Model name: model_name=EAM_Dynamo_ZhangAshcraftMendelev_2016_NiNb__MO_047308317761_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=3.5162327885627747
cohesive_energy=4.87669557134166
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=[2.7101618852427e-19, 3.5182196706005997e-19, 4.16176595917938e-19, 4.69242288212652e-19, 5.14119255730992e-19, 5.5300728699143995e-19, 5.87064755700378e-19, 6.1697579128052395e-19, 6.4316176618662e-19, 6.660264289304339e-19, 6.86016786792852e-19, 7.03568631818322e-19, 7.189703558009639e-19, 7.323549394013999e-19, 7.43797684921428e-19, 7.5331942065729e-19, 7.609666097313719e-19, 7.669138893967799e-19, 7.714576623308039e-19, 7.74952009569558e-19, 7.77637257608142e-19, 7.796111392212299e-19, 7.808480195826779e-19, 7.81270994214054e-19, 7.80790341223854e-19, 7.791977776496579e-19, 7.762722031159739e-19, 7.71813345543552e-19, 7.65644965502652e-19, 7.575683930906579e-19, 7.473545170489079e-19, 7.347229564664519e-19, 7.193052107174701e-19, 7.0058057239591195e-19, 6.777607705978499e-19, 6.49533622660038e-19, 6.13571165933274e-19, 5.659064110717739e-19, 4.998246358024439e-19, 4.03738898708196e-19, 2.5720061940928797e-19, 2.30823985483746e-20, -3.6748965236394596e-19, -1.044973246404114e-18, -2.2629142778616e-18, -4.5024367768668e-18, -8.60694094314702e-18, -1.6482392122274998e-17, -3.2578659675756e-17, -6.822869195889e-17, -1.55790849360258e-16, -4.02620579417664e-16]
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: 0.01987870426016817
Energy: 0.756833575094233
Energy: 0.020783292854610547
Energy: 0.020163189889537452
Energy: 0.756731499946892
Energy: 0.020362016575065416
Energy: 0.7568335750939015
Energy: 0.1525137926915075
Energy: 0.15479639206963833
Energy: 0.15334030774489132
Energy: 0.15246939436494444
Energy: 0.15441009422294968
Energy: 0.020783292853321488
Energy: 0.15479639206963833
Energy: 0.15416339933182763
Energy: 0.020748239998262957
Energy: 0.15245063817248816
Energy: 0.15373610569600973
Energy: 0.02016318988920598
Energy: 0.15334030774360227
Energy: 0.020748239997931486
Energy: 0.020291823737589285
Energy: 0.15293325231498514
Energy: 0.02052615962414437
Energy: 0.756731499946892
Energy: 0.15246939436527593
Energy: 0.15245063817215673
Energy: 0.1529332523153166
Energy: 0.15308492992226164
Energy: 0.1549481614470386
Energy: 0.02036201657539689
Energy: 0.1544100942223236
Energy: 0.1537361056963412
Energy: 0.020526159624475845
Energy: 0.15494816144379753
Energy: 0.02042481508962818

minimum gb energy = 0.01987870426016817 eV
minimum distance =  2.48304183904465 Angstroms
sigma value = 1


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

Energy: 1.9105313521034664
Energy: 1.18205668481553
Energy: 1.2252349610336588
Energy: 1.1919269826090881
Energy: 1.1851194469588038
Energy: 1.2251430101095313
Energy: 1.7776511260209233
Energy: 1.1569183766621203
Energy: 1.1541771449807634
Energy: 1.1468482978669257
Energy: 1.1666470870290921
Energy: 1.147274402850407
Energy: 1.9271355788413496
Energy: 1.1565831922156073
Energy: 1.1595452511021993
Energy: 1.153906609363089
Energy: 1.1635270840958922
Energy: 1.1549204577972663
Energy: 1.958404060547716
Energy: 1.1544051371550914
Energy: 1.1502829194452164
Energy: 1.1499499153583783
Energy: 1.157827546018714
Energy: 1.1502462307480392
Energy: 1.7751973660875624
Energy: 1.1630296321946934
Energy: 1.159097597253568
Energy: 1.1450608490810812
Energy: 1.157731685959905
Energy: 1.1584495925570597
Energy: 1.755000913509465
Energy: 1.1733290151392477
Energy: 1.1671006113747477
Energy: 1.15117132749569
Energy: 1.173219845312919
Energy: 1.1678739213544183
Energy: 1.7550415668080208
Energy: 1.1699012813865362
Energy: 1.1687983379010556
Energy: 1.1590614886485016
Energy: 1.1596305840728056
Energy: 1.1590617500128715
Energy: 1.693176966136969
Energy: 1.156095688492984
Energy: 1.155996110799981
Energy: 1.1522789194805108
Energy: 1.1549939979985626
Energy: 1.1624336912675155
Energy: 1.3816540484204864
Energy: 1.1510628975380734
Energy: 1.1530212510065023
Energy: 1.1728732962726924
Energy: 1.1611509332362309
Energy: 1.1813426192237304
Energy: 1.3728160892839514
Energy: 1.1576074232784022
Energy: 1.1618054693680866
Energy: 1.168103393685574
Energy: 1.1555452985514347
Energy: 1.1598247898599643
Energy: 1.2729525050608363
Energy: 1.143469692384638
Energy: 1.1449253329411264
Energy: 1.1877146344502463
Energy: 1.1430962261032491
Energy: 1.1447036114977827
Energy: 1.1994443479451473
Energy: 1.155346128005671
Energy: 1.1549591359669955
Energy: 1.1630205565406864
Energy: 1.1739156306248846
Energy: 1.1523152114079804
Energy: 1.1977585867889897
Energy: 1.1457605673792706
Energy: 1.1471130071796953
Energy: 1.167190177114192
Energy: 1.1568732966771906
Energy: 1.1478315866630322
Energy: 1.2449068343137077
Energy: 1.152985801565599
Energy: 1.1534804012113495
Energy: 1.1557465518120222
Energy: 1.1548958189990377
Energy: 1.1530268490734101
Energy: 1.2431679155236934
Energy: 1.1458842854185838
Energy: 1.1587495320227486
Energy: 1.1730021360860516
Energy: 1.1459522685607564
Energy: 1.1541491856372803
Energy: 1.243388004000702
Energy: 1.1549715257248334
Energy: 1.1496222729710381
Energy: 1.181062216328095
Energy: 1.1556445878735677
Energy: 1.165274704450798
Energy: 1.710467475525337
Energy: 1.1528938306331826
Energy: 1.1540883360181267
Energy: 1.1465268405597098
Energy: 1.1518023410940836
Energy: 1.1505116394323192
Energy: 1.5577514155110002
Energy: 1.164494723630148
Energy: 1.1659040014756292
Energy: 1.1663265390628734
Energy: 1.1550443897910556
Energy: 1.1786858718944289
Energy: 1.5585163934713056
Energy: 1.1771819585017789
Energy: 1.1787433669857388
Energy: 1.1655263746238598
Energy: 1.1764300149932443
Energy: 1.1785068427188055
Energy: 1.756888118247188
Energy: 1.1758490200272709
Energy: 1.1789467715428839
Energy: 1.1648408069850495
Energy: 1.166645306830188
Energy: 1.177861877164356
Energy: 1.8468670061074293
Energy: 1.1567953604318932
Energy: 1.1459896541507397
Energy: 1.1446343596592492
Energy: 1.1541532949703273
Energy: 1.1458624362383318
Energy: 1.8439136382557337
Energy: 1.1653252804068959
Energy: 1.158393806373841
Energy: 1.1468333089082725
Energy: 1.1793525879250348
Energy: 1.1556395729942497
Energy: 1.8807695626937793
Energy: 1.1551415330845662
Energy: 1.1539073982381416
Energy: 1.1404849244451194
Energy: 1.1469384075777456
Energy: 1.1575001690267201

minimum gb energy = 1.1404849244451194 eV
minimum distance =  2.3005299354742 Angstroms
sigma value = 33


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

Energy: 2.0809508701271953
Energy: 1.1784299119588901
Energy: 1.226900702273821
Energy: 1.2281408291541143
Energy: 1.1777477439411679
Energy: 1.2270365996567987
Energy: 1.6218829821847123
Energy: 1.1914684734897525
Energy: 1.1634512130731234
Energy: 1.2087348832605787
Energy: 1.192707506256588
Energy: 1.21330405510907
Energy: 1.7612251227448124
Energy: 1.1912275623882445
Energy: 1.1884333644984022
Energy: 1.1969125032513033
Energy: 1.1907508790199475
Energy: 1.219451276652649
Energy: 1.7594987086975542
Energy: 1.1911060724656362
Energy: 1.1916865528665022
Energy: 1.1969591130983976
Energy: 1.1910624757809996
Energy: 1.1710986766698646
Energy: 1.622267336565266
Energy: 1.2181757564223306
Energy: 1.2019107100642112
Energy: 1.2172373438022788
Energy: 1.1974210527185514
Energy: 1.2192358007681865
Energy: 1.7605617906627475
Energy: 1.2169435285062835
Energy: 1.2011181208964068
Energy: 1.2023868743150024
Energy: 1.2179036879242873
Energy: 1.1997058568586865
Energy: 1.7595949668208157
Energy: 1.2018274569982892
Energy: 1.203667761423776
Energy: 1.1989051465026692
Energy: 1.1937610849244151
Energy: 1.1997017134200085
Energy: 1.6218396701525297
Energy: 1.2157216841072644
Energy: 1.2195932074275915
Energy: 1.189750310398449
Energy: 1.216184988838983
Energy: 1.2176145138065784
Energy: 1.3438695921588195
Energy: 1.2155475661682118
Energy: 1.2241828968356123
Energy: 1.216652813132192
Energy: 1.21073533474188
Energy: 1.21817347163003
Energy: 1.345337120024783
Energy: 1.217030764263699
Energy: 1.2192914959410621
Energy: 1.1962046032784581
Energy: 1.212431617001218
Energy: 1.2178140202755856
Energy: 1.3547276741309997
Energy: 1.1460932064194103
Energy: 1.146345752722856
Energy: 1.2186199566136777
Energy: 1.1458391020375898
Energy: 1.146677916742135
Energy: 1.1925688778446228
Energy: 1.2152426530127654
Energy: 1.2151333197024474
Energy: 1.1921228045643537
Energy: 1.2166952050151514
Energy: 1.2020458982410513
Energy: 1.192068010371484
Energy: 1.2179009114819357
Energy: 1.22076574621287
Energy: 1.1919307854711179
Energy: 1.2137685572925088
Energy: 1.1902983259235085
Energy: 1.337124828234132
Energy: 1.1974131594250088
Energy: 1.1683714902488052
Energy: 1.1911803584910088
Energy: 1.1973156814564332
Energy: 1.1696582473727621
Energy: 1.341888234744598
Energy: 1.2191219363277208
Energy: 1.2194036506414139
Energy: 1.1930322410165142
Energy: 1.2147339443942033
Energy: 1.2144515370647826
Energy: 1.3456494499595706
Energy: 1.2018688456691562
Energy: 1.1995720717320542
Energy: 1.2170006604851207
Energy: 1.2169508837521115
Energy: 1.2018294262093585
Energy: 1.6592590733211763
Energy: 1.2001879026847369
Energy: 1.2003120875102489
Energy: 1.1921301374375883
Energy: 1.1992365946659238
Energy: 1.2003434156857555
Energy: 1.515227221354994
Energy: 1.2186101564013185
Energy: 1.2201453029436795
Energy: 1.2164874075417225
Energy: 1.1920634012404459
Energy: 1.2167220612061995
Energy: 1.501880304759175
Energy: 1.2159237858531269
Energy: 1.2181221036670782
Energy: 1.2174698054182502
Energy: 1.2164371160344671
Energy: 1.229997449778319
Energy: 1.621676934325796
Energy: 1.2184528118983253
Energy: 1.2183884876532065
Energy: 1.2112059041921917
Energy: 1.2184807240050042
Energy: 1.218936289991225
Energy: 1.9987412753905613
Energy: 1.2006055746782862
Energy: 1.1461765911864374
Energy: 1.1462217877764374
Energy: 1.201966525647986
Energy: 1.146097270669867
Energy: 1.1802008031402969
Energy: 1.1910176916528707
Energy: 1.1739251067145315
Energy: 1.217141595811872
Energy: 1.1906240208080572
Energy: 1.2015952739826763
Energy: 1.627265061645212
Energy: 1.1921762680774703
Energy: 1.1888630243846368
Energy: 1.213145293167785
Energy: 1.1925138498350336
Energy: 1.218966443555391
Energy: 1.76178966012554
Energy: 1.1779570614952477
Energy: 1.1773704399946547
Energy: 1.1973620088606611
Energy: 1.3231200251939617
Energy: 1.20023587935772
Energy: 1.6265447445900514
Energy: 1.1908363122194365
Energy: 1.1796254108837678
Energy: 1.2133994205863337
Energy: 1.190764490122325
Energy: 1.220971277853005
Energy: 1.7636431832485882
Energy: 1.2157385100027782
Energy: 1.2019275328371744
Energy: 1.2149089961839838
Energy: 1.215671061761959
Energy: 1.2033818544940882
Energy: 1.7597731525940605
Energy: 1.173375824906144
Energy: 1.174049845852764
Energy: 1.199384004746825
Energy: 1.1723250222451873
Energy: 1.2008805069747222
Energy: 1.6225812828760948
Energy: 1.2157009130708656
Energy: 1.2172783518816075
Energy: 1.2123889904679983
Energy: 1.2166494910532422
Energy: 1.2237222554162366
Energy: 1.344197065667777
Energy: 1.2156222154999232
Energy: 1.2173238478420054
Energy: 1.2177005840400792
Energy: 1.216230667192889
Energy: 1.2179539245322386
Energy: 1.3441097872187644
Energy: 1.2192359747630346
Energy: 1.218041442621371
Energy: 1.2172973971314731
Energy: 1.2125076574542122
Energy: 1.2108859233882558
Energy: 1.5063710041551244
Energy: 1.1459596211745589
Energy: 1.1460277911387429
Energy: 1.2159185506041108
Energy: 1.1463844082934047
Energy: 1.1462528937710508
Energy: 1.1905647294691992
Energy: 1.170956601643831
Energy: 1.159616496186012
Energy: 1.1906295309595343
Energy: 1.1707349936988365
Energy: 1.202389135518457
Energy: 1.193642903418777
Energy: 1.2189277495374853
Energy: 1.2207229214631776
Energy: 1.1922346100175394
Energy: 1.2150013706935603
Energy: 1.1888314351213864
Energy: 1.1907895052455006
Energy: 1.1949936964841648
Energy: 1.1696333185168628
Energy: 1.1907245803261404
Energy: 1.1974206491264274
Energy: 1.1673143939327284
Energy: 1.3410497979545062
Energy: 1.2174525411510757
Energy: 1.2207700567959945
Energy: 1.1897094419374423
Energy: 1.2143593253455836
Energy: 1.179759331983429
Energy: 1.3416893633811906
Energy: 1.2183715630911884
Energy: 1.2181490433936089
Energy: 1.2171453998733965
Energy: 1.2159391174518182
Energy: 1.201728154392664
Energy: 1.3413105975891042
Energy: 1.2004681430425197
Energy: 1.200550061825933
Energy: 1.2036555427695883
Energy: 1.200206064179559
Energy: 1.1744633183056106
Energy: 1.5017558010322538
Energy: 1.2163051359126664
Energy: 1.2219997894677115
Energy: 1.2145387750176342
Energy: 1.216189649945062
Energy: 1.2252949388996452
Energy: 1.5121718212584583
Energy: 1.2193607136653932
Energy: 1.2191815000209696
Energy: 1.216441818084813
Energy: 1.219011362682152
Energy: 1.217182478676393
Energy: 1.6219533024950963
Energy: 1.2154928138818353
Energy: 1.217701433236235
Energy: 1.208835951825846
Energy: 1.2160462598448503
Energy: 1.219874062098903
Energy: 2.005742223588519
Energy: 1.2001104348405505
Energy: 1.1467759521848468
Energy: 1.1470372956213284
Energy: 1.1888689089089974
Energy: 1.1463230491997989

minimum gb energy = 1.1458391020375898 eV
minimum distance =  2.33410645560134 Angstroms
sigma value = 51


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

Energy: 1.9691127483334077
Energy: 1.2007558201217767
Energy: 1.2275693828399696
Energy: 1.2321670126599966
Energy: 1.2006064445080504
Energy: 1.2566613820313104
Energy: 1.5112938385202694
Energy: 1.2399775240883004
Energy: 1.2229266372553704
Energy: 1.2350242373291405
Energy: 1.2407677252652307
Energy: 1.2470850547908388
Energy: 1.7884488498942501
Energy: 1.2163950554296312
Energy: 1.2398622488049633
Energy: 1.2268591013905068
Energy: 1.2406794307402313
Energy: 1.2458575311431166
Energy: 1.785997764948632
Energy: 1.218662829707681
Energy: 1.2168186299339816
Energy: 1.2144048803240597
Energy: 1.2163730041784357
Energy: 1.2140079963075685
Energy: 1.5126370540885299
Energy: 1.264211560450471
Energy: 1.26264715630104
Energy: 1.2335352078318595
Energy: 1.253645305545457
Energy: 1.2299672854593866
Energy: 1.5120731335436892
Energy: 1.254443516784072
Energy: 1.2622104242124554
Energy: 1.2533789212542281
Energy: 1.253166351587642
Energy: 1.2621110271593474
Energy: 1.5118695179378727
Energy: 1.2072636297510406
Energy: 1.2051618607115013
Energy: 1.2531897030623396
Energy: 1.222403460723266
Energy: 1.253453917004905
Energy: 1.4642429455307862
Energy: 1.1810422528138158
Energy: 1.1812644436740378
Energy: 1.2404510112918186
Energy: 1.1809347070041987
Energy: 1.181814922156639
Energy: 1.240580756626918
Energy: 1.1808194471422206
Energy: 1.1808028356117235
Energy: 1.2405096381392997
Energy: 1.1806672544619599
Energy: 1.2319243459207472
Energy: 1.2405284857307355
Energy: 1.2312824901019928
Energy: 1.2292001670263915
Energy: 1.240596863160423
Energy: 1.2312571449466414
Energy: 1.2477878719965176
Energy: 1.3833241870814075
Energy: 1.2248824306854775
Energy: 1.2250838136253588
Energy: 1.3271569605698776
Energy: 1.2219144320968083
Energy: 1.2144729134116725
Energy: 1.3024469429839713
Energy: 1.2316099366340876
Energy: 1.2302530112680627
Energy: 1.2154277282331079
Energy: 1.249753434328053
Energy: 1.246485312192618
Energy: 1.3021119105015229
Energy: 1.2233617764786962
Energy: 1.222648012200136
Energy: 1.241235046199885
Energy: 1.2166960332058097
Energy: 1.2262421708136761
Energy: 1.3025403936113478
Energy: 1.2157957649708622
Energy: 1.215893722373053
Energy: 1.2334677312030002
Energy: 1.2158756607481414
Energy: 1.21577052827297
Energy: 1.6267201650160816
Energy: 1.2265883854947888
Energy: 1.2262955417590107
Energy: 1.2339217644256149
Energy: 1.2413843401859428
Energy: 1.220713841335871
Energy: 1.6315841661956503
Energy: 1.2412237155261368
Energy: 1.241331285449552
Energy: 1.233748989112749
Energy: 1.2426220647232478
Energy: 1.2337277634673383
Energy: 1.6409117838068186
Energy: 1.2419593290758026
Energy: 1.2418510362115889
Energy: 1.2339985720956905
Energy: 1.2422750340600743
Energy: 1.24534597011489
Energy: 1.9400797886761494
Energy: 1.2176558540699578
Energy: 1.2446990341052853
Energy: 1.181789610922017
Energy: 1.2161661097030936
Energy: 1.194432000028935

minimum gb energy = 1.1806672544619599 eV
minimum distance =  2.29188564073447 Angstroms
sigma value = 19


