Model name: model_name=EAM_Dynamo_ZhouFosterSills_2018_FeNiCr__MO_036303866285_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.523954182863236
cohesive_energy=4.432448362714347
mass=58.6934
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=[2.6741930198093997e-19, 3.52137595856958e-19, 4.15928258539668e-19, 4.69761393442068e-19, 5.137347333388319e-19, 5.4812545478764195e-19, 5.74702360792434e-19, 5.954361286130279e-19, 6.119401501198619e-19, 6.25470531793992e-19, 6.369901817924519e-19, 6.4719604695103195e-19, 6.56536736727252e-19, 6.65228544966702e-19, 6.733227413216699e-19, 6.8077286266977e-19, 6.874907892961319e-19, 6.93399616722324e-19, 6.984560861792279e-19, 7.026489824304059e-19, 7.059382510600079e-19, 7.0827422459238e-19, 7.096520964976199e-19, 7.101007059551399e-19, 7.096248594948419e-19, 7.081140069289799e-19, 7.0544638283337e-19, 7.01503426137096e-19, 6.961617692393401e-19, 6.89286829302846e-19, 6.80718388664214e-19, 6.702433578311219e-19, 6.57566936302914e-19, 6.422773646846519e-19, 6.238170855077039e-19, 6.014699258166719e-19, 5.74361097169392e-19, 5.41486034816346e-19, 5.01748849939878e-19, 4.53909457825272e-19, 3.9635767095535795e-19, 3.26597298134364e-19, 2.40485110586766e-19, 1.315335746861712e-19, -9.3245077922166e-21, -1.9352531344422598e-19, -4.34644885978056e-19, -7.495318750945139e-19, -1.168321621102506e-18, -1.7617534267464e-18, -2.6560403585461797e-18, -4.0445026513369194e-18, -6.371840451651659e-18, -1.0693840095997379e-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: 0.017990628575270843
Energy: 0.018763524481328373
Energy: 0.018400872963025925
Energy: 0.018191223631545007
Energy: 0.5931001552630324
Energy: 0.01839459665173765
Energy: 0.018763524480374976
Energy: 0.15955272839558346
Energy: 0.16125900773914975
Energy: 0.15948494684331174
Energy: 0.15966018046444672
Energy: 0.16086489400779544
Energy: 0.018400872963319277
Energy: 0.16125900773914975
Energy: 0.16040296283481303
Energy: 0.018420558690544483
Energy: 0.15949330956736982
Energy: 0.1598804069516234
Energy: 0.018191223629931568
Energy: 0.15948494684268835
Energy: 0.01842055868992111
Energy: 0.01830063996940684
Energy: 0.15960267661644978
Energy: 0.018286705160932008
Energy: 0.5931001552633623
Energy: 0.15966018046543679
Energy: 0.15949330956736982
Energy: 0.1596026766167798
Energy: 0.15963365272877839
Energy: 0.15966107084191994
Energy: 0.018394596652067666
Energy: 0.16086489400779544
Energy: 0.1598804069516234
Energy: 0.018286705159978607
Energy: 0.15966107084158992
Energy: 0.018347411885755473

minimum gb energy = 0.017990628575270843 eV
minimum distance =  2.48966903279034 Angstroms
sigma value = 1


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

Energy: 1.5118533646640513
Energy: 1.0731790462351285
Energy: 1.1096989474460923
Energy: 1.1357401777596217
Energy: 1.0853528745510004
Energy: 1.1096523845541026
Energy: 1.4663235173761853
Energy: 1.0389708223406544
Energy: 1.048311772500449
Energy: 1.1106492020926226
Energy: 1.0374988273555201
Energy: 1.0911059511766132
Energy: 1.2595298806249526
Energy: 1.0475360064630113
Energy: 1.0479288708573546
Energy: 1.0923827356821791
Energy: 1.0467878619630062
Energy: 1.0473984236274183
Energy: 1.1509971835415382
Energy: 1.0481772972279284
Energy: 1.047073947362581
Energy: 1.04720689039146
Energy: 1.047398263377471
Energy: 1.0470628542579374
Energy: 1.386494317998402
Energy: 1.0921120012319294
Energy: 1.0926217500913915
Energy: 1.109779570351445
Energy: 1.092890517047747
Energy: 1.091448952709175
Energy: 1.4206022958120508
Energy: 1.0916686873550245
Energy: 1.0925441816624526
Energy: 1.0892037702030726
Energy: 1.092012511020268
Energy: 1.0917772521312408
Energy: 1.4210060417231327
Energy: 1.0913571887803382
Energy: 1.0914762174934132
Energy: 1.089662343679213
Energy: 1.0910573078926342
Energy: 1.0916420523197865
Energy: 1.3873539027728599
Energy: 1.110469576802801
Energy: 1.1105311396748365
Energy: 1.0907765478414624
Energy: 1.1104483562352239
Energy: 1.0919727807422959
Energy: 1.1447769945685429
Energy: 1.0914263615454782
Energy: 1.0901586638418357
Energy: 1.0914132837036687
Energy: 1.0907808301175488
Energy: 1.0913691018529836
Energy: 1.1443338366918825
Energy: 1.1111012311280108
Energy: 1.1138906435593774
Energy: 1.0927901664245896
Energy: 1.1094338699590152
Energy: 1.0926673427552849
Energy: 1.183778357647012
Energy: 1.0617013697065887
Energy: 1.061707741822228
Energy: 1.0893016096906445
Energy: 1.0620882987598628
Energy: 1.0278729264957323
Energy: 1.09905614482009
Energy: 1.0479744965871798
Energy: 1.0476601218584403
Energy: 1.0522410925899326
Energy: 1.1111554395772454
Energy: 1.0473686091555057
Energy: 1.09087404621947
Energy: 1.0909989354556597
Energy: 1.0914327482486954
Energy: 1.03513998243767
Energy: 1.1098301220652718
Energy: 1.0845960773288061
Energy: 1.1693096299646923
Energy: 1.0468762231332585
Energy: 1.0468068488330413
Energy: 1.0352870238833565
Energy: 1.0471065610951023
Energy: 1.034998814503684
Energy: 1.0956105912884082
Energy: 1.1093288480601098
Energy: 1.1089871506806144
Energy: 1.0472359345510682
Energy: 1.110455817886744
Energy: 1.0515466917035525
Energy: 1.0960036345921773
Energy: 1.048049803907505
Energy: 1.0479563132217633
Energy: 1.0494527941940983
Energy: 1.0480283095708054
Energy: 1.0478666217149442
Energy: 1.255041986891543
Energy: 1.0895035356032838
Energy: 1.0896186897358826
Energy: 1.0475978746272954
Energy: 1.0889614056607464
Energy: 1.0481229395096556
Energy: 1.2606864522721761
Energy: 1.112552798607162
Energy: 1.1160369014021525
Energy: 1.1139416717342732
Energy: 1.1126517562014444
Energy: 1.1166885915363194
Energy: 1.2650304558170247
Energy: 1.1164113877961996
Energy: 1.1165525905313856
Energy: 1.1117399566544965
Energy: 1.111764291883078
Energy: 1.1161251818019053
Energy: 1.3884796418310599
Energy: 1.1115774782605758
Energy: 1.1170344920988948
Energy: 1.1133142409299819
Energy: 1.1135617480259974
Energy: 1.1159589394197367
Energy: 1.5129876365818735
Energy: 1.0497378733710367
Energy: 1.0623974264512943
Energy: 1.0626941364963356
Energy: 1.0495068195492727
Energy: 1.0625244979213357
Energy: 1.4672948407813262
Energy: 1.0485446119263644
Energy: 1.0497352763594583
Energy: 1.0632630445631157
Energy: 1.0568917694067033
Energy: 1.0480076105983895
Energy: 1.4666898387404754
Energy: 1.0490398864156454
Energy: 1.049549400098372
Energy: 1.110024166058968
Energy: 1.0482108527533427
Energy: 1.1035555082401791

minimum gb energy = 1.0278729264957323 eV
minimum distance =  2.24876630119884 Angstroms
sigma value = 33


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

Energy: 1.8690834820230884
Energy: 1.1421424246621394
Energy: 1.095382318203663
Energy: 1.0969689141064736
Energy: 1.1385294522351024
Energy: 1.140547655048099
Energy: 1.2143947984430783
Energy: 1.08146012061183
Energy: 1.0813622275169665
Energy: 1.149424722797885
Energy: 1.081690507429276
Energy: 1.1033845637199169
Energy: 1.4108200599063143
Energy: 1.0940794845096358
Energy: 1.092791430117688
Energy: 1.1518391177646465
Energy: 1.0924301405017374
Energy: 1.1330438559352654
Energy: 1.5282324986651246
Energy: 1.143896382629083
Energy: 1.080709945181768
Energy: 1.094742528444277
Energy: 1.0858951237233672
Energy: 1.0952555042758592
Energy: 1.4114347746760008
Energy: 1.170441292264233
Energy: 1.1108545357599535
Energy: 1.1349546248343834
Energy: 1.1108722061849308
Energy: 1.1687976982475674
Energy: 1.4121458511469012
Energy: 1.1120322749658804
Energy: 1.1049335925827222
Energy: 1.1749795013376918
Energy: 1.1707792298064685
Energy: 1.1184354424007645
Energy: 1.5153662285718137
Energy: 1.1577768190493976
Energy: 1.1729166211024051
Energy: 1.1776191314132956
Energy: 1.153445972535443
Energy: 1.1728878549437256
Energy: 1.333330880340059
Energy: 1.148644506572306
Energy: 1.1492212423725603
Energy: 1.1500184443131742
Energy: 1.148589300216271
Energy: 1.1496955885088245
Energy: 1.2539236724420033
Energy: 1.1489754816878943
Energy: 1.1861508298395738
Energy: 1.2146238362590807
Energy: 1.1490174018414492
Energy: 1.1968398554752568
Energy: 1.2522805396691337
Energy: 1.1690446760074538
Energy: 1.1708515388852119
Energy: 1.19167943636311
Energy: 1.1854781963918204
Energy: 1.1832292155463973
Energy: 1.3274950689993543
Energy: 1.0048109560514074
Energy: 1.0050576074719755
Energy: 1.1219228230392744
Energy: 1.005158749038882
Energy: 1.005193787530955
Energy: 1.1813109368676697
Energy: 1.065957794465914
Energy: 1.112093611485997
Energy: 1.141201768567843
Energy: 1.0694240274176723
Energy: 1.131944543609507
Energy: 1.1806590140516682
Energy: 1.1806124695055609
Energy: 1.1821067218865007
Energy: 1.1410983322190904
Energy: 1.193850861884359
Energy: 1.1169194142605003
Energy: 1.264457552041781
Energy: 1.0949333648925976
Energy: 1.0950773349151322
Energy: 1.135336499933762
Energy: 1.0946936391661128
Energy: 1.0957111502208414
Energy: 1.23551241141196
Energy: 1.203517498966811
Energy: 1.1435045044758936
Energy: 1.1452865275158348
Energy: 1.2103618621445822
Energy: 1.1431302017634775
Energy: 1.2402692541499565
Energy: 1.1719784988042075
Energy: 1.1722312193383482
Energy: 1.1439113997864085
Energy: 1.1765812613967248
Energy: 1.1759099103180248
Energy: 1.293839068925967
Energy: 1.1766301558625891
Energy: 1.1766425292541458
Energy: 1.1757163754560813
Energy: 1.1770170192854599
Energy: 1.176954022407213
Energy: 1.3239509120283754
Energy: 1.197028780279238
Energy: 1.1966031196593383
Energy: 1.148632290438961
Energy: 1.1990592635122703
Energy: 1.1497174061305755
Energy: 1.325100761391124
Energy: 1.1843476602031235
Energy: 1.1863863115351478
Energy: 1.1487088808489547
Energy: 1.1844744416245172
Energy: 1.1712121170329741
Energy: 1.292587021456891
Energy: 1.185653861114247
Energy: 1.1851386795258432
Energy: 1.212520221530319
Energy: 1.2043804758953316
Energy: 1.184708195465009
Energy: 1.2339782676520947
Energy: 1.160097474011525
Energy: 1.1058263825797499
Energy: 1.0883263710940476
Energy: 1.1562179873685143
Energy: 1.1053468013625163
Energy: 1.2340880498215094
Energy: 1.1414688832692366
Energy: 1.1305749833728813
Energy: 1.1270610204581157
Energy: 1.1447764252022847
Energy: 1.1652761498229178
Energy: 1.451400124819648
Energy: 1.1305843988241773
Energy: 1.1305108501755015
Energy: 1.2127338760900175
Energy: 1.1319132421054425
Energy: 1.1149415460348242
Energy: 1.5398429435004943
Energy: 1.1304317226013676
Energy: 1.1468562808512694
Energy: 1.095036252836019
Energy: 1.149754991511066
Energy: 1.155483804792027
Energy: 1.4523222983318709
Energy: 1.1723168981863998
Energy: 1.1715630167034363
Energy: 1.2169582083800905
Energy: 1.1722165185903053
Energy: 1.1733376185787134
Energy: 1.3874739839907435
Energy: 1.1714084802254492
Energy: 1.1742097706466335
Energy: 1.1698655823419937
Energy: 1.1712467438516576
Energy: 1.1769225920056652
Energy: 1.519764970300444
Energy: 1.161775773308609
Energy: 1.162709326261794
Energy: 1.1691521194987577
Energy: 1.1623654533000691
Energy: 1.1629230252660623
Energy: 1.3353181541411356
Energy: 1.1490395162106515
Energy: 1.1495223107901382
Energy: 1.2022760081658552
Energy: 1.1490230116429032
Energy: 1.1941578682958465
Energy: 1.2565214398704607
Energy: 1.1490614817196863
Energy: 1.1492508796310672
Energy: 1.1961926267185239
Energy: 1.1488304607901811
Energy: 1.1953636633227638
Energy: 1.2528458808839888
Energy: 1.1743423883237818
Energy: 1.1712202737837234
Energy: 1.1957603032287307
Energy: 1.1892053373702227
Energy: 1.1857166345652077
Energy: 1.266025251132659
Energy: 1.0049823835637486
Energy: 1.0050610122573205
Energy: 1.1069180601283295
Energy: 1.0053245558007604
Energy: 1.0053187164042063
Energy: 1.179802257056991
Energy: 1.0059222772163188
Energy: 1.0054011179462716
Energy: 1.113509665838855
Energy: 1.0064027725583455
Energy: 1.102658107173357
Energy: 1.181170970215934
Energy: 1.1916719389362156
Energy: 1.110158679551921
Energy: 1.1372734938262075
Energy: 1.2046544488033044
Energy: 1.1249863551672294
Energy: 1.180496674531609
Energy: 1.0947356750527413
Energy: 1.0950304924893086
Energy: 1.1373446723408416
Energy: 1.094812522826387
Energy: 1.1550572782898227
Energy: 1.2320924227572319
Energy: 1.211969210989154
Energy: 1.1983079136444688
Energy: 1.1329658257309438
Energy: 1.1888175883557717
Energy: 1.1440070149131356
Energy: 1.2361875688595252
Energy: 1.11537037949549
Energy: 1.086784660407881
Energy: 1.146122051395662
Energy: 1.12007903158612
Energy: 1.168018637720256
Energy: 1.2331429323810044
Energy: 1.0768788517235621
Energy: 1.1153686398468006
Energy: 1.1262811467952378
Energy: 1.1158071648150172
Energy: 1.0785230299978696
Energy: 1.3170108171145345
Energy: 1.141818028207984
Energy: 1.134266342147879
Energy: 1.1488950669178746
Energy: 1.1418546071901936
Energy: 1.1303441846091666
Energy: 1.32643125518001
Energy: 1.1378732313170663
Energy: 1.1347698623395717
Energy: 1.1485060352859735
Energy: 1.1434359018348268
Energy: 1.149956175257824
Energy: 1.4111167665493194
Energy: 1.136197645255048
Energy: 1.1427244668998093
Energy: 1.1492228209647495
Energy: 1.1367498001100074
Energy: 1.1320662812172155
Energy: 1.214483083347014
Energy: 1.100066982910529
Energy: 1.0342249126096688
Energy: 1.0348826872517547
Energy: 1.0489861276407133
Energy: 1.082154532349457

minimum gb energy = 1.0048109560514074 eV
minimum distance =  2.23139841078535 Angstroms
sigma value = 51


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

Energy: 1.5776767520894057
Energy: 1.0916303202247186
Energy: 1.090650287923057
Energy: 1.115665931065268
Energy: 1.0698542643577291
Energy: 1.1164909790208206
Energy: 1.3143445218379994
Energy: 1.0708709406422283
Energy: 1.0705810152610227
Energy: 1.1171765535032818
Energy: 1.0888805691730477
Energy: 1.0702541189037762
Energy: 1.4494877689390662
Energy: 1.072130486757638
Energy: 1.0724123412792488
Energy: 1.0745704373535723
Energy: 1.0710854011808055
Energy: 1.0719266089678992
Energy: 1.4431474673908455
Energy: 1.0714531923665742
Energy: 1.0717244655070792
Energy: 1.0734755936423792
Energy: 1.0710167935856287
Energy: 1.0722387406318012
Energy: 1.2399805218238498
Energy: 1.137408324388522
Energy: 1.1363980925315917
Energy: 1.1178403510349373
Energy: 1.1289447825286512
Energy: 1.1325047876517926
Energy: 1.2405613357486152
Energy: 1.1178066079759827
Energy: 1.1178908935060372
Energy: 1.1175626276798543
Energy: 1.1173138587093607
Energy: 1.1247660522037166
Energy: 1.2399292678322222
Energy: 1.1174365028689341
Energy: 1.1319750134267057
Energy: 1.1173093139495938
Energy: 1.1175638515443016
Energy: 1.1308249661581238
Energy: 1.2860432459557232
Energy: 1.0409892879644136
Energy: 1.0408616973313691
Energy: 1.0934612799115835
Energy: 1.041149793953983
Energy: 1.040652795707561
Energy: 1.1114151950006426
Energy: 1.0406693361243635
Energy: 1.04051113544461
Energy: 1.0920319978499924
Energy: 1.0407787343651427
Energy: 1.0931710708277698
Energy: 1.1102194745495286
Energy: 1.0857370009031633
Energy: 1.0920810992292656
Energy: 1.0918655551198886
Energy: 1.154017668881376
Energy: 1.0916556288365564
Energy: 1.1096903331699852
Energy: 1.047370944764172
Energy: 1.0590877196175752
Energy: 1.1099306454496427
Energy: 1.0730508767935194
Energy: 1.059001725070855
Energy: 1.1279189885387526
Energy: 1.0833288108531014
Energy: 1.083475875907999
Energy: 1.0823404626387465
Energy: 1.1101315781597028
Energy: 1.083566234427572
Energy: 1.1274945368992069
Energy: 1.0764012279437525
Energy: 1.0763876135296186
Energy: 1.098495238370809
Energy: 1.0770213735872392
Energy: 1.082878702021703
Energy: 1.1288121575402175
Energy: 1.076858904641144
Energy: 1.077205548461384
Energy: 1.084626517612269
Energy: 1.0778134168297804
Energy: 1.0774350618478836
Energy: 1.3138565010775671
Energy: 1.0856329873358523
Energy: 1.0838733340610534
Energy: 1.1022941435992204
Energy: 1.0848463472475576
Energy: 1.0838810132688483
Energy: 1.3200756291292945
Energy: 1.084370506572856
Energy: 1.0840804889783497
Energy: 1.1027839864489979
Energy: 1.086498667701566
Energy: 1.1006624897567656
Energy: 1.3706287951577418
Energy: 1.1013048866150037
Energy: 1.0833924195547986
Energy: 1.1138452003374613
Energy: 1.1012004642421112
Energy: 1.0832932256218721
Energy: 1.564785181408138
Energy: 1.0708035459056835
Energy: 1.0733089488147516
Energy: 1.039219254508281
Energy: 1.0711328916023515
Energy: 1.1036357311462721

minimum gb energy = 1.039219254508281 eV
minimum distance =  2.20738164416869 Angstroms
sigma value = 19


