068301813921813
Energy: 1.1759193542553024
Energy: 1.0961258293787108
Energy: 1.0906604608754584
Energy: 1.1225428644553184
Energy: 1.14104241613942
Energy: 1.0912579347077676
Energy: 1.0929230836437498
Energy: 1.1300594489341003
Energy: 1.1010218160273446
Energy: 1.0675308443709708
Energy: 1.1453595483786014
Energy: 1.0910790046985241
Energy: 1.1508940148982771
Energy: 1.0559075072804114
Energy: 1.0478773282560527
Energy: 1.0266220178365328
Energy: 1.1656662062293888
Energy: 1.0639615015834465
Energy: 1.1473274552283659
Energy: 1.0355930602645846
Energy: 1.016385544090771
Energy: 1.0231100866114684
Energy: 1.0408954924827198
Energy: 1.0384536819846917
Energy: 1.2221841497998212
Energy: 1.2250409610392867
Energy: 1.2543372282443057
Energy: 1.100751435090189
Energy: 0.9705622501877037
Energy: 1.230625532280231
Energy: 1.0485604592307627
Energy: 0.9872962667621733
Energy: 0.987485987522749
Energy: 1.0492397738774755
Energy: 0.9919582797846316
Energy: 0.987350392800746
Energy: 1.0772762962753857
Energy: 1.0348311910739434
Energy: 1.0526567478221545
Energy: 1.0781628600752453
Energy: 1.048776595448098
Energy: 1.0403998113467312
Energy: 1.0749155227653557
Energy: 1.0627415129697633
Energy: 1.0853977814820415
Energy: 1.0845604321481952
Energy: 1.0697797618878933
Energy: 1.0864284333762035
Energy: 1.0304414791517296
Energy: 0.9898989059516665
Energy: 1.0011581760359256
Energy: 1.0313920997502886
Energy: 0.9916671589794254
Energy: 1.010850077394377
Energy: 1.4585371628671298
Energy: 1.0462398693662198
Energy: 1.0804103932450582
Energy: 1.4251630581602586
Energy: 1.0544380699169598
Energy: 1.0842355566978397
Energy: 0.9938178439185719
Energy: 1.0750628870044743
Energy: 1.077381835852879
Energy: 0.980325415385714
Energy: 1.102494316946903
Energy: 1.0789924447027055
Energy: 1.065057638430724
Energy: 1.0861375491768677
Energy: 1.0255602318333672
Energy: 1.0286570486709161
Energy: 1.0931770094919402
Energy: 1.0279055970641162
Energy: 1.172448757138668
Energy: 1.0972634249481261
Energy: 1.0978425785045716
Energy: 1.1612718929750543
Energy: 1.1517958234348067
Energy: 1.0979241323046975
Energy: 1.1284929493258806
Energy: 1.1004446319397525
Energy: 1.0983089972745863
Energy: 0.9883259690726665
Energy: 1.158341718421847
Energy: 1.097700803738747
Energy: 1.2235946250870393
Energy: 1.1088082142710771
Energy: 1.1261860492295275
Energy: 1.1110805739932188
Energy: 1.1112290504608138
Energy: 1.0902127155257761
Energy: 0.979640882052104
Energy: 1.4325557494384211
Energy: 1.5802796533011692
Energy: 0.9668554886800685
Energy: 1.581574634196224
Energy: 1.0514450275429326
Energy: 1.2550310680907497
Energy: 1.148853820613909
Energy: 1.1100042601087854
Energy: 1.2131615744041309
Energy: 1.1185736896775456
Energy: 1.1733019974475545
Energy: 1.1860525953585723
Energy: 1.0695429088927388
Energy: 1.0486017415477062
Energy: 1.058986030415617
Energy: 1.052103463187963
Energy: 1.1228731119916466
Energy: 1.3164649211120707
Energy: 1.2075141505465812
Energy: 1.2280398891434812
Energy: 1.2178520187927153
Energy: 1.197806976013039
Energy: 1.134707527396072

minimum gb energy = 0.9668554886800685 eV
minimum distance =  2.32525095767068 Angstroms
sigma value = 19