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

Energy: 1.6883459489144514
Energy: 1.1625636643220105
Energy: 1.229263044108879
Energy: 1.3618960375631315
Energy: 1.1394061909036797
Energy: 1.2286327238028905
Energy: 1.4184363717492599
Energy: 1.1611687553785797
Energy: 1.1608996938946172
Energy: 1.203453976726447
Energy: 1.161081017002345
Energy: 1.1609681280002502
Energy: 1.8080450596875821
Energy: 1.1611460329070373
Energy: 1.1612566060445584
Energy: 1.202542645433977
Energy: 1.1609980838201497
Energy: 1.1611235042479682
Energy: 1.4119033360758408
Energy: 1.160736526272141
Energy: 1.1609193274611096
Energy: 1.2124936116240663
Energy: 1.1606779238590734
Energy: 1.160803372386603
Energy: 1.4192935407903071
Energy: 1.1603308571640631
Energy: 1.2021944929519146
Energy: 1.2045846450957196
Energy: 1.1603274390286156
Energy: 1.2032957527235753
Energy: 1.420849994479498
Energy: 1.128702192611117
Energy: 1.201407243714631
Energy: 1.203970533725493
Energy: 1.128756610492562
Energy: 1.2027151512503382
Energy: 1.4174447694288768
Energy: 1.2020941937216116
Energy: 1.2019904539016095
Energy: 1.205121097641968
Energy: 1.13887610093111
Energy: 1.2029912222451993
Energy: 1.3180807929424956
Energy: 1.1677490455831077
Energy: 1.1542638975697637
Energy: 1.1609199053374004
Energy: 1.1666065404187427
Energy: 1.1299372783300334
Energy: 1.160852835402945
Energy: 1.1299167753560553
Energy: 1.1296820210761298
Energy: 1.1608000759059762
Energy: 1.1678450602768713
Energy: 1.1290711543545708
Energy: 1.1612020209627754
Energy: 1.1620887970750406
Energy: 1.161169046307464
Energy: 1.1608228249565962
Energy: 1.224891055550735
Energy: 1.1612347591054504
Energy: 1.1606630314053876
Energy: 1.213408358853623
Energy: 1.2147533184769295
Energy: 1.160768169844981
Energy: 1.212959757530131
Energy: 1.1605714862392387
Energy: 1.4163227666929965
Energy: 1.2022418056513242
Energy: 1.20172413574746
Energy: 1.160646534453574
Energy: 1.2030310358261211
Energy: 1.1606430859502521
Energy: 1.12938867590365
Energy: 1.202254071434161
Energy: 1.2022719877732682
Energy: 1.1292091744429773
Energy: 1.2021161622214118
Energy: 1.2033148475170292
Energy: 1.4168653534558096
Energy: 1.2028111948050648
Energy: 1.2028343914090842
Energy: 1.1615854889949846
Energy: 1.2031248257552478
Energy: 1.2036298331491875
Energy: 1.6940095553167906
Energy: 1.160803172939784
Energy: 1.1607786605763257
Energy: 1.1679773832614728
Energy: 1.1608074074611632
Energy: 1.12928897088325
Energy: 1.694681564046902
Energy: 1.1606517194456953
Energy: 1.129806319018351
Energy: 1.1656241804346645
Energy: 1.1604759982407131
Energy: 1.1548626468858454
Energy: 1.4184509545101687
Energy: 1.1612368538894617
Energy: 1.1614978744968247
Energy: 1.2045705102984643
Energy: 1.1614381984942077
Energy: 1.1610585682058234
Energy: 1.4131890341463098
Energy: 1.1611194151923636
Energy: 1.1612011320045708
Energy: 1.2128812074991207
Energy: 1.160981351934398
Energy: 1.1612455478027135
Energy: 1.4093398302677067
Energy: 1.16096323770086
Energy: 1.1610972595966325
Energy: 1.2128500906457877
Energy: 1.16113891499879
Energy: 1.161147560602597
Energy: 1.4178572757935934
Energy: 1.1287839517107374
Energy: 1.2021806975669562
Energy: 1.205139739197891
Energy: 1.1285619062244838
Energy: 1.2015481246909145
Energy: 1.413556360333276
Energy: 1.201910879319312
Energy: 1.202518372839444
Energy: 1.2036684590583997
Energy: 1.161015768480417
Energy: 1.20257059812278
Energy: 1.417377852809573
Energy: 1.2019279812895087
Energy: 1.201634703069983
Energy: 1.202279844590951
Energy: 1.1389528479779676
Energy: 1.2018161625457118
Energy: 1.3198157165613649
Energy: 1.129645635783863
Energy: 1.1678421381526058
Energy: 1.2037373800308298
Energy: 1.1286232982337037
Energy: 1.1520218698501643
Energy: 1.1608518412669366
Energy: 1.1612906827213592
Energy: 1.1609731721914722
Energy: 1.1610408487348032
Energy: 1.2042631753802238
Energy: 1.1609968431418556
Energy: 1.1609203996291442
Energy: 1.1921895227717947
Energy: 1.1613096932338263
Energy: 1.1611240622612142
Energy: 1.2028280752339786
Energy: 1.16116658114976
Energy: 1.3192319697367667
Energy: 1.2126674571148726
Energy: 1.2138233118645974
Energy: 1.1605333818192622
Energy: 1.212449811548564
Energy: 1.1609294477158438
Energy: 1.4175621514715033
Energy: 1.203174399881039
Energy: 1.2020502328493636
Energy: 1.1602288118921928
Energy: 1.2051723989905436
Energy: 1.2021725565158377
Energy: 1.1288536354370688
Energy: 1.2020153739782888
Energy: 1.2025051399572777
Energy: 1.1287690371582213
Energy: 1.202880710634562
Energy: 1.200947504657761
Energy: 1.319647194493122
Energy: 1.2018010032651572
Energy: 1.2029698912825557
Energy: 1.1391888175971714
Energy: 1.2058837449283815
Energy: 1.201957606816603
Energy: 1.6953207070441305
Energy: 1.1610418392029078
Energy: 1.129671080992732
Energy: 1.1655472332894585
Energy: 1.1605904382330305
Energy: 1.1301226254638141

minimum gb energy = 1.1285619062244838 eV
minimum distance =  2.3320876280289 Angstroms
sigma value = 27


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

Energy: 1.4249375318818998
Energy: 1.1442321912416291
Energy: 1.1614079714445136
Energy: 1.1652622220187059
Energy: 1.2203761899975465
Energy: 1.1614375220228847
Energy: 1.3865212530901723
Energy: 1.184474875959833
Energy: 1.1057117248219117
Energy: 1.1148151150668548
Energy: 1.1832471640267836
Energy: 1.107976177300939
Energy: 1.260945825912479
Energy: 1.1848040461561178
Energy: 1.1054713576934379
Energy: 1.0751505891233146
Energy: 1.1859820675808344
Energy: 1.1073530562651401
Energy: 1.2620902249067272
Energy: 1.1408564473929284
Energy: 1.1059697402747999
Energy: 1.0972674050907478
Energy: 1.1064018482424107
Energy: 1.105001752693684
Energy: 1.3863995162532476
Energy: 1.079220412167698
Energy: 1.0963275269125434
Energy: 1.1843483841607858
Energy: 1.0794620663901113
Energy: 1.1080093161197677
Energy: 1.1872093717266567
Energy: 1.0801904289354163
Energy: 1.081027503720295
Energy: 1.1867196816776302
Energy: 1.0799627926575555
Energy: 1.0809597484595261
Energy: 1.1845386245545884
Energy: 1.0983346466715354
Energy: 1.1078468671106732
Energy: 1.1848882681036552
Energy: 1.0993688863893358
Energy: 1.1078823360512011
Energy: 1.2506746161651885
Energy: 1.0928047802661054
Energy: 1.0927416564034218
Energy: 1.253116449065997
Energy: 1.0931943083221929
Energy: 1.0926941705071642
Energy: 1.2605212023767298
Energy: 1.094548304480138
Energy: 1.1005553998828828
Energy: 1.1833490846819
Energy: 1.0921702450640542
Energy: 1.1059304061446122
Energy: 1.0894282234213482
Energy: 1.1277118738797407
Energy: 1.1368312353337129
Energy: 1.136074723067992
Energy: 1.1317658704815499
Energy: 1.1364264572344116
Energy: 1.2609706366279818
Energy: 1.145513032186618
Energy: 1.1452128270148418
Energy: 1.1073340950176709
Energy: 1.1467297161250087
Energy: 1.1342716913241604
Energy: 1.2267432965675296
Energy: 1.1053880084215055
Energy: 1.1052385073500286
Energy: 1.1135511890432341
Energy: 1.1064931802338818
Energy: 1.1074202883175661

minimum gb energy = 1.0751505891233146 eV
minimum distance =  2.32561156511369 Angstroms
sigma value = 9


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

Energy: 2.2682816339058167
Energy: 1.4317685876453587
Energy: 1.0527504828621894
Energy: 1.0508648284265623
Energy: 1.3252507237328104
Energy: 1.051181164296489
Energy: 1.0795710685821078
Energy: 1.0345655795919502
Energy: 1.0277850064904097
Energy: 1.006977935512591
Energy: 1.0302096041933186
Energy: 1.0082145968728766
Energy: 1.0813001030349219
Energy: 1.0380102130291138
Energy: 1.0241971708388515
Energy: 1.0309557601378365
Energy: 1.0326479539456068
Energy: 1.0192286230542402
Energy: 1.0820121103490252
Energy: 1.0002368224077265
Energy: 1.001036981327359
Energy: 1.0315106793787927
Energy: 1.0035883252656508
Energy: 1.029444458113009
Energy: 1.2637018583587398
Energy: 1.0089212135039491
Energy: 1.038694008103179
Energy: 1.0616062721028408
Energy: 1.0352829587160584
Energy: 1.0219233591829033
Energy: 1.0612221907858184
Energy: 0.9843850647708811
Energy: 0.9843717830243225
Energy: 1.0614323614700423
Energy: 1.0169046578508758
Energy: 0.9843795176499389
Energy: 1.0623661014235146
Energy: 1.0025616484730142
Energy: 1.000194617712849
Energy: 1.0638419824681988
Energy: 1.0022086754338864
Energy: 0.9999287598023741
Energy: 1.0842710235240163
Energy: 1.0099606178086789
Energy: 1.0059461753809071
Energy: 1.0847367557013914
Energy: 1.01538633187476
Energy: 1.0059472816113597
Energy: 1.492713263581726
Energy: 1.0052012511361108
Energy: 1.0431455723332974
Energy: 1.0374552449295653
Energy: 1.054270349955172
Energy: 1.0444786054754094
Energy: 0.9946206630340547
Energy: 1.0033969622199546
Energy: 1.0027461685409378
Energy: 1.043312488748654
Energy: 1.0366164675494483
Energy: 1.0387966723497168
Energy: 0.9844089210760496
Energy: 1.0678864255511054
Energy: 1.0274846305690466
Energy: 1.0359660046514245
Energy: 1.062117046975576
Energy: 1.0112616853387284
Energy: 1.2625316249235872
Energy: 1.067329892808232
Energy: 1.0127178272619832
Energy: 1.016774937541714
Energy: 1.0631450666147375
Energy: 1.0262276022542496
Energy: 1.0811971562489755
Energy: 1.212871762881263
Energy: 1.0497840554156952
Energy: 1.000844235467781
Energy: 1.2198375771852308
Energy: 1.0000768556775335
Energy: 1.262184118868609
Energy: 1.0138503018066432
Energy: 1.021734882838459
Energy: 1.0199305649138015
Energy: 1.0642006283638539
Energy: 1.0258352251319236
Energy: 1.0313660801757267
Energy: 1.003746660716841
Energy: 1.0003818980516124
Energy: 1.031637075436813
Energy: 1.0106690512871639
Energy: 1.0464686057367276
Energy: 1.0314595948583165
Energy: 1.003670449944403
Energy: 1.0191813093417048
Energy: 1.0324442637066495
Energy: 1.0016835356726437
Energy: 1.0251539170778141
Energy: 1.030259977443377
Energy: 0.9987958033117482
Energy: 1.020055310933673
Energy: 1.0308515663561495
Energy: 1.0150705637479849
Energy: 1.0050209705230573
Energy: 1.0080549652837871
Energy: 1.0097205427292577
Energy: 1.0109011874210618
Energy: 1.029996435334076
Energy: 1.0045244431132199
Energy: 1.011401505387931
Energy: 1.0821753003505659
Energy: 1.0024930935813947
Energy: 1.0027004051813417
Energy: 1.005916087272773
Energy: 1.0012096128769643
Energy: 1.0110506440892062
Energy: 1.0819043483053965
Energy: 1.0052224638916998
Energy: 1.0069497111660084
Energy: 1.0046576610397728
Energy: 1.004941765589235
Energy: 0.9924328481682788
Energy: 1.0832390219488468
Energy: 1.0056739684217688
Energy: 1.0019623372610447
Energy: 1.0207038667583015
Energy: 1.006689082327777
Energy: 1.0088747681079313
Energy: 1.1728069188084895
Energy: 1.047219245520555
Energy: 0.9872308706140112
Energy: 1.0365076491388898
Energy: 1.0317583257028828
Energy: 0.9824158407536777
Energy: 1.1705437727993842
Energy: 1.0500735081199946
Energy: 1.0037164351732324
Energy: 1.036404857779602
Energy: 1.0307972673856258
Energy: 0.9863135937770944
Energy: 1.0803355278794449
Energy: 1.0369040679943777
Energy: 1.0259511251415052
Energy: 1.0470229217894795
Energy: 1.0327329524804523
Energy: 1.0161137833334577
Energy: 1.4458340234094682
Energy: 1.0088311930290115
Energy: 1.028281611624192
Energy: 0.9944732737350582
Energy: 1.0306054429110167
Energy: 1.0268839149578328
Energy: 1.079529750314977
Energy: 0.9998766483924889
Energy: 1.0270852253242877
Energy: 1.0567109768376572
Energy: 0.9998807179802969
Energy: 1.0271645259267974
Energy: 0.9970057351611339
Energy: 1.0170074321672438
Energy: 1.0167610133423826
Energy: 0.998896954324789
Energy: 1.016209102769169
Energy: 0.9802330782625214
Energy: 1.0619249772552146
Energy: 1.0002347064166428
Energy: 0.9995785681332571
Energy: 1.0622668809428126
Energy: 0.9993193723079018
Energy: 1.0269892783325818
Energy: 1.0619212002553404
Energy: 1.0053112747721882
Energy: 1.0419865628869849
Energy: 1.0622402247410065
Energy: 1.0407722474305967
Energy: 1.042847948915422
Energy: 1.07800059404638
Energy: 1.010445885005969
Energy: 1.0050053100352943
Energy: 1.0030824351757135
Energy: 1.0158515858084505
Energy: 1.0050408526253831
Energy: 0.9844427253231993
Energy: 1.002293822678083
Energy: 1.0264208938278085
Energy: 1.0345666075036954
Energy: 1.0390267977934098
Energy: 1.013299640131084
Energy: 0.9913547901832727
Energy: 1.0430117441429707
Energy: 0.999512286137389
Energy: 1.0043188640857639
Energy: 1.0613480474212302
Energy: 1.032734075683265
Energy: 1.259804686369628
Energy: 1.071364280604855
Energy: 1.062450842258337
Energy: 1.000094964182941
Energy: 1.0651027632247085
Energy: 0.9992928759664692
Energy: 1.084138179806833
Energy: 1.066913110438256
Energy: 1.0134298265429642
Energy: 1.013006306517715
Energy: 1.0620488818475442
Energy: 1.0096611394810706
Energy: 1.0802289642047034
Energy: 1.02897948882592
Energy: 1.0175216329367833
Energy: 1.0394265505496358
Energy: 1.0623564143949145
Energy: 1.019779465418266
Energy: 1.0798067664714612
Energy: 1.0100054016308038
Energy: 0.9972881181385626
Energy: 1.0011922849799202
Energy: 1.0146552456306055
Energy: 0.9984346589566323
Energy: 1.033025426258996
Energy: 1.0162880763399549
Energy: 1.0214694004438811
Energy: 1.0319909611959495
Energy: 1.0283811210733607
Energy: 1.026567850868743
Energy: 1.0299753169127046
Energy: 1.0073153092033846
Energy: 1.0074021141828349
Energy: 1.0306446152994533
Energy: 1.0066258271453803
Energy: 1.0079824004092697
Energy: 1.2254293424504106
Energy: 0.9999512564994781
Energy: 1.0036817459823544
Energy: 1.2257063918067563
Energy: 1.0003434448006197
Energy: 1.2160211730764758
Energy: 1.082766206598435
Energy: 1.0090363838328629
Energy: 1.0094688853267197
Energy: 1.0301659720393381
Energy: 1.0089528405426895
Energy: 1.0169644164215923
Energy: 1.0804260948994706
Energy: 0.9945929439926293
Energy: 0.9958754965620016
Energy: 1.0021477258949425
Energy: 1.0084367062341373
Energy: 1.0053646965783563
Energy: 1.082411143352049
Energy: 1.0068110701427115
Energy: 1.0084620546851055
Energy: 1.0260150447180363
Energy: 1.0063603879796759
Energy: 1.0063002022650769
Energy: 1.4788882391676446
Energy: 1.0267888226117643
Energy: 1.0102161326617343
Energy: 1.0368708303822631
Energy: 1.0305492255608288
Energy: 0.9859207216157478

minimum gb energy = 0.9802330782625214 eV
minimum distance =  2.30374849469237 Angstroms
sigma value = 57


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

Energy: 0.558202597206561
Energy: 0.5674818670291255
Energy: 0.55431109698877
Energy: 0.5562767109160418
Energy: 0.5680771931910349
Energy: 0.5488513917233622
Energy: 0.6749865024440241
Energy: 0.5672735784603337
Energy: 0.562010042679445
Energy: 0.5767815369036758
Energy: 0.572018348223531
Energy: 0.5607858887308866
Energy: 0.6798262250387657
Energy: 0.5681935099308704
Energy: 0.5642139097317157
Energy: 0.5736298525958485
Energy: 0.5742092812261456
Energy: 0.5613055956334048
Energy: 0.6803598653112015
Energy: 0.5698017964190956
Energy: 0.5646085346687718
Energy: 0.5745299735116816
Energy: 0.5733270855670635
Energy: 0.5627456722535866
Energy: 0.6742156708157753
Energy: 0.5553979314463309
Energy: 0.552468265305762
Energy: 0.5735518430661807
Energy: 0.5491993434187756
Energy: 0.5629011201339059
Energy: 0.6214474834782691
Energy: 0.5482618867813508
Energy: 0.5542725732425632
Energy: 0.5702052111841496
Energy: 0.5509723770574041
Energy: 0.5513074250694904
Energy: 0.6135742088034731
Energy: 0.5672590391565063
Energy: 0.5631871727375504
Energy: 0.5875195820225579
Energy: 0.5705765688473527
Energy: 0.5598192825651804
Energy: 0.6213304706978151
Energy: 0.5672163637200998
Energy: 0.5660800434837135
Energy: 0.5789295919233788
Energy: 0.5718103631667834
Energy: 0.5660634939020434
Energy: 0.6732130301246492
Energy: 0.5601226090846689
Energy: 0.5611685314803208
Energy: 0.582881507341609
Energy: 0.5671671072849436
Energy: 0.5639714993830945
Energy: 0.558970340704197
Energy: 0.5635251216156084
Energy: 0.5500992751056208
Energy: 0.5538221163103222
Energy: 0.5743357387485333
Energy: 0.5533432342817403
Energy: 0.5590433518648983
Energy: 0.5672292002327063
Energy: 0.5627612038173903
Energy: 0.552997872511868
Energy: 0.5726717331651016
Energy: 0.5525646525719923
Energy: 0.6757313070722352
Energy: 0.5638983792002481
Energy: 0.560946652743468
Energy: 0.5728584052188419
Energy: 0.5802239386241371
Energy: 0.5602119198995974
Energy: 0.6808143309545043
Energy: 0.5712597593593418
Energy: 0.5704664305499881
Energy: 0.5733268158410875
Energy: 0.5720138242398853
Energy: 0.5715205877643789
Energy: 0.6741686991618915
Energy: 0.564284496418044
Energy: 0.5615178666064813
Energy: 0.5732039219608356
Energy: 0.5803618158281406
Energy: 0.5616230394712097
Energy: 0.6797272287997218
Energy: 0.5501651522363861
Energy: 0.5484654599563528
Energy: 0.5727163700302278
Energy: 0.5550677478280943
Energy: 0.5517755466888852
Energy: 0.6175597876502249
Energy: 0.5610491349671956
Energy: 0.560452072605027
Energy: 0.5754270354939863
Energy: 0.5609810021230719
Energy: 0.5617234780872108
Energy: 0.6205659028168172
Energy: 0.5599689198042808
Energy: 0.5603829627586713
Energy: 0.5837575906495561
Energy: 0.5655243296821115
Energy: 0.5632892351862401
Energy: 0.6793313397482825
Energy: 0.5670573262150825
Energy: 0.5642039918440654
Energy: 0.5808698627527301
Energy: 0.5718058275603427
Energy: 0.5641452049441228
Energy: 0.5591536954935801
Energy: 0.5680418627500022
Energy: 0.5645708282713007
Energy: 0.552136774810371
Energy: 0.5707854002311568
Energy: 0.5619824641670802

minimum gb energy = 0.5482618867813508 eV
minimum distance =  2.37264579771333 Angstroms
sigma value = 11