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

Energy: 1.5522470501793375
Energy: 1.0541531404615725
Energy: 1.055095056777833
Energy: 1.0541921733515351
Energy: 1.0870013905501323
Energy: 1.0963840921522885
Energy: 1.3366267723629248
Energy: 1.1038501819947493
Energy: 1.1040094044305722
Energy: 1.0740771063324523
Energy: 1.103738648856333
Energy: 1.1045710326562477
Energy: 1.2764296756797169
Energy: 1.104173690655304
Energy: 1.104414110746857
Energy: 1.0987970434033487
Energy: 1.1037009721199924
Energy: 1.1044669733681163
Energy: 1.2322155021442993
Energy: 1.1039589226103173
Energy: 1.1037886368707608
Energy: 1.056993268687656
Energy: 1.1039665876134293
Energy: 1.1040166097498691
Energy: 1.2934194059450441
Energy: 1.0870835180291762
Energy: 1.088899309147494
Energy: 1.0711140178551157
Energy: 1.0895742536459732
Energy: 1.0916254316283882
Energy: 1.285596744694539
Energy: 1.0356406126915805
Energy: 1.0886938410653106
Energy: 1.1092953738107623
Energy: 1.055170047513706
Energy: 1.0918332455658448
Energy: 1.285833606002125
Energy: 1.1046877364313024
Energy: 1.0871496357203732
Energy: 1.1132368972704558
Energy: 1.08672119639403
Energy: 1.1218071241983696
Energy: 1.2384761167559328
Energy: 0.9619820184506748
Energy: 0.9626207093373232
Energy: 1.0600393909085417
Energy: 0.9623360289339363
Energy: 0.9693703130692983
Energy: 1.11607867042374
Energy: 0.9613761390057782
Energy: 0.9654931720706597
Energy: 1.0633723203137677
Energy: 0.9605910692269356
Energy: 0.9727716832473455
Energy: 1.116057731510068
Energy: 1.0995541723554012
Energy: 1.102428364583895
Energy: 1.1023490823904516
Energy: 1.118196553478303
Energy: 1.1019808712738448
Energy: 1.1150516048847643
Energy: 1.0604501376506512
Energy: 1.056547814906973
Energy: 1.1024981844354296
Energy: 1.0573437071683445
Energy: 1.0900741432143144
Energy: 1.1421534642099733
Energy: 1.1422588150966988
Energy: 1.0984538087310853
Energy: 1.0897564879392287
Energy: 1.1199795105351473
Energy: 1.0982104302565376
Energy: 1.0583399668457907
Energy: 1.1223164222135882
Energy: 1.134221830302374
Energy: 1.0548038856199389
Energy: 1.1169860236222575
Energy: 1.1329620743360664
Energy: 1.1421857151077779
Energy: 1.122384088209939
Energy: 1.1218601065086689
Energy: 1.1161417261703395
Energy: 1.1088881621887756
Energy: 1.127372781113691
Energy: 1.3539937726573024
Energy: 1.0696135550556363
Energy: 1.0699533502487055
Energy: 0.9603103180781294
Energy: 1.0701241632941274
Energy: 0.9684606678490868
Energy: 1.3505686528098035
Energy: 1.110243124310552
Energy: 0.970350695198924
Energy: 0.9617621674626577
Energy: 1.0868276179658949
Energy: 0.9628586124594765
Energy: 1.2878598291673677
Energy: 1.095329552182122
Energy: 1.109997157098012
Energy: 1.1161916815556179
Energy: 1.1112869062020854
Energy: 1.1103439422487376
Energy: 1.2343939973492717
Energy: 1.0976021182478026
Energy: 1.0959570526191076
Energy: 1.0575936481871062
Energy: 1.0971501836282955
Energy: 1.1217399789727218
Energy: 1.2293584164362603
Energy: 1.0561479735793424
Energy: 1.0749952830457663
Energy: 1.0578361782786134
Energy: 1.0972013392661473
Energy: 1.1096115068386911
Energy: 1.2972745588590737
Energy: 1.0552097752761433
Energy: 1.1071131671976984
Energy: 1.1092258919012392
Energy: 1.0564958645325084
Energy: 1.124731927394323
Energy: 1.2842873839381086
Energy: 1.088120695325172
Energy: 1.088374456486905
Energy: 1.1578280387182263
Energy: 1.0553370341514463
Energy: 1.0750484628850752
Energy: 1.2793790673582148
Energy: 1.1081081381011793
Energy: 1.1262984532065865
Energy: 1.1086204203059917
Energy: 1.09315406877722
Energy: 1.1255124511847596
Energy: 1.1480888493853636
Energy: 0.9722022408153208
Energy: 0.9628075564880544
Energy: 1.1736956708868145
Energy: 0.9826917138883153
Energy: 1.0370551655856586
Energy: 1.123455821609318
Energy: 1.074518503566151
Energy: 1.0598491102861134
Energy: 1.0698273395964153
Energy: 0.970198842756943
Energy: 1.0569418440228797
Energy: 1.1214283065617625
Energy: 1.0965979727602095
Energy: 1.0966118468377044
Energy: 1.106328197962412
Energy: 1.0860118126263758
Energy: 1.0967098810371798
Energy: 1.257222065375428
Energy: 1.058451668618764
Energy: 1.0635409397847606
Energy: 1.096620191585856
Energy: 1.0577906725796862
Energy: 1.1480647453627721
Energy: 1.277254501829557
Energy: 1.12049714674162
Energy: 1.1512785248399233
Energy: 1.1712569014096987
Energy: 1.100997662208272
Energy: 1.142564383716782
Energy: 1.0585499195395627
Energy: 1.1248590222520585
Energy: 1.129250757829996
Energy: 1.0563254507643072
Energy: 1.1236895066086356
Energy: 1.1335609685998682
Energy: 1.2562788130659082
Energy: 1.1240344117114742
Energy: 1.129442908255011
Energy: 1.1045652429151176
Energy: 1.1230908876034138
Energy: 1.130848002004107
Energy: 1.341281071419697
Energy: 1.1040360709711305
Energy: 1.0246342719227728
Energy: 1.0232389833030908
Energy: 1.1036037882613625
Energy: 1.0235014422054158

minimum gb energy = 0.9603103180781294 eV
minimum distance =  2.24189068747862 Angstroms
sigma value = 27


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

Energy: 1.1758066616234075
Energy: 1.0912405934917582
Energy: 1.0911623678080904
Energy: 1.080526955968275
Energy: 1.0397719563935743
Energy: 1.091309363000176
Energy: 1.1040994759655258
Energy: 1.0177611649225151
Energy: 1.0183100973362607
Energy: 1.00721489897577
Energy: 1.0178701207061893
Energy: 1.0071853716849561
Energy: 1.077165542419071
Energy: 1.0405930777726542
Energy: 1.018358521430573
Energy: 1.0074175197555217
Energy: 1.0434278396391494
Energy: 1.0093306459453628
Energy: 0.964638322262019
Energy: 1.018638466828304
Energy: 1.0187630327366055
Energy: 1.0082372528343966
Energy: 1.0185104584255638
Energy: 0.9660899868752417
Energy: 1.1945333006613583
Energy: 0.9140991871226042
Energy: 1.0065802253559868
Energy: 1.0177587070463814
Energy: 0.9149700610967395
Energy: 1.0072050478143124
Energy: 1.0398017967570383
Energy: 0.9154709955618286
Energy: 0.914581107695511
Energy: 1.0170454729926224
Energy: 0.9167626745713788
Energy: 0.9152848351316476
Energy: 1.0419165911162414
Energy: 1.006984765520977
Energy: 1.0089242966729501
Energy: 1.0417325768412748
Energy: 1.007062489710969
Energy: 1.0164361218667912
Energy: 1.0401884210436103
Energy: 1.005789869092698
Energy: 0.9576158265314916
Energy: 1.0158244812625
Energy: 1.0004310624095185
Energy: 0.9594616219266251
Energy: 1.0769071441148585
Energy: 1.0021657413481082
Energy: 1.0101664898169616
Energy: 1.0397282002840729
Energy: 0.9997906395562033
Energy: 1.0085443170141977
Energy: 0.9647950550392913
Energy: 0.9652884888628794
Energy: 0.9640306775021412
Energy: 0.989244640521031
Energy: 0.964668494621992
Energy: 0.9625235993278451
Energy: 1.0765192284443392
Energy: 0.9941716820795677
Energy: 0.9673477518882826
Energy: 0.9660054126129352
Energy: 1.03456003713296
Energy: 0.9645787871768738
Energy: 1.1040994729519176
Energy: 0.9654734596680806
Energy: 0.9633830909716943
Energy: 0.9644679329096767
Energy: 0.9645878507926996
Energy: 0.9631820901910482

minimum gb energy = 0.9140991871226042 eV
minimum distance =  2.27575987484597 Angstroms
sigma value = 9


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

Energy: 2.015414984247999
Energy: 0.986126912238009
Energy: 0.8650552522808737
Energy: 0.9197040339741709
Energy: 0.9769404366839504
Energy: 0.8588758004771921
Energy: 0.8761302465213222
Energy: 0.9002580954607995
Energy: 0.9026957874638537
Energy: 0.9229909677873166
Energy: 0.9006449587494497
Energy: 0.9140164928320785
Energy: 0.9371341600261107
Energy: 0.9043829826976943
Energy: 0.9017710920393375
Energy: 0.9188548601096134
Energy: 0.9191717834076042
Energy: 0.8945754850521425
Energy: 0.9370571847274999
Energy: 0.8854586619929768
Energy: 0.8866768297628426
Energy: 0.9192214604954418
Energy: 0.9270734422052266
Energy: 0.889750973059958
Energy: 0.9348099038112737
Energy: 0.9621265342366647
Energy: 0.9670322249270311
Energy: 0.9531518774804925
Energy: 0.9614801126877631
Energy: 0.9139400115086765
Energy: 0.9534522095464517
Energy: 0.8386962248888366
Energy: 0.9263769238424331
Energy: 0.9536648504480457
Energy: 0.9058910448535751
Energy: 0.9357015731944796
Energy: 0.9536060190532222
Energy: 0.9169055579189215
Energy: 0.9158317648520548
Energy: 0.9533742918530425
Energy: 0.9377776879639091
Energy: 0.9533621821151201
Energy: 0.9745712481486123
Energy: 0.8865607653407619
Energy: 0.9157079527423552
Energy: 0.9745910113941769
Energy: 0.9148420912147297
Energy: 0.9405966969915949
Energy: 1.0988381203811322
Energy: 0.9596469543183829
Energy: 0.998605435546505
Energy: 0.9857251325146248
Energy: 0.9602224739897625
Energy: 0.9960907280898758
Energy: 0.8752019810035147
Energy: 0.9431721993966641
Energy: 0.9466727433207194
Energy: 0.9070855492328899
Energy: 0.9852297869571621
Energy: 0.9288409217964464
Energy: 0.8752999746543308
Energy: 0.9533844575669858
Energy: 0.9529429093160416
Energy: 0.9046097556963206
Energy: 0.952939591008904
Energy: 0.9676193833673659
Energy: 1.0989147339036216
Energy: 0.9538142061391783
Energy: 0.9533143772899136
Energy: 0.9358849068099074
Energy: 0.953445830255952
Energy: 0.9949325002814479
Energy: 1.0817754929106873
Energy: 0.9527012452300114
Energy: 0.9064819859693427
Energy: 0.885053890866497
Energy: 0.9602799578425467
Energy: 0.9050072422402817
Energy: 1.0972289756182316
Energy: 0.9528332313312476
Energy: 0.9155851189055827
Energy: 0.9042891267696543
Energy: 0.9530402309171214
Energy: 0.9147506280778989
Energy: 0.919321895129167
Energy: 0.9272908430440805
Energy: 0.9211961898595868
Energy: 0.9002670759102946
Energy: 0.9360629860992872
Energy: 0.909835851328377
Energy: 0.9193093468279984
Energy: 0.8986465940127066
Energy: 0.8987323101966083
Energy: 0.9008199115426043
Energy: 0.9115540613071884
Energy: 0.901108307237658
Energy: 0.9178152479872878
Energy: 0.9329444024285014
Energy: 0.9139458244284964
Energy: 0.9012464981934601
Energy: 0.9326131762380802
Energy: 0.930733347012185
Energy: 0.9397659305739818
Energy: 0.9222298939276287
Energy: 0.9122062325304261
Energy: 0.8999789669164876
Energy: 0.9481523268333826
Energy: 0.9736367021569193
Energy: 0.9375870601726719
Energy: 0.8885384130748724
Energy: 0.8918712676394643
Energy: 0.902160397321686
Energy: 0.8876201619273034
Energy: 0.8779626661812413
Energy: 0.9370336904759717
Energy: 0.8864855903472523
Energy: 0.8789787916553403
Energy: 0.8868905161953482
Energy: 0.8867437038981534
Energy: 0.8758725691035221
Energy: 0.9354950891459886
Energy: 0.8821160187680389
Energy: 0.8798412781572293
Energy: 0.8821942835496506
Energy: 0.8891417798041046
Energy: 0.8806586480150227
Energy: 0.9809106675985593
Energy: 0.9012515593210626
Energy: 0.9553917043752893
Energy: 0.9607084893957122
Energy: 0.9029746287890904
Energy: 0.9212061094038749
Energy: 0.9779438732692203
Energy: 0.9007390228562434
Energy: 0.9066393966764549
Energy: 0.960208359392668
Energy: 0.903786478603164
Energy: 0.8962035710198465
Energy: 0.9357600372541116
Energy: 0.901984214780878
Energy: 0.9011594448224959
Energy: 0.9186814851844742
Energy: 0.9025010672447388
Energy: 0.8995656820326445
Energy: 1.089974373884964
Energy: 0.9022929084976826
Energy: 0.9027922566288785
Energy: 0.8865053812750966
Energy: 0.9051794819408385
Energy: 0.9035921595055787
Energy: 0.9359413617985762
Energy: 0.9155590221351911
Energy: 0.9530910422228318
Energy: 0.9531075616179026
Energy: 0.9347284042810913
Energy: 0.9160729426772655
Energy: 0.9547948411857508
Energy: 0.9430481150773777
Energy: 0.943994031018473
Energy: 0.9552428366896311
Energy: 0.8679776257621387
Energy: 0.8414398216038844
Energy: 0.9530342155605889
Energy: 0.913899454874733
Energy: 0.9144642356547663
Energy: 0.953231236584296
Energy: 0.9377287961592077
Energy: 0.9528730964285586
Energy: 0.9533000671607454
Energy: 0.9613532413782119
Energy: 0.9676592244983906
Energy: 0.9535466740121952
Energy: 0.9595929810554333
Energy: 0.9533192551394086
Energy: 0.9638986982635572
Energy: 0.8776476037393947
Energy: 0.9144188833713861
Energy: 0.9367188719659703
Energy: 0.9156152000972676
Energy: 0.9955309548975837
Energy: 0.8754977057697324
Energy: 0.9439578185883806
Energy: 0.996390840005906
Energy: 0.9518812363909932
Energy: 0.9599432264185263
Energy: 0.9267167402907432
Energy: 0.8858230959544205
Energy: 0.9762274655516178
Energy: 0.9750172449693004
Energy: 0.9056965831021442
Energy: 0.9755168930943582
Energy: 0.9732278415282716
Energy: 1.097019484182775
Energy: 0.9540104514938668
Energy: 0.9537277712661216
Energy: 0.9818466755571206
Energy: 0.9542771964951038
Energy: 0.9561474972926529
Energy: 0.9341674165338383
Energy: 0.9541170005653843
Energy: 0.952854313028951
Energy: 0.9469530980934173
Energy: 0.9536950889857311
Energy: 0.9477146515778943
Energy: 0.9279300980905157
Energy: 0.9535686122656177
Energy: 0.9486418725318282
Energy: 0.9644178591145628
Energy: 0.953540559244169
Energy: 0.9141279433382425
Energy: 1.0988213618503955
Energy: 0.9204209744404803
Energy: 0.8987942626122823
Energy: 0.9287782686032302
Energy: 0.9164560021452685
Energy: 0.8947210614787803
Energy: 0.918695220980169
Energy: 0.9318128381887506
Energy: 0.896902550187769
Energy: 0.9010647262533676
Energy: 0.9456637128143452
Energy: 0.9014325916514099
Energy: 0.9177959315780636
Energy: 0.9136244363641179
Energy: 0.9127423928387667
Energy: 0.9172971470485428
Energy: 0.9144831020537696
Energy: 0.903027147344368
Energy: 0.9307482744828016
Energy: 0.9115507954927927
Energy: 0.8880017024944625
Energy: 0.9307181556625046
Energy: 0.8828314776802976
Energy: 0.9586769524486253
Energy: 0.9354218922151631
Energy: 0.9131191477957256
Energy: 0.912220551080767
Energy: 0.9010681835045741
Energy: 0.9185820204138494
Energy: 0.902746095379256
Energy: 0.9349964293468106
Energy: 0.8799826156906825
Energy: 0.8881984031902428
Energy: 0.8858036502088338
Energy: 0.8899821045950594
Energy: 0.8886399269891285
Energy: 0.9361831641532484
Energy: 0.9057766936679702
Energy: 0.8790039215339965
Energy: 0.8883730940332417
Energy: 0.8886680253576198
Energy: 0.8747199013429792
Energy: 0.9779952040629559
Energy: 0.9005209887282841
Energy: 0.9069004192000567
Energy: 0.960530873657417
Energy: 0.9005995765707698
Energy: 0.8965773505365204

minimum gb energy = 0.8386962248888366 eV
minimum distance =  2.2656674054964 Angstroms
sigma value = 57


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

Energy: 1.0134962324334595
Energy: 0.8968503527908686
Energy: 0.500745156068825
Energy: 0.47156285355515304
Energy: 0.7283996475742942
Energy: 0.9186201772759931
Energy: 0.903705514853421
Energy: 0.7127169685948045
Energy: 0.7137109583851267
Energy: 0.7107178642638523
Energy: 0.7117247202339997
Energy: 0.7212517522923164
Energy: 0.8947029857668454
Energy: 0.724184319099064
Energy: 0.7216109703423201
Energy: 0.7208772112297395
Energy: 0.7182267168566618
Energy: 0.7477958202638373
Energy: 0.9641282402630266
Energy: 0.7244615738315087
Energy: 0.9116984952325607
Energy: 0.8902069442190471
Energy: 0.9213483562904179
Energy: 0.7462825875117902
Energy: 0.8968182815063619
Energy: 0.6453154401327887
Energy: 0.6133863301415589
Energy: 0.8969207492694358
Energy: 0.6519344826607456
Energy: 0.9115112561541701
Energy: 0.9137991465425532
Energy: 0.6526397375205003
Energy: 0.6461966286835288
Energy: 0.7205762662014566
Energy: 0.6508028050075441
Energy: 0.61309852267127
Energy: 0.9098242543491627
Energy: 0.9111937120487231
Energy: 0.7183274103086421
Energy: 0.8886810849547041
Energy: 0.9102177037053055
Energy: 0.9093964562794363
Energy: 0.9540567158653371
Energy: 0.9082671210713764
Energy: 0.9667952363474295
Energy: 0.7891716966468506
Energy: 0.8929559610205234
Energy: 1.2178142904738192
Energy: 0.9199881150452733
Energy: 0.9412779714018187
Energy: 0.9396407365599196
Energy: 0.9065700003198639
Energy: 0.9064261733109916
Energy: 0.9408116023789961
Energy: 0.8378804661360103
Energy: 0.9407156530723475
Energy: 0.47268689192147295
Energy: 0.47064897565505115
Energy: 0.9207118488457312
Energy: 0.7847148185585474
Energy: 0.8383734647384605
Energy: 0.9083912818652311
Energy: 0.9066692981749903
Energy: 0.4708596816814071
Energy: 0.9110573986490971
Energy: 0.7525007183083336
Energy: 0.9211115067618989
Energy: 0.9409730513403557
Energy: 0.9191759518298821
Energy: 0.9187041905960471
Energy: 0.9073978103084437
Energy: 0.9205810394735453
Energy: 0.9324038555099275
Energy: 1.020974799022742
Energy: 0.956487417428324
Energy: 0.8974432418500151
Energy: 0.9952760291494954
Energy: 0.9599197631822972
Energy: 0.9314081315537693
Energy: 0.9227284356594074
Energy: 0.711909495951063
Energy: 0.8844708077884315
Energy: 0.7894281499630137
Energy: 0.9087575361665746
Energy: 0.9319827500257095
Energy: 0.6522959519946409
Energy: 0.653703905493611
Energy: 0.9260414648508236
Energy: 0.6516149846379846
Energy: 0.6461876685012827
Energy: 0.8893669738543324
Energy: 0.9027633989780092
Energy: 0.9099784238361219
Energy: 0.888366479365704
Energy: 0.651622735315234
Energy: 0.7493256425965518
Energy: 0.9383614959477216
Energy: 0.9194540716506012
Energy: 0.9203917017186296
Energy: 0.8888158548541116
Energy: 0.7205642588139045
Energy: 0.7464215742300041
Energy: 0.8953591561384893
Energy: 0.7238088338304914
Energy: 0.7208591882458708
Energy: 0.7231760133174767
Energy: 0.7242926426826665
Energy: 0.9099100744921238
Energy: 0.9167017535372869
Energy: 0.7116920580002011
Energy: 0.7112830974816766
Energy: 0.47087047793308917
Energy: 0.7136585368290864
Energy: 0.7508932166888189

minimum gb energy = 0.47064897565505115 eV
minimum distance =  2.25621809421833 Angstroms
sigma value = 11


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

Energy: 1.737113113118522
Energy: 0.8363148062415949
Energy: 0.8376704938864413
Energy: 0.8497222267188411
Energy: 0.837208591292334
Energy: 0.8346653820653058
Energy: 0.8569629976333366
Energy: 0.830071132620322
Energy: 0.8344690333664173
Energy: 0.8244934797365937
Energy: 0.854827229770775
Energy: 0.8358746224438147
Energy: 0.8316881435372518
Energy: 0.8274433553660084
Energy: 0.831583138207392
Energy: 0.8325030825596336
Energy: 0.8238105082502224
Energy: 0.8341284225588455
Energy: 0.8313901555246023
Energy: 0.8280464592943844
Energy: 0.8335021554830703
Energy: 0.8327013504386882
Energy: 0.8412999506539036
Energy: 0.8421260065261991
Energy: 0.8343498944531995
Energy: 0.8341037361155712
Energy: 0.8327186964389278
Energy: 0.835497889311145
Energy: 0.8390898755754663
Energy: 0.8415871919711011
Energy: 0.8995063259797473
Energy: 0.8400105240305656
Energy: 0.8359457782609401
Energy: 0.8423773117389594
Energy: 0.8403910065396727
Energy: 0.835299110090535
Energy: 0.899269027026691
Energy: 0.8314225486913946
Energy: 0.831663949170605
Energy: 0.8335599859598031
Energy: 0.8285927139895876
Energy: 0.8294440743842223
Energy: 0.8588397773311438
Energy: 0.8254867089201566
Energy: 0.8293798319961427
Energy: 0.841969271679182
Energy: 0.8220899245055441
Energy: 0.8345241978068748
Energy: 0.905002650802424
Energy: 0.8337807300404193
Energy: 0.8340888108672967
Energy: 0.8567746841223307
Energy: 0.8329627726240671
Energy: 0.8423375900369234
Energy: 1.1066368021314745
Energy: 0.8386548652078891
Energy: 0.8366392139324502
Energy: 0.8169915929118183
Energy: 0.8405346443710039
Energy: 0.8343820012228075
Energy: 1.1136226537891656
Energy: 0.8474800848392687
Energy: 0.8341147774354865
Energy: 0.8412110444193502
Energy: 0.8473319540586706
Energy: 0.8342759443490521
Energy: 0.8985771042879451
Energy: 0.8195634059460211
Energy: 0.846658043523906
Energy: 0.8405982765855452
Energy: 0.8127679440693938
Energy: 0.8461632980377967
Energy: 0.9050381865402061
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Energy: 0.8406569816862471
Energy: 0.8238641827177398
Energy: 0.8107215280710971
Energy: 0.8345031713108354
Energy: 0.9065066631390801
Energy: 0.8357901263568523
Energy: 0.8348960201713495
Energy: 0.8458619074384046
Energy: 0.8441991541704589
Energy: 0.8347732496764205
Energy: 0.9089424362449972
Energy: 0.8331800188062424
Energy: 0.8385478904440283
Energy: 0.8406957554578743
Energy: 0.8290437649091579
Energy: 0.8405851582256616
Energy: 1.1131712394691968
Energy: 0.8388371773276511
Energy: 0.8357500980071696
Energy: 0.8420002545736229
Energy: 0.8422484069214795
Energy: 0.8354256988648264
Energy: 1.2345164485623832
Energy: 0.8304949385443741
Energy: 0.8196533486197662
Energy: 0.8074577442486296
Energy: 0.8308748185458733
Energy: 0.807886673773819
Energy: 1.2839387654757113
Energy: 0.8409987748182227
Energy: 0.839303462877578
Energy: 0.8528194194930823
Energy: 0.8404280933868344
Energy: 0.8369843679654123
Energy: 1.1127871119484547
Energy: 0.8419670046716301
Energy: 0.8404314621873225
Energy: 0.8413904510248944
Energy: 0.8409278747856157
Energy: 0.8358500348521551
Energy: 1.0454011084430543
Energy: 0.8309550490511842
Energy: 0.8329681332788659
Energy: 0.8322419748918582
Energy: 0.8440851535472542
Energy: 0.8340276387568382
Energy: 1.1128929325215484
Energy: 0.8372598029715461
Energy: 0.8355340967375425
Energy: 0.826771388935888
Energy: 0.8371529775809157
Energy: 0.8389113751376033
Energy: 0.8272251263348193
Energy: 0.8455346453523197
Energy: 0.8463542667698556
Energy: 0.8373756907265489
Energy: 0.8403230079447691
Energy: 0.8354365459038333
Energy: 0.8332098791094775
Energy: 0.8362787597068901
Energy: 0.8346004256156823
Energy: 0.8342385545853575
Energy: 0.8465215576561432
Energy: 0.8314109465679635
Energy: 0.8211434197984262
Energy: 0.8309494589767772
Energy: 0.8334324678154296
Energy: 0.8228165794376784
Energy: 0.8324992010424679
Energy: 0.8308270147962562
Energy: 0.8334146703822863
Energy: 0.8311323811576004
Energy: 0.8401280012439726
Energy: 0.8315912187404211
Energy: 0.8346818818003612
Energy: 0.832606804393831
Energy: 0.9358243427652444
Energy: 0.8410872075964719
Energy: 0.8426683619558047
Energy: 0.844282253945372
Energy: 0.8470492242756875
Energy: 0.8326013782803265

minimum gb energy = 0.8074577442486296 eV
minimum distance =  2.28328086694491 Angstroms
sigma value = 41