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

Energy: 1.4164510507444867
Energy: 1.6245472251493502
Energy: 1.4463881943068104
Energy: 1.313247575066539
Energy: 1.0154907195382714
Energy: 1.4482956224876495
Energy: 1.0416145163772361
Energy: 1.0489387078253976
Energy: 1.0428675358912762
Energy: 1.1197190178325953
Energy: 1.0389652574909651
Energy: 0.9857477226060959
Energy: 1.0499350730520562
Energy: 1.0421551214485134
Energy: 1.026197511722347
Energy: 1.0480005116682003
Energy: 1.0468439947490706
Energy: 1.026241460694174
Energy: 1.0176793796474497
Energy: 0.9850531684740997
Energy: 0.9862585125067037
Energy: 1.0179128404841908
Energy: 0.9913911434421765
Energy: 0.9851527306826089
Energy: 0.9286674903255797
Energy: 1.0313487897934506
Energy: 1.021785829474963
Energy: 0.9298871339034698
Energy: 1.0283600522561522
Energy: 1.0218726242127234
Energy: 1.0360803431372512
Energy: 1.000581916348368
Energy: 0.987015623750479
Energy: 1.0364566410345886
Energy: 1.119524608211842
Energy: 0.9868725521362158
Energy: 0.9625112526310707
Energy: 1.3859518524742334
Energy: 1.1957696023956261
Energy: 1.0046919718342966
Energy: 1.3858228891291522
Energy: 1.3490306493801854
Energy: 1.0870380684520164
Energy: 0.9767392723635345
Energy: 0.9856957297307305
Energy: 1.0874872338024255
Energy: 1.0298202965663503
Energy: 1.0753277038489142
Energy: 0.9177647647580749
Energy: 0.971814336912805
Energy: 0.9402733470903496
Energy: 0.9179511761763252
Energy: 0.984375466472267
Energy: 0.9567857349519521
Energy: 0.939714419962701
Energy: 0.9685543072234929
Energy: 0.9637840685209398
Energy: 0.9688849710304202
Energy: 1.0266083058343678
Energy: 0.9637449321459489
Energy: 1.1766814729071489
Energy: 1.1113767478937626
Energy: 1.0971485048380767
Energy: 1.1781057734265867
Energy: 1.1204252635208716
Energy: 1.0944210220982413
Energy: 1.0338908334572159
Energy: 0.9763290988687173
Energy: 0.9828668823116158
Energy: 1.0338869437415497
Energy: 1.0007642803106114
Energy: 0.9779284143818919
Energy: 1.286858324092259
Energy: 1.0009608750224173
Energy: 1.0356474528671757
Energy: 1.2103509992918577
Energy: 1.0016664660060353
Energy: 1.0356394719726423
Energy: 0.9966188284082238
Energy: 0.9766139934590595
Energy: 0.9760163951609443
Energy: 1.0044650513176174
Energy: 0.99011001094449
Energy: 0.9840463066360415
Energy: 0.9585919954859725
Energy: 0.9407481967787434
Energy: 0.9463808976040889
Energy: 0.9584016682986413
Energy: 0.9023576070228585
Energy: 0.9444985758278535
Energy: 0.9805562616806482
Energy: 0.9522335558987524
Energy: 0.9494263467000236
Energy: 1.0332231187620358
Energy: 0.9309369640645625
Energy: 0.949865714391085
Energy: 1.1576254402138073
Energy: 1.0591510001665232
Energy: 0.9553414268980722
Energy: 1.158498358921267
Energy: 1.0530806018811367
Energy: 0.9543082264230518
Energy: 0.9712023264011068
Energy: 0.9857039409997378
Energy: 0.9745902477060535
Energy: 0.9718232708826583
Energy: 1.0247514032385865
Energy: 0.9757867973400577
Energy: 1.0067487952406462
Energy: 1.0673120404011516
Energy: 0.9612689802648361
Energy: 1.0081900696051282
Energy: 1.0641770603972174
Energy: 0.9750384904948862
Energy: 0.9885757841614476
Energy: 0.9783584038748249
Energy: 0.9838170880358333
Energy: 0.9896045061636237
Energy: 0.9573513419298064
Energy: 0.9755679061732861
Energy: 0.9016121657875866
Energy: 0.9569010753684488
Energy: 0.9409309006936638
Energy: 0.9018776733784436
Energy: 0.9588961684890882
Energy: 0.9389928051414764
Energy: 0.9396195079345059
Energy: 0.9605165593226479
Energy: 0.9592432629761207
Energy: 0.9393717540591674
Energy: 1.0089496655955392
Energy: 0.9588047464287699
Energy: 1.1318266914232853
Energy: 0.9618316823432678
Energy: 0.9541055462377092
Energy: 1.1323313565051356
Energy: 0.9633070366400474
Energy: 0.9716208371571923
Energy: 1.010043454530181
Energy: 1.00475005617914
Energy: 0.987365923287683
Energy: 1.0038510105816012
Energy: 0.9299229968663149
Energy: 0.988167808719949
Energy: 0.9778313539278715
Energy: 1.0024757836837515
Energy: 0.9784740834618952
Energy: 0.962972896623454
Energy: 1.0239084240482952
Energy: 0.9727489055525325
Energy: 1.0436894684563267
Energy: 0.996541052299955
Energy: 1.0333575407064857
Energy: 1.026788114005936
Energy: 1.1918660079267518
Energy: 1.033481387974718
Energy: 0.9922864719738057
Energy: 0.9458897400287947
Energy: 0.9460759500190692
Energy: 0.9913687914283688
Energy: 0.9388589834863952
Energy: 0.9475318843085311
Energy: 0.9905744622297521
Energy: 0.9592268329272181
Energy: 0.9735332532500856
Energy: 0.9710680390623317
Energy: 0.9518680317902966
Energy: 0.9721105732734224
Energy: 1.1690132633631607
Energy: 1.0727333840307955
Energy: 1.0884192906846486
Energy: 1.0535027990939914
Energy: 1.104749663058486
Energy: 0.9649218359832008