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

Energy: 1.8054293776005133
Energy: 1.0525472014524764
Energy: 1.0020215906687528
Energy: 0.8782225517558689
Energy: 1.0713889159031362
Energy: 1.0020173989404135
Energy: 0.8612683645812599
Energy: 0.8387621080369972
Energy: 0.8366376666261854
Energy: 0.8402534492651751
Energy: 0.8375590000270543
Energy: 0.8371056267201838
Energy: 0.8636878753142512
Energy: 0.8432857266380831
Energy: 0.8400720584614387
Energy: 0.8464927401913585
Energy: 0.8485020479567001
Energy: 0.83893887810285
Energy: 0.8653724453375625
Energy: 0.8419821193551537
Energy: 0.8391374668021299
Energy: 0.8466591644688501
Energy: 0.8335535425446969
Energy: 0.837343426065619
Energy: 0.8613355428750835
Energy: 0.975153967767999
Energy: 0.9055709585502021
Energy: 0.8394803110179156
Energy: 0.9101107789169146
Energy: 0.836228674346001
Energy: 1.1889810289223945
Energy: 0.9084825115525983
Energy: 0.9122708626500788
Energy: 0.8450195492228427
Energy: 0.8389828993301561
Energy: 0.9097544298091629
Energy: 1.1018376904463525
Energy: 0.8393452669670952
Energy: 0.8379847313382317
Energy: 0.837544292924588
Energy: 0.840990703116871
Energy: 0.8386833377332432
Energy: 0.8819216951353955
Energy: 0.9833910285352382
Energy: 0.9832796206900373
Energy: 0.8337565937288448
Energy: 0.982901494378957
Energy: 0.9830684166260061
Energy: 1.1890094281454804
Energy: 0.8382970645394022
Energy: 0.8392350152949963
Energy: 0.8419913453915642
Energy: 0.8428741498480979
Energy: 0.8381523456370115
Energy: 1.4576256251126343
Energy: 0.9081325990389397
Energy: 0.9103299722880643
Energy: 0.8493363756872689
Energy: 0.9087716697432585
Energy: 0.9111593591666571
Energy: 1.5440965716573867
Energy: 0.9073277175002572
Energy: 0.906117010248861
Energy: 0.9071696427004561
Energy: 0.9069785514946448
Energy: 0.9062886727793509
Energy: 1.330811986603743
Energy: 0.832000577826562
Energy: 0.838627225759206
Energy: 0.9777816189306956
Energy: 0.8353984672002712
Energy: 0.8390655446673683
Energy: 1.1581117997757036
Energy: 0.8317834901674334
Energy: 0.832769392581884
Energy: 0.9820016067719922
Energy: 0.8370601620081661
Energy: 0.8371612906025088
Energy: 1.025505716045136
Energy: 0.975268486131365
Energy: 0.9758090168584644
Energy: 0.972355463896508
Energy: 0.9735724027405002
Energy: 0.9754342834647186
Energy: 1.1441703532189542
Energy: 1.0218339456808223
Energy: 1.0037841702296053
Energy: 0.8367560372917171
Energy: 1.021642256946618
Energy: 0.8369718754687201
Energy: 1.5212606552091388
Energy: 0.9802318887025626
Energy: 0.9766468795586403
Energy: 0.9730387878085478
Energy: 0.9728737904131163
Energy: 0.9763482659016693
Energy: 1.3342483591108525
Energy: 0.9080439701285763
Energy: 0.8490147039241145
Energy: 1.1814375595443507
Energy: 0.9087417060823808
Energy: 0.8393573781334315
Energy: 1.5796190610046479
Energy: 0.9037737880084343
Energy: 0.9768400669403341
Energy: 0.8318383399453615
Energy: 0.9065822509840883
Energy: 0.9767466481806584
Energy: 1.4504566844130422
Energy: 0.8364117682587904
Energy: 0.9130047972977829
Energy: 0.8354837855372516
Energy: 0.840620059889011
Energy: 0.9122579817290691
Energy: 1.1145226398404446
Energy: 0.9859908788686196
Energy: 0.9846665230174307
Energy: 1.0087243231139587
Energy: 1.013943545585783
Energy: 0.8389269203871978
Energy: 1.5217467076432813
Energy: 0.9084570034115288
Energy: 0.9048491024773265
Energy: 0.9080029706260189
Energy: 0.9816683879652888
Energy: 0.9029710213329228
Energy: 1.4275126882735865
Energy: 0.8449758471503471
Energy: 0.8462752409504323
Energy: 1.2236853735445408
Energy: 0.8460414253651003
Energy: 0.9122759525973482
Energy: 0.8658079024528162
Energy: 0.9082673908147506
Energy: 0.9067618216806055
Energy: 0.9042727585963631
Energy: 0.9073258038442752
Energy: 0.9051860852882669
Energy: 0.9826260209135754
Energy: 0.8354718003851341
Energy: 0.8366045286744492
Energy: 0.9821846003544726
Energy: 0.8421609288431382
Energy: 0.8372873215343626
Energy: 1.0069935359574735
Energy: 0.8361717570605403
Energy: 0.8397812369496375
Energy: 0.9798104716474441
Energy: 0.8414784618770222
Energy: 0.839217681377101
Energy: 1.4901518850652726
Energy: 0.8391682189155117
Energy: 0.8366680989898991
Energy: 0.9727744112376975
Energy: 0.8405603512366818
Energy: 0.836675588777225

minimum gb energy = 0.8317834901674334 eV
minimum distance =  2.33946862658754 Angstroms
sigma value = 41


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

Energy: 1.7156257291649446
Energy: 1.1996704199279469
Energy: 0.9477380730115049
Energy: 0.92427213379311
Energy: 1.1979419884846911
Energy: 0.924459665021297
Energy: 0.9237330731861813
Energy: 0.8950706346952066
Energy: 0.8951111021010341
Energy: 0.8944358249555063
Energy: 0.8933121236740268
Energy: 0.8935601070910941
Energy: 0.9254012405962075
Energy: 0.891749052626053
Energy: 0.891811139716149
Energy: 0.8917513385951601
Energy: 0.8913823550476827
Energy: 0.8923022128452774
Energy: 0.9264307957210074
Energy: 0.8927685100651822
Energy: 0.8923470599687202
Energy: 0.8931718807955721
Energy: 0.8917706281559894
Energy: 0.8936958839402754
Energy: 0.924254872462463
Energy: 0.8978724564409571
Energy: 0.8991913018246923
Energy: 0.8932012380202977
Energy: 0.8954490808786754
Energy: 0.8933833773337456
Energy: 1.360793672843843
Energy: 0.8945201575461336
Energy: 0.8938658408971915
Energy: 0.8907345396484113
Energy: 0.8963396867552542
Energy: 0.8954271269277956
Energy: 1.0193655494063572
Energy: 0.8938687714320585
Energy: 0.8930869507203744
Energy: 0.8958746310982123
Energy: 0.8937209804719939
Energy: 0.8926477374319369
Energy: 0.9575728425371579
Energy: 1.1225914727704427
Energy: 1.12216435027855
Energy: 0.8871589529881925
Energy: 0.8938576962450643
Energy: 0.9086414074620595
Energy: 1.3599795632601206
Energy: 0.892684549789485
Energy: 0.8953838125115676
Energy: 0.8926685502824298
Energy: 0.8939216034171106
Energy: 0.8965492369041945
Energy: 1.2978543636453639
Energy: 0.8898860362390051
Energy: 0.8941736594245687
Energy: 1.154850693841709
Energy: 0.890972117812047
Energy: 0.8929117261771014
Energy: 1.3560790295995058
Energy: 0.8900128952291834
Energy: 0.893589889784716
Energy: 0.8952292076826991
Energy: 0.8907834710765452
Energy: 0.8917931584555875
Energy: 1.596467849843732
Energy: 0.8896853234311647
Energy: 0.8896197107639953
Energy: 0.890956661795915
Energy: 0.8921617682094218
Energy: 0.8907436867703151
Energy: 0.9318125885871463
Energy: 0.8878602624019136
Energy: 0.8858334178946736
Energy: 0.8925801545896926
Energy: 0.895942323290188
Energy: 0.886540949271167
Energy: 1.0852582131099457
Energy: 0.891907244731722
Energy: 0.8920242155699792
Energy: 0.8947250549594727
Energy: 0.8923283439137665
Energy: 0.8933598551555575
Energy: 1.12047480745335
Energy: 1.1241775790968476
Energy: 1.1256607100027445
Energy: 1.1210763815960008
Energy: 0.896362436179362
Energy: 1.1260564204208416
Energy: 0.9238344392670018
Energy: 0.8943275073898034
Energy: 0.8940061404069729
Energy: 0.8944149773302769
Energy: 0.8973507207561608
Energy: 0.8945683841995978
Energy: 1.6366088022426324
Energy: 0.8955551809427142
Energy: 0.8873529439261627
Energy: 1.4122160848970886
Energy: 0.895088935162176
Energy: 1.17318360197099
Energy: 0.9573980743214666
Energy: 0.8956631375280819
Energy: 0.8942832392351661
Energy: 0.888831484420087
Energy: 0.8957166864698762
Energy: 0.889637729520269
Energy: 0.9263553230023388
Energy: 0.8918165845212707
Energy: 0.8941621823816701
Energy: 0.894230906588859
Energy: 0.8915782678518425
Energy: 0.8938343202771345
Energy: 0.9247689208857149
Energy: 0.8942234391157833
Energy: 0.8917042665934137
Energy: 0.8915646147527918
Energy: 0.8924610938969232
Energy: 0.8909023402829942
Energy: 0.9238692900276523
Energy: 0.8912567861591891
Energy: 0.8919409001491678
Energy: 0.8977357392536978
Energy: 0.8925141612812537
Energy: 0.8944367270986764
Energy: 1.4662483521096885
Energy: 1.1525456720441352
Energy: 1.15331290521118
Energy: 1.1709373595406298
Energy: 1.1537587387157837
Energy: 1.1528189671181863
Energy: 1.36057874141982
Energy: 0.8930825160742347
Energy: 0.8920502118205067
Energy: 0.8981803283758307
Energy: 0.8938326588866944
Energy: 0.8943466476132266
Energy: 0.9585058904403182
Energy: 0.8918964583768911
Energy: 0.8912334792500851
Energy: 0.8879439231614246
Energy: 1.1240185834368834
Energy: 0.887700162713203
Energy: 1.0184419575237038
Energy: 0.8937974228773751
Energy: 0.8928243457109265
Energy: 0.8980389184954033
Energy: 0.8935599380989597
Energy: 0.8921407417989559
Energy: 1.3561857158129045
Energy: 0.8897738982009827
Energy: 0.8900804844773892
Energy: 0.8941040924323596
Energy: 0.8910417274120691
Energy: 0.8943802154720842
Energy: 1.2979575776204046
Energy: 0.8898378720548351
Energy: 0.8899262863517116
Energy: 0.892842915171351
Energy: 0.8902391194136258
Energy: 0.892630771374344
Energy: 1.3605222601607017
Energy: 0.8900195235347771
Energy: 0.8972868247581691
Energy: 0.8924395585353075
Energy: 0.892657304922023
Energy: 0.896799474973708
Energy: 0.931282965228608
Energy: 0.8874636053942133
Energy: 0.8872315418654253
Energy: 0.8931286824216498
Energy: 0.8893185306290046
Energy: 0.8862589920231498
Energy: 1.0843046530585265
Energy: 0.8956991124294652
Energy: 0.895730861956824
Energy: 0.8910948620827185
Energy: 0.8960128440524016
Energy: 0.895448925961756
Energy: 0.9334674003593433
Energy: 0.893165384767559
Energy: 0.892214689408113
Energy: 0.8935927129611646
Energy: 0.8911049342164523
Energy: 0.8919149970696707
Energy: 0.9247704355385246
Energy: 0.8964019837492656
Energy: 0.8942553918775639
Energy: 0.8914294825746704
Energy: 0.8942359639334997
Energy: 0.8926966275667382
Energy: 1.7006623520831448
Energy: 0.8941112876873291
Energy: 0.8864151805815024
Energy: 0.8974885984099736
Energy: 0.894808233853006
Energy: 0.8882467579414514

minimum gb energy = 0.8858334178946736 eV
minimum distance =  2.32329013019107 Angstroms
sigma value = 33


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

Energy: 1.2505007123711078
Energy: 0.9876337140305659
Energy: 0.9724247779072863
Energy: 0.9855695569474936
Energy: 0.9871264983663965
Energy: 0.9718908372971271
Energy: 1.004129329068333
Energy: 0.9604441671922681
Energy: 0.9625302135670528
Energy: 0.9672736861957797
Energy: 0.9620262869068925
Energy: 0.9596270541538728
Energy: 1.0040810012479362
Energy: 0.9607455395050478
Energy: 0.9621325001433114
Energy: 0.9679660807695135
Energy: 0.960548833552865
Energy: 0.9616970025996917
Energy: 1.0143580267409726
Energy: 0.9618851715455329
Energy: 0.9713866326195607
Energy: 0.9641646417551034
Energy: 0.9662611437880809
Energy: 0.971037264066622
Energy: 1.0029868653447656
Energy: 0.9696714800719859
Energy: 0.9699791118641136
Energy: 0.9641881292163297
Energy: 0.9750517996856207
Energy: 0.9607932754971265
Energy: 1.0278582497777178
Energy: 0.9566412100452191
Energy: 0.9661778679410932
Energy: 0.9631079965887732
Energy: 0.9568420190428082
Energy: 0.9560159669445494
Energy: 1.0527425993913124
Energy: 0.9552692954306499
Energy: 0.97011131721217
Energy: 0.9663693237683089
Energy: 0.9538570415013999
Energy: 0.9643712109553155
Energy: 1.046035522623786
Energy: 0.9765271497211754
Energy: 0.978697762188182
Energy: 0.9517888932202305
Energy: 0.9768981633233218
Energy: 0.980962475109243
Energy: 1.0516936535654289
Energy: 0.9550871093517614
Energy: 0.9570834745667733
Energy: 0.9550113212298358
Energy: 0.9536014766342344
Energy: 0.9573642259382754
Energy: 1.0503023227351165
Energy: 0.9600398731761123
Energy: 0.9606122588503282
Energy: 0.9603168632501278
Energy: 0.9598188683493295
Energy: 0.9659309543497029
Energy: 1.0492732136313234
Energy: 0.9575666217107239
Energy: 0.960587656432784
Energy: 0.9626231245847479
Energy: 0.9557540191065449
Energy: 0.9605553749547945
Energy: 1.3765170298963987
Energy: 0.9587641204612071
Energy: 0.9582677734127045
Energy: 0.9664196936343535
Energy: 0.9589455691146207
Energy: 0.9586655572504083
Energy: 1.0010949229048514
Energy: 0.9624598739385228
Energy: 0.952492029627999
Energy: 0.9686609426077445
Energy: 0.9644137602825359
Energy: 0.9524343542863567
Energy: 1.006305912945724
Energy: 0.962193006550554
Energy: 0.9615872011699382
Energy: 0.9762079629070899
Energy: 0.96251264571461
Energy: 0.9633769450955262
Energy: 0.9493015106963205
Energy: 0.9612463872079335
Energy: 0.9613216439576082
Energy: 0.9604941304809095
Energy: 0.9620183794669717
Energy: 0.9620866571761797
Energy: 1.0026117589519343
Energy: 0.9604414160157413
Energy: 0.9623197900441932
Energy: 0.9687030994171004
Energy: 0.9660249845031835
Energy: 0.965702829270448
Energy: 1.516257686171714
Energy: 0.9668964756429521
Energy: 0.9581900306251238
Energy: 1.328497107823444
Energy: 0.9623610064974647
Energy: 0.9584273653897192
Energy: 1.0499177093094092
Energy: 0.9621523423945901
Energy: 0.9593742330105429
Energy: 0.9716020027719587
Energy: 0.9629667203134366
Energy: 0.9746705162170063
Energy: 1.001287552293446
Energy: 0.9535237272131685
Energy: 0.9505147955544497
Energy: 0.9538677384773198
Energy: 0.9524997989351888
Energy: 0.9630070487413716
Energy: 0.956716785368343
Energy: 0.9525503474979271
Energy: 0.9517232238410922
Energy: 0.9565082264689253
Energy: 0.9520343233946122
Energy: 0.9611282645615076
Energy: 0.9534745501675026
Energy: 0.9543176587489267
Energy: 0.9605660254497385
Energy: 0.9548142577181065
Energy: 0.9653551886963829
Energy: 0.9574523471692186
Energy: 0.9833193525445966
Energy: 0.9527871765423729
Energy: 0.9665209651186717
Energy: 0.9834804363332638
Energy: 0.9567168090679287
Energy: 0.9598932025255641
Energy: 1.0023458247985977
Energy: 0.962083955053146
Energy: 0.9606826268631571
Energy: 0.9556766307095332
Energy: 0.9631851367181646
Energy: 0.9581500291652825
Energy: 1.0519494683466892
Energy: 0.972070624987211
Energy: 0.969156092367493
Energy: 0.9518341243918511
Energy: 0.9727480401028393
Energy: 0.9523879053495125
Energy: 1.140897245217181
Energy: 0.965892720800673
Energy: 0.9633226866398623
Energy: 0.9550308749647879
Energy: 0.9608802872929488
Energy: 0.9604528874189685
Energy: 1.0163898192313463
Energy: 0.9654551320865675
Energy: 0.9637130747869006
Energy: 0.9646208813342044
Energy: 0.9606504361900001
Energy: 0.9599718970902335
Energy: 1.0038656785553277
Energy: 0.9614830398539108
Energy: 0.9612876186575857
Energy: 0.9672189238511023
Energy: 0.9624834914479087
Energy: 0.9635480650544487
Energy: 1.00151827416557
Energy: 0.9584082171094432
Energy: 0.9593042883484952
Energy: 0.9641867982250636
Energy: 0.969718285440394
Energy: 0.9626765450738755
Energy: 1.0439036355826863
Energy: 0.9554880654502249
Energy: 0.9563101553033564
Energy: 0.9638601795733218
Energy: 1.329136417074032
Energy: 0.9571107266157716
Energy: 1.050726357499666
Energy: 0.9551562580082549
Energy: 0.9587030423130672
Energy: 0.9650696710398066
Energy: 0.9536985880998732
Energy: 0.9645320565846502
Energy: 1.0462302797493588
Energy: 0.9590770939048621
Energy: 0.9777766571503719
Energy: 0.9523248119093874
Energy: 0.9747125505073496
Energy: 0.9794077832616795
Energy: 1.0533998838040566
Energy: 0.9552605387601327
Energy: 0.957483087973275
Energy: 0.9558719477156993
Energy: 0.9553488324461409
Energy: 0.9590562083065233
Energy: 1.0495360474194733
Energy: 0.9580852835587672
Energy: 0.9670111613886195
Energy: 0.965558875442344
Energy: 0.9568465317395649
Energy: 0.9646398376933643
Energy: 1.0499019802858334
Energy: 0.9574168348794028
Energy: 0.9666914904431422
Energy: 0.96556373920526
Energy: 0.9533826949521197
Energy: 0.9642485693296842
Energy: 1.0528158718640601
Energy: 0.9557550844934695
Energy: 0.9856053989520709
Energy: 0.9636908933468985
Energy: 0.954161190802416
Energy: 0.9706426643262965
Energy: 1.001569132762048
Energy: 0.9519420033424021
Energy: 0.961783013209936
Energy: 0.9670382326657327
Energy: 0.9497941251258697
Energy: 0.9534661556937299
Energy: 1.00297159207217
Energy: 0.9687063728826233
Energy: 0.9675103884256928
Energy: 0.9691468451156805
Energy: 0.9711238515063563
Energy: 0.9684026862799614
Energy: 1.0046609312166799
Energy: 0.9597108006451999
Energy: 0.9611716324118191
Energy: 1.0059370048281688
Energy: 0.9603636726119745
Energy: 0.9616379961242375
Energy: 1.0035066112265072
Energy: 0.9653463685579095
Energy: 0.9612784513369627
Energy: 0.9618472923027687
Energy: 0.9691105483613983
Energy: 0.9714249557345717
Energy: 1.5164369988994044
Energy: 0.9642887534189679
Energy: 0.9561807252298204
Energy: 0.9704036564003495
Energy: 0.9636986196362524
Energy: 0.9608235842286943
Energy: 1.1335835310036053
Energy: 0.9638900138846739
Energy: 0.9578130560416089
Energy: 0.9685631977538053
Energy: 0.9632904916842877
Energy: 0.9621485929231387
Energy: 1.007378354207904
Energy: 0.9516635312972087
Energy: 0.9513317499466399
Energy: 0.9530723076324384
Energy: 0.9543300685318931
Energy: 0.9619821205654764
Energy: 0.9579979325084943
Energy: 0.9527057215068393
Energy: 0.9509795083868446
Energy: 0.9579480768177895
Energy: 0.9523965522057241
Energy: 0.9525313315732509
Energy: 0.951698740187922
Energy: 0.9538715114108528
Energy: 0.9682229287341836
Energy: 0.9521572841782021
Energy: 0.9545169248680925
Energy: 0.9675319654039428
Energy: 0.9831695119301458
Energy: 0.9583350237500468
Energy: 0.9955689191214366
Energy: 0.9746458491362099
Energy: 0.9589818499082514
Energy: 0.9952443068234904
Energy: 1.0026392228511571
Energy: 0.964745584846185
Energy: 0.9642049505956793
Energy: 0.9535010854812423
Energy: 0.9644818386681159
Energy: 0.9641357678462928
Energy: 1.0452620087755924
Energy: 0.9651517244169157
Energy: 0.9628890496654123
Energy: 0.9646454498277506
Energy: 0.9666055216540701
Energy: 0.9653513269712232

minimum gb energy = 0.9493015106963205 eV
minimum distance =  2.32913646371522 Angstroms
sigma value = 67