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

Energy: 1.6481797968878746
Energy: 0.8761384175080101
Energy: 0.8838328833617218
Energy: 0.8984055488973405
Energy: 0.9142780199749073
Energy: 0.8998329535544155
Energy: 0.943299235373746
Energy: 0.9045981280351152
Energy: 0.9057293529848806
Energy: 0.90303720450251
Energy: 0.9145826964182096
Energy: 0.907862207295786
Energy: 0.904201541215665
Energy: 0.8939640524420474
Energy: 0.8954431313550971
Energy: 0.9060323213179637
Energy: 0.8965964462486155
Energy: 0.8970189008890429
Energy: 0.9055984435944839
Energy: 0.900501824656621
Energy: 0.9019303399519455
Energy: 0.9063089336434104
Energy: 0.9012172355942182
Energy: 0.9015570503238356
Energy: 0.9118807427905182
Energy: 0.9192829467687749
Energy: 0.9223324014833985
Energy: 0.9134607585136675
Energy: 0.9025099583842865
Energy: 0.9327703214094173
Energy: 1.0200127897800142
Energy: 0.8959772345249145
Energy: 0.9009986569908343
Energy: 0.9296582801976125
Energy: 0.8934849423993042
Energy: 0.8981258846228851
Energy: 1.1811182829468176
Energy: 0.9043465653759561
Energy: 0.9014831803486837
Energy: 0.9092815547406552
Energy: 0.9057344220575088
Energy: 0.9033410330276667
Energy: 0.9410899737212317
Energy: 0.9001183128213045
Energy: 0.8989679435874399
Energy: 0.9008250190230044
Energy: 0.8995262394137165
Energy: 0.8654350039708768
Energy: 1.1824680543791903
Energy: 0.9026171883368471
Energy: 0.9281018665322668
Energy: 0.9088090946250807
Energy: 0.9050716224934005
Energy: 0.9267532427936058
Energy: 1.0077733120707075
Energy: 0.9032691715093227
Energy: 0.9023032382738441
Energy: 0.9006349817386607
Energy: 0.9095944580302971
Energy: 0.9050362539865165
Energy: 1.0067031936768862
Energy: 0.9073574548674199
Energy: 0.9264749015382792
Energy: 0.9042923640266762
Energy: 0.9060936458941354
Energy: 0.9075111875717725
Energy: 1.1823810948483529
Energy: 0.8970839565847963
Energy: 0.8992488519077236
Energy: 0.9036663378282802
Energy: 0.8658330017942641
Energy: 0.9063332284410612
Energy: 0.9152740446058241
Energy: 0.8981782469874579
Energy: 0.900027972073394
Energy: 0.9084905819421514
Energy: 0.864901070012671
Energy: 0.9048084325452516
Energy: 0.9018841523779659
Energy: 0.9065456402674755
Energy: 0.9065684047018859
Energy: 0.9013629317241278
Energy: 0.9050171643826828
Energy: 0.9071768485500121
Energy: 0.8975877702070405
Energy: 0.8992087328025041
Energy: 0.897788699159579
Energy: 0.8978407458942498
Energy: 0.9078397514813108
Energy: 0.8954085065955899
Energy: 0.9099767225053806
Energy: 0.9055189397135274
Energy: 0.9049728555783129
Energy: 0.9055125370660693
Energy: 0.9144086911885103
Energy: 0.9032977704497892
Energy: 1.0738208905717264
Energy: 0.9176254821318561
Energy: 0.8752377381007084
Energy: 0.8638019441501282
Energy: 0.915359897867232
Energy: 0.8997311111099653
Energy: 0.9450158970433681
Energy: 0.933627458548553
Energy: 0.9321032853843294
Energy: 0.9111676556389529
Energy: 0.9110285463917538
Energy: 0.9423257682687228
Energy: 0.9058610772267458
Energy: 0.8969960811865435
Energy: 0.898601063077291
Energy: 0.9070288856586344
Energy: 0.9052187035847339
Energy: 0.8971088287942128
Energy: 0.9047077593197566
Energy: 0.8986841189741739
Energy: 0.8999727834654095
Energy: 0.8998705289849125
Energy: 0.9003492849910274
Energy: 0.8978543972577937
Energy: 0.9107880633766969
Energy: 0.9010990257570172
Energy: 0.9043102056159146
Energy: 0.9142825032134122
Energy: 0.8996378056625006
Energy: 0.9054968539791145
Energy: 1.1940090249313398
Energy: 0.9026825798187621
Energy: 0.9032606105408665
Energy: 0.9868261578784682
Energy: 0.9031611522418935
Energy: 0.9002312714748276
Energy: 1.1829500383944722
Energy: 0.9000979125088842
Energy: 0.9043717540067507
Energy: 0.9135368496963789
Energy: 0.9030564741890932
Energy: 0.905119541200565
Energy: 0.9403244548643194
Energy: 0.8978885992103595
Energy: 0.8972206158341819
Energy: 0.9011687822370468
Energy: 0.89459944686748
Energy: 0.8653637560461702
Energy: 1.1813027219642918
Energy: 0.9009122373457248
Energy: 0.9028696227584672
Energy: 0.9130384281039577
Energy: 0.9017767548190105
Energy: 0.9044416176454868
Energy: 1.0063421977871225
Energy: 0.9052728236068148
Energy: 0.9264639114041305
Energy: 0.9038628177636499
Energy: 0.9357265360147268
Energy: 0.9088282246936621
Energy: 1.0073733764853083
Energy: 0.9024136044182401
Energy: 0.9030089940877993
Energy: 0.9018615952223537
Energy: 0.9056051856017711
Energy: 0.9048546455192802
Energy: 1.182320659591017
Energy: 0.875555957846405
Energy: 0.9262563759359997
Energy: 0.9384931120943085
Energy: 0.8908431674905685
Energy: 0.9284704320820241
Energy: 0.9145172164889785
Energy: 0.8699646740653967
Energy: 0.9284718834138512
Energy: 0.9080801937172562
Energy: 0.8709711182708177
Energy: 0.9298933432559883
Energy: 0.9558689810686778
Energy: 0.9320928990937891
Energy: 0.9307618090180643
Energy: 0.9033076543314115
Energy: 0.937081950241088
Energy: 0.9271739240243211
Energy: 0.8982025354334878
Energy: 0.9000411570057287
Energy: 0.8957968396418214
Energy: 0.8992217238600644
Energy: 0.8957657813905883
Energy: 0.894962514258612
Energy: 0.9085189345509518
Energy: 0.9060261906101625
Energy: 0.9019771325952767
Energy: 0.9060210714844337
Energy: 0.9084670054422939
Energy: 0.8993636999709707
Energy: 1.0747440936673482
Energy: 0.9161799926001833
Energy: 0.8765884454406826
Energy: 0.8663347712888487
Energy: 0.9144894697512697
Energy: 0.8765476354054547

minimum gb energy = 0.8638019441501282 eV
minimum distance =  2.2758836609666 Angstroms
sigma value = 33


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

Energy: 1.1507924438848423
Energy: 0.9797329392745687
Energy: 0.9247654875328064
Energy: 0.9158377861092283
Energy: 1.0725292944756368
Energy: 0.9600052743276241
Energy: 1.051972990729831
Energy: 0.9821659316625627
Energy: 0.9808057475944381
Energy: 0.96240442875688
Energy: 0.9902211755630148
Energy: 0.9728473316412088
Energy: 1.040370531934255
Energy: 1.016241359195726
Energy: 0.9593803458050199
Energy: 0.9727775006738737
Energy: 0.9589741459071057
Energy: 1.0100342141622831
Energy: 1.0393685106501422
Energy: 0.9748219949844257
Energy: 0.9596880521837884
Energy: 1.0588795265252948
Energy: 0.9651737264403486
Energy: 0.9615975073024733
Energy: 1.0467841360788162
Energy: 1.006113152361013
Energy: 0.9622388055993406
Energy: 1.0163900858703474
Energy: 1.004308442236985
Energy: 0.9549605970787047
Energy: 1.132975452577268
Energy: 0.989890351876171
Energy: 0.9941361453916194
Energy: 1.115797285751417
Energy: 0.992169651193552
Energy: 0.9905579801957547
Energy: 1.1325194538091874
Energy: 0.9980966095279112
Energy: 0.9673271482283632
Energy: 1.0014293502960854
Energy: 1.003874767747906
Energy: 1.0001270945917906
Energy: 1.0968327995169054
Energy: 0.9670972307692046
Energy: 0.9671970161145262
Energy: 0.9621435963903135
Energy: 1.0004715909504274
Energy: 0.9678696783484122
Energy: 1.1297073636768857
Energy: 1.0315098133108005
Energy: 1.0284683420716452
Energy: 1.0183364210250923
Energy: 1.0356236655753057
Energy: 1.0165133705564993
Energy: 1.1332931159339117
Energy: 1.0299021399142116
Energy: 1.0278344894836582
Energy: 1.0103210856333231
Energy: 1.0394050953584957
Energy: 1.0259744036776148
Energy: 1.1320588652898633
Energy: 1.0158668127742827
Energy: 1.0161431482933365
Energy: 1.0191828252128698
Energy: 1.0129817943681407
Energy: 1.0126414113890634
Energy: 1.1296750330364225
Energy: 0.9181824782711872
Energy: 0.9179327255732855
Energy: 1.0196796859869786
Energy: 0.9259701331428289
Energy: 0.9174844128490018
Energy: 1.1504176941625888
Energy: 0.9300362134690876
Energy: 0.9169771760945957
Energy: 1.0195005115506486
Energy: 0.9221878032548816
Energy: 0.9165912699391681
Energy: 1.070123087520927
Energy: 1.0172331229585636
Energy: 1.0163829803386486
Energy: 1.0232709829267188
Energy: 1.0171139898907633
Energy: 1.0148636778250972
Energy: 0.9592574611907294
Energy: 1.0310599462520245
Energy: 1.0288229662378587
Energy: 1.03955729721572
Energy: 1.0597696238837355
Energy: 1.026149435976536
Energy: 1.0750153920154
Energy: 1.017549559020894
Energy: 1.0178294438992828
Energy: 1.026782514349176
Energy: 1.07818250456796
Energy: 1.0158538858116473
Energy: 1.101133596296881
Energy: 1.0854841308960617
Energy: 0.9916724057445083
Energy: 0.9932679884494964
Energy: 1.0746780353713756
Energy: 0.9888573025942103
Energy: 1.105123067974027
Energy: 1.016787284717388
Energy: 1.017559683998065
Energy: 1.0119257244425428
Energy: 1.0774673006319049
Energy: 1.0257185336682926
Energy: 1.0826755323224053
Energy: 0.9714165713358323
Energy: 0.9630286439348509
Energy: 1.0244391820247747
Energy: 0.9662824597570755
Energy: 1.0134871504972647
Energy: 1.0641208482860174
Energy: 0.9707536628451694
Energy: 0.9624953307912084
Energy: 1.0153936891272075
Energy: 0.9649889676820035
Energy: 1.0455415078286645
Energy: 1.0327988285644396
Energy: 1.0183262949903182
Energy: 1.0731914946584529
Energy: 1.0458693710058844
Energy: 1.029344068570753
Energy: 1.021224001577075
Energy: 1.0677327649607113
Energy: 1.0297632517779396
Energy: 1.0364585502903623
Energy: 1.068227125515361
Energy: 1.0296335178283353
Energy: 1.0332343704218097
Energy: 1.0787081084242585
Energy: 1.0309049069438225
Energy: 1.0170197139377513
Energy: 1.0306029496259648
Energy: 1.0333478838447925
Energy: 1.0222505281576326
Energy: 1.0302383442715417
Energy: 1.026841227257743
Energy: 0.9166544708780425
Energy: 0.9186636353818347
Energy: 1.028900725016456
Energy: 0.9160720538235573
Energy: 1.0295949714151982
Energy: 1.0348962918677387
Energy: 1.0178059099962211
Energy: 0.9575968795473878
Energy: 1.0291104943163953
Energy: 1.021373487042378
Energy: 1.0687786028730204
Energy: 1.009967277804742
Energy: 1.0084185730046957
Energy: 1.0668214198498727
Energy: 1.012459511880222
Energy: 1.0253999282605029
Energy: 1.0680084467780795
Energy: 1.008746736871538
Energy: 1.011188154159604
Energy: 1.0633395541513833
Energy: 1.0146138335499333
Energy: 1.0155801449508293
Energy: 1.0728254026532085
Energy: 1.0194945781462958
Energy: 1.023383737849458
Energy: 1.0711944397090871
Energy: 0.996953581612751
Energy: 1.0195889506681282
Energy: 1.2083248057494766
Energy: 0.9889837664687995
Energy: 0.9879174598978899
Energy: 1.1332612101720017
Energy: 0.9921049470552143
Energy: 0.988584653233881
Energy: 1.1638440962651964
Energy: 1.043425429354828
Energy: 1.0490930497834354
Energy: 1.0974864579990322
Energy: 1.0722193809598142
Energy: 1.0520605829762308
Energy: 1.1478619123668197
Energy: 1.0338081387786953
Energy: 0.9685220255061867
Energy: 0.9624252687687718
Energy: 1.0288780322266105
Energy: 0.962545475975093
Energy: 1.1530505853023811
Energy: 1.0218619098120971
Energy: 1.0245943100612687
Energy: 1.090189876724222
Energy: 1.0288920995391797
Energy: 1.0180070215633101
Energy: 1.1328058890250021
Energy: 1.032112257782694
Energy: 1.0300048776826316
Energy: 1.0134286323291932
Energy: 1.0438035219090382
Energy: 1.0118120536934203
Energy: 1.1324980102567552
Energy: 1.0192530034905285
Energy: 1.013979466294272
Energy: 1.014566399472176
Energy: 1.0164194548586456
Energy: 1.0108440657231046
Energy: 1.1349516589436754
Energy: 0.9619545763617681
Energy: 0.9193375845859529
Energy: 1.0620288413446275
Energy: 0.9551520001253428
Energy: 1.0166950805661994
Energy: 1.1265061721958947
Energy: 0.9297624049081841
Energy: 0.9163963041813749
Energy: 1.0200452868214758
Energy: 0.9205893669166898
Energy: 0.9165449621456866
Energy: 1.0738610715401553
Energy: 1.013429116068835
Energy: 1.0186482931260736
Energy: 1.0244213397929343
Energy: 1.0144110522601424
Energy: 1.0159614687426826
Energy: 0.9589565949378474
Energy: 1.0337422127677396
Energy: 1.0303999029047726
Energy: 0.9606711740070075
Energy: 1.0388355243142287
Energy: 1.0286795007434035
Energy: 1.074691223900555
Energy: 1.0169968773914149
Energy: 1.016834333130629
Energy: 1.0182438576924044
Energy: 1.0734857171239967
Energy: 1.015055500383499
Energy: 1.1040595340246264
Energy: 1.0712794544325035
Energy: 0.9599818103727448
Energy: 0.9941183719628397
Energy: 1.1181195807218918
Energy: 0.9886972545496169
Energy: 1.106038770327744
Energy: 1.009380135549958
Energy: 0.9604644570388773
Energy: 1.0094576354808151
Energy: 1.052563152909538
Energy: 0.9618553647573747
Energy: 1.069278889914057
Energy: 0.9658124422791563
Energy: 0.9632203221217673
Energy: 1.014418761409937
Energy: 1.041474313742791
Energy: 1.0118729328560623
Energy: 1.0765584144745726
Energy: 0.9691058349276119
Energy: 0.9627738091423845
Energy: 0.9696959716373936
Energy: 0.9629432147181082
Energy: 0.9624449396189071
Energy: 1.0034935572960029
Energy: 0.9608368546942231
Energy: 0.961138571843385
Energy: 1.0232872909250519
Energy: 0.9605865769974651
Energy: 0.9621246684352006
Energy: 1.0480617856672196
Energy: 1.0127124392283642
Energy: 1.0119635122545143
Energy: 1.0716683231677482
Energy: 1.0101739971529273
Energy: 1.0125333886511767
Energy: 1.0456410650073493
Energy: 0.9780408778368689
Energy: 0.9672347450711438
Energy: 0.9843611225335885
Energy: 0.9930954345697163
Energy: 0.9689768552591634
Energy: 1.054036479318726
Energy: 0.9594967993085732
Energy: 0.9167387064186377
Energy: 0.9187063281252347
Energy: 0.963149132440278
Energy: 0.9831568451102828

minimum gb energy = 0.9158377861092283 eV
minimum distance =  2.26335517256264 Angstroms
sigma value = 67


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

Energy: 1.2145862585506857
Energy: 0.9601365131061209
Energy: 0.9607004657992678
Energy: 0.9595974095148049
Energy: 1.073479878456232
Energy: 0.9595060665466035
Energy: 1.1075288544239756
Energy: 1.0185626161489656
Energy: 1.0201132838909437
Energy: 1.021907430392544
Energy: 1.0458885060445204
Energy: 1.0197492997786628
Energy: 1.0472319946121613
Energy: 0.9482410505780905
Energy: 0.9957476504707949
Energy: 0.9998792401174305
Energy: 0.9477748806370176
Energy: 0.9949066285406372
Energy: 1.0405177639915808
Energy: 0.9979761112357924
Energy: 0.9980123384058611
Energy: 1.0443986453075578
Energy: 0.9991294897777478
Energy: 0.9983042652495602
Energy: 1.0426768104538162
Energy: 1.0196271973753745
Energy: 1.0206027487919624
Energy: 1.0434422886112233
Energy: 1.0210131329278247
Energy: 1.0216669115912167
Energy: 1.0421414505008078
Energy: 0.9825075097492674
Energy: 1.0228704201030867
Energy: 1.0452961650738941
Energy: 0.980033096141816
Energy: 1.0222705183529608
Energy: 1.1091822332896564
Energy: 1.0191737928603075
Energy: 1.0200159816603578
Energy: 1.1131208235661423
Energy: 1.0456890706381792
Energy: 1.019462824923891

minimum gb energy = 0.9477748806370176 eV
minimum distance =  2.32080723754343 Angstroms
sigma value = 3