minimum gb energy = 0.9016121657875866 eV
minimum distance =  2.33812911857587 Angstroms
sigma value = 101


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

Energy: 1.29180688972284
Energy: 1.478951568118432
Energy: 1.4996661401873004
Energy: 1.2931066176259174
Energy: 1.6729350372768605
Energy: 1.1982405178930582
Energy: 1.0271771962520335
Energy: 0.9767932334270436
Energy: 0.9742955440428007
Energy: 1.136971267780893
Energy: 0.9817319615460522
Energy: 0.9387860160056211
Energy: 1.0388368453443055
Energy: 1.0720136055650182
Energy: 1.0575318221394907
Energy: 1.0398388001994343
Energy: 1.0728939258037138
Energy: 1.0559843137303864
Energy: 0.9800158057549028
Energy: 0.9436091652519102
Energy: 0.9407938700183271
Energy: 0.9810736132931541
Energy: 0.9666474815286624
Energy: 0.9399941107850018
Energy: 0.8840273904438332
Energy: 1.0195652004471503
Energy: 1.0511331106649096
Energy: 0.8857124791812064
Energy: 1.0407462628313406
Energy: 0.918130372331647
Energy: 1.032703616553288
Energy: 0.9397724615992669
Energy: 0.9390580429836145
Energy: 1.033342048963134
Energy: 1.0874099416243654
Energy: 0.9422587928510908
Energy: 0.955202429523257
Energy: 1.3624353694144034
Energy: 1.337123183229582
Energy: 0.9554956689480015
Energy: 1.3647970081295933
Energy: 1.3361093427360662
Energy: 1.1117513030877912
Energy: 0.942552940223573
Energy: 0.9412569360925459
Energy: 1.1125650191007626
Energy: 0.9626278809325552
Energy: 0.9792023996211381
Energy: 0.8728352106398292
Energy: 0.9392270197329226
Energy: 0.9160648140186504
Energy: 0.87401645746098
Energy: 0.9739050713279735
Energy: 0.914843374451335
Energy: 0.9177823921723084
Energy: 0.9372309798988983
Energy: 0.9363657833514558
Energy: 0.9505210506457898
Energy: 0.9944460657579834
Energy: 0.9360796502224895
Energy: 1.3239124308210484
Energy: 1.2215483635773703
Energy: 1.1843371294698417
Energy: 1.3242089604764944
Energy: 1.224830694504808
Energy: 1.1820118857349566
Energy: 0.9897507534030875
Energy: 0.944966413581431
Energy: 0.941676118440912
Energy: 0.9899165131523457
Energy: 0.9514098694121607
Energy: 0.9408587141002877
Energy: 1.083721505881813
Energy: 1.0217733220852327
Energy: 1.058737611520506
Energy: 1.084094874670216
Energy: 1.0358830385656244
Energy: 1.0592993585068007
Energy: 0.8945462310120765
Energy: 0.9284222665486496
Energy: 0.9282442360788706
Energy: 0.9197679515605278
Energy: 0.9706214465237211
Energy: 0.9419415826052044
Energy: 0.9738345634256015
Energy: 0.8885329850923807
Energy: 0.9129178969496144
Energy: 0.9749212859933302
Energy: 0.8874552790522436
Energy: 0.9140885803902792
Energy: 0.9719007360492066
Energy: 0.9326870206335206
Energy: 0.9354719328890847
Energy: 0.971948153427703
Energy: 0.8716072891504495
Energy: 0.9355038109678451
Energy: 1.2903130587156837
Energy: 1.3825576980285414
Energy: 1.495466563459314
Energy: 1.283956251197489
Energy: 1.5088611669259742
Energy: 1.1897050921716568
Energy: 0.9773918468244609
Energy: 0.9898806371679428
Energy: 0.9765216874541628
Energy: 0.9782578236782675
Energy: 1.008293299531044
Energy: 0.9414250697670468
Energy: 1.0363933248681405
Energy: 1.0969340671506096
Energy: 1.0858976480464155
Energy: 1.0414328644435198
Energy: 1.0982208358349135