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

Energy: 1.474037404697296
Energy: 1.0221755980280436
Energy: 1.0564570847495414
Energy: 1.063834052297461
Energy: 1.0198430782464927
Energy: 1.0584543593380802
Energy: 1.0750467543797342
Energy: 1.0187264149489934
Energy: 1.0212324385792584
Energy: 1.017436278314495
Energy: 1.0186782437389166
Energy: 1.0257573641017286
Energy: 1.0717865093190053
Energy: 0.9919460196816042
Energy: 1.019269398617733
Energy: 1.0188428685595232
Energy: 0.9900844532751936
Energy: 1.019187034240809
Energy: 1.0706180016729558
Energy: 1.0185503384820247
Energy: 1.0167597439015772
Energy: 1.0169907673229504
Energy: 1.0179773198579272
Energy: 1.0178574463900263
Energy: 1.0718212323704863
Energy: 1.0199370608031797
Energy: 1.0210751459661065
Energy: 1.0242251930155613
Energy: 1.0197124243551978
Energy: 1.020187366419462
Energy: 1.0745532502311497
Energy: 1.025530495528124
Energy: 1.0244684601340113
Energy: 1.0267520834500783
Energy: 1.025249758146912
Energy: 1.0249033113686024
Energy: 1.1345531120567314
Energy: 1.0231951661141205
Energy: 1.0200283635575396
Energy: 0.9897384592603677
Energy: 1.0189570245920128
Energy: 1.0201072257255999

minimum gb energy = 0.9897384592603677 eV
minimum distance =  2.35569013527876 Angstroms
sigma value = 3


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

Energy: 1.8681334387835102
Energy: 1.2452639297566885
Energy: 1.1146565964299686
Energy: 1.2469236556149366
Energy: 1.8089314188575085
Energy: 1.1113455927791924
Energy: 1.1709773060908086
Energy: 1.1596522668664784
Energy: 1.1545742767648832
Energy: 1.165119354659525
Energy: 1.1484677499723
Energy: 1.1531373175962045
Energy: 1.2085820715805307
Energy: 1.139622677644286
Energy: 1.1381216406811614
Energy: 1.2093051441824705
Energy: 1.1401646514451456
Energy: 1.16543137620893
Energy: 1.1493290593851728
Energy: 1.15747192600785
Energy: 1.1651112185899244
Energy: 1.1496444415806728
Energy: 1.136984911578967
Energy: 1.1664467529485094
Energy: 1.1278925484240174
Energy: 1.117462792282799
Energy: 1.1190302744648
Energy: 1.1163603601987755
Energy: 1.1193774619743742
Energy: 1.1190068559644049
Energy: 1.1277632299646523
Energy: 1.1194212988967733
Energy: 1.1192468010930354
Energy: 1.1210120368630505
Energy: 1.1182561389274202
Energy: 1.1178483183487797
Energy: 1.1402353680818735
Energy: 1.1145392087613633
Energy: 1.1255495062372671
Energy: 1.123900660968987
Energy: 1.1138085508601134
Energy: 1.1213111678906043
Energy: 1.5230519680503736
Energy: 1.1650464687332023
Energy: 1.181977869481038
Energy: 1.1993467524264598
Energy: 1.16797304172136
Energy: 1.1909964781983042
Energy: 1.1461699814103392
Energy: 1.1501578052689094
Energy: 1.148603285510773
Energy: 1.1293868063934251
Energy: 1.2306489904575746
Energy: 1.1473572684752362
Energy: 1.128390885292387
Energy: 1.2145762160197433
Energy: 1.2139029925590825
Energy: 1.2369586789696552
Energy: 1.216125589146257
Energy: 1.1424146227784564
Energy: 1.2077792569587724
Energy: 1.132648770535625
Energy: 1.1356996303405715
Energy: 1.1132324816975587
Energy: 1.1024239050499192
Energy: 1.1217101740056195
Energy: 1.1950603878726807
Energy: 1.1191654966045215
Energy: 1.1167761861312973
Energy: 1.122830998591579
Energy: 1.1204563931669576
Energy: 1.1232395208103396
Energy: 1.1547800740437724
Energy: 1.1184428163223343
Energy: 1.1201147057439609
Energy: 1.0986864451551956
Energy: 1.1190641431816015
Energy: 1.122190438012458
Energy: 1.182241400013715
Energy: 1.1575490396865742
Energy: 1.1638634603514006
Energy: 1.143613831529642
Energy: 1.151444689788258
Energy: 1.1640753172943015
Energy: 1.1970823217791688
Energy: 1.2289351944500913
Energy: 1.205541418328251
Energy: 1.1244635197628388
Energy: 1.2196514182281992
Energy: 1.151238271184566
Energy: 1.2767441099366346
Energy: 1.1742776333985945
Energy: 1.154226048688102
Energy: 1.1533126553221507
Energy: 1.1709937100471697
Energy: 1.1495963461005454
Energy: 1.2926853750651623
Energy: 1.1755531680380205
Energy: 1.1764761605755902
Energy: 1.150915645410059
Energy: 1.1937240604094952
Energy: 1.1200324000378892
Energy: 1.2694176926737435
Energy: 1.152669069351066
Energy: 1.1522380604385638
Energy: 1.149200770697685
Energy: 1.1540285510659622
Energy: 1.1473788581476903
Energy: 1.31886976915189
Energy: 1.159891884518376
Energy: 1.1616178620969062
Energy: 1.1983136935253507
Energy: 1.1615172250472425
Energy: 1.1918988356243114
Energy: 1.231411305978077
Energy: 1.1606030552559115
Energy: 1.1630129760743761
Energy: 1.2018322766850227
Energy: 1.1637171015381103
Energy: 1.1935880689643457
Energy: 1.1394981485591866
Energy: 1.100887571168513
Energy: 1.1096570118116158
Energy: 1.100014289645051
Energy: 1.098987666487569
Energy: 1.109935398700565
Energy: 1.1410284119394118
Energy: 1.101351875722063
Energy: 1.1030442648949106
Energy: 1.104572416774675
Energy: 1.1077204936186982
Energy: 1.103511118846816
Energy: 1.1522309380651141
Energy: 1.1069542098441771
Energy: 1.1035344335996493
Energy: 1.120439769736137
Energy: 1.1014200409027137
Energy: 1.1050320788665358
Energy: 1.2016913786927972
Energy: 1.164901387533568
Energy: 1.1658070594383731
Energy: 1.202813210574867
Energy: 1.1576961449536918
Energy: 1.1773046901152862
Energy: 1.1487110521258623
Energy: 1.1546302763064278
Energy: 1.1558706143014228
Energy: 1.1725373744041785
Energy: 1.155642430012309
Energy: 1.163215105145756
Energy: 1.331117940323641
Energy: 1.163366438094561
Energy: 1.129094214638631
Energy: 1.1548975457977513
Energy: 1.166092453597797
Energy: 1.099273488961523
Energy: 1.3021853936516974
Energy: 1.1514609291819393
Energy: 1.1296530423559759
Energy: 1.1512563170275225
Energy: 1.1653932698515703
Energy: 1.1385566134023037
Energy: 1.1493123974926263
Energy: 1.153107839970602
Energy: 1.156449876120629
Energy: 1.1789814518219086
Energy: 1.1568854070643708
Energy: 1.1660005435559957
Energy: 1.1492168733104522
Energy: 1.1423896890972236
Energy: 1.140142447581067
Energy: 1.1516116430041097
Energy: 1.143568222873667
Energy: 1.1688663541885178
Energy: 1.17980441682552
Energy: 1.1272607817404048
Energy: 1.1289440513660307
Energy: 1.181204515888423
Energy: 1.1790292141236327
Energy: 1.1288295253822223
Energy: 1.1284341729562766
Energy: 1.1261597076681171
Energy: 1.1229348455831627
Energy: 1.1212394716373886
Energy: 1.1158951233502505
Energy: 1.1232799352347747
Energy: 1.1587730565698728
Energy: 1.1192538094097553
Energy: 1.117693946507203
Energy: 1.1155604163579043
Energy: 1.1183053722933352
Energy: 1.130016466634027
Energy: 1.2868141964072042
Energy: 1.1128416021779939
Energy: 1.1595605259299668
Energy: 1.1828236797988316
Energy: 1.1128816636514445
Energy: 1.1723715248622542
Energy: 1.3169407291607598
Energy: 1.1551360044954408
Energy: 1.154485659469988
Energy: 1.1766109974663386
Energy: 1.1557831716513967
Energy: 1.151299569361415
Energy: 1.1275695540798891
Energy: 1.1444454642713018
Energy: 1.138575084023746
Energy: 1.11745567007854
Energy: 1.1456164584236785
Energy: 1.1194758997439025
Energy: 1.1979498973527944
Energy: 1.21156043879045
Energy: 1.2128296065417183
Energy: 1.1171135878808245
Energy: 1.2151979126005554
Energy: 1.100482180194928
Energy: 1.195750328429234
Energy: 1.129593768373896
Energy: 1.1198966139796585
Energy: 1.1169718500468613
Energy: 1.1301550150078237
Energy: 1.1177460744905652
Energy: 1.155047808908654
Energy: 1.1234430993952573
Energy: 1.123639173038218
Energy: 1.1058774474552235
Energy: 1.1212894239719073
Energy: 1.1194315494005629
Energy: 1.1334775822512035
Energy: 1.1384290660332759
Energy: 1.121825719556571
Energy: 1.1797761441496784
Energy: 1.114528270137577
Energy: 1.123344925490395
Energy: 1.1980598962479783
Energy: 1.1512230536868864
Energy: 1.168007899977508
Energy: 1.1217795025631365
Energy: 1.1508431231795684
Energy: 1.159105536820759
Energy: 1.2786057500544972
Energy: 1.159441869609504
Energy: 1.162640838566497
Energy: 1.1594718908278914
Energy: 1.15162212049471
Energy: 1.1675630761012687
Energy: 1.2768937393413742
Energy: 1.1530920749589622
Energy: 1.1592374725764245
Energy: 1.1484690405312636
Energy: 1.1788483343553748
Energy: 1.1475981477454684
Energy: 1.2701601334800683
Energy: 1.1751886893871621
Energy: 1.1749246248271241
Energy: 1.2748534297886949
Energy: 1.1877816641244014
Energy: 1.1612580721361236
Energy: 1.2747271413922374
Energy: 1.1771770107420325
Energy: 1.1522543093063953
Energy: 1.1561509361415487
Energy: 1.177219324492415
Energy: 1.1522920841231086
Energy: 1.6487171398738387
Energy: 1.1818609044384525
Energy: 1.254360428593576
Energy: 1.2080252458208487
Energy: 1.2010689371543557
Energy: 1.2407271528017043
Energy: 1.1555151003324
Energy: 1.1106670564611987
Energy: 1.1072427227629813
Energy: 1.0986069954537259
Energy: 1.126246810660407
Energy: 1.1035518897930479
Energy: 1.1423871417171079
Energy: 1.1000075030921679
Energy: 1.1005206110364942
Energy: 1.1049043881725054
Energy: 1.10311373487456
Energy: 1.1018801785045755
Energy: 1.139773879213901
Energy: 1.099096294845609
Energy: 1.0993655782343839
Energy: 1.1001162437287344
Energy: 1.0983551673188303
Energy: 1.1124064974046315
Energy: 1.1873296153786637
Energy: 1.1726690896990504
Energy: 1.1531024095217388
Energy: 1.1875393822458462
Energy: 1.1740066043384716
Energy: 1.1653888669536954
Energy: 1.2004739054725055
Energy: 1.1726775141609784
Energy: 1.1713638966420084
Energy: 1.2002670812017953
Energy: 1.1698720731790768
Energy: 1.1646290590727009
Energy: 1.1494345033883597
Energy: 1.1320044462985828
Energy: 1.1475319029699895
Energy: 1.1382907044328128
Energy: 1.243720623436924
Energy: 1.156734197221702

minimum gb energy = 1.0983551673188303 eV
minimum distance =  2.31658198120999 Angstroms
sigma value = 81


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

Energy: 1.9124912911482626
Energy: 1.7611274238888959
Energy: 1.2358737531663826
Energy: 1.2427971886150646
Energy: 1.7609512056488081
Energy: 1.2361131728794879
Energy: 1.106632508945939
Energy: 1.047605097500724
Energy: 1.044123026895311
Energy: 1.0984248851511067
Energy: 1.048414598946804
Energy: 1.043135101786769
Energy: 1.10472463988876
Energy: 1.0395803837812347
Energy: 1.0393423008362699
Energy: 1.1088686451980856
Energy: 1.0407518134125606
Energy: 1.1033485260546008
Energy: 1.1028499587077123
Energy: 1.0388153414488417
Energy: 1.0407216941426665
Energy: 1.0986177291559989
Energy: 1.03953129047734
Energy: 1.1077503824329662
Energy: 1.103025069396783
Energy: 1.1015049548255886
Energy: 1.1114146751542042
Energy: 1.1047195294561496
Energy: 1.1014091312887535
Energy: 1.1094451565356023
Energy: 1.1047165851292609
Energy: 1.102137412343564
Energy: 1.101619102525099
Energy: 1.1167934775667372
Energy: 1.1024720381950948
Energy: 1.1087042209572675
Energy: 1.1056043619614186
Energy: 1.0933224495593747
Energy: 1.0940706285782933
Energy: 1.0984631922260735
Energy: 1.0963837809335617
Energy: 1.094739975281736
Energy: 1.202216300162814
Energy: 1.2154965912701967
Energy: 1.2182914581028446
Energy: 1.1305754906026333
Energy: 1.2170187092133258
Energy: 1.1101834917510134
Energy: 1.1047891032829542
Energy: 1.171611623349767
Energy: 1.178662581059184
Energy: 1.097934469146042
Energy: 1.17975234808577
Energy: 1.0955981430919706
Energy: 1.1676645802634653
Energy: 1.1462820410066994
Energy: 1.1336112961378744
Energy: 1.147325847628452
Energy: 1.1441172145202319
Energy: 1.1351398025478627
Energy: 1.1018592454421732
Energy: 1.1499718687403786
Energy: 1.1494100685538888
Energy: 1.1023382737724292
Energy: 1.1033935320137667
Energy: 1.1044969805663816
Energy: 1.0665792301080386
Energy: 1.0992714955275704
Energy: 1.1011228722280835
Energy: 1.0392291485190805
Energy: 1.105809905764152
Energy: 1.1008940926716833
Energy: 1.066113117666617
Energy: 1.110285954474755
Energy: 1.1037010474334887
Energy: 1.0413541014626053
Energy: 1.1088118493400239
Energy: 1.0386924897934853
Energy: 1.0895789587321214
Energy: 1.105198095997622
Energy: 1.1086523568609126
Energy: 1.0421535096338097
Energy: 1.0706674730158874
Energy: 1.0446734881178021
Energy: 1.1933522299267871
Energy: 1.1470972408570035
Energy: 1.1121314000127787
Energy: 1.1055543418672282
Energy: 1.1509725994331794
Energy: 1.1124387566850928
Energy: 1.189564141368176
Energy: 1.1007069832409437
Energy: 1.101437044855355
Energy: 1.0965258915062464
Energy: 1.0993428304996566
Energy: 1.0965649497473535
Energy: 1.2770390480079405
Energy: 1.129669393436646
Energy: 1.1310433481686006
Energy: 1.1883969040593882
Energy: 1.1143147280257795
Energy: 1.1280760600997457
Energy: 1.2940038479204088
Energy: 1.1014373018592327
Energy: 1.1769970564123624
Energy: 1.1869972122161607
Energy: 1.0976638361845603
Energy: 1.1714597541062517
Energy: 1.2999521123547335
Energy: 1.1054833183209047
Energy: 1.1324108766141545
Energy: 1.1420415503765804
Energy: 1.1067805656732508
Energy: 1.1435619771704182
Energy: 1.288256720331957
Energy: 1.10592366549675
Energy: 1.132969283417851
Energy: 1.1442994476190342
Energy: 1.104338537193897
Energy: 1.136323521724512
Energy: 1.1041324211064365
Energy: 1.0442993443069222
Energy: 1.043139607246016
Energy: 1.1007966306620334
Energy: 1.0454914746828554
Energy: 1.099583573207608
Energy: 1.1027483207489812
Energy: 1.0406422362269994
Energy: 1.0398185760408636
Energy: 1.1140633739337893
Energy: 1.040485638103156
Energy: 1.0391993475775474
Energy: 1.0795792117615088
Energy: 1.040365319372209
Energy: 1.0410964002117329
Energy: 1.0819809782854106
Energy: 1.0416820595188372
Energy: 1.0410428149482016
Energy: 1.1024676220843757
Energy: 1.1151434868975587
Energy: 1.1151295301787363
Energy: 1.1140581387907467
Energy: 1.1119525369825658
Energy: 1.115186953356067
Energy: 1.1045231032578346
Energy: 1.0965677767595894
Energy: 1.09716313148907
Energy: 1.102128408276401
Energy: 1.0968450345582414
Energy: 1.098997650541307
Energy: 1.1975858196055078
Energy: 1.1921041277243216
Energy: 1.177484700126508
Energy: 1.1149140877690873
Energy: 1.1928336005006832
Energy: 1.179199280879955
Energy: 1.1973149304168094
Energy: 1.1855537121021946
Energy: 1.1768938520548524
Energy: 1.1043088061384492
Energy: 1.1906765914405422
Energy: 1.1783581765784097
Energy: 1.1037447103187559
Energy: 1.102907386444359
Energy: 1.0980677972654531
Energy: 1.1009336607987843
Energy: 1.1018668033833512
Energy: 1.098556034299006
Energy: 1.100556519298283
Energy: 1.1381633915769693
Energy: 1.1348212950779808
Energy: 1.107697432905173
Energy: 1.1341557546233567
Energy: 1.1365601036390296
Energy: 1.0882438936392826
Energy: 1.096003887816731
Energy: 1.046523787081099
Energy: 1.0763976612986124
Energy: 1.1011115274951824
Energy: 1.044070478147829
Energy: 1.0664149800483191
Energy: 1.1272287078888894
Energy: 1.1088128067771272
Energy: 1.040991185217173
Energy: 1.1500356590782705
Energy: 1.0394812737282955
Energy: 1.0901490840685475
Energy: 1.044707219732005
Energy: 1.0414603151396096
Energy: 1.044954576258114
Energy: 1.0516661070648512
Energy: 1.0407311386990998
Energy: 1.192805306099643
Energy: 1.110236718176525
Energy: 1.111128939803776
Energy: 1.1035556293855515
Energy: 1.108255936483326
Energy: 1.1112595062392938
Energy: 1.191329165335649
Energy: 1.105995668496995
Energy: 1.1055791229177745
Energy: 1.099161003454057
Energy: 1.105825035298125
Energy: 1.1001205875306352
Energy: 1.1909312949253634
Energy: 1.099302278906508
Energy: 1.0965224685339563
Energy: 1.0948228557867319
Energy: 1.1046181457477333
Energy: 1.0957454338665709
Energy: 1.2839665359778296
Energy: 1.1173607427173324
Energy: 1.1157448432126043
Energy: 1.216254358951024
Energy: 1.1283649399481492
Energy: 1.1826286502822174
Energy: 1.2961055738567666
Energy: 1.0997889785982369
Energy: 1.1023528052565303
Energy: 1.1851063034322145
Energy: 1.0994651311599588
Energy: 1.0962278466834492
Energy: 1.3077227500028497
Energy: 1.1591779458097402
Energy: 1.2354980933670214
Energy: 1.1379669334518054
Energy: 1.1532398497922387
Energy: 1.1376542701277108

minimum gb energy = 1.0386924897934853 eV
minimum distance =  2.3336542346086 Angstroms
sigma value = 43