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

Energy: 1.5785681149389832
Energy: 1.2444603401306045
Energy: 1.1338303016123927
Energy: 1.1482785225414753
Energy: 1.2740438356025539
Energy: 1.135813566594861
Energy: 1.0766428753219357
Energy: 1.0957782941812093
Energy: 1.070708119839282
Energy: 1.0968069236509876
Energy: 1.167374208998422
Energy: 1.0721160183001266
Energy: 1.0756883009695632
Energy: 1.0797353855160334
Energy: 1.079254818826524
Energy: 1.0747088776805878
Energy: 1.0791541934488038
Energy: 1.0809751554179836
Energy: 1.102159992789174
Energy: 1.0758680592979044
Energy: 1.0759803261371557
Energy: 1.082133840379945
Energy: 1.0765208595202966
Energy: 1.0782559017434479
Energy: 1.077947881171193
Energy: 1.090276192400667
Energy: 1.0909516966974087
Energy: 1.0779143772872544
Energy: 1.0894027112341187
Energy: 1.0936864463688158
Energy: 1.072658606876283
Energy: 1.0905936517756663
Energy: 1.109450950001888
Energy: 1.1009967098820608
Energy: 1.0898106222931323
Energy: 1.107374103541524
Energy: 1.0699198523848341
Energy: 1.1404548458805894
Energy: 1.1127373978874948
Energy: 1.1026108790654698
Energy: 1.1650938670424953
Energy: 1.1137217296431987
Energy: 1.2628578699060293
Energy: 1.080500785348211
Energy: 1.1429578933954523
Energy: 1.105427421015694
Energy: 1.1804904761465478
Energy: 1.1430027576175186
Energy: 1.072552851339268
Energy: 1.0953748996138264
Energy: 1.1109254303524103
Energy: 1.1019054423615078
Energy: 1.108366229222568
Energy: 1.139923306203506
Energy: 1.0731459315184424
Energy: 1.0643164145920818
Energy: 1.070695598367583
Energy: 1.0970335215122853
Energy: 1.0647971314622502
Energy: 1.131147734090781
Energy: 1.104580382545819
Energy: 1.073531799151302
Energy: 1.0754216381979238
Energy: 1.1067938708389427
Energy: 1.1064623817562005
Energy: 1.091283806516651
Energy: 1.1655774030882264
Energy: 1.1070531179858385
Energy: 1.1074125553717433
Energy: 1.1255177046446971
Energy: 1.1055740292827063
Energy: 1.0922527049925943
Energy: 1.114092077371349
Energy: 1.0976597341608476
Energy: 1.0961138629089024
Energy: 1.0890958232706724
Energy: 1.0733014096422457
Energy: 1.0920430876396872
Energy: 1.098945668972077
Energy: 1.0731211462221
Energy: 1.0725824911691382
Energy: 1.107168695910986
Energy: 1.0782188891966438
Energy: 1.0756422920698077
Energy: 1.1633420698541403
Energy: 1.0695917261083923
Energy: 1.1077996405079016
Energy: 1.10712174831769
Energy: 1.1810069586246295
Energy: 1.124133303470473
Energy: 1.1929166566859708
Energy: 1.0744115940665857
Energy: 1.0754057212132482
Energy: 1.150676181450458
Energy: 1.0984400784854267
Energy: 1.0739914993723576
Energy: 1.2770618607570077
Energy: 1.0763754232919711
Energy: 1.07684638641894
Energy: 1.2693208249324173
Energy: 1.1024114981044095
Energy: 1.1112892080587713
Energy: 1.0926669881145468
Energy: 1.1058166582897246
Energy: 1.0959346995548405
Energy: 1.1097057769118477
Energy: 1.1255569001314054
Energy: 1.0952614843231885
Energy: 1.316868828320915
Energy: 1.123451720268722
Energy: 1.0796783192722152
Energy: 1.067216914593992
Energy: 1.0823813739586117
Energy: 1.0783326476986506
Energy: 1.209751310438591
Energy: 1.077088401527002
Energy: 1.0781252753101185
Energy: 1.0774221718256767
Energy: 1.0783350896701724
Energy: 1.0812906306674779
Energy: 1.0954236102109265
Energy: 1.1017254440736857
Energy: 1.096707700768614
Energy: 1.1006460525107602
Energy: 1.0986263190941057
Energy: 1.098782876293456
Energy: 1.0921917497025058
Energy: 1.0985696815360733
Energy: 1.1035478586202698
Energy: 1.0954366289948962
Energy: 1.0969013095033127
Energy: 1.0966692448241473
Energy: 1.0942366695866395
Energy: 1.101845736357723
Energy: 1.0994022394223284
Energy: 1.0958456186958152
Energy: 1.104660043997838
Energy: 1.1043378849396976
Energy: 1.1321115449280776
Energy: 1.1460565567158787
Energy: 1.1464538195775256
Energy: 1.1271746655420114
Energy: 1.107064891701208
Energy: 1.0796264862854712
Energy: 1.1014814007334068
Energy: 1.0739321762335508
Energy: 1.0733597592244282
Energy: 1.1445057035469497
Energy: 1.094030555402547
Energy: 1.0738642804014584
Energy: 1.3129174529985375
Energy: 1.0952715228632262
Energy: 1.091921212024942
Energy: 1.0764040708597065
Energy: 1.0927876325357162
Energy: 1.098859972037856
Energy: 1.0641253896894776
Energy: 1.1131850324011685
Energy: 1.0927930809592241
Energy: 1.076405579752079
Energy: 1.0973709812016248
Energy: 1.0776902836405307
Energy: 1.1048623332562382
Energy: 1.077174294720319
Energy: 1.0784803029130905
Energy: 1.1160075100760007
Energy: 1.0759637361201468
Energy: 1.079946860406172
Energy: 1.0716000605603724
Energy: 1.0799314376716151
Energy: 1.078616499423347
Energy: 1.0726545906811735
Energy: 1.0804354330782358
Energy: 1.0799887866843532
Energy: 1.0717537584810026
Energy: 1.0893218092009573
Energy: 1.0702215075099843
Energy: 1.0737642739166113
Energy: 1.1480960633431117
Energy: 1.071204812177236
Energy: 1.0730168948861516
Energy: 1.1156633832520868
Energy: 1.1019588082702365
Energy: 1.1027430977081385
Energy: 1.1227118314333504
Energy: 1.1256164985882842
Energy: 1.0743377630772302
Energy: 1.1152466701557195
Energy: 1.0907676144046228
Energy: 1.088575420807586
Energy: 1.132651626015055
Energy: 1.089895645868355
Energy: 1.2627006891298014
Energy: 1.1369271239324348
Energy: 1.1274146348190044
Energy: 1.1011684600351292
Energy: 1.1531627039417138
Energy: 1.075009900616268
Energy: 1.1945894886175559
Energy: 1.0909394327627904
Energy: 1.093924096386907
Energy: 1.0760794606057777
Energy: 1.1019520660398892
Energy: 1.0903832533469056
Energy: 1.079974398068167
Energy: 1.0762958245776626
Energy: 1.0755228323127295
Energy: 1.084189273089196
Energy: 1.0766918524167561
Energy: 1.09136583265985
Energy: 1.1736302240338956
Energy: 1.0645294347807162
Energy: 1.0702752606891408
Energy: 1.1518413207316245
Energy: 1.0812381619110496
Energy: 1.1302965523956026
Energy: 1.1661194238591177
Energy: 1.0920791396320024
Energy: 1.0921937502507109
Energy: 1.163834746509962
Energy: 1.1047099621402612
Energy: 1.089936847272416
Energy: 1.2128495297435657
Energy: 1.1247776737889739
Energy: 1.1266513197178474
Energy: 1.0907171046438822
Energy: 1.1108709681514901
Energy: 1.1275276545579163
Energy: 1.099152821888401
Energy: 1.072734596246069
Energy: 1.0708829537780036
Energy: 1.103068442923173
Energy: 1.073398391457867
Energy: 1.0711409869716972
Energy: 1.162588718193728
Energy: 1.0759579306833882
Energy: 1.0786939872369783
Energy: 1.091513079862611
Energy: 1.0735364175729054
Energy: 1.0781962920839934
Energy: 1.2673121544527037
Energy: 1.0797776624066266
Energy: 1.0797309508453976
Energy: 1.082701925221291
Energy: 1.1045797561806505
Energy: 1.0797960078517534
Energy: 1.0962901828857536
Energy: 1.086477546381452
Energy: 1.0884811359796196
Energy: 1.0790609558457773
Energy: 1.0746427217145464
Energy: 1.0951306258363795
Energy: 1.200569489795651
Energy: 1.1005615224647896
Energy: 1.0753776034094387
Energy: 1.2009154522682075
Energy: 1.0769974009521006
Energy: 1.1420479328854296
Energy: 1.2014713376445385
Energy: 1.074860796817288
Energy: 1.0743407048665863
Energy: 1.1482452091846398
Energy: 1.101897897140185
Energy: 1.0720078228220509
Energy: 1.3795055983164428
Energy: 1.0772633302509784
Energy: 1.1289710883522852
Energy: 1.119667354094265
Energy: 1.070901520005389
Energy: 1.1324261583829494
Energy: 1.0922094335318275
Energy: 1.1037882852737193
Energy: 1.1068699242841304
Energy: 1.1037831065677124
Energy: 1.0963177712231624
Energy: 1.1041270075919831
Energy: 1.0926407758202301
Energy: 1.0982157644424972
Energy: 1.0974229201265906
Energy: 1.0964913510947036
Energy: 1.0973413464249933
Energy: 1.0961884715120864
Energy: 1.095636497643436
Energy: 1.0971051233046145
Energy: 1.0965755458071453
Energy: 1.0970043405605794
Energy: 1.1032379884653511
Energy: 1.0999864496647895
Energy: 1.0952126335442793
Energy: 1.0768384051240218
Energy: 1.0773957218245713
Energy: 1.0956875519519353
Energy: 1.07721999958115
Energy: 1.0760820018552282
Energy: 1.0986861726874573
Energy: 1.0777483743965073
Energy: 1.077283793037517
Energy: 1.0723725416374887
Energy: 1.0774678780682674
Energy: 1.0773016531741946
Energy: 1.071403502533318
Energy: 1.1072256365505684
Energy: 1.0966821484056677
Energy: 1.0981003093154984
Energy: 1.1149872464940345
Energy: 1.0968180935942171

minimum gb energy = 1.0641253896894776 eV
minimum distance =  2.24984546841876 Angstroms
sigma value = 81


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

Energy: 2.105859208954797
Energy: 1.2098342481413342
Energy: 1.1199701380888112
Energy: 1.1778826389411818
Energy: 1.1656705539834575
Energy: 1.116710870373757
Energy: 1.0401753662506903
Energy: 1.0952084449819441
Energy: 1.0998982889207287
Energy: 1.0774492948335972
Energy: 1.0434621384822569
Energy: 1.1101461126263983
Energy: 1.077387708068982
Energy: 1.0682648081720896
Energy: 1.0687058817546016
Energy: 1.117766031066241
Energy: 1.0668054533265412
Energy: 1.1063658177479465
Energy: 1.08156723475241
Energy: 1.0634137889282345
Energy: 1.100812713345043
Energy: 1.081580233840642
Energy: 1.071934813001803
Energy: 1.1077115347747442
Energy: 1.0777326250696533
Energy: 1.0939461300916429
Energy: 1.0948297340470328
Energy: 1.078125021860946
Energy: 1.096885413075073
Energy: 1.0944082176066496
Energy: 1.0811371021052583
Energy: 1.0974633172609307
Energy: 1.0948857558103322
Energy: 1.0943009146200957
Energy: 1.094977091065204
Energy: 1.0948613729925858
Energy: 1.0606086249208384
Energy: 1.0644089630935747
Energy: 1.07622311494634
Energy: 1.0565024242509369
Energy: 1.0425495641546492
Energy: 1.0761452847357493
Energy: 1.2714144771651803
Energy: 1.2267877919601282
Energy: 1.1960082450079448
Energy: 1.0400493877745338
Energy: 1.2271176810089994
Energy: 1.1157952712026136
Energy: 1.1508376393512316
Energy: 1.0761390649201512
Energy: 1.0756375401076663
Energy: 1.1112591427274916
Energy: 1.0720712275769673
Energy: 1.0962245598870526
Energy: 1.0587878025989552
Energy: 1.0802975765491063
Energy: 1.080116822245796
Energy: 1.137615696846146
Energy: 1.0796453620190873
Energy: 1.0415822895087288
Energy: 1.0475915404880318
Energy: 1.0409733440177469
Energy: 1.0409029313085287
Energy: 1.0568237879835354
Energy: 1.07554379776132
Energy: 1.041202170738459
Energy: 1.1381768857186014
Energy: 1.0886652017701137
Energy: 1.0855951329792484
Energy: 1.0717922846960601
Energy: 1.0812677990723578
Energy: 1.0660205405448582
Energy: 1.1386921579463394
Energy: 1.0734862828734342
Energy: 1.0884655327515698
Energy: 1.0672908982298677
Energy: 1.041224288280808
Energy: 1.0689746580981676
Energy: 1.0916336042412715
Energy: 1.042057822352669
Energy: 1.0416278673852952
Energy: 1.09067604431118
Energy: 1.0912764111108346
Energy: 1.0408748799545027
Energy: 1.2256693449073495
Energy: 1.0988827695956453
Energy: 1.1670639055115124
Energy: 1.104187693520902
Energy: 1.0992372616805248
Energy: 1.1012175871944858
Energy: 1.0889048368584635
Energy: 1.098182467588893
Energy: 1.10169334439293
Energy: 1.0890259883926616
Energy: 1.0555440350535001
Energy: 1.103845921098264
Energy: 1.2290822025234127
Energy: 1.0395406049725104
Energy: 1.132543344487944
Energy: 1.2280875829494011
Energy: 1.0394678369797716
Energy: 1.1308256339586074
Energy: 1.0505912719675754
Energy: 1.0847650225035987
Energy: 1.086202044255481
Energy: 1.04967239458502
Energy: 1.1261065202549716
Energy: 1.085492848605109
Energy: 1.197404271943424
Energy: 1.0556690929076806
Energy: 1.0556220128488258
Energy: 1.0554476303201754
Energy: 1.0539486971707028
Energy: 1.054551977666687
Energy: 1.1974686403068202
Energy: 1.0538924452994525
Energy: 1.0547060112767
Energy: 1.055419347229049
Energy: 1.0541005279643676
Energy: 1.0544639659130173
Energy: 1.050172353622916
Energy: 1.08550162023471
Energy: 1.0871776855991282
Energy: 1.0498239104509077
Energy: 1.1271027850918556
Energy: 1.069074039578996
Energy: 1.087191739199499
Energy: 1.1130897933219783
Energy: 1.1139708402627204
Energy: 1.117338929476808
Energy: 1.0755469776827296
Energy: 1.1169312765691837
Energy: 1.092979251373322
Energy: 1.091876330079514
Energy: 1.0888381787802364
Energy: 1.0892571581127133
Energy: 1.0550202327033715
Energy: 1.088934050082699
Energy: 1.0885649101616943
Energy: 1.0932118652189002
Energy: 1.1035701713440613
Energy: 1.0902116313489425
Energy: 1.0934711892369962
Energy: 1.102430499748334
Energy: 1.0909018091826812
Energy: 1.0983362334618845
Energy: 1.1002289224830597
Energy: 1.094144796113831
Energy: 1.1025691958791606
Energy: 1.10507904748211
Energy: 1.271246266680029
Energy: 1.1399094059420294
Energy: 1.0755024052869302
Energy: 1.0400134462867685
Energy: 1.1863780543472149
Energy: 1.075192140472719
Energy: 1.271991711260544
Energy: 1.0962633707736902
Energy: 1.0862634452523705
Energy: 1.0420680468846786
Energy: 1.1937659068354771
Energy: 1.1040665308722784
Energy: 1.0461062281934128
Energy: 1.0961123802442743
Energy: 1.0408623652220539
Energy: 1.0554902542599698
Energy: 1.0763849457602634
Energy: 1.04060341331288
Energy: 1.1700367883462945
Energy: 1.0806234201795382
Energy: 1.0553724251542502
Energy: 1.1210224049636575
Energy: 1.0805737376005735
Energy: 1.0419969411409662
Energy: 1.062329036043228
Energy: 1.062038249081579
Energy: 1.0761338491250039
Energy: 1.1109331677249943
Energy: 1.0849631521623484
Energy: 1.096909858280559
Energy: 1.1381540521291784
Energy: 1.0987714308973713
Energy: 1.0976129923742906
Energy: 1.0761017654361067
Energy: 1.0985610392414373
Energy: 1.1189265675434623
Energy: 1.0593442597053846
Energy: 1.041342174112261
Energy: 1.0414085095820835
Energy: 1.0432830100963353
Energy: 1.0443884100812078
Energy: 1.041387866779688
Energy: 1.21728434739035
Energy: 1.0770851934431116
Energy: 1.0998114680412914
Energy: 1.0993658004351299
Energy: 1.076327498197792
Energy: 1.0998538584290474
Energy: 1.2174403366849382
Energy: 1.096351190617073
Energy: 1.0960841717861933
Energy: 1.1103015863250987
Energy: 1.0782368969245824
Energy: 1.0959104011673566
Energy: 1.0766060731502625
Energy: 1.0956742161338537
Energy: 1.1153450985348654
Energy: 1.0768841052578595
Energy: 1.0404638971913807
Energy: 1.1152946961340957
Energy: 1.2961055603157665
Energy: 1.0394332380020823
Energy: 1.0398903326618054
Energy: 1.2975670582702334
Energy: 1.0395856105151982
Energy: 1.1903734289521803
Energy: 1.0802891356738804
Energy: 1.0985822791191575
Energy: 1.0981095100808074
Energy: 1.0785209270933727
Energy: 1.0439053353844674
Energy: 1.1099843687581536
Energy: 1.1909541275453952
Energy: 1.2088472374063615
Energy: 1.1255818934751551
Energy: 1.0716044555305313
Energy: 1.1105972031920603
Energy: 1.2009155371853213

minimum gb energy = 1.0394332380020823 eV
minimum distance =  2.29938929910048 Angstroms
sigma value = 43


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

Energy: 1.7145472095828558
Energy: 1.262682701780454
Energy: 1.1180218911301638
Energy: 1.1515067944384112
Energy: 1.233145969235157
Energy: 1.1412206044466462
Energy: 1.0290839817215711
Energy: 1.0329710619629013
Energy: 1.0722027243127166
Energy: 1.0934905870945868
Energy: 1.046787655952814
Energy: 1.0685237099631852
Energy: 1.0543142109917762
Energy: 1.0277217599861668
Energy: 1.0281930283348724
Energy: 1.082483917485329
Energy: 1.0281220265807667
Energy: 1.0564051769906282
Energy: 1.0554783296307135
Energy: 1.032138803862693
Energy: 1.056584678843907
Energy: 1.0555258228085918
Energy: 1.0289773326519052
Energy: 1.0564699322785203
Energy: 1.051807240645222
Energy: 1.0923565250476068
Energy: 1.0999839500864652
Energy: 1.0517697733249576
Energy: 1.0971848177826227
Energy: 1.0999674851080803
Energy: 1.0547951331223686
Energy: 1.0968339842235495
Energy: 1.0944580752837458
Energy: 1.0897212588324128
Energy: 1.069351912784122
Energy: 1.0928003937902036
Energy: 1.0525959533478169
Energy: 1.0528628129281496
Energy: 1.0529721392128872
Energy: 1.0458932475424
Energy: 1.052609893693266
Energy: 1.0537011444271176
Energy: 1.2059513087137474
Energy: 1.0556786789961936
Energy: 1.054139511485728
Energy: 1.0280793566210764
Energy: 1.055498178349527
Energy: 1.118951913385395
Energy: 1.0460727552181925
Energy: 1.0538598470122196
Energy: 1.053164786502169
Energy: 1.0461859823344546
Energy: 1.0548096538887488
Energy: 1.0528146015581545
Energy: 1.0448799572426326
Energy: 1.0518305132889834
Energy: 1.050432222245915
Energy: 1.1039700016530056
Energy: 1.051887285227613
Energy: 1.051612349183164
Energy: 1.029645058191214
Energy: 1.0681074371705492
Energy: 1.0273700501838214
Energy: 1.046351657388165
Energy: 1.079181042439828
Energy: 1.0723442654174706
Energy: 1.1663355724879272
Energy: 1.05647859092535
Energy: 1.0562614568914268
Energy: 1.0813496972270964
Energy: 1.0567371043766307
Energy: 1.0557141580939495
Energy: 1.2452445096839728
Energy: 1.054982940232342
Energy: 1.074651613184089
Energy: 1.0309737770803247
Energy: 1.055467087499327
Energy: 1.07511632930959
Energy: 1.0301245151391831
Energy: 1.054277388656622
Energy: 1.0826120689917091
Energy: 1.0455252490778566
Energy: 1.0534119988496071
Energy: 1.071485233816066
Energy: 1.0312115425564972
Energy: 1.1109446043116005
Energy: 1.113110644109382
Energy: 1.0325224986586725
Energy: 1.0875436225379924
Energy: 1.1142931662460978
Energy: 1.029023072598061
Energy: 1.0310889375209695
Energy: 1.0299664353753395
Energy: 1.0312892712797948
Energy: 1.051847982800762
Energy: 1.0290566021929959
Energy: 1.0302000936174902
Energy: 1.0311125001341164
Energy: 1.0308068755569593
Energy: 1.0303005215138459
Energy: 1.1055621942648757
Energy: 1.0306590230840615
Energy: 1.031915071577019
Energy: 1.030407234916296
Energy: 1.0307231310160214
Energy: 1.106279100002422
Energy: 1.0300974409930588
Energy: 1.0311905438300328
Energy: 1.1499640443484347
Energy: 1.0311605851580146
Energy: 1.0309842351954368
Energy: 1.0509382936879308
Energy: 1.0310340631327184
Energy: 1.0523166962948791
Energy: 1.1498810252607212
Energy: 1.0310882539884139
Energy: 1.0306149290254987
Energy: 1.0508692579785797
Energy: 1.147662955461369
Energy: 1.052533609324138
Energy: 1.0314641415358035
Energy: 1.0317806108424996
Energy: 1.0296113644766536
Energy: 1.0828569242648074
Energy: 1.0465853614377425
Energy: 1.0303536703003604
Energy: 1.2101456411360856
Energy: 1.07229255704295
Energy: 1.1367761052400962
Energy: 1.2100288078126182
Energy: 1.0292082329628802
Energy: 1.105264882340258
Energy: 1.0823438864171309
Energy: 1.0304433315058368
Energy: 1.0312106425228507
Energy: 1.047884550942719
Energy: 1.049599248954718
Energy: 1.0301654477337472
Energy: 1.1631815098949227
Energy: 1.0329881332151987
Energy: 1.031216720783376
Energy: 1.0283513862928972
Energy: 1.177848345244094
Energy: 1.031243400328597
Energy: 1.081030321127843
Energy: 1.0304765453554443
Energy: 1.0308585258105583
Energy: 1.0310007255869555
Energy: 1.0303225883116895
Energy: 1.0315627562124199
Energy: 1.1209430293700173
Energy: 1.0297266038214226
Energy: 1.0304086729409274
Energy: 1.0730987633691016
Energy: 1.0298220213455935
Energy: 1.0772776788692149
Energy: 1.1204365233930418
Energy: 1.1037089111051737
Energy: 1.1065313298568218
Energy: 1.053703135485024
Energy: 1.1103491047922502
Energy: 1.0778390390571464
Energy: 1.0926769107326415
Energy: 1.0816948063851908
Energy: 1.068727804894263
Energy: 1.0556903500484522
Energy: 1.0460279043728922
Energy: 1.0530707437857723
Energy: 1.0525214204610471
Energy: 1.0524110819001433
Energy: 1.0516257560042204
Energy: 1.0531835618376308
Energy: 1.081147705107471
Energy: 1.0529971991217482
Energy: 1.0541609482833838
Energy: 1.0328661140817652
Energy: 1.1229476326517782
Energy: 1.0970643551866697
Energy: 1.0460575783884036
Energy: 1.052926422834613
Energy: 1.027354752686892
Energy: 1.1054379618742285
Energy: 1.0290480235794872
Energy: 1.0730743610709343
Energy: 1.1133541106706804
Energy: 1.0284836624921576

minimum gb energy = 1.027354752686892 eV
minimum distance =  2.26743992652737 Angstroms
sigma value = 57