Energy: 1.0688800448786702
Energy: 1.1110110402222992
Energy: 0.9340181012252922
Energy: 0.9301557107401488
Energy: 1.0997630828501124
Energy: 1.096937020720507
Energy: 0.947872566326649
Energy: 0.8873342532249997
Energy: 1.0745672251338176
Energy: 1.0649093654488617
Energy: 0.8889569559307542
Energy: 1.0927714857518003
Energy: 0.91949929673056
Energy: 0.9747861278005168
Energy: 0.9418227963415802
Energy: 0.9403274823833183
Energy: 0.942169298536614
Energy: 1.0251760825312546
Energy: 0.9432227445666318
Energy: 0.9551861141452203
Energy: 1.3610727492455164
Energy: 1.3405570943371912
Energy: 0.9555504391289058
Energy: 1.3656038605813916
Energy: 1.3375594600986698
Energy: 1.128947184794543
Energy: 0.9670654996718087
Energy: 0.9414545923867713
Energy: 1.1297190334010156
Energy: 0.9392253645240949
Energy: 0.9769156408939739
Energy: 0.870403855389388
Energy: 0.9378770753599158
Energy: 0.9304584784701079
Energy: 0.8707715465356408
Energy: 0.9743611846759086
Energy: 0.9293855937820648
Energy: 0.9189625323665848
Energy: 0.9449557572985384
Energy: 0.9332357063311528
Energy: 0.8733045126229704
Energy: 1.0230842531140967
Energy: 0.9324799544057034
Energy: 1.07261326381015
Energy: 1.219481521995555
Energy: 1.1887356185957043
Energy: 1.0745045835679965
Energy: 1.2272126934910261
Energy: 1.1856811627409447
Energy: 1.0260511499224663
Energy: 0.9056819776974357
Energy: 0.9364097746673641
Energy: 1.0166747715007296
Energy: 0.8890044921435424
Energy: 0.9420432165478136
Energy: 0.894794544244964
Energy: 0.9767186043755988
Energy: 0.9292717552750307
Energy: 0.8951623230962397
Energy: 0.9761293112376808
Energy: 0.9288609422840287
Energy: 1.08324541529152
Energy: 0.9705801641602256
Energy: 0.9306919161894059
Energy: 1.0838213116703652
Energy: 0.9706674638411317
Energy: 0.9281971185383912
Energy: 0.979846901114193
Energy: 0.9036792603936719
Energy: 0.9406013209603103
Energy: 0.9808271329646786
Energy: 0.886834101520937
Energy: 0.9408047572771177
Energy: 0.9732852702601957
Energy: 0.913790941177049
Energy: 0.9293617764850516
Energy: 0.9458965515549462
Energy: 0.8716771586677454
Energy: 0.9349012904146183
Energy: 1.2811391713745244
Energy: 0.9848731480976386
Energy: 0.9109730276759211
Energy: 1.2549877488852916
Energy: 0.9839355290283166
Energy: 0.9105815958705339

minimum gb energy = 0.870403855389388 eV
minimum distance =  2.33922444377476 Angstroms
sigma value = 33


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

Energy: 0.015463000208596913
Energy: 0.016172936147666576
Energy: 0.01607030511639883
Energy: 0.017167518323023923
Energy: 0.7213035810111783
Energy: 0.01596969448719201
Energy: 0.01621276385026743
Energy: 0.11151452225394984
Energy: 0.11005208483600405
Energy: 0.11139829744288546
Energy: 0.11192646468818755
Energy: 0.10987156294540351
Energy: 1.1095340052080451
Energy: 0.7216416559640746
Energy: 0.7201359920635282
Energy: 0.7224777681900066
Energy: 0.7225910918588908
Energy: 0.7202953068641789
Energy: 0.4948324526281048
Energy: 0.1115145222543691
Energy: 0.1100520848355848
Energy: 0.1113982974433047
Energy: 0.11192646468818755
Energy: 0.10987156294540351

minimum gb energy = 0.015463000208596913 eV
minimum distance =  2.52121301542233 Angstroms
sigma value = 1