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

Energy: 2.007906242640457
Energy: 1.150750548035071
Energy: 1.0906018660378909
Energy: 1.2940167018109996
Energy: 1.1519850708303518
Energy: 1.2958615069007524
Energy: 1.1482324265509314
Energy: 1.1012344349635632
Energy: 1.1095287121159538
Energy: 1.162809840081695
Energy: 1.0938667606669217
Energy: 1.1113758903020945
Energy: 1.190157032760249
Energy: 1.131966222939599
Energy: 1.1311814137661433
Energy: 1.1578732343161315
Energy: 1.1314165838943653
Energy: 1.173806365115326
Energy: 1.148862988692651
Energy: 1.134327695078063
Energy: 1.203452848079244
Energy: 1.1488280699498754
Energy: 1.1360549063151428
Energy: 1.1562617395337396
Energy: 1.0992598581851591
Energy: 1.0657932900907068
Energy: 1.065372458354376
Energy: 1.0648192796517675
Energy: 1.067009110645422
Energy: 1.0652829804323398
Energy: 1.100230908092192
Energy: 1.0667000208605555
Energy: 1.0660017490847753
Energy: 1.0658440498775537
Energy: 1.0677660522559966
Energy: 1.0660261957735406
Energy: 1.0997295565356244
Energy: 1.0643552572840256
Energy: 1.0641377636773308
Energy: 1.1281536152202651
Energy: 1.0841956140110394
Energy: 1.064718251628875
Energy: 1.2190297528514638
Energy: 1.1617384448604802
Energy: 1.1651278810238304
Energy: 1.1193928542992226
Energy: 1.1540686549200192
Energy: 1.1535970537093172
Energy: 1.0896449015440879
Energy: 1.1587448649310472
Energy: 1.1594043103727691
Energy: 1.0830299523673683
Energy: 1.14784759888147
Energy: 1.1582219773638902
Energy: 1.2854599460361424
Energy: 1.1859118074724453
Energy: 1.1828279127113852
Energy: 1.1504021695174378
Energy: 1.1861582215184143
Energy: 1.1978128690368712
Energy: 1.0929807230982982
Energy: 1.1601789039918609
Energy: 1.1550284583742398
Energy: 1.0803826931698393
Energy: 1.1811646881661795
Energy: 1.0781360489454035
Energy: 1.2608410219387025
Energy: 1.1743264350180616
Energy: 1.1800688705651101
Energy: 1.0633782483340013
Energy: 1.155124132179186
Energy: 1.1760529862919815
Energy: 1.2593341581955528
Energy: 1.1498293276048115
Energy: 1.2177763178554946
Energy: 1.1603390263333748
Energy: 1.204099000750212
Energy: 1.215756674601893
Energy: 1.0932329401997123
Energy: 1.0811038919699982
Energy: 1.0816718093658881
Energy: 1.0794593873329403
Energy: 1.0793392748717192
Energy: 1.0821800413876141
Energy: 1.0932708752471583
Energy: 1.0806659765388393
Energy: 1.0842248390726568
Energy: 1.0818841559067156
Energy: 1.0629512889918131
Energy: 1.0846851011422574
Energy: 1.1307966910241176
Energy: 1.0658472674210642
Energy: 1.119611658335566
Energy: 1.1310617734533
Energy: 1.0656765385819107
Energy: 1.1198156168648497
Energy: 1.114684316397372
Energy: 1.1201997085506472
Energy: 1.1196946783880521
Energy: 1.1172171639318633
Energy: 1.0868755056726682
Energy: 1.1140198244332866
Energy: 1.1156946114406907
Energy: 1.1212170571399835
Energy: 1.121723603813201
Energy: 1.1113821132034973
Energy: 1.11758368922594
Energy: 1.1211260249436694
Energy: 1.2585047950479207
Energy: 1.160562474245957
Energy: 1.1243811864364557
Energy: 1.1824113991786676
Energy: 1.173049130348596
Energy: 1.1806635809064818
Energy: 1.2906185825691576
Energy: 1.1085589618625546
Energy: 1.1243572887745825
Energy: 1.1792429413725802
Energy: 1.114464522312887
Energy: 1.1794505130873953
Energy: 1.1167871510973297
Energy: 1.2318594400340352
Energy: 1.115312758162711
Energy: 1.1119512623658974
Energy: 1.096164432518035
Energy: 1.1176018603026292
Energy: 1.2158574434554614
Energy: 1.2167823834278784
Energy: 1.2165752569830248
Energy: 1.1062904188403029
Energy: 1.1698563481746245
Energy: 1.298714183861449
Energy: 1.2000968594248937
Energy: 1.1093532990204884
Energy: 1.1110071962902157
Energy: 1.1167851425383524
Energy: 1.1073094661206329
Energy: 1.1110528444153505
Energy: 1.1805075331681196
Energy: 1.1118416240820215
Energy: 1.1125150894354012
Energy: 1.091428180947373
Energy: 1.1149861207047216
Energy: 1.1161408785155364
Energy: 1.103645639816536
Energy: 1.11573116502897
Energy: 1.1061602137264368
Energy: 1.1364262946733032
Energy: 1.1150354324401865
Energy: 1.1159207262533257
Energy: 1.1498419790557772
Energy: 1.0813795894494371
Energy: 1.0791335602790013
Energy: 1.0793184264379698
Energy: 1.0816708328814946
Energy: 1.080078985649026
Energy: 1.1487924751754819
Energy: 1.084151021468788
Energy: 1.077762511168932
Energy: 1.0853384139019748
Energy: 1.0824246129653257
Energy: 1.0784538057518946
Energy: 1.1468015661203295
Energy: 1.0850477490413717
Energy: 1.0774767231025635
Energy: 1.0774012640514352
Energy: 1.0815402006293011
Energy: 1.077269853013913
Energy: 1.2368920724994308
Energy: 1.175686950376968
Energy: 1.175421339915156
Energy: 1.203208153086862
Energy: 1.1393279040288657
Energy: 1.170852055787798
Energy: 1.1492505782088436
Energy: 1.0793671648512086
Energy: 1.0795257769995086
Energy: 1.1568342525255433
Energy: 1.0836996202944287
Energy: 1.2017419601510326
Energy: 1.3346001490955608
Energy: 1.1486169925689875
Energy: 1.0940233226968894
Energy: 1.237045771845047
Energy: 1.1491440303459732
Energy: 1.0948577792274028

minimum gb energy = 1.0629512889918131 eV
minimum distance =  2.31642538421976 Angstroms
sigma value = 57


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

Energy: 1.3410076035763194
Energy: 1.2647838558956819
Energy: 1.2618488288432186
Energy: 1.049383874583112
Energy: 1.7483718951993177
Energy: 1.2597184834301465
Energy: 1.2265792457722846
Energy: 1.0407785705497556
Energy: 1.0439866250844716
Energy: 1.044906393181769
Energy: 1.0441355589262713
Energy: 1.043048861413547
Energy: 1.1267654621659051
Energy: 1.0365427086032146
Energy: 1.0364025693254408
Energy: 1.1280904669305443
Energy: 1.036977964062163
Energy: 1.0366564234512066
Energy: 1.1182438395587397
Energy: 1.0354334418846747
Energy: 1.0351078292802511
Energy: 1.1189910271804047
Energy: 1.036108414125932
Energy: 1.041218517395418
Energy: 1.0734434220761047
Energy: 1.0390050775939819
Energy: 1.0388434706123055
Energy: 1.0499181566522517
Energy: 1.039154425038506
Energy: 1.038932555472829
Energy: 1.0442846642485601
Energy: 1.0393601256428113
Energy: 1.0388009930837345
Energy: 1.0388380877765557
Energy: 1.0400884083856334
Energy: 1.0388676259539693
Energy: 1.1440019393137209
Energy: 1.0446044690424214
Energy: 1.0435853501353696
Energy: 1.041419688013147
Energy: 1.1212953892827422
Energy: 1.0399227609142674
Energy: 1.0770118810028195
Energy: 1.1372888151081177
Energy: 1.1790000610226503
Energy: 1.042073331912252
Energy: 1.0866336403654273
Energy: 1.1528350221430779
Energy: 1.141291461259064
Energy: 1.131286795674742
Energy: 1.1315078818172892
Energy: 1.0495436757325574
Energy: 1.130321370731508
Energy: 1.0396049960164158
Energy: 1.359824213109643
Energy: 1.0981265919163257
Energy: 1.1042666761458415
Energy: 1.2628735038707681
Energy: 1.1589848115270338
Energy: 1.0977184732271263
Energy: 1.1210269106722888
Energy: 1.1583309482621622
Energy: 1.0410897449307444
Energy: 1.1298480202778782
Energy: 1.0459753355852317
Energy: 1.1079535186552352
Energy: 1.0438363045465318
Energy: 1.163574089723015
Energy: 1.1378813065265059
Energy: 1.0366786632763265
Energy: 1.1622184523725978
Energy: 1.1384311501039421
Energy: 1.0434550090316825
Energy: 1.1636633968232344
Energy: 1.2700445833189518
Energy: 1.2079030738496488
Energy: 1.163437506724512
Energy: 1.2401267145354247
Energy: 1.1206321443641722
Energy: 1.04738384472451
Energy: 1.0435215668718314
Energy: 1.129494312409613
Energy: 1.0451460524928196
Energy: 1.0427982992587186
Energy: 1.1214555209678791
Energy: 1.0389743163087874
Energy: 1.048893598863812
Energy: 1.0922826696794574
Energy: 1.038634710859199
Energy: 1.0463149345146068
Energy: 1.1186216474463988
Energy: 1.040405195062175
Energy: 1.041411317919952
Energy: 1.0399153490181714
Energy: 1.0412064011528606
Energy: 1.0397623520411579
Energy: 1.0748034825699488
Energy: 1.038992346864292
Energy: 1.039338114066616
Energy: 1.041220329034106
Energy: 1.039273689135299
Energy: 1.0393509037902655
Energy: 1.0742507702622333
Energy: 1.038463516628713
Energy: 1.0389729043478826
Energy: 1.0395561082104292
Energy: 1.0404794147965282
Energy: 1.0389166137790726
Energy: 1.1489865313709826
Energy: 1.1633859211637532
Energy: 1.1629363724558095
Energy: 1.0415656512801041
Energy: 1.1317810576759388
Energy: 1.163559734868323
Energy: 1.149447428580639
Energy: 1.1649803679586332
Energy: 1.1643582097495617
Energy: 1.0425594518950267
Energy: 1.1631585762688859
Energy: 1.127501004101972
Energy: 1.1412913317280504
Energy: 1.1280009146167391
Energy: 1.0437415068313405
Energy: 1.0425134737158461
Energy: 1.1279339592896722
Energy: 1.042301547526335
Energy: 1.235628181381162
Energy: 1.0926703183993618
Energy: 1.0823179021756062
Energy: 1.1056768744187406
Energy: 1.09354389543891
Energy: 1.0873900865760726
Energy: 1.1186350458428274
Energy: 1.1297402476921905
Energy: 1.130130929131167
Energy: 1.1286928583804454
Energy: 1.1276841709132155
Energy: 1.0464647401248546
Energy: 1.0433293863269206
Energy: 1.1640991606867668
Energy: 1.271437040676011
Energy: 1.2080804057940984
Energy: 1.1627039666406327
Energy: 1.2404858202358382

minimum gb energy = 1.0351078292802511 eV
minimum distance =  2.31411221994895 Angstroms
sigma value = 17


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

Energy: 1.0172098030636298
Energy: 1.4552760148821349
Energy: 1.2038270479820306
Energy: 1.0230658336116547
Energy: 1.128685280088891
Energy: 1.0265574720572719
Energy: 1.2213571816045519
Energy: 1.1367940547116129
Energy: 1.0156988108149565
Energy: 1.1517998331705845
Energy: 1.1362607187476328
Energy: 1.0220472400697356
Energy: 1.1468590674657244
Energy: 0.9965028417829298
Energy: 0.9960289255411215
Energy: 1.1277470218716141
Energy: 0.9972413489536616
Energy: 0.9953506097210046
Energy: 1.1458799188210105
Energy: 0.9962748854906226
Energy: 0.9955787456797679
Energy: 1.1466665552312438
Energy: 1.0390539911282024
Energy: 1.016551324543709
Energy: 1.046945688682953
Energy: 0.9671692727480324
Energy: 0.9670760787044517
Energy: 1.0510399136728874
Energy: 0.9664087722926186
Energy: 0.9651439037511164
Energy: 1.0287516223870234
Energy: 0.9744006113930938
Energy: 0.9740167307408455
Energy: 0.9450601335052465
Energy: 0.9662086305709339
Energy: 0.9419388964936418
Energy: 1.0418194077339742
Energy: 1.0360544447369326
Energy: 0.9897416643950208
Energy: 0.9389935166333948
Energy: 1.0367768705104223
Energy: 0.9368444579557349
Energy: 0.9914148983195116
Energy: 0.9413547505707168
Energy: 0.9420787789038723
Energy: 0.9412260622892734
Energy: 0.940376922991219
Energy: 0.93931644841541
Energy: 1.0372710920927064
Energy: 0.9367080839645192
Energy: 0.9365097901801105
Energy: 1.0379634077916116
Energy: 0.9393826716893486
Energy: 0.9373237401374178
Energy: 1.0410728495712047
Energy: 0.9738920378961716
Energy: 0.9743104198341869
Energy: 1.0085516038913658
Energy: 0.9734224348413316
Energy: 0.9740753126823857
Energy: 1.037202050210883
Energy: 0.9649705320645289
Energy: 0.9656187489986064
Energy: 0.9670816199827121
Energy: 0.9652391042125529
Energy: 0.9662118347346759
Energy: 1.1550968634904173
Energy: 1.1572588688769279
Energy: 1.129734365534348
Energy: 0.9672287335100138
Energy: 1.159606517614383
Energy: 1.0147219356859993
Energy: 1.1560361628397127
Energy: 1.128337318355153
Energy: 1.0535377021157388
Energy: 0.9704186267442995
Energy: 1.1277666776563284
Energy: 1.0541589751319762
Energy: 1.1803869731184171
Energy: 1.0535155577186361
Energy: 1.0044155940162194
Energy: 1.1582080569192958
Energy: 1.062733662495454
Energy: 1.0048547635348217
Energy: 1.2307737685661422
Energy: 1.126870085850037
Energy: 1.1268671688789087
Energy: 1.1354638065561207
Energy: 1.072352373626457
Energy: 1.0944861951061617
Energy: 1.1243405585296762
Energy: 1.0615111366021612
Energy: 1.0168236644232564
Energy: 1.1267133263014961
Energy: 1.0627196576285616
Energy: 1.1207603707363423
Energy: 1.1436057138694493
Energy: 1.0703978353586978
Energy: 1.2011172506717653
Energy: 1.0022317604356001
Energy: 1.1302610039926189
Energy: 1.1250267575935355

minimum gb energy = 0.9365097901801105 eV
minimum distance =  2.31399348731148 Angstroms
sigma value = 17


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

Energy: 1.0152916414543973
Energy: 1.201790703355499
Energy: 1.0020541399757716
Energy: 0.9925907295544533
Energy: 1.262982890486788
Energy: 1.059141333812146
Energy: 1.1553044378678774
Energy: 1.085814955528893
Energy: 0.9847713418407358
Energy: 0.9910116751721982
Energy: 1.1390690763848923
Energy: 0.9400255199562101
Energy: 1.3597620462581839
Energy: 0.9355934783427826
Energy: 1.0052183337725724
Energy: 0.9672499632682096
Energy: 0.9357067844167722
Energy: 1.004902899263934
Energy: 1.1633643951642818
Energy: 1.0047799955978225
Energy: 1.0052785448756592
Energy: 1.0755696370953285
Energy: 0.9428809647665802
Energy: 1.0074125863352346
Energy: 1.06525755341715
Energy: 1.015405363134964
Energy: 1.0266791990552089
Energy: 1.0562056139850282
Energy: 1.0165275773066427
Energy: 1.0183867645663807
Energy: 0.9467909345946603
Energy: 1.0015948962848245
Energy: 0.932490871721993
Energy: 0.9375412953729007
Energy: 1.0338181324287368
Energy: 0.9336469344650887
Energy: 0.9927991441552599
Energy: 1.0579608147475894
Energy: 1.0734072574455626
Energy: 0.9836564409199904
Energy: 1.05567387898173
Energy: 0.9778825849574694
Energy: 0.9951880677862431
Energy: 0.9125097384545314
Energy: 0.978186212284255
Energy: 0.9763454063036718
Energy: 0.9115676127417865
Energy: 0.9764165677679533
Energy: 0.9978429124790208
Energy: 0.9566113399252988
Energy: 0.9613532595316684
Energy: 0.9996854875271145
Energy: 0.9546823652708997
Energy: 0.9942339731933614
Energy: 0.9927608498820969
Energy: 0.9714258072039038
Energy: 0.9704819629005889
Energy: 0.9934155857877297
Energy: 0.970838450295934
Energy: 0.9702370894871405
Energy: 1.009741988032726
Energy: 0.9533453339804983
Energy: 0.9632319200534794
Energy: 0.9658693746983746
Energy: 0.9948583275747852
Energy: 0.9612599686080496
Energy: 1.0335011838209947
Energy: 0.9933625753495563
Energy: 1.0031008606382503
Energy: 1.0336272506295747
Energy: 1.0002806853839157
Energy: 0.9835975437343073
Energy: 1.0290229709174246
Energy: 0.9928620726207981
Energy: 0.9925542646718751
Energy: 0.9729837235179459
Energy: 0.9916579615594413
Energy: 0.9810893687604444
Energy: 1.0517615329778083
Energy: 0.9775070089774804
Energy: 0.9787277876877591
Energy: 1.0536924457346586
Energy: 0.9810130205126465
Energy: 1.0533491854379433
Energy: 1.05026609287449
Energy: 0.9252488503339088
Energy: 0.9239330483340482
Energy: 1.0757917619848931
Energy: 0.92930427108332
Energy: 1.0526185811098603
Energy: 1.0524193078212534
Energy: 1.0171554756590218
Energy: 1.0278150730889712
Energy: 1.0221269115549099
Energy: 1.0334334681110238
Energy: 1.02567914951348
Energy: 0.9605729440944316
Energy: 1.1046492228958524
Energy: 1.0953275821510828
Energy: 0.9496235922329618
Energy: 1.1755387727991027
Energy: 0.9682773267076944
Energy: 0.9591159239357021
Energy: 1.104698693554041
Energy: 1.1022501272935417
Energy: 0.943781095408514
Energy: 1.1047764130706101
Energy: 0.9686668452005572
Energy: 1.2616256113188489
Energy: 1.1006519965785224
Energy: 1.070338173258874
Energy: 1.0753311751099204
Energy: 1.0268098209544314
Energy: 1.0654530392594441
Energy: 1.3492054368612925
Energy: 0.9757568245986631
Energy: 0.9808044076805249
Energy: 1.137702905739546
Energy: 0.976101125293708
Energy: 1.0887612112767378
Energy: 1.2456455352996054
Energy: 1.0998425860661176
Energy: 1.0703004391051278
Energy: 1.0236391116635861
Energy: 1.098994472037779
Energy: 1.0248193871471794
Energy: 0.9377001864835676
Energy: 1.113157842023608
Energy: 1.0295498570989845
Energy: 0.9472685115601462
Energy: 1.1954936447257438
Energy: 0.9472060758843798
Energy: 0.9414271261930391
Energy: 1.1120703086493149
Energy: 1.1215217652132519
Energy: 0.8891589102413805
Energy: 1.1884752284976723
Energy: 1.0000763491616202
Energy: 1.353457097907175
Energy: 1.0111873142154406
Energy: 1.0629311274326252
Energy: 1.0659170151935495
Energy: 0.9394787836807874
Energy: 1.0650319933317192
Energy: 1.1715804455711658
Energy: 0.9377514638625903
Energy: 1.0059799569824248
Energy: 1.1948292096775508
Energy: 0.9379726324553131
Energy: 1.0050242385115904
Energy: 1.1427079754842158
Energy: 1.0240499255132716
Energy: 1.0253955211269696
Energy: 1.113529509270868
Energy: 1.024075615909446
Energy: 1.0387190962289732
Energy: 0.9454471371134846
Energy: 1.032032000443153
Energy: 1.034971687010792
Energy: 0.9356095355951626
Energy: 1.0323879146753558
Energy: 0.9360486800181722
Energy: 0.951440180056023
Energy: 1.0452031079544009
Energy: 1.0464907863321617
Energy: 0.9536037578978862
Energy: 1.055573679248606
Energy: 1.0443265136076247
Energy: 1.0315545435388873
Energy: 0.9818302749832885
Energy: 0.9813369235463267
Energy: 0.9795065103550105
Energy: 1.0007169244145895
Energy: 0.9804255266157424
Energy: 0.9932118173251332
Energy: 0.9104918332684352
Energy: 0.9845309640755262
Energy: 0.993578928834224
Energy: 0.9105821067783325
Energy: 0.9921940011648192
Energy: 1.000978839681334
Energy: 0.9649975850750326
Energy: 0.9636584080518177
Energy: 1.0026880119849433
Energy: 0.9728571758862683
Energy: 0.9637329315688645
Energy: 1.034194851971783
Energy: 0.9720441382440654
Energy: 0.9714138295589771
Energy: 0.9791237571732663
Energy: 0.9708573121392848
Energy: 0.9716479982645754
Energy: 1.0344649198002867
Energy: 0.9930997876321465
Energy: 0.9927723367635044
Energy: 1.0116925911926744
Energy: 0.9979651234526997
Energy: 0.9930993399824508
Energy: 1.0347205888979687
Energy: 0.9787690086534149
Energy: 0.9742148793960703
Energy: 0.9738088538464044
Energy: 0.9785932753037073
Energy: 0.9742423365789725
Energy: 1.0606145415620865
Energy: 0.978228373463649
Energy: 0.977811014208034
Energy: 1.0620387227022525
Energy: 0.9743729550693928
Energy: 0.9796443645709078
Energy: 1.0511560450354875
Energy: 0.922063940457308
Energy: 0.9991691906599792
Energy: 1.0511833603213359
Energy: 0.9223173662770201
Energy: 0.9998690886864522
Energy: 1.05616234412159
Energy: 1.0159476635892744
Energy: 1.0186654160813784
Energy: 1.017761778935423
Energy: 1.036839040253322
Energy: 1.0225234029905028
Energy: 0.9667771717379693
Energy: 1.110694729037821
Energy: 1.0747595892700879
Energy: 1.0382320590262113
Energy: 1.184365583670783
Energy: 1.0739786661657396
Energy: 0.9605587302971369
Energy: 1.1182366686061185
Energy: 0.9770965694133444
Energy: 0.9710727715848032
Energy: 1.136494066217004
Energy: 0.9783426654720102
Energy: 1.0512803067404108
Energy: 1.08009390645104
Energy: 1.0747199579921098
Energy: 1.0120945483638053
Energy: 1.0787102159820536
Energy: 0.9956091461363453
Energy: 1.1974641674428532
Energy: 0.973190504970462
Energy: 1.0512057553073686
Energy: 1.040663746967658
Energy: 0.9732905276645589
Energy: 1.0502296334944041
Energy: 1.3766944859356791
Energy: 1.069288764076583
Energy: 0.9750244407474987
Energy: 0.9700778366831919
Energy: 1.003736435722411
Energy: 0.9888961746148704
Energy: 0.9822240282104628
Energy: 1.0577264515824245
Energy: 1.0123742610210846
Energy: 0.8807954067597573
Energy: 1.0676452700078072
Energy: 1.0125431740205437