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

Energy: 1.3028266924960925
Energy: 1.1254674862316183
Energy: 1.1256778155106926
Energy: 1.086916900951108
Energy: 1.2072735403391632
Energy: 1.1262566332138852
Energy: 0.959032596144792
Energy: 1.0295164128580896
Energy: 1.0254333395951303
Energy: 1.0297603318310196
Energy: 1.0305434620373295
Energy: 1.0255287753186946
Energy: 1.0248292063559632
Energy: 0.9589923434242482
Energy: 0.9592077038346952
Energy: 1.1044409999228657
Energy: 0.959713647150144
Energy: 1.0880177831866038
Energy: 1.0299109813508012
Energy: 0.9598771278718325
Energy: 0.9602343922651759
Energy: 1.0252757511037645
Energy: 0.9609253480290689
Energy: 1.025686157597506
Energy: 1.0223430903193031
Energy: 1.003190863934587
Energy: 1.0037258561628053
Energy: 1.0225155289289922
Energy: 1.0071999257511925
Energy: 1.0041370209833331
Energy: 0.9593893849551375
Energy: 1.003031662923562
Energy: 1.0019763170298808
Energy: 1.0912029415045517
Energy: 1.0030249681343841
Energy: 1.003874402106242
Energy: 1.0289279214426275
Energy: 1.023405529881107
Energy: 1.0236331675455514
Energy: 1.028823005065924
Energy: 1.026644134884802
Energy: 1.0238847827411561
Energy: 1.017884669190753
Energy: 1.1121662992974426
Energy: 1.109117971480937
Energy: 1.088374579050233
Energy: 1.1128655190040528
Energy: 1.0256942660809723
Energy: 1.0291255971076914
Energy: 1.0247468575499405
Energy: 1.02556793197323
Energy: 1.0305320910578175
Energy: 1.0309811463271341
Energy: 1.0244142031264405
Energy: 1.028925403526208
Energy: 1.0192681961044914
Energy: 1.0207045672595623
Energy: 1.1038949259017514
Energy: 1.0966387603605743
Energy: 1.0180914665993541
Energy: 1.0290059467361525
Energy: 1.0185305757138317
Energy: 1.0254823702267137
Energy: 1.0298839126046644
Energy: 1.0186422270345392
Energy: 1.0248561080148866
Energy: 0.959716382643439
Energy: 1.0972022387571925
Energy: 1.024619928526696
Energy: 0.9596694665722676
Energy: 1.0289376434713597
Energy: 1.0786512351154236
Energy: 0.9608241869503729
Energy: 1.1053830778488127
Energy: 1.0810191350716845
Energy: 1.0817376314934786
Energy: 1.100431978361975
Energy: 1.0815471767356455
Energy: 1.026497201423529
Energy: 1.030037784856022
Energy: 1.0043336264095541
Energy: 1.031014035046827
Energy: 1.0303361652711678
Energy: 1.0247861347627998
Energy: 1.0355279969485902
Energy: 1.0873687893834239
Energy: 1.0866840323140956
Energy: 1.0271142562727718
Energy: 1.0873702383228918
Energy: 1.0880337258201562
Energy: 1.0234414933713718
Energy: 1.003793673643559
Energy: 1.0074202849368226
Energy: 1.0251733415530102
Energy: 1.003825707090023
Energy: 1.0227939932834116
Energy: 1.0222091320539781
Energy: 1.0491197232454483
Energy: 1.0440604739447037
Energy: 1.0254346588704242
Energy: 1.0442546471876755
Energy: 1.0443036751532486
Energy: 1.0230663251780483
Energy: 1.024153072913372
Energy: 1.004213471331999
Energy: 1.0030234255152273
Energy: 1.0229482893366861
Energy: 1.0030446016915557
Energy: 1.0285352314058875
Energy: 1.026422519822783
Energy: 1.0272579680178664
Energy: 1.0040905939231468
Energy: 1.026310901821297
Energy: 1.0270687778722287
Energy: 1.0293559927765008
Energy: 1.0260721423648396
Energy: 1.026896870668821
Energy: 1.0287201947242837
Energy: 1.0254322230730382
Energy: 1.0275490712316357
Energy: 1.03019864096272
Energy: 1.0257311222448804
Energy: 1.0304397252851107
Energy: 1.03063932769198
Energy: 1.0295951957195302
Energy: 1.023831942171092
Energy: 1.2060275807722114
Energy: 1.1042392714797733
Energy: 1.1039793757099974
Energy: 1.1656622673508343
Energy: 1.01838230244217
Energy: 1.1041626482127307
Energy: 1.0269612267874257
Energy: 1.0306778703752766
Energy: 1.032600230660363
Energy: 1.0311716059304732
Energy: 1.0305069068428556
Energy: 1.0239697065510502
Energy: 0.9612143022938404
Energy: 1.105241216430155
Energy: 1.0812361085893003
Energy: 1.0818501743848121
Energy: 1.0373975994436877
Energy: 1.0817587156031643

minimum gb energy = 0.9589923434242482 eV
minimum distance =  2.25308026643165 Angstroms
sigma value = 17


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

Energy: 1.5187966332098488
Energy: 1.178639838498685
Energy: 1.1790362121868763
Energy: 1.1395549940100127
Energy: 1.029660573773908
Energy: 0.9959085976176199
Energy: 0.9364888035487672
Energy: 1.0305829531098274
Energy: 1.030204882173045
Energy: 1.0428544783395002
Energy: 1.0307511546788999
Energy: 0.9806644507900568
Energy: 1.2483517486831013
Energy: 0.9372425333682679
Energy: 0.9378156564403254
Energy: 1.0298796385715943
Energy: 0.9368993258330174
Energy: 0.9383896282523693
Energy: 1.0302975900712081
Energy: 0.9380574200495917
Energy: 0.9380125638169583
Energy: 1.02857442340651
Energy: 0.9379225847082937
Energy: 1.029094607965693
Energy: 1.0295967423366958
Energy: 0.914565530352277
Energy: 0.913143881486959
Energy: 1.0295502703746466
Energy: 0.913026272655268
Energy: 0.9881185584762654
Energy: 0.9366394253154736
Energy: 0.9123370114345156
Energy: 0.9127255200929805
Energy: 0.880886019442073
Energy: 0.9115068187943488
Energy: 0.8819912125604251
Energy: 0.9106239394079322
Energy: 0.9105374999814879
Energy: 0.9105849411408868
Energy: 0.9119753082894857
Energy: 0.915380642306144
Energy: 0.9728306889568188
Energy: 0.9128794520642795
Energy: 0.9740769731832335
Energy: 0.9730781516252404
Energy: 0.9254546267380646
Energy: 1.0254666019359844
Energy: 1.0325053715470598
Energy: 0.9135740718682201
Energy: 1.0312257815743586
Energy: 0.9748751265508703
Energy: 0.915535688224788
Energy: 0.9113313410141151
Energy: 0.9114382360150114
Energy: 0.9111105415099114
Energy: 0.9119760093576929
Energy: 0.9115858376059692
Energy: 0.9113027903980208
Energy: 0.9130058297205689
Energy: 0.9119569215085916
Energy: 0.9111765686334578
Energy: 0.9820051750888148
Energy: 0.9119986574389073
Energy: 0.9116648053608147
Energy: 1.0298730619815832
Energy: 0.9125401892720618
Energy: 1.0250926043766813
Energy: 1.0284465585687195
Energy: 1.0288740449122389
Energy: 1.0245196462062598
Energy: 1.0283174981381233
Energy: 1.0289854216800662
Energy: 1.0253001445228445
Energy: 1.0302799511470235
Energy: 1.030987333369391
Energy: 0.9076650458166531
Energy: 1.0291597774179773
Energy: 1.0316276703382121
Energy: 1.0412455258131883
Energy: 1.029055656186298
Energy: 1.029312223749968
Energy: 1.0407648983085627
Energy: 1.0296915238774142
Energy: 0.9816182104756711
Energy: 1.0906491510017833
Energy: 1.0253546363630746
Energy: 1.0248050424599815
Energy: 1.0486475254567007
Energy: 1.0273170379092005
Energy: 1.085495428931316
Energy: 1.0141746174649673
Energy: 1.0890503229178936
Energy: 1.0271546650310692
Energy: 1.0317272874010175
Energy: 1.0422995113504483
Energy: 1.029596339477485
Energy: 1.112773652604736
Energy: 1.029416197667167
Energy: 1.1150735681627322
Energy: 1.0641795618801106
Energy: 1.0297835054257516
Energy: 1.115179625039889

minimum gb energy = 0.880886019442073 eV
minimum distance =  2.26471369655266 Angstroms
sigma value = 17


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

Energy: 1.6208509377896658
Energy: 1.1501893804622854
Energy: 0.984690731637013
Energy: 0.9376041910497674
Energy: 1.0172238713945536
Energy: 0.9803896000740585
Energy: 0.9331887019707771
Energy: 1.0183879997064966
Energy: 1.0186803551441797
Energy: 1.028267868186327
Energy: 1.0205983114644315
Energy: 0.9672404688230911
Energy: 1.1994616821598363
Energy: 0.8439853388623136
Energy: 0.9338155271802613
Energy: 1.0178725151439576
Energy: 0.8509512607963111
Energy: 0.9345857421274072
Energy: 1.0178010475085864
Energy: 0.9344059916738836
Energy: 0.9342004249317559
Energy: 1.0179208712877312
Energy: 0.8453487879474326
Energy: 0.9345183426512143
Energy: 0.9060604041756509
Energy: 0.8928911315215173
Energy: 0.8932180825113485
Energy: 0.9067372285853819
Energy: 0.8929035927002064
Energy: 0.8939948860124795
Energy: 0.9345317205444179
Energy: 0.8914113512668173
Energy: 0.8453430340011183
Energy: 0.8481069110113735
Energy: 0.8917308411423246
Energy: 0.8450415901609379
Energy: 0.83135225983325
Energy: 0.8922783263973633
Energy: 0.8917995459699096
Energy: 0.8346700874951771
Energy: 0.8932582826201542
Energy: 0.9309060963022657
Energy: 0.8324070975082423
Energy: 0.819583586317154
Energy: 0.8366325691739385
Energy: 0.8360574349958632
Energy: 0.8243040565896593
Energy: 0.8332577683028645
Energy: 0.8338507443124015
Energy: 0.9593905570805827
Energy: 0.8320852414777739
Energy: 0.8352157859481324
Energy: 0.9022270722635214
Energy: 0.8335074209541926
Energy: 0.8338048835146319
Energy: 0.9642197730459653
Energy: 0.9562253340143071
Energy: 0.8343444558192238
Energy: 0.9085410661316179
Energy: 0.9055714088550393
Energy: 0.8327740761634986
Energy: 0.8326422261157469
Energy: 0.9030207871566382
Energy: 0.9110349148845469
Energy: 0.8343252694840746
Energy: 0.9591665593647589
Energy: 0.8363375290515265
Energy: 0.83340290663365
Energy: 0.8332896615409954
Energy: 0.8491227848077255
Energy: 0.8335995462465712
Energy: 0.8316837990123205
Energy: 0.8903607386900304
Energy: 0.8318434123982629
Energy: 0.8344981359166219
Energy: 0.9605742358068459
Energy: 0.8318937812581594
Energy: 0.8340949556903239
Energy: 0.8921644291190399
Energy: 0.9149640967088686
Energy: 0.9314775345586864
Energy: 0.8936122371602541
Energy: 0.8347851093442672
Energy: 0.8923061671694684
Energy: 0.8916499919227177
Energy: 0.8410103726014064
Energy: 0.8323934996695289
Energy: 0.8913693742948009
Energy: 0.9116299924387967
Energy: 0.8909974031890883
Energy: 1.0245748165106827
Energy: 1.0181287108317687
Energy: 0.9547956103729184
Energy: 0.8927056714108786
Energy: 1.0185272418824467
Energy: 0.9550189663999511
Energy: 0.8326889861053627
Energy: 1.0174409526641361
Energy: 1.0173850152059478
Energy: 0.924669576197792
Energy: 1.017412642884533
Energy: 0.889514721596345
Energy: 0.9065772516104711
Energy: 1.0181278198415225
Energy: 1.01720064856431
Energy: 0.906797975921459
Energy: 1.0181201732279501
Energy: 0.8913617766765399
Energy: 1.124619800223593
Energy: 1.018356972509707
Energy: 0.9691530562375099
Energy: 1.018863192243437
Energy: 0.9051549296632555
Energy: 0.8930331813221118
Energy: 1.2095770342253516
Energy: 0.8998600152346004
Energy: 0.8998928695020898
Energy: 1.0188720883815772
Energy: 0.8999096028280575
Energy: 1.025388632439772
Energy: 1.1190004256629396
Energy: 1.0183889817312815
Energy: 1.0182587688900988
Energy: 1.0191663909769426
Energy: 1.0255846259209593
Energy: 1.0181907279950446
Energy: 0.845647178616673
Energy: 1.0312461763864613
Energy: 1.097030601203086
Energy: 0.932403976881834
Energy: 1.029605484359059
Energy: 0.9335631527594926
Energy: 0.9844663383364651
Energy: 1.0198168502107745
Energy: 1.0192443974286518
Energy: 0.9858427203490333
Energy: 1.0193283124823147
Energy: 1.0975212902085438
Energy: 1.1182822746943075
Energy: 0.9351725813785559
Energy: 1.017906262289998
Energy: 1.0219264954151515
Energy: 0.9863391820274532
Energy: 1.0175525523518854
Energy: 1.0172609801949932
Energy: 0.8472198550888134
Energy: 0.9342815563462932
Energy: 1.0170191893449962
Energy: 0.8522537415030274
Energy: 0.9345540233158461
Energy: 1.019519753338943
Energy: 0.8935723028919038
Energy: 0.9552281715908697
Energy: 1.0209969052270282
Energy: 0.8933002934149159
Energy: 0.9673701906779535
Energy: 0.9344608018869135
Energy: 0.8918358932492351
Energy: 0.8916441904248882
Energy: 0.8474458015321246
Energy: 0.8910134075418354
Energy: 0.845808866626735
Energy: 0.8892972474121174
Energy: 0.8924142833515196
Energy: 0.8923441540144417
Energy: 0.8903729514834016
Energy: 0.8935862688306813
Energy: 0.8919734041999677
Energy: 0.8315520777279665
Energy: 0.966497996053418
Energy: 0.9609689502948838
Energy: 0.8435476703879813
Energy: 0.8910601212148448
Energy: 0.9614612925268392
Energy: 0.8336509108450623
Energy: 0.821283600063562
Energy: 0.9033408820931281
Energy: 0.833728608567123
Energy: 0.9500478144284874
Energy: 0.8329379999197837
Energy: 0.8381654021230648
Energy: 0.9601234678887162
Energy: 0.9563528396480766
Energy: 0.8337821482418187
Energy: 0.959456179996483
Energy: 0.8341322303852275
Energy: 0.8346030506465096
Energy: 0.957344658710514
Energy: 0.957456302391849
Energy: 0.9045783487684721
Energy: 0.9029821995741834
Energy: 0.9552986826813623
Energy: 0.8468098174780204
Energy: 0.833469014577443
Energy: 0.8336045350890913
Energy: 0.8468783251692619
Energy: 0.833836820124737
Energy: 0.8336298021379808
Energy: 0.8915513801559055
Energy: 0.9241953735924392
Energy: 0.9129034270762976
Energy: 0.9677493119676767
Energy: 0.8324357492101186
Energy: 0.9129804961017508
Energy: 0.892620294323166
Energy: 0.9111736599350315
Energy: 0.9128771675690028
Energy: 0.8927924596646843
Energy: 0.9107853171572722
Energy: 0.971840632819457
Energy: 0.8912252471505451
Energy: 0.8331491116692626
Energy: 0.8910383912354498
Energy: 0.8912341075041595
Energy: 0.8320011574111356
Energy: 0.8908069142206125
Energy: 1.1275775151772107
Energy: 0.8913374545215241
Energy: 0.8918417191469787
Energy: 0.8927820764457122
Energy: 0.9067324392545643
Energy: 0.9547832374463185
Energy: 0.8314445389581508
Energy: 1.0190433477579033
Energy: 1.018777158469684
Energy: 0.9260822171566602
Energy: 1.0195048025565632
Energy: 1.0169568603499963
Energy: 0.9070253482988256
Energy: 1.0309549311789556
Energy: 0.9016604205701564
Energy: 0.8912461886876885
Energy: 1.030528567048259
Energy: 0.8898892329840897
Energy: 1.0333844804221333
Energy: 1.018729318464506
Energy: 1.018482203237964
Energy: 1.019584375875337
Energy: 1.0195197433047967
Energy: 0.9672896212181189
Energy: 1.1245342375669638
Energy: 0.8923400567205226
Energy: 1.016351744472899
Energy: 1.0295070487972762
Energy: 0.89216410851858
Energy: 1.016010575237394
Energy: 1.1171410626536662
Energy: 0.9650782480381505
Energy: 1.015402196787468
Energy: 1.0285157246405228
Energy: 0.9042376344145527
Energy: 1.0185157216682814
Energy: 0.984017235378057
Energy: 1.0186256103101556
Energy: 1.0190987296970406
Energy: 0.9852496654350916
Energy: 1.0197907089794418
Energy: 1.097646971492127

minimum gb energy = 0.819583586317154 eV
minimum distance =  2.23995649101547 Angstroms
sigma value = 57


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

Energy: 0.7867111396254456
Energy: 1.10632870813798
Energy: 0.9646272009244905
Energy: 0.8365591946756097
Energy: 1.0089866997220003
Energy: 1.0124918326404717
Energy: 1.0974711900458352
Energy: 1.001562251689602
Energy: 0.8825335196521287
Energy: 1.0001976220760591
Energy: 0.9962679693339039
Energy: 0.9499747007098157
Energy: 1.0674210306477592
Energy: 0.8310520166434295
Energy: 0.8312647152284897
Energy: 0.9942817494143246
Energy: 0.8306536551847462
Energy: 0.9212670504468741
Energy: 1.0014734472937215
Energy: 0.8323144226928321
Energy: 0.9206808156475595
Energy: 1.0017903082248736
Energy: 0.8311394898946678
Energy: 0.9205536800180882
Energy: 0.8684060022337807
Energy: 0.8859144822543172
Energy: 0.8791211755337316
Energy: 0.9224019842893545
Energy: 0.8806060197514702
Energy: 0.878851162099263
Energy: 0.8326372180023642
Energy: 0.8773041532139337
Energy: 0.8314639790243593
Energy: 0.9137242190342503
Energy: 0.8772956433755872
Energy: 0.8359523373388679
Energy: 0.8083434273453968
Energy: 0.880607397355077
Energy: 0.8774117616151663
Energy: 0.8819691302383325
Energy: 0.8814730165279583
Energy: 0.9019441232413816
Energy: 0.9358243610567742
Energy: 0.9008170058469049
Energy: 0.9208426108473259
Energy: 0.8080823741788081
Energy: 0.9009854142569554
Energy: 0.813599495854585
Energy: 0.8116676677735373
Energy: 0.8727921251995544
Energy: 0.8071731085861416
Energy: 0.8129302127353337
Energy: 0.829892799964733
Energy: 0.8072766714558204
Energy: 0.8078124683448358
Energy: 0.89793821888762
Energy: 0.8992242907894228
Energy: 0.8081417493451721
Energy: 0.7755065389830855
Energy: 0.9045074402775838
Energy: 0.7817744368355511
Energy: 0.7749005195882498
Energy: 0.7786888487218082
Energy: 0.8988079045887152
Energy: 0.7757622964339065
Energy: 0.9060322180746253
Energy: 0.811465685509453
Energy: 0.7752839674380848
Energy: 0.7747310682439983
Energy: 0.8605858716960468
Energy: 0.7803521713985557
Energy: 0.8429389627915354
Energy: 0.7734529111993187
Energy: 0.9012234763557827
Energy: 0.8987342938383835
Energy: 0.9060089631892129
Energy: 0.8476680290873946
Energy: 0.8993330320385906
Energy: 0.7750535320881783
Energy: 0.9010204774490321
Energy: 0.7743751393683305
Energy: 0.7774501986011974
Energy: 0.7766741264303917
Energy: 0.7748499740844138
Energy: 0.7747690127306744
Energy: 0.9090361557596737
Energy: 0.8443234284298199
Energy: 0.7743437111316149
Energy: 0.9004159679256644
Energy: 0.896323648556492
Energy: 0.8279673412988053
Energy: 0.8077302409912182
Energy: 0.9161422675124256
Energy: 0.8536160020855295
Energy: 0.8083607230320236
Energy: 0.9130422023056122
Energy: 0.8232920425352319
Energy: 0.8074708016452482
Energy: 0.8073872930924904
Energy: 0.8845370475966357
Energy: 0.8071526709870791
Energy: 0.8076326097549886
Energy: 0.8773069598454963
Energy: 0.8078983956178267
Energy: 0.871552165647388
Energy: 0.875732135642373
Energy: 0.8176450237591635
Energy: 0.9246693224487731
Energy: 0.8773861172986082
Energy: 0.8729809265978347
Energy: 0.8766183348742997
Energy: 0.8788663313878308
Energy: 0.8259518045088997
Energy: 0.8774651647033278
Energy: 0.9893040656779901
Energy: 0.8715286403652092
Energy: 0.8123691783001744
Energy: 0.8796815754765971
Energy: 0.8130077590704323
Energy: 0.8775742799744266
Energy: 1.0810176161141243
Energy: 0.8836429350593157
Energy: 0.9304142153760124
Energy: 0.8793122167959765
Energy: 1.002314906033149
Energy: 0.8775018594329002
Energy: 0.8763354069687636
Energy: 0.9945925163405268
Energy: 0.8765714012273984
Energy: 0.8707162332066317
Energy: 0.9948353921899182
Energy: 0.876201254682157
Energy: 0.8908382533559438
Energy: 0.9947476854256021
Energy: 0.9947375353330694
Energy: 0.8916352425201304
Energy: 1.0014475080116638
Energy: 0.9971072935386068
Energy: 1.0838968932608148
Energy: 0.8826125448855249
Energy: 0.9288117366113462
Energy: 1.002690594582327
Energy: 0.8939959088995204
Energy: 0.8787602513134495
Energy: 1.1539499472060082
Energy: 0.8789283292511739
Energy: 0.8805616230169461
Energy: 1.0030648511401599
Energy: 0.881306059332308
Energy: 0.9928671997707699
Energy: 1.0693685512801598
Energy: 1.0046724570727934
Energy: 0.9947316689451668
Energy: 0.9966708521067815
Energy: 0.9992060656530883
Energy: 0.9934937742970087
Energy: 0.8704322910740593
Energy: 1.003802416543404
Energy: 0.9209362929267331
Energy: 0.8329074648346396
Energy: 1.003083868237399
Energy: 0.9213258513873143

minimum gb energy = 0.7734529111993187 eV
minimum distance =  2.25131564360664 Angstroms
sigma value = 43


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

Energy: 0.6979416874038062
Energy: 1.0108985220623543
Energy: 0.8995533297065956
Energy: 0.8590482721650532
Energy: 0.9318744169040922
Energy: 0.8249494322587467
Energy: 0.9799674937212283
Energy: 0.8134006430751707
Energy: 0.8480980599600618
Energy: 0.9042286332561443
Energy: 0.8172908411269143
Energy: 0.8474015004275439
Energy: 0.9544087681394167
Energy: 0.7251632471811226
Energy: 0.7733310486275363
Energy: 0.9037122454075344
Energy: 0.7275670380143
Energy: 0.7742693553237011
Energy: 0.9037245423526288
Energy: 0.7730689762277658
Energy: 0.7741396624255313
Energy: 0.815986195173413
Energy: 0.7772279072394068
Energy: 0.847716102316296
Energy: 0.8829923835136697
Energy: 0.8116771293383431
Energy: 0.8116869004883845
Energy: 0.790535172918614
Energy: 0.815010314461916
Energy: 0.847429539529843
Energy: 0.6738705517233531
Energy: 0.8111512976451578
Energy: 0.7733158675697626
Energy: 0.7989457883271966
Energy: 0.8110478903407106
Energy: 0.7244635573543913
Energy: 0.9346013937678505
Energy: 0.8114070295152549
Energy: 0.8112941630270428
Energy: 0.7534725465811535
Energy: 0.8123946331647449
Energy: 0.837478192652974
Energy: 0.9308799936276052
Energy: 0.797071642907989
Energy: 0.8104431381678288
Energy: 0.7505246734989419
Energy: 0.797161514899861
Energy: 0.8095443868982813
Energy: 0.7525170598893915
Energy: 0.8097222006090703
Energy: 0.7486963660439078
Energy: 0.7500811229601748
Energy: 0.7583197892278446
Energy: 0.7487608122532675
Energy: 0.723194962297696
Energy: 0.8101710844726032
Energy: 0.7994303018139408
Energy: 0.7485208487409868
Energy: 0.7138530761255394
Energy: 0.7993988450808108
Energy: 0.6680065783301369
Energy: 0.7073018289399955
Energy: 0.7077073255009767
Energy: 0.7834908757114107
Energy: 0.7072885964180525
Energy: 0.7985403327761887
Energy: 0.8128443618601703
Energy: 0.7074469444935461
Energy: 0.7070672361024755
Energy: 0.7463206581797577
Energy: 0.707900855523114
Energy: 0.8025359300384848
Energy: 0.8827153523006851
Energy: 0.7832456857850578
Energy: 0.7912615600677431
Energy: 0.7488889152236381
Energy: 0.7832522522660569
Energy: 0.7927181814299304
Energy: 0.6828623425704702
Energy: 0.7410537290522655
Energy: 0.6821154545316609
Energy: 0.6848830901199151
Energy: 0.6706193391387804
Energy: 0.6825336382237112
Energy: 0.681746752701191
Energy: 0.7776495177148381
Energy: 0.7775386053445009
Energy: 0.6817864665707688
Energy: 0.7364073273489476
Energy: 0.7779392754537986
Energy: 0.6733299310922813
Energy: 0.6704157730094659
Energy: 0.6700676415876115
Energy: 0.7810631800424332
Energy: 0.6705641601494728
Energy: 0.7808246233109334
Energy: 0.6878253795644708
Energy: 0.6708477455527352
Energy: 0.6701201350738465
Energy: 0.7792502189358359
Energy: 0.6705031079521709
Energy: 0.7787521078263999
Energy: 0.670005378875291
Energy: 0.7801539068148108
Energy: 0.7849706659039037
Energy: 0.6707440265345255
Energy: 0.7798571157739133
Energy: 0.7806194816108413
Energy: 0.6706363267499003
Energy: 0.7363393470790038
Energy: 0.6702049937064106
Energy: 0.6725394266544631
Energy: 0.812233741077188
Energy: 0.6704102925860174
Energy: 0.6709174357842951
Energy: 0.7826692148838108
Energy: 0.7831993915167544
Energy: 0.6710676668789021
Energy: 0.7819269420007608
Energy: 0.7830416444010766
Energy: 0.7867177201244737
Energy: 0.6826032163198698
Energy: 0.6821215050803723
Energy: 0.784516027021753
Energy: 0.682653843480459
Energy: 0.7871142594311579
Energy: 0.6737784295564044
Energy: 0.6824292074189046
Energy: 0.6818634613886803
Energy: 0.7906816979000557
Energy: 0.6821070708876245
Energy: 0.7840548499382379
Energy: 0.7071234756294222
Energy: 0.743091433162318
Energy: 0.7836406710794758
Energy: 0.7069454031960306
Energy: 0.6833839672818304
Energy: 0.7840831239131948
Energy: 0.7079122908734966
Energy: 0.7086606926111558
Energy: 0.7072977583185537
Energy: 0.7102136644533288
Energy: 0.6827905189812079
Energy: 0.7077757943236908
Energy: 0.9024535915125139
Energy: 0.7904421688876557
Energy: 0.8004501761324547
Energy: 0.7095789946986858
Energy: 0.7905202308740272
Energy: 0.7997953452758941
Energy: 0.9060578815033316
Energy: 0.7487109766296383
Energy: 0.7484056986961094
Energy: 0.7093421384399355
Energy: 0.7490287156297909
Energy: 0.8117202483464065
Energy: 0.6716374751062892
Energy: 0.7486523820692083
Energy: 0.7485833920106746
Energy: 0.7914439380892704
Energy: 0.7485416370986119
Energy: 0.8083075108230654
Energy: 0.7855505792676796
Energy: 0.794529449664275
Energy: 0.7954301329315983
Energy: 0.8111775779531416
Energy: 0.7511732722913417
Energy: 0.8262242133193032
Energy: 0.815475966660224
Energy: 0.7484439587729077
Energy: 0.8115069184682743
Energy: 0.8131326387525486
Energy: 0.7985666321198484
Energy: 0.8116700571462508
Energy: 0.9673666887432111
Energy: 0.8095467615245108
Energy: 0.7492376487600133
Energy: 0.8115683466020255
Energy: 0.8094421877842302
Energy: 0.7944641771368456
Energy: 0.9642245452685815
Energy: 0.8118668153417011
Energy: 0.848324183366309
Energy: 0.8141080095219366
Energy: 0.8173288810821975
Energy: 0.8471130940276016
Energy: 0.6849783469357225
Energy: 0.9037486316108317
Energy: 0.8108562053275736
Energy: 0.8123394802492847
Energy: 0.9034678228399007
Energy: 0.7506312611285219
Energy: 0.8971979536191342
Energy: 0.9040943446154176
Energy: 0.903839473175278
Energy: 0.8121503503985629
Energy: 0.9066815698291567
Energy: 0.9051664173911366
Energy: 0.9718596171997129
Energy: 0.8121877124131167
Energy: 0.8117213274429044
Energy: 0.8151784303530487
Energy: 0.8174962877081399
Energy: 0.9027352160663141
Energy: 0.9543700196392395
Energy: 0.7514091089836133
Energy: 0.8125343586853709
Energy: 0.9093999453304412
Energy: 0.752578148115208
Energy: 0.8128509257850064
Energy: 0.9799674943344897
Energy: 0.9048946892275561
Energy: 0.9038911741625753
Energy: 0.9046053221459485
Energy: 0.9067057991227486
Energy: 0.9047197673128243

minimum gb energy = 0.6680065783301369 eV
minimum distance =  2.22497316471494 Angstroms
sigma value = 81


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

Energy: 0.4699202917087948
Energy: 0.5180038506720337
Energy: 0.14343844499448416
Energy: 0.14606556585753924
Energy: 0.7041287482440469
Energy: 0.47000686020437465
Energy: 0.5182461945406662
Energy: 0.7408059398946937
Energy: 0.7030232509151253
Energy: 0.811197988974796
Energy: 0.770648854904092
Energy: 0.7493886146614016
Energy: 0.8010515263073157
Energy: 0.14356596614587416
Energy: 0.1435237849653084
Energy: 0.8138787442312112
Energy: 0.14349641094075416
Energy: 0.19903004147081974
Energy: 0.7803118068464131
Energy: 0.14383172610076325
Energy: 0.1439340874161122
Energy: 0.798853852205523
Energy: 0.14352677304819753
Energy: 0.1982245700898723
Energy: 0.1977609169916658
Energy: 0.786237486932528
Energy: 0.771227900606187
Energy: 0.19885505798585307
Energy: 0.8474526777084007
Energy: 0.7851609366015796
Energy: 0.1445851697902276
Energy: 0.7965038787422534
Energy: 0.14382087698733742
Energy: 0.14326154786975287
Energy: 0.7950087867434853
Energy: 0.1437528459170468
Energy: 0.8313960322612942
Energy: 0.7346559861258185
Energy: 0.7473337846581929
Energy: 0.8489578978150649
Energy: 0.7495354596986864
Energy: 0.7958550287951714
Energy: 0.8253556100155228
Energy: 0.14357325152250142
Energy: 0.14354547924242275
Energy: 0.8467345680453016
Energy: 0.14345811590630914
Energy: 0.1438315939150612
Energy: 0.7611459207229705
Energy: 0.1436033487891808
Energy: 0.19871672408269606
Energy: 0.7659400849388747
Energy: 0.14361117726637398
Energy: 0.2001400156669679
Energy: 0.47001821325223403
Energy: 0.7845970118705977
Energy: 0.7571691690052328
Energy: 0.14418791953139815
Energy: 0.756665747572508
Energy: 0.7861222024824329

minimum gb energy = 0.14326154786975287 eV
minimum distance =  2.3167929833192 Angstroms
sigma value = 3


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

Energy: 1.0124434523147716
Energy: 0.9937700280509391
Energy: 0.952896120793122
Energy: 0.8529146839006538
Energy: 0.9569478474989038
Energy: 0.8565319171668877
Energy: 0.8985315888835135
Energy: 0.9322020350953133
Energy: 0.9313825664816763
Energy: 0.9322728710955532
Energy: 0.9337047726298064
Energy: 0.8590935652958083
Energy: 0.949187020051705
Energy: 0.8522911456773427
Energy: 0.8539993244528099
Energy: 0.9332832969539382
Energy: 0.8519859748017283
Energy: 0.9262351813755179
Energy: 0.8651583155269365
Energy: 0.8519763509505868
Energy: 0.8803867803426121
Energy: 0.8626662021547867
Energy: 0.7764054148180753
Energy: 0.8513264857581236
Energy: 0.7796413922824581
Energy: 0.9324347299887865
Energy: 0.8572697575562681
Energy: 0.7796328295034887
Energy: 0.9331453168280487
Energy: 0.8574013358204353
Energy: 0.7236569232120141
Energy: 0.8564463087870874
Energy: 0.8582283171521631
Energy: 0.7224796325515874
Energy: 0.8562708881335288
Energy: 0.7774945977669425
Energy: 0.8606134709661727
Energy: 0.785314653606312
Energy: 0.7870334958930414
Energy: 0.8607662663857402
Energy: 0.7855179815903335
Energy: 0.7867898507526998
Energy: 0.8632455774471023
Energy: 0.7809781853487507
Energy: 0.7812151836682851
Energy: 0.8631718335490356
Energy: 0.7693719887933315
Energy: 0.7811422380617405
Energy: 0.7316255128387958
Energy: 0.7817197583231109
Energy: 0.7882420965174156
Energy: 0.7885936833406569
Energy: 0.7246359687945334
Energy: 0.7890359243713686
Energy: 0.729472052478639
Energy: 0.785137290960994
Energy: 0.7853519751020729
Energy: 0.7297494915248257
Energy: 0.7880086092707291
Energy: 0.7860511052565943
Energy: 0.6894911121030471
Energy: 0.786759909689934
Energy: 0.7869082541180106
Energy: 0.6893950598339176
Energy: 0.6942024170050155
Energy: 0.7259542446320904
Energy: 0.728566393382753
Energy: 0.786352991301805
Energy: 0.7865604563111165
Energy: 0.728443065271077
Energy: 0.732805562732036
Energy: 0.728809121051921
Energy: 0.7287109339860641
Energy: 0.7238760255411104
Energy: 0.7294191481074068
Energy: 0.7287200237151189
Energy: 0.6718382044266441
Energy: 0.7288666286835243
Energy: 0.6746636128894259
Energy: 0.7290775636655872
Energy: 0.7315333776986725
Energy: 0.7329556915109218
Energy: 0.6921879009269596
Energy: 0.7320731129158948
Energy: 0.831943940505217
Energy: 0.6919155385288144
Energy: 0.692013269578292
Energy: 0.8313168898243278
Energy: 0.6945293551340852
Energy: 0.6923873199509759
Energy: 0.8315010191867722
Energy: 0.6921457304795657
Energy: 0.6924081368513764
Energy: 0.7535184798052157
Energy: 0.8230996011228239
Energy: 0.6940280810402712
Energy: 0.6744749890837703
Energy: 0.692386558956091
Energy: 0.8016478885867289
Energy: 0.6744811106814893
Energy: 0.6921574472154355
Energy: 0.6744570147558476
Energy: 0.6743988292941147
Energy: 0.6765994732472492
Energy: 0.7166788970407312
Energy: 0.6744138489182411
Energy: 0.6741806369423488
Energy: 0.6755910357636375
Energy: 0.6919898515034593
Energy: 0.6745571461523661
Energy: 0.7673217185376711
Energy: 0.6753975293191029
Energy: 0.6744337764301578
Energy: 0.8070924536887891
Energy: 0.8231138893321551
Energy: 0.6745928369415006
Energy: 0.6744096364057677
Energy: 0.8249619120292452
Energy: 0.6749316528518161
Energy: 0.674754884862446
Energy: 0.8234687423298789
Energy: 0.7251854926050942
Energy: 0.8021265694529224
Energy: 0.8420604390444963
Energy: 0.7537680778331513
Energy: 0.6924570633273566
Energy: 0.6918792863974897
Energy: 0.7532368643852215
Energy: 0.6933117067918435
Energy: 0.6917360657951388
Energy: 0.7527342997484905
Energy: 0.6917258315010303
Energy: 0.6917605313742612
Energy: 0.7289051781019456
Energy: 0.7292112116508515
Energy: 0.6917617291824224
Energy: 0.7285395193606241
Energy: 0.7285850094239332
Energy: 0.8378084410689253
Energy: 0.7282982686891762
Energy: 0.7287082386240271
Energy: 0.7281092779936209
Energy: 0.7280721606549699
Energy: 0.7039181713266489
Energy: 0.691671959140072
Energy: 0.7286578497230651
Energy: 0.7284744218570628
Energy: 0.6933836723208961
Energy: 0.7287582199535898
Energy: 0.7288952817311732
Energy: 0.856298270544043
Energy: 0.7502909778601565
Energy: 0.7524125173257201
Energy: 0.6928164922372703
Energy: 0.8031753621481256
Energy: 0.7859345357798143
Energy: 0.7876515781599848
Energy: 0.7517475392217193
Energy: 0.7505697528263541
Energy: 0.7876704582379105
Energy: 0.706140130944996
Energy: 0.7855355052500241
Energy: 0.7484231111011529
Energy: 0.7884731590971319
Energy: 0.7893868710895976
Energy: 0.7484079475260057
Energy: 0.7883648865776469
Energy: 0.7865608314458907
Energy: 0.8570797454303647
Energy: 0.8626629994291894
Energy: 0.8174107976261332
Energy: 0.7011065480658543
Energy: 0.8622240394951628
Energy: 0.745965881385599
Energy: 0.7851046122781234
Energy: 0.860986651215918
Energy: 0.7883836012584404
Energy: 0.7852197338852757
Energy: 0.8614079112848668
Energy: 0.7871487273621984
Energy: 0.8623226705786843
Energy: 0.8122897845066704
Energy: 0.8114296255891976
Energy: 0.8626709893761694
Energy: 0.7005568006398881
Energy: 0.811367412998695
Energy: 0.9632917970700965
Energy: 0.813554234291068
Energy: 0.7487893793726271
Energy: 0.9348501987109925
Energy: 0.7457153409473575
Energy: 0.8578461767404932
Energy: 0.8100472537978859
Energy: 0.8614261574351638
Energy: 0.8613397366975352
Energy: 0.8101039277962522
Energy: 0.8653000869350401
Energy: 0.8857021478065058

minimum gb energy = 0.6718382044266441 eV
minimum distance =  2.21780478670067 Angstroms
sigma value = 67


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

Energy: 1.078018198356145
Energy: 1.1330009328354238
Energy: 1.0346384197373193
Energy: 0.8232256064045509
Energy: 1.139525828426421
Energy: 1.03932616526248
Energy: 1.0021538070022071
Energy: 1.046819949085002
Energy: 1.043152666794021
Energy: 1.0440281354099024
Energy: 1.0447687577921443
Energy: 0.9534717817980857
Energy: 1.0825860697177545
Energy: 0.9403318456867276
Energy: 1.037443235359423
Energy: 1.042152351526942
Energy: 0.9388167437025104
Energy: 1.0384991117826612
Energy: 0.9481983772163861
Energy: 1.0372614825775854
Energy: 1.038206409586239
Energy: 0.9496697283334967
Energy: 0.8565015216356198
Energy: 1.0384354651186574
Energy: 0.947677767406957
Energy: 1.0471838577664951
Energy: 0.9533092551424308
Energy: 0.948004628964752
Energy: 1.0444843063696008
Energy: 1.0399356412291412
Energy: 0.9811886887237817
Energy: 1.0408104117964456
Energy: 0.9436484802731776
Energy: 0.8572616841778479
Energy: 1.0409500547049662
Energy: 0.9439094745002609
Energy: 0.9479980278581158
Energy: 0.9547918611291342
Energy: 0.8570490547144324
Energy: 0.9476681166751904
Energy: 0.9528161718525062
Energy: 0.8634513827521354
Energy: 0.9468365152002965
Energy: 0.8088399924680119
Energy: 0.8512817753426524
Energy: 0.9466985318719587
Energy: 0.8103715504381441
Energy: 0.9452335316343224
Energy: 0.9841902298539165
Energy: 0.8453786912724621
Energy: 0.8556368169616504
Energy: 0.8626751545400545
Energy: 0.8532751169186454
Energy: 0.9482110436941698
Energy: 0.9882049103454826
Energy: 0.859501187278995
Energy: 0.8549402272024358
Energy: 0.9899436068018389
Energy: 0.856778234088338
Energy: 0.8538831543821183
Energy: 0.9844693373395693
Energy: 0.8532599045702285
Energy: 0.8530224210291824
Energy: 0.8104238890840778
Energy: 0.9635822937573533
Energy: 0.8550048758931035
Energy: 0.8091197981250136
Energy: 0.852905643525213
Energy: 0.9469111953641969
Energy: 0.80880446132469
Energy: 0.8585132518464577
Energy: 0.807569163566102
Energy: 0.8088805167450478
Energy: 0.8071200749252256
Energy: 0.8441189124235272
Energy: 0.8089230792176172
Energy: 0.8132242920897655
Energy: 0.8076871274572928
Energy: 0.9578134389388931
Energy: 0.8381663715373322
Energy: 0.8109569677683713
Energy: 0.8106395254260785
Energy: 0.8080994007573663
Energy: 0.843333811425706
Energy: 0.9590884506719625
Energy: 0.814064252629015
Energy: 0.8090019467517594
Energy: 0.9587737195203566
Energy: 0.8121100876447804
Energy: 0.8095046886361049
Energy: 0.9602002189477258
Energy: 0.8110790768235263
Energy: 0.8663626959725181
Energy: 0.8568382442969253
Energy: 0.8990501303531561
Energy: 0.8543668576864732
Energy: 0.8538158618625096
Energy: 0.793535540771474
Energy: 0.866750544426661
Energy: 0.85392526105774
Energy: 0.7991509637384555
Energy: 0.8532389199441097
Energy: 0.8547589450113797
Energy: 0.8619360611601388
Energy: 0.8657277497752425
Energy: 0.8545400441405714
Energy: 0.8612211995272916
Energy: 0.8585360203735246
Energy: 0.9602265030735531
Energy: 0.9878846768087481
Energy: 0.8864876470362422
Energy: 0.8236640758718193
Energy: 0.9834635011874863
Energy: 0.8851846179745702
Energy: 0.8520845465282392
Energy: 0.9525251286002377
Energy: 0.9462412556564869
Energy: 0.9506377975238006
Energy: 0.95070320741322
Energy: 0.9456487311820803
Energy: 0.9483901160198912
Energy: 1.0019365236006326
Energy: 1.003332889804678
Energy: 0.9499062868733391
Energy: 0.961824309512993
Energy: 1.0013494738958322
Energy: 1.0819514994198327
Energy: 0.875041801383622
Energy: 1.0020399886006142
Energy: 1.0423475775208693
Energy: 0.8160602707453596
Energy: 1.002376422577564
Energy: 1.0024860127407031
Energy: 0.95585714937298
Energy: 0.9460982774835047
Energy: 1.0031905375001027
Energy: 0.9496497804634567
Energy: 0.9461679237901333

minimum gb energy = 0.793535540771474 eV
minimum distance =  2.21919151894256 Angstroms
sigma value = 33