minimum gb energy = 0.8807954067597573 eV
minimum distance =  2.22955992135993 Angstroms
sigma value = 57


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

Energy: 0.9587307505154231
Energy: 1.0162065931218343
Energy: 0.9407733533815178
Energy: 0.8422578012862229
Energy: 0.9834366600416854
Energy: 0.942780126546041
Energy: 1.0952449378538727
Energy: 0.8625370318611832
Energy: 0.8642862077840985
Energy: 0.9250931809252453
Energy: 0.9306171228265481
Energy: 0.9030105207652971
Energy: 1.2304843671475028
Energy: 0.8307973040609878
Energy: 0.8308999255983162
Energy: 0.9422830005373722
Energy: 0.8299529520267298
Energy: 0.8899851516764751
Energy: 1.065568963431692
Energy: 0.8297664551885547
Energy: 0.8904342176671315
Energy: 0.9833866154997786
Energy: 0.8284944148221369
Energy: 0.8916175153908752
Energy: 0.931414488688489
Energy: 0.8655160884848954
Energy: 0.8674106993222344
Energy: 0.9324291715171182
Energy: 0.8647687477664834
Energy: 0.8654813792003768
Energy: 0.8351223623983546
Energy: 0.8586719578765032
Energy: 0.829952786597055
Energy: 0.8046927679917417
Energy: 0.8985584769014242
Energy: 0.830224091268707
Energy: 0.8721884335759444
Energy: 0.9507057226899861
Energy: 0.9018393778715638
Energy: 0.8203205336378638
Energy: 0.9470004186194787
Energy: 0.8209105844603997
Energy: 0.8749812874775117
Energy: 0.7990782631587201
Energy: 0.7994016368403495
Energy: 0.821126888011636
Energy: 0.7984989340210448
Energy: 0.8151969366463476
Energy: 0.8765663898268212
Energy: 0.8147999101010824
Energy: 0.8210993597185084
Energy: 0.8785386623039647
Energy: 0.833458207386568
Energy: 0.882370573886248
Energy: 0.8726753499235049
Energy: 0.8028828052854583
Energy: 0.8026488711726549
Energy: 0.8738834360962391
Energy: 0.8324950233417229
Energy: 0.8034692406979207
Energy: 0.8494991400110303
Energy: 0.823839799860142
Energy: 0.8118394043511608
Energy: 0.7910651428218227
Energy: 0.8418561858455014
Energy: 0.7929057128064569
Energy: 0.8779984299619823
Energy: 0.8523946834874454
Energy: 0.842902058608206
Energy: 0.8394162399319544
Energy: 0.8483770289241207
Energy: 0.7945592570181667
Energy: 0.842059639094662
Energy: 0.8642249863925657
Energy: 0.8604149453564646
Energy: 0.7977858154980162
Energy: 0.869929496530816
Energy: 0.7980272562690961
Energy: 0.8427442063964563
Energy: 0.794332750793287
Energy: 0.7912570590616388
Energy: 0.8451750629645179
Energy: 0.8378773805636224
Energy: 0.8421085618265093
Energy: 0.8418434025759912
Energy: 0.7965772183264369
Energy: 0.794515461500057
Energy: 0.8425046598396431
Energy: 0.8731631969830226
Energy: 0.7939383729105115
Energy: 0.8921525802315498
Energy: 0.8840580174229158
Energy: 0.8013947005880507
Energy: 0.801986196003507
Energy: 0.8861764652417696
Energy: 0.7999058411154206
Energy: 0.8445357839778707
Energy: 0.8850699438962318
Energy: 0.8170728758945456
Energy: 0.8030861908595562
Energy: 0.8816814017560113
Energy: 0.8136446092498917
Energy: 0.8463777215913844
Energy: 0.8255192784144052
Energy: 0.8256693907102532
Energy: 0.889378332011484
Energy: 0.8267067340554118
Energy: 0.8271502709341342
Energy: 0.9412085337689515
Energy: 0.8224441326210246
Energy: 0.8248096235506522
Energy: 0.9431859859710503
Energy: 0.8231878899308118
Energy: 0.9413059063032284
Energy: 0.9409777010533404
Energy: 0.8235023884188883
Energy: 0.8305658842698241
Energy: 0.8620227200230633
Energy: 0.8196218760931874
Energy: 0.8634739308973477
Energy: 1.0615594864891416
Energy: 0.8686583921101232
Energy: 0.8648233782286356
Energy: 0.9102738032519728
Energy: 0.9135479557996208
Energy: 0.8633011851084176
Energy: 0.8425609027028559
Energy: 0.9789836965007145
Energy: 0.8613172613314862
Energy: 0.8164910309777769
Energy: 1.0747856193455796
Energy: 0.8619386107877807
Energy: 0.8780981588183393
Energy: 0.9279779124738936
Energy: 0.9206746394186677
Energy: 0.8501620351775567
Energy: 0.9391456765155077
Energy: 0.9205250532243168
Energy: 1.0661951132253353
Energy: 0.8622065876424333
Energy: 0.8601763988345037
Energy: 0.8671145341741852
Energy: 0.9275967543856092
Energy: 0.8692754439729931
Energy: 1.235629219358461
Energy: 0.8645909490504784
Energy: 0.8636592143187682
Energy: 0.9451595382070407
Energy: 0.8648912357280015
Energy: 0.9271398072719782
Energy: 1.2528866512028893
Energy: 0.9219788923925815
Energy: 0.9247674445051437
Energy: 0.9229300616254469
Energy: 0.9283443942271561
Energy: 0.9047242861115999
Energy: 0.8497091549120152
Energy: 0.9465777022828337
Energy: 0.8924385179064341
Energy: 0.8335480394058782
Energy: 0.9558143442989632
Energy: 0.8926741669612624

minimum gb energy = 0.7910651428218227 eV
minimum distance =  2.32283005985553 Angstroms
sigma value = 43


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

Energy: 0.726476859056809
Energy: 0.8694113555324667
Energy: 0.8376285635177003
Energy: 0.7163797421993996
Energy: 0.8861717209545016
Energy: 0.7913287357990488
Energy: 1.0159292387770136
Energy: 0.7364458312280775
Energy: 0.7360013140977612
Energy: 0.7743925264342617
Energy: 0.7388077528301626
Energy: 0.7334700408248447
Energy: 1.0565689130296396
Energy: 0.6986261116796297
Energy: 0.7224198266038635
Energy: 0.7678773881171727
Energy: 0.6974527453314235
Energy: 0.7222359345620527
Energy: 0.9309028770247506
Energy: 0.7215411987874176
Energy: 0.7222518076707009
Energy: 0.7959544831850479
Energy: 0.7267920293082234
Energy: 0.7614294863412839
Energy: 0.7473833506101116
Energy: 0.7375201391597952
Energy: 0.7352589404568233
Energy: 0.6849336772656285
Energy: 0.738217980798683
Energy: 0.7341202321565076
Energy: 0.7054306294893589
Energy: 0.7334061251292143
Energy: 0.714306819913648
Energy: 0.729126631634515
Energy: 0.8304689593453766
Energy: 0.7226099884004249
Energy: 0.9309789734695921
Energy: 0.7769652172042043
Energy: 0.8580809121622018
Energy: 0.6994897062596674
Energy: 0.832170448778382
Energy: 0.6975552809139375
Energy: 0.97469833540167
Energy: 0.6761205426655459
Energy: 0.6857888674741778
Energy: 0.7300966649983472
Energy: 0.6742757818426048
Energy: 0.6854716500534705
Energy: 0.7740015530518052
Energy: 0.6850394185259432
Energy: 0.7008851076162241
Energy: 0.7761218037756146
Energy: 0.7337425226805997
Energy: 0.7387521343603334
Energy: 0.7575444533366463
Energy: 0.6779464115993548
Energy: 0.6782143072545733
Energy: 0.7606450815678875
Energy: 0.6773017474277396
Energy: 0.6782073602898483
Energy: 0.6998369632628636
Energy: 0.7337223461061482
Energy: 0.6763417473138157
Energy: 0.6729602278891481
Energy: 0.733212882978425
Energy: 0.6713345395648114
Energy: 0.7743701258396468
Energy: 0.733847180959697
Energy: 0.7399558150345609
Energy: 0.6727419176687657
Energy: 0.7341064552139486
Energy: 0.6787027361651016
Energy: 0.7134389148904551
Energy: 0.7133825148898791
Energy: 0.7214035647048075
Energy: 0.7051743632865174
Energy: 0.7094163616244716
Energy: 0.7207452498140214
Energy: 0.7120884104898927
Energy: 0.6712672463617883
Energy: 0.726532206971332
Energy: 0.7141436000674622
Energy: 0.7671830398646411
Energy: 0.7117199430081059
Energy: 0.7117462165575279
Energy: 0.6645810339704662
Energy: 0.6634502073440172
Energy: 0.7272706890344616
Energy: 0.6648440313389418
Energy: 0.6623383052211206
Energy: 0.7060014944481887
Energy: 0.7021042033396399
Energy: 0.7090323293904204
Energy: 0.6618007277882412
Energy: 0.7019562367807477
Energy: 0.6631951599097483
Energy: 0.7163428525986408
Energy: 0.7018909013400264
Energy: 0.7181779772689488
Energy: 0.6659981004375348
Energy: 0.7019448921032555
Energy: 0.6683284287153332
Energy: 0.7014564458083086
Energy: 0.7069690532109192
Energy: 0.6866841623464949
Energy: 0.7177909691883498
Energy: 0.7078388388106119
Energy: 0.6677860534621631
Energy: 0.7022819539555673
Energy: 0.6960191784298432
Energy: 0.7015926286961438
Energy: 0.7036609698493527
Energy: 0.8212724187645509
Energy: 0.7021444564724382
Energy: 0.7022353685484385
Energy: 0.7122281216687155
Energy: 0.7086100162569464
Energy: 0.7187619752469943
Energy: 0.7064556662284847
Energy: 0.6726231785871157
Energy: 0.7382870560981063
Energy: 0.7121258407858255
Energy: 0.7323512672383087
Energy: 0.6739736749247143
Energy: 0.7121785711960136
Energy: 0.6738218508517219
Energy: 0.7073380423080031
Energy: 0.7118055007517576
Energy: 0.6655220400443665
Energy: 0.6657091702825139
Energy: 0.7120629007592817
Energy: 0.6651874530067787
Energy: 0.733283863346542
Energy: 0.6691747823699226
Energy: 0.6688427847572528
Energy: 0.7463504192064467
Energy: 0.6700053385692721
Energy: 0.6681069622491079
Energy: 0.7341031462863569
Energy: 0.6816630697773085
Energy: 0.7466730224189093
Energy: 0.736124633397647
Energy: 0.6920344826825628
Energy: 0.7332081175841652
Energy: 0.950835909562159
Energy: 0.6951479479901027
Energy: 0.7064242869637081
Energy: 0.7377662428433496
Energy: 0.6952874346003525
Energy: 0.7066725891811987
Energy: 0.8362385018431965
Energy: 0.7707483435815586
Energy: 0.779353743101866
Energy: 0.6769326139556334
Energy: 0.7710681252293049
Energy: 0.6763642378016965
Energy: 0.7030850439755439
Energy: 0.7712226586081452
Energy: 0.6971582233646273
Energy: 0.6744431989715958
Energy: 0.7702700899711183
Energy: 0.6820200857632016
Energy: 0.7336264630858462
Energy: 0.7017952496343413
Energy: 0.7012232065261716
Energy: 0.7063814157373315
Energy: 0.7435557873379238
Energy: 0.6982239157693859
Energy: 0.8343830415629794
Energy: 0.7025607760487506
Energy: 0.7360024458363644
Energy: 0.8364049210975991
Energy: 0.706738334112059
Energy: 0.736629244812474
Energy: 1.0059393940975252
Energy: 0.6873955028193741
Energy: 0.7040759608698796
Energy: 0.7337629236732924
Energy: 0.6866576449930131
Energy: 0.7042800506698316
Energy: 1.0055198178237796
Energy: 0.739003790171849
Energy: 0.8161149778886396
Energy: 0.7380219512115185
Energy: 0.7919809314918619
Energy: 0.7364606742415338
Energy: 0.714720972718317
Energy: 0.7676703874935307
Energy: 0.7423444934038677
Energy: 0.7205837940976574
Energy: 0.8401758151641139
Energy: 0.713086035895356
Energy: 0.7709292022162484
Energy: 0.7754206358302723
Energy: 0.7758129080786436
Energy: 0.7263553115714948
Energy: 0.7748020735013641
Energy: 0.7681816711209852
Energy: 1.006731475339533
Energy: 0.7521227718434839
Energy: 0.7523226306161056
Energy: 0.795693487726716
Energy: 0.7432838950996444
Energy: 0.7828633304651356
Energy: 1.0565558767814534
Energy: 0.7196314151377209
Energy: 0.7528980944265898
Energy: 0.7678327575607136
Energy: 0.718586660125051
Energy: 0.7535370131259266
Energy: 1.015999466240033
Energy: 0.7752646463278835
Energy: 0.7754154533671473
Energy: 0.7766038616336467
Energy: 0.7751969653348726
Energy: 0.7747648172452304

minimum gb energy = 0.6618007277882412 eV
minimum distance =  2.32604363187442 Angstroms
sigma value = 81


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

Energy: 0.06175682254410987
Energy: 0.06359264071366404
Energy: 0.06258903028912859
Energy: 0.06486849344944315
Energy: 0.06291805153786179
Energy: 0.06248661142833054
Energy: 0.11091761611501641
Energy: 0.06311772177995442
Energy: 0.06326844145153139
Energy: 0.11199456196430553
Energy: 0.0661330837894248
Energy: 0.06309886340805596
Energy: 0.10936988443693106
Energy: 0.06264729080359527
Energy: 0.06296127557559014
Energy: 0.10956474929474208
Energy: 0.06270409896416015
Energy: 0.10992386686876084
Energy: 0.0670128050136147
Energy: 0.06284607208186949
Energy: 0.06291268736601167
Energy: 0.06626292565495788
Energy: 0.06249970037605867
Energy: 0.11053226655787957
Energy: 0.10994409402482798
Energy: 0.10984009214813223
Energy: 0.10968529611781817
Energy: 0.11109451915230714
Energy: 0.10948801694987922
Energy: 0.11169450996533367
Energy: 0.06326017674115918
Energy: 0.06325077113415176
Energy: 0.06247357851234973
Energy: 0.06522683565738062
Energy: 0.06347690505439117
Energy: 0.06269027354860358
Energy: 0.1128071197786984
Energy: 0.063178808001792
Energy: 0.06291577797564335
Energy: 0.11000403930078283
Energy: 0.06360110729426
Energy: 0.06339709109343429
Energy: 0.10965390536128708
Energy: 0.06291185052288956
Energy: 0.06280646660394315
Energy: 0.10949273374245856
Energy: 0.06252069500567853
Energy: 0.11262694812664416
Energy: 0.06524318342391507
Energy: 0.06288057330174943
Energy: 0.11306097046679746
Energy: 0.0665425019978262
Energy: 0.06297614971368551
Energy: 0.11247654170285037
Energy: 0.06319509069379396
Energy: 0.10924400648707745
Energy: 0.10957857159048229
Energy: 0.06343617362253336
Energy: 0.10935040949568688
Energy: 0.10965412316796784

minimum gb energy = 0.06175682254410987 eV
minimum distance =  2.46346673869582 Angstroms
sigma value = 3