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

Energy: 1.225074553068285
Energy: 1.2009554977068808
Energy: 1.2021214759423704
Energy: 1.107945932869181
Energy: 1.1198610826481266
Energy: 1.079949674920229
Energy: 1.0436777378405426
Energy: 1.0895110353629975
Energy: 1.0889283552417883
Energy: 1.088356377533441
Energy: 1.0910918841596777
Energy: 1.089432156332432
Energy: 1.1448354492563915
Energy: 1.0539551987203246
Energy: 1.056604356620009
Energy: 1.0903831883113333
Energy: 1.0557892995205413
Energy: 1.084298050717579
Energy: 1.0928593772563828
Energy: 1.056412362217214
Energy: 1.0535041364653797
Energy: 1.089765446253657
Energy: 0.9898914324559643
Energy: 1.0971027128884665
Energy: 0.9841596910498615
Energy: 1.0920165125229635
Energy: 1.0896056983488394
Energy: 0.9831375891212413
Energy: 1.0919550658617712
Energy: 1.1053608746678545
Energy: 1.0869447945226074
Energy: 1.0921880162861364
Energy: 1.0924036165339401
Energy: 0.8968495873664819
Energy: 1.0919686910637334
Energy: 0.987934135826141
Energy: 0.985734179356146
Energy: 1.102303965007317
Energy: 0.9945628424633367
Energy: 0.9847053168002691
Energy: 1.0973876588479714
Energy: 0.9868456101175551
Energy: 0.9845856586338099
Energy: 0.9009347760845823
Energy: 0.9518095087150531
Energy: 0.9842908380301705
Energy: 0.9010416210672896
Energy: 0.9840789895615063
Energy: 1.0406009330115678
Energy: 0.9993233856641444
Energy: 0.9915440781492167
Energy: 0.9886448229640643
Energy: 0.9028482243148982
Energy: 0.9871674422296147
Energy: 1.0389324125395405
Energy: 0.9022638040954744
Energy: 0.9013666668501624
Energy: 1.0411664436571986
Energy: 0.9034461078572409
Energy: 0.9020356331974284
Energy: 1.0391673292954349
Energy: 0.9016945382614484
Energy: 0.9021613036047175
Energy: 0.9063548585383833
Energy: 0.9743480128124132
Energy: 0.9051450225601527
Energy: 0.9009580214514666
Energy: 0.902539803772376
Energy: 0.9032687770782245
Energy: 0.9009072708636119
Energy: 0.9189423456692358
Energy: 0.9010825630655337
Energy: 0.9011099332779279
Energy: 0.9903043976872224
Energy: 0.9027216607337262
Energy: 0.9010320380525998
Energy: 0.9879109529357464
Energy: 0.9017304988584933
Energy: 1.0469563433305353
Energy: 0.989275070380309
Energy: 0.9890163968222578
Energy: 0.8843284043074585
Energy: 1.0215745926896214
Energy: 0.9194560490183189
Energy: 0.9719473598993493
Energy: 0.9846783004580502
Energy: 0.9838410529444294
Energy: 0.9737970213155572
Energy: 0.9862848169230395
Energy: 0.9488912204255644
Energy: 1.0943257548081107
Energy: 1.0543662921841817
Energy: 0.9201799666779841
Energy: 1.0955686314291702
Energy: 0.9186759638299923
Energy: 0.9847167315958233
Energy: 1.1458746288979482
Energy: 0.9181043453701194
Energy: 0.9190939911392736
Energy: 1.089918274478079
Energy: 0.9255555090982367
Energy: 1.0572027594466766
Energy: 1.1447898565847772
Energy: 1.0883457091884392
Energy: 0.984386298834604
Energy: 1.0937312972093816
Energy: 1.0926940053197614
Energy: 1.0778033186062876
Energy: 1.1216786592271422
Energy: 1.0897519602462127
Energy: 1.1264861564838595
Energy: 0.9161956585149473
Energy: 1.0896199527882073
Energy: 1.0562731417834303
Energy: 1.0437490193871204
Energy: 1.091586302668193
Energy: 1.0891761028296172
Energy: 1.04404256289605
Energy: 1.0915835679375432
Energy: 1.0899800321046444
Energy: 1.1507170387088894
Energy: 1.0534860057043411
Energy: 1.0554545931116215
Energy: 1.0911667762990642
Energy: 0.985817041750527
Energy: 1.0837750232368983
Energy: 1.0901196328012293
Energy: 1.0539211293600654
Energy: 1.0564405944704351
Energy: 1.0898851261727374
Energy: 1.0538354195949127
Energy: 1.0989103298523235
Energy: 0.9842478424028419
Energy: 1.090579867123939
Energy: 1.0886065820310242
Energy: 0.9840682837449781
Energy: 1.0909876515452444
Energy: 1.096215192559216
Energy: 1.0867966515290763
Energy: 1.0956399487265431
Energy: 1.0917500840255523
Energy: 0.9466859173437416
Energy: 1.1420871450137553
Energy: 1.0169002626338388
Energy: 0.9853542422296374
Energy: 1.1037485573689947
Energy: 1.0906825081239868
Energy: 0.9831410847122569
Energy: 1.1002165432190447
Energy: 0.9870460763825785
Energy: 0.9843787869027918
Energy: 0.9012065538117301
Energy: 0.9516192568399934
Energy: 0.984177122867175
Energy: 0.9088372182912684
Energy: 0.9835857805852066
Energy: 1.0395448276026609
Energy: 0.9009522888192435
Energy: 0.9049114141222324
Energy: 0.988618955860475
Energy: 0.9274018660192617
Energy: 0.9867189736253225
Energy: 1.0381010601154972
Energy: 0.9027710709234368
Energy: 0.9030058022725083
Energy: 1.040563252082202
Energy: 0.9038301597284895
Energy: 0.9021800322277032
Energy: 1.0399021106193527
Energy: 0.9335541524188506
Energy: 0.9022149776758015
Energy: 0.9084036603117795
Energy: 0.9017860864448839
Energy: 0.9031123821984002
Energy: 0.9009496887066968
Energy: 0.9025779155617146
Energy: 0.9039950283811272
Energy: 0.9009704202426619
Energy: 0.9295222282286532
Energy: 0.9013914181860251
Energy: 0.9042120802665234
Energy: 0.9895017736281433
Energy: 0.9022467891127001
Energy: 0.9021429820358334
Energy: 0.9890826190721401
Energy: 0.9016448562900558
Energy: 1.0476558065459431
Energy: 0.9881974632993669
Energy: 0.9889012225609374
Energy: 0.8855695465995345
Energy: 0.9887705979247391
Energy: 0.9319388218663452
Energy: 1.0492977929032137
Energy: 0.9847960727952978
Energy: 0.9838832604077064
Energy: 1.049994128959698
Energy: 0.9873769077080451
Energy: 0.9493442601324008
Energy: 0.9865681133725738
Energy: 1.0072448902057922
Energy: 0.987513437620217
Energy: 0.9879972388148068
Energy: 0.9175433857528565
Energy: 0.9864243463552593
Energy: 1.145371387127325
Energy: 0.9182244492686749
Energy: 0.929040085751566
Energy: 1.089798718815925
Energy: 0.8764106937721167
Energy: 1.0505356683043112
Energy: 1.1529202448344196
Energy: 0.9840722491449515
Energy: 0.9894199005999597
Energy: 1.0920455523550558
Energy: 0.9869715238350859
Energy: 0.9879084038265128
Energy: 1.1220630585147355
Energy: 1.0898421046974205
Energy: 1.1270911727969959
Energy: 0.9159032838851017
Energy: 1.0902044799064687
Energy: 0.9175319349331802

minimum gb energy = 0.8764106937721167 eV
minimum distance =  2.22780522664874 Angstroms
sigma value = 41


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

Energy: 1.3674908050020698
Energy: 1.2547705264955664
Energy: 1.2564252582051396
Energy: 1.1105524064255932
Energy: 1.1784638632497293
Energy: 1.2534644705434743
Energy: 1.0926190433683483
Energy: 1.1471240318155858
Energy: 1.1385502266107057
Energy: 1.140694105797839
Energy: 1.1415509927808607
Energy: 1.1202138460010984
Energy: 1.220660023974183
Energy: 1.0276450795297574
Energy: 1.026917215845286
Energy: 1.141346518092048
Energy: 1.0290420968000606
Energy: 1.0477628421625946
Energy: 1.145590647176609
Energy: 1.0289386217689942
Energy: 1.028489248534735
Energy: 1.1474651364911295
Energy: 1.0482994477857646
Energy: 1.0525824018809677
Energy: 1.0510653150929727
Energy: 1.1485899201999827
Energy: 1.1388249546063092
Energy: 1.051112556043852
Energy: 1.1434841247693952
Energy: 1.0321563599477617
Energy: 1.1473729753256052
Energy: 1.1227483654011665
Energy: 1.0314631879626162
Energy: 1.032870650144731
Energy: 1.1817562978891056
Energy: 1.0298460467619712
Energy: 1.0511275323186922
Energy: 1.1590097829277142
Energy: 1.0302531387867577
Energy: 1.0509402813695456
Energy: 1.156126211681162
Energy: 1.0348991941193517
Energy: 1.0579046443003888
Energy: 1.0303751784431987
Energy: 1.0320998063517757
Energy: 1.0593934834626662
Energy: 1.0392490001443242
Energy: 1.0516849623605025
Energy: 1.1178295246735381
Energy: 1.033595758726836
Energy: 1.0295890272864983
Energy: 1.1161328279982843
Energy: 1.057645011472122
Energy: 1.0294331419864193
Energy: 1.0892757701713622
Energy: 1.0592582948068556
Energy: 1.0508794641939012
Energy: 1.063701730908294
Energy: 1.0543436222954288
Energy: 1.032220518139986
Energy: 1.1516788555980977
Energy: 1.073954003715224
Energy: 1.0561155409393446
Energy: 1.1518861136905454
Energy: 1.004374656376945
Energy: 1.1217576225625288
Energy: 1.2329457352281261
Energy: 1.0032352980497001
Energy: 1.0726320992147091
Energy: 1.1406657539242246
Energy: 1.004040649121104
Energy: 1.0712760267887877
Energy: 1.224383861859423
Energy: 1.1390943513940663
Energy: 1.0718414881486344
Energy: 1.1414597735014287
Energy: 1.1464187848216463
Energy: 1.1267012287457574
Energy: 1.1676847653085822
Energy: 1.1416694559738405
Energy: 1.0128154055926042
Energy: 1.0114411658836564
Energy: 1.1416161683478023
Energy: 1.0033688244142005

minimum gb energy = 1.0032352980497001 eV
minimum distance =  2.23626447753039 Angstroms
sigma value = 11


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

Energy: 1.6865039852542578
Energy: 1.2017288436790194
Energy: 1.2079148006281855
Energy: 1.2168952719546866
Energy: 1.1866938857001224
Energy: 1.2093728441116092
Energy: 1.2799652032358189
Energy: 1.1610986127824297
Energy: 1.1613377759125703
Energy: 1.198665784176815
Energy: 1.1607896820389008
Energy: 1.1885752650027614
Energy: 1.2201111101231334
Energy: 1.1508241682929292
Energy: 1.180682560388291
Energy: 1.1685543370516367
Energy: 1.1499891903161987
Energy: 1.182442416115953
Energy: 1.19660830943146
Energy: 1.1496486208868988
Energy: 1.183096446870334
Energy: 1.166201529329281
Energy: 1.1496448133986008
Energy: 1.1823220138790669
Energy: 1.1958007095815277
Energy: 1.1607133030914325
Energy: 1.1604308890549906
Energy: 1.2002518270084503
Energy: 1.1610648758379873
Energy: 1.1617379867997124
Energy: 1.1969199206097796
Energy: 1.1835868722609217
Energy: 1.17771851506826
Energy: 1.1636610090080879
Energy: 1.1778577342144312
Energy: 1.1620809732183128
Energy: 1.1774439991973404
Energy: 1.1623509130574299
Energy: 1.1784176785452094
Energy: 1.1776300601971803
Energy: 1.158370075603266
Energy: 1.1790682203612737
Energy: 1.1782301071390817
Energy: 1.1619991357792916
Energy: 1.1889135474574648
Energy: 1.161676609920962
Energy: 1.1958448704168083
Energy: 1.1615816963311827
Energy: 1.1815338619484255
Energy: 1.167321264106109
Energy: 1.1944639291198624
Energy: 1.1446728181534462
Energy: 1.1690805253554761
Energy: 1.1567326419777157
Energy: 1.17964267764601
Energy: 1.1678028360474197
Energy: 1.1939958946736304
Energy: 1.1441594595082465
Energy: 1.1698431303362316
Energy: 1.1567445006414303
Energy: 1.1790038787507366
Energy: 1.167659765537378
Energy: 1.1886736232394217
Energy: 1.1633208864233686
Energy: 1.1692044355469056
Energy: 1.1607689838547173
Energy: 1.163419156906712
Energy: 1.150288588021527
Energy: 1.149945587536358
Energy: 1.1634489849634495
Energy: 1.178753650692868
Energy: 1.1776103355107619
Energy: 1.1616002530835765
Energy: 1.197744630673944
Energy: 1.1742124689715594
Energy: 1.1614574693771347
Energy: 1.1994776236235731
Energy: 1.2084436938135692
Energy: 1.1697683593562758
Energy: 1.1683240384816846
Energy: 1.1883233531460937
Energy: 1.1498713745618374
Energy: 1.3186127002617687
Energy: 1.18495634680882
Energy: 1.1618963206725832
Energy: 1.1655961837492903
Energy: 1.1653855715264618
Energy: 1.1537360043702913
Energy: 1.1664186313777627
Energy: 1.1528014937203275
Energy: 1.1535423222940646
Energy: 1.1652988506431643
Energy: 1.152604509817551
Energy: 1.1550350449521498
Energy: 1.1658334865878084
Energy: 1.1520430337165424
Energy: 1.152082264607227
Energy: 1.1661438593200146
Energy: 1.1853238900227898
Energy: 1.15270013403268
Energy: 1.1780997242707185
Energy: 1.1533626200653537
Energy: 1.3659485443145152
Energy: 1.1752816502038297
Energy: 1.1768774115881435
Energy: 1.160272062201648
Energy: 1.2418280433903452
Energy: 1.181515841027505
Energy: 1.1712544903275823
Energy: 1.1661292850792389
Energy: 1.1653825636596373
Energy: 1.171634950390435
Energy: 1.1761312203305374
Energy: 1.1797460368100305
Energy: 1.1728746488254105
Energy: 1.1527323824575724
Energy: 1.1541260324617881
Energy: 1.1663301394043972
Energy: 1.1523275500496917
Energy: 1.185056665285333
Energy: 1.2398677088654104
Energy: 1.1522459010033246
Energy: 1.184900604108411
Energy: 1.178488012589093
Energy: 1.1522468564526165
Energy: 1.176625423258839
Energy: 1.176371601019129
Energy: 1.1673627625964496
Energy: 1.1664247109312367
Energy: 1.1756803885259657
Energy: 1.1774830149348878
Energy: 1.1757856752731817
Energy: 1.1921124893051953
Energy: 1.178905402185475
Energy: 1.1787894589702634
Energy: 1.1497124450603187
Energy: 1.1673209801800541
Energy: 1.1796499106617382
Energy: 1.2412491270637949
Energy: 1.1726940680659372
Energy: 1.1909439205609529
Energy: 1.1744250936216494
Energy: 1.1727741827162832
Energy: 1.1657674379263618
Energy: 1.238677530007299
Energy: 1.1777785961500737
Energy: 1.1812673341620934
Energy: 1.2399407226752048
Energy: 1.1590512809570748
Energy: 1.1666731387796838
Energy: 1.2256788362746587
Energy: 1.1524659818215321
Energy: 1.1525329149504686
Energy: 1.1773312270645673
Energy: 1.1558835807160448
Energy: 1.1829873735853458
Energy: 1.2216727768886022
Energy: 1.1525437234242006
Energy: 1.1520828414181554
Energy: 1.1660892043171855
Energy: 1.1556307890133015
Energy: 1.1522535678408978
Energy: 1.220983015226935
Energy: 1.1527702567261386
Energy: 1.1527812618402342
Energy: 1.2063561925144586
Energy: 1.1541178947181905
Energy: 1.1919607160914425
Energy: 1.3262313129037517
Energy: 1.1844044610149052
Energy: 1.1889313532451402
Energy: 1.326864103886315
Energy: 1.1576778279094657
Energy: 1.1866287949283298
Energy: 1.2203782372670278
Energy: 1.1616208380432815
Energy: 1.1766393893799552
Energy: 1.1985298288504567
Energy: 1.1612684832164824
Energy: 1.1649200438239102
Energy: 1.1527222606824838
Energy: 1.1612796057281323
Energy: 1.1821158334499147
Energy: 1.1534315432242996
Energy: 1.164299184436604
Energy: 1.1810974580199887

minimum gb energy = 1.1441594595082465 eV
minimum distance =  2.24872805615577 Angstroms
sigma value = 57


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

Energy: 1.5256310712619128
Energy: 1.2916348210476034
Energy: 1.288321978370732
Energy: 1.3081754054863233
Energy: 1.6634896989168206
Energy: 1.287627319189103
Energy: 1.157316894193878
Energy: 1.1753747030263804
Energy: 1.179194107798644
Energy: 1.1724725586685831
Energy: 1.1762486308566273
Energy: 1.183631863620163
Energy: 1.2398023963928404
Energy: 1.168601146624907
Energy: 1.1666548209051553
Energy: 1.2413812819740506
Energy: 1.175554624628895
Energy: 1.1760229680973944
Energy: 1.1642895713191768
Energy: 1.174885514846871
Energy: 1.181128171178935
Energy: 1.170202236566219
Energy: 1.1713749058655103
Energy: 1.1931859910339266
Energy: 1.1745484271745652
Energy: 1.1756873368453726
Energy: 1.1782064164337513
Energy: 1.1663021877712818
Energy: 1.171706234046769
Energy: 1.1841502019113903
Energy: 1.1673396779432565
Energy: 1.1610744981112509
Energy: 1.1625350383427928
Energy: 1.1752081644295105
Energy: 1.179509325032908
Energy: 1.1776122666074214
Energy: 1.2422527370704446
Energy: 1.148527514745318
Energy: 1.1605319867620465
Energy: 1.243342357049413
Energy: 1.1537920607236578
Energy: 1.175957058793224
Energy: 1.2393735138916646
Energy: 1.1637974598874046
Energy: 1.178250093786671
Energy: 1.1732088926694955
Energy: 1.1730150397837693
Energy: 1.1919383731057036
Energy: 1.1573028884364769
Energy: 1.1759133320402928
Energy: 1.1618224149391325
Energy: 1.1596097733011401
Energy: 1.163680927296428
Energy: 1.1646770603415544
Energy: 1.2338234041070135
Energy: 1.172520930649987
Energy: 1.1620158770784061
Energy: 1.1591642517854408
Energy: 1.1651153712305848
Energy: 1.165110185703413
Energy: 1.2396183516031718
Energy: 1.1644977227754454
Energy: 1.1649086220801077
Energy: 1.173427068615352
Energy: 1.1670884090394755
Energy: 1.1935226197241886
Energy: 1.2314046937685437
Energy: 1.1685055092431686
Energy: 1.1680719647454454
Energy: 1.2318131945957278
Energy: 1.1683371167179157
Energy: 1.1731508355893046
Energy: 1.1805617941300361
Energy: 1.1747701604496388
Energy: 1.179837144455456
Energy: 1.1777228418488601
Energy: 1.1627321174165188
Energy: 1.1862305585931896
Energy: 1.166525260198803
Energy: 1.244596388071918
Energy: 1.1673203259985647
Energy: 1.1775798468812453
Energy: 1.2391236681107585
Energy: 1.1745981902726788
Energy: 1.1738917170122047
Energy: 1.1609247825725084
Energy: 1.1806670688641336
Energy: 1.1665606241234014
Energy: 1.1591488062199624
Energy: 1.1843789765926716
Energy: 1.2401407919651022
Energy: 1.1620180189763742
Energy: 1.1664376139809909
Energy: 1.2415907661974435
Energy: 1.1595133467756478
Energy: 1.178318492564803
Energy: 1.1573972106416308
Energy: 1.174930846932823
Energy: 1.1782597005499567
Energy: 1.1727921343339256
Energy: 1.1767471142689714
Energy: 1.1965303123410005

minimum gb energy = 1.148527514745318 eV
minimum distance =  2.21801192120334 Angstroms
sigma value = 9