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

Energy: 0.833457784232209
Energy: 0.8201430174706653
Energy: 0.8322841603399336
Energy: 0.7809038565571065
Energy: 0.8202228563143663
Energy: 0.7701540820906467
Energy: 0.8591090809065439
Energy: 0.833977639102335
Energy: 0.8306502221464077
Energy: 0.8321339112363441
Energy: 0.8296743113725793
Energy: 0.8297495161655006
Energy: 0.8607843750104179
Energy: 0.7856890406290841
Energy: 0.7860264411602881
Energy: 0.8341288890735551
Energy: 0.7866728190265702
Energy: 0.8148248437973129
Energy: 0.8083566880581997
Energy: 0.7872265638295646
Energy: 0.7868416069544586
Energy: 0.8089547745128037
Energy: 0.7452635300191933
Energy: 0.815527170981726
Energy: 0.7416949410405923
Energy: 0.8353606679537976
Energy: 0.8323560957258743
Energy: 0.7424210217203777
Energy: 0.836344823975058
Energy: 0.8312248564798712
Energy: 0.793408601108039
Energy: 0.8295108334687612
Energy: 0.8040813268724676
Energy: 0.6918803058266688
Energy: 0.8292819371843337
Energy: 0.7666610552844705
Energy: 0.8073333602365782
Energy: 0.7542326668874554
Energy: 0.8015990034656671
Energy: 0.8102373563995855
Energy: 0.7614774742882762
Energy: 0.811140480016179
Energy: 0.8068653132038514
Energy: 0.7426369406654244
Energy: 0.7791719434907197
Energy: 0.8080239924729137
Energy: 0.6654179942038204
Energy: 0.7800572395575174
Energy: 0.829954801274871
Energy: 0.7781036811671459
Energy: 0.8132395987687506
Energy: 0.8262253449964705
Energy: 0.7008340280451357
Energy: 0.8167141240950777
Energy: 0.764384277887494
Energy: 0.7528561756627108
Energy: 0.7535084892003716
Energy: 0.765449869382081
Energy: 0.7599745168610371
Energy: 0.7679882139831202
Energy: 0.79170182848564
Energy: 0.7886710570926125
Energy: 0.7901101659738891
Energy: 0.6757862512532139
Energy: 0.7992360661288119
Energy: 0.7570932265118343
Energy: 0.7061819416147064
Energy: 0.794398689979792
Energy: 0.7970470047428018
Energy: 0.706057374082182
Energy: 0.7682567862199655
Energy: 0.7061463304102726
Energy: 0.7077246841566838
Energy: 0.7115457561817592
Energy: 0.7651849123556671
Energy: 0.7078164517601548
Energy: 0.6539946879617848
Energy: 0.7103096612822096
Energy: 0.7851648231741886
Energy: 0.7396186016771432
Energy: 0.7650472045174721
Energy: 0.7117853812554463
Energy: 0.6766378608008421
Energy: 0.7666772017699327
Energy: 0.7832993221189655
Energy: 0.6745923344404663
Energy: 0.6742825932269872
Energy: 0.7803721965244964
Energy: 0.6825662998997616
Energy: 0.6750685405931209
Energy: 0.7801092525336354
Energy: 0.7469931157905785
Energy: 0.7515939151963943
Energy: 0.7182365802409126
Energy: 0.7737928260644983
Energy: 0.7514963140499005
Energy: 0.6588730542113687
Energy: 0.7509420080544944
Energy: 0.7488289739367826
Energy: 0.6584298891004801
Energy: 0.6780739142356602
Energy: 0.6583871487298297
Energy: 0.6590511533154119
Energy: 0.7465900867708523
Energy: 0.7455578507573328
Energy: 0.6590935032793427
Energy: 0.6600761149994708
Energy: 0.7445819225475457
Energy: 0.7705773589846385
Energy: 0.7158432649211025
Energy: 0.7434686719767453
Energy: 0.6644047605112945
Energy: 0.7130584975399714
Energy: 0.7443160614722508
Energy: 0.7739742745381899
Energy: 0.6586222764172814
Energy: 0.6581382176617165
Energy: 0.7748860582839487
Energy: 0.6665357076911516
Energy: 0.6589905651026899
Energy: 0.7730642261350817
Energy: 0.7480949460674886
Energy: 0.7518151269813871
Energy: 0.7246585020625946
Energy: 0.7487768891204966
Energy: 0.7494646045695905
Energy: 0.6779739785169685
Energy: 0.7477570672020044
Energy: 0.7494279416628861
Energy: 0.6753874779248937
Energy: 0.7476045378519282
Energy: 0.6747367271670432
Energy: 0.6745139236477534
Energy: 0.7097186529878816
Energy: 0.7115204623434441
Energy: 0.674612195748506
Energy: 0.7102805483531545
Energy: 0.7647481043371455
Energy: 0.7849600523902476
Energy: 0.7080213046004996
Energy: 0.763152712079454
Energy: 0.6605627359537776
Energy: 0.7083111143552587
Energy: 0.7507081268037474
Energy: 0.8010324882884368
Energy: 0.7063320941883392
Energy: 0.7062199817679465
Energy: 0.8037738413519124
Energy: 0.7075020305560242
Energy: 0.707083970781254
Energy: 0.803325223882079
Energy: 0.7701263314681686
Energy: 0.771131159397106
Energy: 0.803570229960752
Energy: 0.7431292865506828
Energy: 0.7901846407158767
Energy: 0.7593606419987599
Energy: 0.769395870803493
Energy: 0.7699478900768928
Energy: 0.7578553204991686
Energy: 0.8086348428093332
Energy: 0.7680750117503153
Energy: 0.7216797555332861
Energy: 0.8190216418352114
Energy: 0.819083504118914
Energy: 0.7216285257469768
Energy: 0.820547458043527
Energy: 0.8197276094847551
Energy: 0.7969788415361777
Energy: 0.8075851820283794
Energy: 0.8010428481833812
Energy: 0.6831182704755282
Energy: 0.8093323917784585
Energy: 0.7615299158197857
Energy: 0.7538209977593547
Energy: 0.8078404447046735
Energy: 0.8061793127581459
Energy: 0.7538392973336631
Energy: 0.8174077536745876
Energy: 0.8140259655168097
Energy: 0.8293222525869189
Energy: 0.7855025154009108
Energy: 0.7861966847616809
Energy: 0.8297246752378078
Energy: 0.6700305708475244
Energy: 0.7861624305860344
Energy: 0.8705140095732374
Energy: 0.7813020421416748
Energy: 0.8264241930359929
Energy: 0.8354251701395233
Energy: 0.7530585507978189
Energy: 0.8312178161826304
Energy: 0.7595050775369485
Energy: 0.8115437263783036
Energy: 0.8065311118270324
Energy: 0.7595037839483885
Energy: 0.8164519453382598
Energy: 0.7974591364711323

minimum gb energy = 0.6539946879617848 eV
minimum distance =  2.26855787424697 Angstroms
sigma value = 67


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

Energy: 1.0221691781449258
Energy: 1.0118460396061308
Energy: 1.008500700827991
Energy: 0.8667312930947764
Energy: 1.0117588089473402
Energy: 1.0110174214810312
Energy: 1.0505061092753474
Energy: 1.00642773288267
Energy: 1.010916160431508
Energy: 1.00936841373217
Energy: 0.9985527837674508
Energy: 0.9989986667284942
Energy: 1.0461951678206627
Energy: 0.9606081555550918
Energy: 0.9838819810811489
Energy: 1.006702914199646
Energy: 0.9430982846462015
Energy: 0.9842671700497764
Energy: 0.9987865505302486
Energy: 0.9850393119743316
Energy: 0.9843902113516029
Energy: 0.9990814381991474
Energy: 0.9655215777241826
Energy: 0.9849342819153167
Energy: 0.9584844750931254
Energy: 1.0035841148927636
Energy: 1.002515925310645
Energy: 0.9590809864757742
Energy: 1.000305300125576
Energy: 1.0015238249325298
Energy: 0.9663626947532241
Energy: 0.9930614103540124
Energy: 0.9705958539425618
Energy: 0.894027220756099
Energy: 0.9916920653824778
Energy: 0.9697769846200869
Energy: 0.9726182935090187
Energy: 0.9669384934222024
Energy: 1.0642464247931018
Energy: 0.960887913748307
Energy: 0.9652028028230137
Energy: 0.9619466025556813
Energy: 0.9610746499798377
Energy: 0.8601507672215527
Energy: 0.9461813067180054
Energy: 0.9622810681185419
Energy: 0.8536355615805654
Energy: 0.9763223284216065
Energy: 0.9799598529437101
Energy: 0.980416916189428
Energy: 0.985978880815933
Energy: 0.9606242096595563
Energy: 0.8946808708747881
Energy: 0.9814216383592662
Energy: 0.9810460200621243
Energy: 0.8992638269230151
Energy: 0.8950740149001469
Energy: 0.982502678536379
Energy: 0.8983012986153295
Energy: 0.9154748957184711
Energy: 0.9771991936669293
Energy: 0.9483616592707441
Energy: 0.9474880372149741
Energy: 0.8553577777727401
Energy: 0.9602315555872772
Energy: 0.9497575931580837
Energy: 0.8602382663401956
Energy: 0.9130140902679076
Energy: 0.9421879749733171
Energy: 0.8543005186553384
Energy: 0.9003400875038777
Energy: 0.8547069082810308
Energy: 0.8541216753495143
Energy: 0.8645274090857633
Energy: 0.9318395292774535
Energy: 0.8542901436888557
Energy: 0.8577955018720326
Energy: 0.8545137177238847
Energy: 0.9559655959123298
Energy: 0.9367146975839143
Energy: 0.9325120828952316
Energy: 0.8552356834216682
Energy: 0.9149337575193782
Energy: 0.9308488056164776
Energy: 0.9594818819331105
Energy: 0.8590215256543912
Energy: 0.8566944808120894
Energy: 0.9593171533453845
Energy: 0.8571160399959052
Energy: 0.8558589152349125
Energy: 0.9601273527191385
Energy: 0.9521193894457162
Energy: 0.9464571939233534
Energy: 0.89769418066296
Energy: 0.9220023564545105
Energy: 0.9439855375191857
Energy: 0.8949316564211388
Energy: 0.851431918063946
Energy: 0.930834335625349
Energy: 0.8948224147401743
Energy: 0.8448292491496318
Energy: 0.9162493103198466
Energy: 0.8936217437353845
Energy: 0.9782577911954397
Energy: 0.9808752173230982
Energy: 0.8939341208330356
Energy: 0.9762220851782161
Energy: 0.8919535980205431
Energy: 0.9553870490094037
Energy: 0.9772245980822312
Energy: 0.9530334923510917
Energy: 0.8668228183840306
Energy: 0.9775916997455187
Energy: 0.9535244445200843
Energy: 0.9604226559580895
Energy: 0.9682303212008783
Energy: 0.9678454011940532
Energy: 0.9610736161607776
Energy: 0.9579513115902067
Energy: 0.98479474304804
Energy: 1.0014612032492525
Energy: 0.9535267370414795
Energy: 0.9878042350342886
Energy: 1.0013898411207842
Energy: 0.9462140257938697
Energy: 1.00117615490471
Energy: 1.0457273941269098
Energy: 0.9435383538787959
Energy: 0.9882183989400359
Energy: 1.0060605137539664
Energy: 0.9160693564418175
Energy: 1.0007860872403425
Energy: 0.9936180131658668
Energy: 1.0053960902392431
Energy: 1.0126653802780585
Energy: 0.9980044078287164
Energy: 1.06034594930853
Energy: 1.0075617839989992

minimum gb energy = 0.8448292491496318 eV
minimum distance =  2.27905011193609 Angstroms
sigma value = 33


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

Energy: 1.181567108014844
Energy: 1.1770902776093513
Energy: 1.175763294275725
Energy: 1.0347949628343056
Energy: 1.1775287998909676
Energy: 1.1275404069204902
Energy: 1.1914629088863675
Energy: 1.1325612034774617
Energy: 1.1365544140884007
Energy: 1.1338502936588783
Energy: 1.1278443428065374
Energy: 1.137021079295781
Energy: 1.1923690808026102
Energy: 1.06321438535479
Energy: 1.1032563518419967
Energy: 1.1366484489705677
Energy: 1.0587051787431618
Energy: 1.1124902885764645
Energy: 1.1392958840884897
Energy: 1.0916618091696892
Energy: 1.099139472651836
Energy: 1.1348914857885255
Energy: 1.092779772688518
Energy: 1.112745044186563
Energy: 1.0735390032439371
Energy: 1.1327306712494505
Energy: 1.136721632045127
Energy: 1.0638714395951978
Energy: 1.1271117876186658
Energy: 1.1257199075910178
Energy: 1.1066805384020229
Energy: 1.1256346574929041
Energy: 1.125607511258442
Energy: 0.9993931560670964
Energy: 1.1224470780432305
Energy: 1.0540595013695089
Energy: 1.0735998015982793
Energy: 1.1344300433830485
Energy: 1.1330708187146796
Energy: 1.065479347156896
Energy: 1.1325830189022112
Energy: 1.0667789794876927
Energy: 1.0738981151307796
Energy: 0.9980827070697929
Energy: 1.02369513117939
Energy: 1.0751822228882757
Energy: 1.0041594501490192
Energy: 1.0652879323342852
Energy: 1.0916490801301633
Energy: 1.0592956746421598
Energy: 1.0611801262212
Energy: 1.065060474061878
Energy: 1.0704256929729248
Energy: 1.0852117532336736
Energy: 1.0917621888073554
Energy: 1.0019254874436316
Energy: 0.9985012662677876
Energy: 1.0953498184206525
Energy: 0.9996824631046303
Energy: 1.0231628970595943
Energy: 1.0915814470254521
Energy: 1.0018014985570571
Energy: 1.0639472736283402
Energy: 1.0029093761141419
Energy: 1.0953712788863388
Energy: 1.0000969353130416
Energy: 0.9989913614514345
Energy: 0.9993193673915459
Energy: 1.0004852611015038
Energy: 0.999020913183807
Energy: 1.0226860093762309
Energy: 0.9986703952942813
Energy: 0.9993419993953564
Energy: 1.0665968432630628
Energy: 1.0489848612655832
Energy: 0.9985574070322468
Energy: 1.068139403951304
Energy: 0.9982847040338252
Energy: 1.0964944642453465
Energy: 1.0850312168446143
Energy: 1.0876951201818297
Energy: 0.9793977541597361
Energy: 1.0928731428301348
Energy: 0.9746005865516932
Energy: 1.09999090841214
Energy: 1.0667482160309694
Energy: 1.0709214498595536
Energy: 1.1019221055214794
Energy: 1.064548110413813
Energy: 1.0888886953412138
Energy: 1.132890592611668
Energy: 1.0168957517617778
Energy: 1.116225000608942
Energy: 1.1335007396182282
Energy: 1.0822389002189536
Energy: 1.132999474803324
Energy: 1.1903562272864168
Energy: 1.0136940684011266
Energy: 1.0547338892524558
Energy: 1.1361452455973293
Energy: 1.0209881722924028
Energy: 1.1040250761600103
Energy: 1.191233571654052
Energy: 1.1342448728768986
Energy: 1.1363217943220842
Energy: 1.1311686312565434
Energy: 1.1326076318261962
Energy: 1.1265260082053652
Energy: 1.110319902630976
Energy: 1.1345488491490183
Energy: 1.1297840405941362
Energy: 1.0093367964937185
Energy: 1.13385423018471
Energy: 1.096239544994953
Energy: 1.1154255377047644
Energy: 1.1295076173343535
Energy: 1.1366657877427326
Energy: 1.1029817318646786
Energy: 1.1276226262686369
Energy: 1.127309339071116
Energy: 1.1922231524252573
Energy: 1.0920062788008904
Energy: 1.0999291934103528
Energy: 1.1367635963681655
Energy: 1.1044796601922233
Energy: 1.1122780054691013
Energy: 1.1343258462212495
Energy: 1.0632077110500429
Energy: 1.1030070893111041
Energy: 1.135420196247067
Energy: 1.0591940979616696
Energy: 1.1125921004503692
Energy: 1.0727981739369605
Energy: 1.1341751768057908
Energy: 1.1368991871146412
Energy: 1.0657363844508103
Energy: 1.129021674099707
Energy: 1.1365890097282367
Energy: 1.1061431265676636
Energy: 1.1223679143811367
Energy: 1.1257032606604727
Energy: 0.9923170061761087
Energy: 1.121449696225583
Energy: 1.0568997778945617
Energy: 1.0733608044709713
Energy: 1.1347596013483305
Energy: 1.134851608955532
Energy: 1.0653210959628527
Energy: 1.1343668431250222
Energy: 1.0664617506290084
Energy: 1.0741337667485367
Energy: 0.9985654035711563
Energy: 1.0236364349430582
Energy: 1.0753458490666534
Energy: 1.0044523062516866
Energy: 1.06600884099536
Energy: 1.0900528434307535
Energy: 1.0002823672854886
Energy: 1.0232878866653012
Energy: 1.064841200046526
Energy: 1.0029101545307388
Energy: 1.085827325334548
Energy: 1.091124591124993
Energy: 1.0000658942234812
Energy: 0.9981564263403208
Energy: 1.0628889928084937
Energy: 1.000412089399082
Energy: 0.9988089386554533
Energy: 1.0916458332172818
Energy: 1.1148552381143049
Energy: 1.0237439902301608
Energy: 1.0032999625258539
Energy: 1.0480821686330908
Energy: 0.9995623572649279
Energy: 1.0006753596206164
Energy: 0.9996522666665884
Energy: 1.0002787595213027
Energy: 1.0002851059154148
Energy: 1.0153073983169143
Energy: 0.9985172949930925
Energy: 0.9999086807039094
Energy: 1.0722861731057987
Energy: 1.062074655542349
Energy: 1.000117270686367
Energy: 1.0680067822177983
Energy: 0.9980692475154567
Energy: 1.0966350269001846
Energy: 1.0699791685131053
Energy: 1.087165446361671
Energy: 0.9793049748756465
Energy: 1.0644062755649408
Energy: 0.9746469329259901
Energy: 1.104293040206302
Energy: 1.0673528957017981
Energy: 1.0700743870235139
Energy: 1.101350550536515
Energy: 1.0652666099164891
Energy: 1.0612021297197027
Energy: 1.1504852309024165
Energy: 1.1100019410427542
Energy: 1.132456384449888
Energy: 1.063297805845145
Energy: 1.014334151704541
Energy: 1.0680622625527174
Energy: 1.1910850719839088
Energy: 1.0138195506510004
Energy: 1.0546220365223686
Energy: 1.1351827417409681
Energy: 0.9784376676893024
Energy: 1.1017242608677158
Energy: 1.191708954177118
Energy: 1.1362772172505067
Energy: 1.1276649154550709
Energy: 1.1297866839881825
Energy: 1.1313540240566695
Energy: 1.1342197678809953
Energy: 1.1046431787297655
Energy: 1.1263877979924526
Energy: 1.1285079827584747
Energy: 1.0160139345380688
Energy: 1.1363466637096051
Energy: 1.095800393675721

minimum gb energy = 0.9746005865516932 eV
minimum distance =  2.29646286724997 Angstroms
sigma value = 41


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

Energy: 1.3565259766952849
Energy: 1.283575840264519
Energy: 1.2105541139349236
Energy: 1.2095277671272484
Energy: 1.2837655235649288
Energy: 1.2065345165931336
Energy: 1.3938754969030005
Energy: 1.2168014508148624
Energy: 1.2151852029804615
Energy: 1.2405052089946729
Energy: 1.2086544009110975
Energy: 1.2063736170367991
Energy: 1.3981385254916796
Energy: 1.209271627358638
Energy: 1.2016069333720902
Energy: 1.2383157386145411
Energy: 1.211048765983545
Energy: 1.2009905198161646
Energy: 1.3047015781072702
Energy: 1.210460777031792
Energy: 1.2015839324390363
Energy: 1.2187217433645934
Energy: 1.2111953070257064
Energy: 1.2271304075048264
Energy: 1.2372640310657939
Energy: 1.2172323909226148
Energy: 1.2150796341748111
Energy: 1.239880263647343
Energy: 1.2085986463730678
Energy: 1.2270663789100205
Energy: 1.287442512520244
Energy: 1.215791019782965
Energy: 1.2156499383141721
Energy: 1.2142825516489988
Energy: 1.2143569937270058
Energy: 1.2086397475507356
Energy: 1.233547032435963
Energy: 1.2170952156844932
Energy: 1.2148847838771006
Energy: 1.2186244979712224
Energy: 1.2159572784684478
Energy: 1.2119891328231698
Energy: 1.2409461387937586
Energy: 1.21335953782326
Energy: 1.2086599812201941
Energy: 1.2419470591571347
Energy: 1.2164819600382402
Energy: 1.213828497919841
Energy: 1.2647893520655649
Energy: 1.213673534341428
Energy: 1.2315098325994247
Energy: 1.1840015822686032
Energy: 1.2152743427010164
Energy: 1.2267379639263933
Energy: 1.2980621034079132
Energy: 1.2168511022904025
Energy: 1.21644295766227
Energy: 1.2156820099997876
Energy: 1.2353386651337739
Energy: 1.226449479288932
Energy: 1.3014435458586844
Energy: 1.2371307583175875
Energy: 1.2277130277908876
Energy: 1.2965282095939556
Energy: 1.2093851388424348
Energy: 1.2069317706008011
Energy: 1.3424928493129422
Energy: 1.1859694076831124
Energy: 1.1851281704013648
Energy: 1.2411375505838873
Energy: 1.1840758776371616
Energy: 1.1849604212746612
Energy: 1.4009599449032046
Energy: 1.2359526644127208
Energy: 1.2337304385461483
Energy: 1.241213982905218
Energy: 1.2097161448143592
Energy: 1.2075897036867795
Energy: 1.3048844014027823
Energy: 1.2158723670693468
Energy: 1.184386665210397
Energy: 1.186735192402361
Energy: 1.2181059285050797
Energy: 1.1879436298425308

minimum gb energy = 1.1840015822686032 eV
minimum distance =  2.28675230201817 Angstroms
sigma value = 11