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

Energy: 1.8556188218068022
Energy: 1.3582334818240989
Energy: 1.2389412407683582
Energy: 1.239315902524904
Energy: 1.3641183157072747
Energy: 1.3306114748852327
Energy: 1.2889900574556772
Energy: 1.2333832393080257
Energy: 1.2418960490714401
Energy: 1.255798972201328
Energy: 1.2338820321064976
Energy: 1.2489142650609393
Energy: 1.3257357216422225
Energy: 1.249404106174064
Energy: 1.2495954346461666
Energy: 1.2952968446954956
Energy: 1.2527886225480984
Energy: 1.2459747034225743
Energy: 1.2670111784500986
Energy: 1.2453156270826422
Energy: 1.2443299990335863
Energy: 1.253376212944553
Energy: 1.2492885225071568
Energy: 1.24348725653116
Energy: 1.2458666718147107
Energy: 1.2357388326126009
Energy: 1.233431619518703
Energy: 1.2540489091860518
Energy: 1.2329897925456093
Energy: 1.2254194745634137
Energy: 1.2494894128750451
Energy: 1.2283209141925395
Energy: 1.2453643556516751
Energy: 1.2486352452521274
Energy: 1.2265683213724599
Energy: 1.245948763317019
Energy: 1.24530454379976
Energy: 1.2391483625430524
Energy: 1.2573162468346342
Energy: 1.2308432623839578
Energy: 1.2365952601512797
Energy: 1.255421375324576
Energy: 1.2775501341773876
Energy: 1.2534773813552806
Energy: 1.2260968862408523
Energy: 1.2387355045391892
Energy: 1.2422863614110933
Energy: 1.2334936546328907
Energy: 1.3930915914791173
Energy: 1.2271119636255567
Energy: 1.2286866971915509
Energy: 1.2530580172810177
Energy: 1.2276670854017302
Energy: 1.243250733368645
Energy: 1.3904832904694613
Energy: 1.226208864724088
Energy: 1.228394324355112
Energy: 1.2532416724430664
Energy: 1.2361639932533524
Energy: 1.2317713343381596
Energy: 1.27744026324432
Energy: 1.22557387962299
Energy: 1.2351376667093774
Energy: 1.2367407870595912
Energy: 1.2510502318971914
Energy: 1.2302134074783135
Energy: 1.277042693791019
Energy: 1.239541188970836
Energy: 1.2478809565078706
Energy: 1.2335159482772353
Energy: 1.25381836522349
Energy: 1.2431845797358054
Energy: 1.4147251731756558
Energy: 1.2406101003995635
Energy: 1.2468705534358588
Energy: 1.2449369655229958
Energy: 1.2405090630082312
Energy: 1.2431486448019
Energy: 1.4116364367550278
Energy: 1.247843309141152
Energy: 1.245210181494031
Energy: 1.242469476704956
Energy: 1.2516488331122306
Energy: 1.2448276948431591
Energy: 1.277694377569107
Energy: 1.221206532303715
Energy: 1.2308071532973412
Energy: 1.231381861713825
Energy: 1.2456397972335762
Energy: 1.225642120285831
Energy: 1.2607254176692793
Energy: 1.2478130480907825
Energy: 1.2303358798073343
Energy: 1.2277499851815
Energy: 1.2514384332616721
Energy: 1.2267757540195234
Energy: 1.292881082251071
Energy: 1.2475361579106747
Energy: 1.2452774087900025
Energy: 1.2537121512490426
Energy: 1.2503345881430232
Energy: 1.2451589754308345
Energy: 1.3390045108326865
Energy: 1.2368344226267654
Energy: 1.2327151694254044
Energy: 1.2542357688564287
Energy: 1.2337974935559026
Energy: 1.2311274496953672
Energy: 1.263242495005329
Energy: 1.2522850580936888
Energy: 1.249801015035157
Energy: 1.2349216258877969
Energy: 1.2636359454829305
Energy: 1.2478669083287284
Energy: 1.3220312837466341
Energy: 1.250870984066869
Energy: 1.2474232228281144
Energy: 1.2970166152019458
Energy: 1.2562018028658848
Energy: 1.2462623741111931
Energy: 1.2568684075338623
Energy: 1.234861547421863
Energy: 1.2326680606961788
Energy: 1.2638419904561962
Energy: 1.2326044674362162
Energy: 1.2265866104135237

minimum gb energy = 1.221206532303715 eV
minimum distance =  2.21070462233014 Angstroms
sigma value = 27


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

Energy: 1.540333993511652
Energy: 1.2295559057276695
Energy: 1.2265484809994807
Energy: 1.201236967950444
Energy: 1.8540112748631035
Energy: 1.225454219818632
Energy: 1.2428168892814357
Energy: 1.2831839369471552
Energy: 1.270792858699158
Energy: 1.2784829161213973
Energy: 1.2211443098707067
Energy: 1.2785978180610098
Energy: 1.2477213945250185
Energy: 1.284996965521348
Energy: 1.2819973552466792
Energy: 1.1852004957328266
Energy: 1.1993103578665494
Energy: 1.2026981406599144
Energy: 1.2719035969293662
Energy: 1.2731467095270839
Energy: 1.2747883686887218
Energy: 1.2517821455292413
Energy: 1.2648949639815623
Energy: 1.274785105453629
Energy: 1.2060206462540757
Energy: 1.2867544216797202
Energy: 1.2819980951802408
Energy: 1.199084593400824
Energy: 1.2794732798667836
Energy: 1.269196427573358
Energy: 1.2750500990571816
Energy: 1.273058514464303
Energy: 1.2830305091714227
Energy: 1.2536456714577051
Energy: 1.2760539732122784
Energy: 1.2837733113439398
Energy: 1.3047327930824468
Energy: 1.1956159828973782
Energy: 1.2026358159211197
Energy: 1.2285750969430476
Energy: 1.1939248702865395
Energy: 1.2039206450648907
Energy: 1.3223760504119932
Energy: 1.2215566034105236
Energy: 1.2814886247862916
Energy: 1.2111850744772794
Energy: 1.2028622163587406
Energy: 1.2872443339009645
Energy: 1.3537763149628481
Energy: 1.2715648763002299
Energy: 1.270069550339713
Energy: 1.252327030811492
Energy: 1.2682206113852736
Energy: 1.2712233948621534
Energy: 1.2806001264149436
Energy: 1.1550341721016402
Energy: 1.1611873452909405
Energy: 1.1610578604271733
Energy: 1.1476310548066628
Energy: 1.1693250767282197
Energy: 1.3240355903457026
Energy: 1.276470646097642
Energy: 1.2082088870423318
Energy: 1.2097121517128464
Energy: 1.2160658976478895
Energy: 1.2105486614909406
Energy: 1.1976979124946134
Energy: 1.1633879163645056
Energy: 1.1678583735973402
Energy: 1.1719773367191095
Energy: 1.1546257971756695
Energy: 1.1716229155516171
Energy: 1.1452679576280904
Energy: 1.1707807188249817
Energy: 1.1720209724035064
Energy: 1.1508697098753264
Energy: 1.1773225968071923
Energy: 1.1705881442089925
Energy: 1.136602713760219
Energy: 1.1649215595266533
Energy: 1.1813407163141652
Energy: 1.1444797687384016
Energy: 1.1711815425047072
Energy: 1.1778725073591894
Energy: 1.1678454421067064
Energy: 1.1677137283828185
Energy: 1.1688776413290507
Energy: 1.166295649702603
Energy: 1.1425803989626393
Energy: 1.1696138373003595
Energy: 1.2566956828912823
Energy: 1.1666530628988536
Energy: 1.170389145129153
Energy: 1.1636827964426737
Energy: 1.147904028004274
Energy: 1.1684635211656562
Energy: 1.2140783027924629
Energy: 1.1800515932831561
Energy: 1.1809012777429686
Energy: 1.2194824883889577
Energy: 1.170626491739778
Energy: 1.1833427767804265
Energy: 1.2844887817498967
Energy: 1.27836384164441
Energy: 1.2758735501912415
Energy: 1.2520454766877709
Energy: 1.289468626030208
Energy: 1.2751287016336692
Energy: 1.3194022760844732
Energy: 1.2060109575619886
Energy: 1.2081025525133335
Energy: 1.209472575575361
Energy: 1.203707883426174
Energy: 1.2070029923397594
Energy: 1.29292540631557
Energy: 1.206440468038761
Energy: 1.2058153640067517
Energy: 1.2108360521473442
Energy: 1.2035452276140732
Energy: 1.2075357278162917
Energy: 1.4249220953030781
Energy: 1.2760964246067825
Energy: 1.2777318492740477
Energy: 1.252716184299152
Energy: 1.2734021187004059
Energy: 1.2757041539341214
Energy: 1.1976670827802796
Energy: 1.2798959101241574
Energy: 1.279603909631852
Energy: 1.1996445355316538
Energy: 1.2780111622578458
Energy: 1.271243833244486
Energy: 1.3311948296819758
Energy: 1.2870194206007022
Energy: 1.285955430802341
Energy: 1.2739081020050778
Energy: 1.196016129728112
Energy: 1.285092208560618
Energy: 1.313578915550813
Energy: 1.2755323258024351
Energy: 1.2790365779459625
Energy: 1.2082556061425094
Energy: 1.2667154634479156
Energy: 1.2794905947203286
Energy: 1.3001722259249562
Energy: 1.3532573743293075
Energy: 1.3533200392293383
Energy: 1.199577480430272
Energy: 1.3547072196793495
Energy: 1.2123018374768446

minimum gb energy = 1.136602713760219 eV
minimum distance =  2.17842506498799 Angstroms
sigma value = 19


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

Energy: 1.261679867356631
Energy: 1.305163629954182
Energy: 1.2535062163898045
Energy: 1.1774617628386557
Energy: 1.2750327206224963
Energy: 1.2531198101677277
Energy: 1.2677987243571618
Energy: 1.1851345145534098
Energy: 1.187589601518054
Energy: 1.1809553263144719
Energy: 1.1868260202504028
Energy: 1.1878781866735795
Energy: 1.280562700087808
Energy: 1.1892084668753173
Energy: 1.1966134759784597
Energy: 1.2161249366443603
Energy: 1.1787278406885946
Energy: 1.200990417090571
Energy: 1.2353361448531448
Energy: 1.1928054104879338
Energy: 1.1917409900371552
Energy: 1.2095023724177874
Energy: 1.183056314398152
Energy: 1.2138655395186742
Energy: 1.1842532979561775
Energy: 1.2141772504282886
Energy: 1.2096971422611837
Energy: 1.1916103544439391
Energy: 1.21563537096438
Energy: 1.19955906271871
Energy: 1.1910623859411422
Energy: 1.1928915197420171
Energy: 1.191700920224234
Energy: 1.16981140838896
Energy: 1.1906244538003543
Energy: 1.2134486631553447
Energy: 1.1946218742582233
Energy: 1.1607007210443425
Energy: 1.1592456292976934
Energy: 1.1924276219546508
Energy: 1.1656098057464819
Energy: 1.1583313498366306
Energy: 1.1673253845274707
Energy: 1.1810618273434401
Energy: 1.1904670328322042
Energy: 1.166928728456408
Energy: 1.1796550096817187
Energy: 1.1934342884129068
Energy: 1.1662859823598155
Energy: 1.210425928961876
Energy: 1.1958296785728604
Energy: 1.1752869333911626
Energy: 1.2136185443053598
Energy: 1.190295172860097
Energy: 1.1680364781772101
Energy: 1.1851412240124213
Energy: 1.206800684448556
Energy: 1.177491104005766
Energy: 1.1859357774766308
Energy: 1.2038386840288189
Energy: 1.2727369660890155
Energy: 1.1695895255189832
Energy: 1.1760055453429048
Energy: 1.2124017538444642
Energy: 1.1480507342300776
Energy: 1.17080538188678
Energy: 1.2677961923533576
Energy: 1.1425839383419845
Energy: 1.1629437037997625
Energy: 1.1421302063185876
Energy: 1.1484966086464772
Energy: 1.158428679419889
Energy: 1.2103640400918179
Energy: 1.1946276425130777
Energy: 1.1768638136823837
Energy: 1.1349471618375835
Energy: 1.1937432544348607
Energy: 1.199792029376758
Energy: 1.2800935465762975
Energy: 1.1788361105228147
Energy: 1.2057759995696076
Energy: 1.1377789952838895
Energy: 1.143439498733645
Energy: 1.194874473430353
Energy: 1.2683022571359457
Energy: 1.1472114760067855
Energy: 1.1434123261091296
Energy: 1.191790665703438
Energy: 1.1416498756775715
Energy: 1.1542805767765794
Energy: 1.269120212947598
Energy: 1.1688333405017477
Energy: 1.171900445623807
Energy: 1.173215141558829
Energy: 1.1487581943781362
Energy: 1.1700236685111691
Energy: 1.1798968814981872
Energy: 1.195885475444279
Energy: 1.221406988695306
Energy: 1.1420323551327312
Energy: 1.193760437252172
Energy: 1.2143225137386966
Energy: 1.2492315032387438
Energy: 1.177090591711996
Energy: 1.1684628527491656
Energy: 1.136283593329923
Energy: 1.17459501956759
Energy: 1.1691284960336585
Energy: 1.2614947477601848
Energy: 1.1373121668596
Energy: 1.1365157189572004
Energy: 1.2014694609213912
Energy: 1.1369311972950231
Energy: 1.2158779604155077
Energy: 1.196459644269269
Energy: 1.1379059539787046
Energy: 1.1367024545604327
Energy: 1.1694904929023162
Energy: 1.1370491285435975
Energy: 1.2109343550238754
Energy: 1.142568768353657
Energy: 1.1750624295505534
Energy: 1.1766903269823248
Energy: 1.1499131343214821
Energy: 1.188915198439998
Energy: 1.1766737790330974
Energy: 1.1427869990826187
Energy: 1.164056264093845
Energy: 1.1587821182614735
Energy: 1.1463313802111692
Energy: 1.1958303150262917
Energy: 1.1612191019073161
Energy: 1.1431388850501716
Energy: 1.1590938167977687
Energy: 1.128042122272552
Energy: 1.2128539338707955
Energy: 1.1286118281193913
Energy: 1.1870859014890471
Energy: 1.2590177749302172
Energy: 1.132325423335035
Energy: 1.1789739445505065
Energy: 1.1433199989249885
Energy: 1.1295738826217423
Energy: 1.172556941874383
Energy: 1.2144705787597034
Energy: 1.1951450237113839
Energy: 1.168345279837945
Energy: 1.1419347133754407
Energy: 1.1977359181111444
Energy: 1.1546438385564648
Energy: 1.1795186635522001
Energy: 1.2131320566255075
Energy: 1.209226570496523
Energy: 1.1702594985026267
Energy: 1.2169212295551524
Energy: 1.1931508928892434
Energy: 1.2778209581488464
Energy: 1.1905435413741223
Energy: 1.1950460883416012
Energy: 1.1969717643255107
Energy: 1.178641475778286
Energy: 1.2004802341566745
Energy: 1.2796811893357678
Energy: 1.1812353342118591
Energy: 1.1886639955873106
Energy: 1.2145270931266492
Energy: 1.1780287328150278
Energy: 1.190850019832364
Energy: 1.2409579344955906
Energy: 1.2531221061457871
Energy: 1.2526103689262378
Energy: 1.1266195545107711
Energy: 1.1678256442110408
Energy: 1.1304350639421443

minimum gb energy = 1.1266195545107711 eV
minimum distance =  2.19507217048309 Angstroms
sigma value = 101


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

Energy: 1.7203442647739509
Energy: 1.1656414119641498
Energy: 1.1642579676590643
Energy: 1.078346556694198
Energy: 1.1241052119878292
Energy: 1.0793784380754443
Energy: 1.2928184066630504
Energy: 1.1446417439740857
Energy: 1.1424469305147917
Energy: 1.1238793670824685
Energy: 1.1073646933812253
Energy: 1.1224799140885122
Energy: 1.2757201531171078
Energy: 1.1250622397257386
Energy: 1.1228595994606887
Energy: 1.1821199441977108
Energy: 1.1206327030631602
Energy: 1.123644626284846
Energy: 1.150764929097149
Energy: 1.1195234664709441
Energy: 1.1459840095653426
Energy: 1.1302067554943909
Energy: 1.1286866729244232
Energy: 1.1425186224001256
Energy: 1.1262133330812476
Energy: 1.1755546513633341
Energy: 1.1737544112358393
Energy: 1.128873733261482
Energy: 1.180877868349717
Energy: 1.1567877715660435
Energy: 1.1515755506560874
Energy: 1.1420538728230658
Energy: 1.1431774709604547
Energy: 1.1105253488294342
Energy: 1.1192218102804388
Energy: 1.1599353544049549
Energy: 1.2211216078941152
Energy: 1.1178348252150938
Energy: 1.114581775949154
Energy: 1.1738238562995458
Energy: 1.1132071854882737
Energy: 1.1141133054368086
Energy: 1.1073916520107103
Energy: 1.1250591899121676
Energy: 1.1238864573328151
Energy: 1.1091831447156164
Energy: 1.1135960744675995
Energy: 1.1422748945259271
Energy: 1.110157725639755
Energy: 1.1693828412767875
Energy: 1.1231531675335371
Energy: 1.112444652080003
Energy: 1.1724799426044943
Energy: 1.1234028357240426
Energy: 1.1088617284524958
Energy: 1.1769081261825334
Energy: 1.1732368388585337
Energy: 1.1217238002403325
Energy: 1.1237795262077246
Energy: 1.1229761642760967
Energy: 1.2600150041685638
Energy: 1.0757867248305268
Energy: 1.07697998748865
Energy: 1.1776339916748153
Energy: 1.0814606068802142
Energy: 1.162216736808296
Energy: 1.2390438125605154
Energy: 1.1234938210420744
Energy: 1.1215129549655671
Energy: 1.108834128464191
Energy: 1.122929582800106
Energy: 1.1189655043611137
Energy: 1.1374719645460247
Energy: 1.171804016755552
Energy: 1.1690771392245336
Energy: 1.1035077297336984
Energy: 1.1742198661719332
Energy: 1.1225343074410394
Energy: 1.1347583018507188
Energy: 1.1297975400051286
Energy: 1.1233068634385248
Energy: 1.1204628597432233
Energy: 1.1300749803706704
Energy: 1.127034720517079
Energy: 1.2709105088133439
Energy: 1.1268233472068674
Energy: 1.1206905949793387
Energy: 1.1806726460734636
Energy: 1.121702164755152
Energy: 1.1202306616885174
Energy: 1.2714929966242006
Energy: 1.1294669541004034
Energy: 1.1402478295408252
Energy: 1.106383125939565
Energy: 1.1076839816379112
Energy: 1.1581696811164461
Energy: 1.1441890048138643
Energy: 1.2467509391203522
Energy: 1.1531069647920462
Energy: 1.0765469927839109
Energy: 1.2442071568068798
Energy: 1.0733786124042142
Energy: 1.2946829745595032
Energy: 1.1195080520440692
Energy: 1.1224129467166668
Energy: 1.1469250068365129
Energy: 1.1105651066005555
Energy: 1.1651698149940655
Energy: 1.2707947113135123
Energy: 1.1224142230155336
Energy: 1.1240416901422732
Energy: 1.1715432998612225
Energy: 1.120868248952673
Energy: 1.1226526182165666
Energy: 1.2424497740241087
Energy: 1.1230573119554008
Energy: 1.1234945192934007
Energy: 1.122405064473282
Energy: 1.1213089540081052
Energy: 1.1229041856449054
Energy: 1.129493146102378
Energy: 1.1704454365713455
Energy: 1.1695227033834723
Energy: 1.12945124070389
Energy: 1.172995110479322
Energy: 1.158689010130548
Energy: 1.1555622274085102
Energy: 1.1392875121404888
Energy: 1.1195068639811547
Energy: 1.1080908103792575
Energy: 1.1191669218209572
Energy: 1.1217553291668405
Energy: 1.1498383117676172
Energy: 1.131977924704874
Energy: 1.134431885710001
Energy: 1.1629799848968778
Energy: 1.1034153522723869
Energy: 1.1028045327352534
Energy: 1.1099412027222648
Energy: 1.1006978212248026
Energy: 1.102178567284764
Energy: 1.1633085286307512
Energy: 1.119958493038914
Energy: 1.1666456624115533
Energy: 1.118073103809448
Energy: 1.1222153598440232
Energy: 1.1227422647261924
Energy: 1.1219683449031468
Energy: 1.1726787123334896
Energy: 1.1235399399145782
Energy: 1.110208129701834
Energy: 1.1196459518363422
Energy: 1.1207694670403965
Energy: 1.1114358921874539
Energy: 1.117497330746098
Energy: 1.1223242922221075
Energy: 1.172705699474899
Energy: 1.076738996026499
Energy: 1.0772194583573014
Energy: 1.1358574712060336
Energy: 1.0816101070763704
Energy: 1.0772110264182588
Energy: 1.267499403771609
Energy: 1.0778984806035254
Energy: 1.077518215136103
Energy: 1.1758113373053727
Energy: 1.082831051004242
Energy: 1.1180446956692098
Energy: 1.134697239395082
Energy: 1.1360239180036258
Energy: 1.1225358331878394
Energy: 1.1000231728853034
Energy: 1.1369847149416832
Energy: 1.1195620210753872
Energy: 1.1341832877104623
Energy: 1.1398349104665486
Energy: 1.1093668886524677
Energy: 1.099952585619193
Energy: 1.1360594263879789
Energy: 1.143321953112347
Energy: 1.2687554907758103
Energy: 1.1230764959467816
Energy: 1.1232156795751986
Energy: 1.169885393096036
Energy: 1.120923051390128
Energy: 1.1198024260756576
Energy: 1.2721589773756943
Energy: 1.1308087437632
Energy: 1.1201426808232298
Energy: 1.1728253601069654
Energy: 1.1263542676067158
Energy: 1.1234345385429458
Energy: 1.1504553021088055
Energy: 1.1986191799028574
Energy: 1.0779797370582427
Energy: 1.0735178108966905
Energy: 1.2010735838119484
Energy: 1.168381110148822

minimum gb energy = 1.0733786124042142 eV
minimum distance =  2.21645813440579 Angstroms
sigma value = 33


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

Energy: 0.020354072735292737
Energy: 0.021242872782944146
Energy: 0.020926755905091316
Energy: 0.023050459549991083
Energy: 1.1011438894627035
Energy: 0.020830734607146652
Energy: 0.022390533389295062
Energy: 0.1765060191714019
Energy: 0.17398567634312992
Energy: 0.1741656399114683
Energy: 0.1742979055100809
Energy: 0.17374727688553193
Energy: 1.5236791616749923
Energy: 1.1033673469581653
Energy: 1.0999267069802652
Energy: 1.097347576416597
Energy: 1.1003594990294758
Energy: 1.1004968834875575
Energy: 0.5865653117880292
Energy: 0.17650601917098702
Energy: 0.17398567634266318
Energy: 0.1741656399114683
Energy: 0.1742979055100809
Energy: 0.17374727688553193

minimum gb energy = 0.020354072735292737 eV
minimum distance =  2.45893238229632 Angstroms
sigma value = 1