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

Energy: 1.532689094341759
Energy: 1.5460157692599605
Energy: 1.4316568280662938
Energy: 1.4553000576964163
Energy: 1.4357265396189847
Energy: 1.4569006566319163
Energy: 1.4695045064517738
Energy: 1.4248919725047164
Energy: 1.4243934470044695
Energy: 1.4090310994570523
Energy: 1.426891131818323
Energy: 1.4286607715992943
Energy: 1.4645497752456114
Energy: 1.3808560741848526
Energy: 1.3800579257603955
Energy: 1.3963199911035085
Energy: 1.381576639496485
Energy: 1.3924286494764815
Energy: 1.4505008075779078
Energy: 1.3812042279365255
Energy: 1.3843471243627437
Energy: 1.3860123509604316
Energy: 1.3810818623717014
Energy: 1.3840290645984914
Energy: 1.4655371934410426
Energy: 1.396247506000231
Energy: 1.3928586578786797
Energy: 1.391938651310741
Energy: 1.3924611810229335
Energy: 1.3921467039609505
Energy: 1.4489542949361502
Energy: 1.3853938854766326
Energy: 1.3865984965232012
Energy: 1.3925180996192075
Energy: 1.3857261744908205
Energy: 1.3822624413879938
Energy: 1.4628058410716966
Energy: 1.3873533050180455
Energy: 1.3861581114123211
Energy: 1.3786886136946441
Energy: 1.3781552707523552
Energy: 1.3855545320685987
Energy: 1.449044045640324
Energy: 1.3913806202549377
Energy: 1.3923649526182778
Energy: 1.3969899131893688
Energy: 1.3931422618760592
Energy: 1.3935559766863141
Energy: 1.4341555969760051
Energy: 1.3991614522385396
Energy: 1.384877608725619
Energy: 1.3738611860315204
Energy: 1.3932204650426447
Energy: 1.3883692752890098
Energy: 1.4342305304048357
Energy: 1.385457054346415
Energy: 1.3843057186124539
Energy: 1.3735445943387794
Energy: 1.3932166106638935
Energy: 1.3882866075358358
Energy: 1.463572520441428
Energy: 1.4336609634945354
Energy: 1.4346296432281331
Energy: 1.4486652870712486
Energy: 1.3880045160055134
Energy: 1.4243727104627977
Energy: 1.4290489262381578
Energy: 1.3848237245461674
Energy: 1.3846631244471976
Energy: 1.449396912102393
Energy: 1.3712344188747494
Energy: 1.3849550691723929
Energy: 1.448175087012536
Energy: 1.3841659041399546
Energy: 1.3838992972499502
Energy: 1.451546107195936
Energy: 1.384597732900227
Energy: 1.3839003714397244
Energy: 1.4358924434936617
Energy: 1.393916740683322
Energy: 1.394288930274823
Energy: 1.3809340895492952
Energy: 1.4498328395640614
Energy: 1.3956483507620225
Energy: 1.4235957038933869
Energy: 1.3869799068996056
Energy: 1.3844977556085358
Energy: 1.3930793860744017
Energy: 1.385064527835082
Energy: 1.3848047642315575
Energy: 1.419516371921811
Energy: 1.3873981528436279
Energy: 1.3844165719711021
Energy: 1.4194014940879331
Energy: 1.384061202030794
Energy: 1.3856124285153162
Energy: 1.4226566773862999
Energy: 1.3841229107373745
Energy: 1.3869170411229146
Energy: 1.371506536456596
Energy: 1.3852303091049163
Energy: 1.3861685109217456
Energy: 1.4286222795096852
Energy: 1.418721221648479
Energy: 1.4183043575786651
Energy: 1.397666796659211
Energy: 1.4254461336145061
Energy: 1.3860013501775488
Energy: 1.4434167324511928
Energy: 1.3846975268391648
Energy: 1.3863810962380652
Energy: 1.4248762043633143
Energy: 1.385510177168809
Energy: 1.3838966838531235
Energy: 1.4226785098899355
Energy: 1.3854687332695705
Energy: 1.3846205006596652
Energy: 1.4092241961449308
Energy: 1.3863821411793809
Energy: 1.3903021102234763
Energy: 1.5141584633578402
Energy: 1.3851754163048724
Energy: 1.3753645662800997
Energy: 1.3846717641776267
Energy: 1.3854339173781398
Energy: 1.3844841374402321
Energy: 1.5114913527660576
Energy: 1.4116546703570918
Energy: 1.410126111515633
Energy: 1.4184205081197092
Energy: 1.4160200316196605
Energy: 1.411668291453371
Energy: 1.4603281629878286
Energy: 1.4160881136267538
Energy: 1.3883049858018035
Energy: 1.3585605511574224
Energy: 1.419784586975827
Energy: 1.3877239526877245
Energy: 1.5123405483749803
Energy: 1.386477006523632
Energy: 1.384252414305656
Energy: 1.3855286226751635
Energy: 1.465785606649656
Energy: 1.3846189138127325
Energy: 1.5081174863092843
Energy: 1.3933477119542468
Energy: 1.3919654504809644
Energy: 1.4302417830407326
Energy: 1.3955690586839926
Energy: 1.393465871486695
Energy: 1.4654217032456924
Energy: 1.373428820407228
Energy: 1.3860565701230085
Energy: 1.3848768743269504
Energy: 1.3707605854932787
Energy: 1.3855527516787576
Energy: 1.4625734875440761
Energy: 1.3856452740282326
Energy: 1.386575107625595
Energy: 1.3840553417503805
Energy: 1.3851425950872898
Energy: 1.383978943240491
Energy: 1.4621386853704847
Energy: 1.3885668659243602
Energy: 1.3858933861025637
Energy: 1.3844518804642394
Energy: 1.3943924356326922
Energy: 1.384140458885698
Energy: 1.4625005928328474
Energy: 1.3762222427356103
Energy: 1.3840357531050196
Energy: 1.4479470000234622
Energy: 1.384770368090879
Energy: 1.3856018652022064
Energy: 1.6087858930617243
Energy: 1.4041040876272415
Energy: 1.3848686067123601
Energy: 1.3844350071715095
Energy: 1.40882266650795
Energy: 1.3836002362303483
Energy: 1.481608207545446
Energy: 1.4184939249964132
Energy: 1.3859153689227428
Energy: 1.3557712699602744
Energy: 1.4263936400462585
Energy: 1.385706511746344

minimum gb energy = 1.3557712699602744 eV
minimum distance =  2.26748348452858 Angstroms
sigma value = 57


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

Energy: 1.8326302030598405
Energy: 1.4865787788779468
Energy: 1.5581676456811737
Energy: 1.5596447159425733
Energy: 1.4869927196445765
Energy: 1.564131732353538
Energy: 1.5372572372400883
Energy: 1.4577294523840738
Energy: 1.4570694737785665
Energy: 1.4576771582895027
Energy: 1.4575377298296845
Energy: 1.4576024472569085
Energy: 1.538361078361285
Energy: 1.447244040700105
Energy: 1.446491173795301
Energy: 1.4572172311541416
Energy: 1.4454550624716065
Energy: 1.4579125888129956
Energy: 1.503451907767042
Energy: 1.4567048811476508
Energy: 1.4587224743523741
Energy: 1.4581767867473665
Energy: 1.4452842740365743
Energy: 1.4570416827407129
Energy: 1.5024411261750055
Energy: 1.460862031015293
Energy: 1.4566321838980396
Energy: 1.456015518256147
Energy: 1.4564807152009465
Energy: 1.4556903867536126
Energy: 1.5027927606797205
Energy: 1.4575215238495434
Energy: 1.4573889281383061
Energy: 1.4570190861843382
Energy: 1.457093186858925
Energy: 1.4568486936996181
Energy: 1.5383010902243983
Energy: 1.4441078403671856
Energy: 1.4444007613564713
Energy: 1.4918358116861725
Energy: 1.4799552914183882
Energy: 1.4575068532101618
Energy: 1.5397884606643486
Energy: 1.4587036757279994
Energy: 1.457822718361097
Energy: 1.456382439613349
Energy: 1.4596782626151314
Energy: 1.4570190974377397
Energy: 1.490375362602196
Energy: 1.4578302543707606
Energy: 1.4438646046851848
Energy: 1.4466205354023627
Energy: 1.458962331320848
Energy: 1.4438679728710164
Energy: 1.4900528572233542
Energy: 1.4570524430392051
Energy: 1.4438470044709186
Energy: 1.44649198845946
Energy: 1.4581516368694798
Energy: 1.4439807742171795
Energy: 1.5374076883710903
Energy: 1.4563819477255306
Energy: 1.457057975193197
Energy: 1.4569463340294126
Energy: 1.4573589625916323
Energy: 1.455839624095954
Energy: 1.5026673579634602
Energy: 1.4452211811167184
Energy: 1.4454226884421033
Energy: 1.4572467742805055
Energy: 1.445405701736954
Energy: 1.4581898865417424
Energy: 1.5023603685807851
Energy: 1.4587997173821288
Energy: 1.456842676323911
Energy: 1.456066099515738
Energy: 1.456697481663757
Energy: 1.4558723228567547
Energy: 1.5020093424255443
Energy: 1.4563872662363768
Energy: 1.4571691754232643
Energy: 1.4563566471743414
Energy: 1.455298055274285
Energy: 1.4570477370687873
Energy: 1.531190476336587
Energy: 1.447628730874791
Energy: 1.456568777156881
Energy: 1.4578100723564031
Energy: 1.4433524642787474
Energy: 1.4560574302191087
Energy: 1.536434701759928
Energy: 1.4465104624713276
Energy: 1.444212360701057
Energy: 1.457346929553961
Energy: 1.443224369138601
Energy: 1.4552510625334933
Energy: 1.493622468969221
Energy: 1.4581448309698573
Energy: 1.4572499617001051
Energy: 1.4448507037868445
Energy: 1.4579925467918542
Energy: 1.4579995221265711

minimum gb energy = 1.443224369138601 eV
minimum distance =  2.27579290690065 Angstroms
sigma value = 9


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

Energy: 1.7122454351696137
Energy: 1.477445258345367
Energy: 1.5122978741468442
Energy: 1.5519071609142636
Energy: 1.4680805928373966
Energy: 1.5122542318873902
Energy: 1.5919106436097181
Energy: 1.5117206845033218
Energy: 1.5012692693245462
Energy: 1.504509087733261
Energy: 1.5144729714179779
Energy: 1.501972067319609
Energy: 1.6318640530764392
Energy: 1.5266087031670186
Energy: 1.5313052807268415
Energy: 1.5356043024953876
Energy: 1.529966626096311
Energy: 1.5304504401946442
Energy: 1.5449907825016735
Energy: 1.495854144664593
Energy: 1.520384205966464
Energy: 1.5062975618162013
Energy: 1.4965180853458735
Energy: 1.5209822604399796
Energy: 1.5567205716834875
Energy: 1.474248599793774
Energy: 1.4753123214301525
Energy: 1.475561964145179
Energy: 1.4778319206474577
Energy: 1.4741370291555185
Energy: 1.5260325199590348
Energy: 1.4860396886036944
Energy: 1.4844229309934127
Energy: 1.4932607716995037
Energy: 1.4917143841106746
Energy: 1.48443540959757
Energy: 1.5257987561737283
Energy: 1.5278781716477785
Energy: 1.5229400449917179
Energy: 1.4687441917272603
Energy: 1.5316344801295647
Energy: 1.5223584832153891
Energy: 1.6358849439486625
Energy: 1.4877063339502692
Energy: 1.4873432004796276
Energy: 1.4849544739262102
Energy: 1.4822422014190078
Energy: 1.4871978022219878
Energy: 1.6331822974078856
Energy: 1.4643652352489955
Energy: 1.4678254618637423
Energy: 1.4931357499448021
Energy: 1.4761600082197568
Energy: 1.5199190102976983
Energy: 1.6330754058140764
Energy: 1.4649129913456647
Energy: 1.4690196267378304
Energy: 1.4939495449057767
Energy: 1.4756993878839255
Energy: 1.4923432096974765
Energy: 1.6257748836547783
Energy: 1.4705263054427276
Energy: 1.4690514355789763
Energy: 1.4643400414857808
Energy: 1.4715021320329562
Energy: 1.4666122406756896
Energy: 1.6170507664347002
Energy: 1.5085509563896424
Energy: 1.5056077975525095
Energy: 1.5063158534435424
Energy: 1.50392111802432
Energy: 1.5038065300722117
Energy: 1.68638912922102
Energy: 1.5345268297301347
Energy: 1.5310638604069102
Energy: 1.5311528631854587
Energy: 1.5255591803536808
Energy: 1.5287474206805485
Energy: 1.676517752412711
Energy: 1.4942444330581661
Energy: 1.4925447849169848
Energy: 1.4890935374076097
Energy: 1.495929749956251
Energy: 1.4937660544896982
Energy: 1.6192942057465702
Energy: 1.4829618567063036
Energy: 1.4824026392485303
Energy: 1.4815584833073696
Energy: 1.4896546225841294
Energy: 1.4842233328725114
Energy: 1.5817823218660694
Energy: 1.5222961922147906
Energy: 1.4782938074297167
Energy: 1.4770097941314126
Energy: 1.5264026479906423
Energy: 1.47836406577558
Energy: 1.5959633158195834
Energy: 1.4968760472056004
Energy: 1.5048384408906386
Energy: 1.514995047024282
Energy: 1.4988344703031553
Energy: 1.504784764919767
Energy: 1.646245306191723
Energy: 1.5311534690452229
Energy: 1.5306628277910481
Energy: 1.5273478542318908
Energy: 1.5399297711903037
Energy: 1.531374404540164
Energy: 1.5941883478029213
Energy: 1.5348288268016514
Energy: 1.5309048097753393
Energy: 1.5033873706509981
Energy: 1.512514400690729
Energy: 1.5281446089907653
Energy: 1.5930171654208753
Energy: 1.493833695722427
Energy: 1.5372173726930554
Energy: 1.500986934111685
Energy: 1.4932808570742102
Energy: 1.535467096501858
Energy: 1.5965502034943548
Energy: 1.5145028156738685
Energy: 1.5134867976015478
Energy: 1.4813708482101848
Energy: 1.516138529281598
Energy: 1.5133293218681263

minimum gb energy = 1.4643400414857808 eV
minimum distance =  2.24012499732941 Angstroms
sigma value = 27


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

Energy: 1.6406088767975335
Energy: 2.1862593429988917
Energy: 1.4496747868860247
Energy: 1.4466963664016692
Energy: 2.181062234442531
Energy: 1.4484806240733141
Energy: 1.7418510323265333
Energy: 1.4569734141521173
Energy: 1.4639580592632886
Energy: 1.4691648966102422
Energy: 1.463096503102686
Energy: 1.4701032328208035
Energy: 1.5862689980903864
Energy: 1.476052761494785
Energy: 1.4750802607065747
Energy: 1.4475894729257188
Energy: 1.449241212308404
Energy: 1.4732399212858405
Energy: 1.5625184545716357
Energy: 1.4633358713465985
Energy: 1.4535645157151993
Energy: 1.4561575043595105
Energy: 1.468357895046613
Energy: 1.4528530402892903
Energy: 1.4887372598371063
Energy: 1.4544197047737875
Energy: 1.4541059092361557
Energy: 1.4568634940332101
Energy: 1.4544102894643405
Energy: 1.454496140994606
Energy: 1.5383583844404403
Energy: 1.4682002099729576
Energy: 1.4639755231362224
Energy: 1.456972777832613
Energy: 1.473680469410832
Energy: 1.463417290882918
Energy: 1.5585418905353896
Energy: 1.4094876998341985
Energy: 1.4057628680672507
Energy: 1.4494151771587898
Energy: 1.4122583654343612
Energy: 1.4073370448923412
Energy: 1.568420438532385
Energy: 1.4110897678903083
Energy: 1.479894205547753
Energy: 1.482374845389102
Energy: 1.410227910189148
Energy: 1.4806836784560249
Energy: 1.6096069799421104
Energy: 1.4445919769327005
Energy: 1.4435504068652465
Energy: 1.443864524474161
Energy: 1.4457174421862644
Energy: 1.4428893724540806
Energy: 1.6097146659840047
Energy: 1.447325890795945
Energy: 1.4457203290407272
Energy: 1.45224316289405
Energy: 1.4467605073401637
Energy: 1.444637867193089
Energy: 1.550109145022866
Energy: 1.4590795553023852
Energy: 1.4668120657760317
Energy: 1.477423929018657
Energy: 1.458614625366227
Energy: 1.4713270548788604
Energy: 1.5504804325964092
Energy: 1.4652807681226216
Energy: 1.4617202592683116
Energy: 1.4742287683563557
Energy: 1.4707450531619373
Energy: 1.4612000316694669
Energy: 1.4561209387794873
Energy: 1.4667645822813722
Energy: 1.41183912852647
Energy: 1.419514240562768
Energy: 1.4866400189685836
Energy: 1.4093163989376776
Energy: 1.4602558301755035
Energy: 1.47306517725015
Energy: 1.4790963761934675
Energy: 1.4107026515727363
Energy: 1.4535237676803032
Energy: 1.4218731601938015
Energy: 1.5661313135456154
Energy: 1.4629476411165532
Energy: 1.4615616698509368
Energy: 1.4659861045254223
Energy: 1.4659012251816301
Energy: 1.462402725506068
Energy: 1.5933489897452544
Energy: 1.4434232564334488
Energy: 1.4424295232856215
Energy: 1.4468964084012244
Energy: 1.4472614981411187
Energy: 1.4434783663898778
Energy: 1.4915934479739061
Energy: 1.4678743775657075
Energy: 1.4647648482114877
Energy: 1.4562753105949655
Energy: 1.467101408734199
Energy: 1.463540810837956
Energy: 1.5325693533916294
Energy: 1.4561714367642065
Energy: 1.4524155865883714
Energy: 1.4592455332750107
Energy: 1.4461310312449505
Energy: 1.4517161239836047
Energy: 1.5482172359270752
Energy: 1.4182726282050977
Energy: 1.4146561330702303
Energy: 1.444294027484439
Energy: 1.4205368331333141
Energy: 1.4145650762051116
Energy: 1.5680932496922597
Energy: 1.418374443615954
Energy: 1.4148412710708904
Energy: 1.459441690860007
Energy: 1.4209701347076167
Energy: 1.4150173667078463
Energy: 1.7217103832745755
Energy: 1.4596271385647641
Energy: 1.4555184290956023
Energy: 1.461488387763215
Energy: 1.4461210069227923
Energy: 1.4531571134562367
Energy: 1.4735622879819394
Energy: 1.4461606065803687
Energy: 1.4446783671036245
Energy: 1.447984966853807
Energy: 1.4534550212200863
Energy: 1.4420936903720922
Energy: 1.5852997996815597
Energy: 1.4437371896933164
Energy: 1.4448150483633178
Energy: 1.4769996144148887
Energy: 1.4437118919724583
Energy: 1.4755864596971549
Energy: 1.5886688731579504
Energy: 1.4638648182932141
Energy: 1.4705547690025904
Energy: 1.475497935261859
Energy: 1.4655376344018238
Energy: 1.4714715213780971
Energy: 1.5346629254003572
Energy: 1.4461189722273116
Energy: 1.489655819090851
Energy: 1.4453921939904355
Energy: 1.4469234595975076
Energy: 1.4474883138850942

minimum gb energy = 1.4057628680672507 eV
minimum distance =  2.23760373184785 Angstroms
sigma value = 19


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

Energy: 2.205124983863712
Energy: 1.4168202453465595
Energy: 1.4255481034628967
Energy: 1.412698146921184
Energy: 1.4357715421295563
Energy: 1.4247957705070886
Energy: 1.5512971294275468
Energy: 1.4075043378862926
Energy: 1.4072267210147396
Energy: 1.4054902884208473
Energy: 1.4075739430414753
Energy: 1.4101499704818365
Energy: 1.5509467240019215
Energy: 1.4046733675032046
Energy: 1.407208852654651
Energy: 1.4131519136622688
Energy: 1.406659610080581
Energy: 1.408915984150295
Energy: 1.4997925677026511
Energy: 1.4068108135954929
Energy: 1.4069567950998518
Energy: 1.4294350869242824
Energy: 1.4055459690265084
Energy: 1.406964874892715
Energy: 1.4443993579222851
Energy: 1.417981251115266
Energy: 1.4157613643174956
Energy: 1.4153741237851785
Energy: 1.4145044385961365
Energy: 1.4087497195245102
Energy: 1.467651235549655
Energy: 1.4069288326875733
Energy: 1.405731546620992
Energy: 1.4116320267876932
Energy: 1.4066438157344694
Energy: 1.4037019296777584
Energy: 1.5007805402479204
Energy: 1.4125869684152075
Energy: 1.412598348752114
Energy: 1.4088000838454606
Energy: 1.4135666602278978
Energy: 1.4280730133557227
Energy: 1.5091953693081213
Energy: 1.402420965395842
Energy: 1.4104066969804097
Energy: 1.4248218657646299
Energy: 1.398566856389211
Energy: 1.4121178725213506
Energy: 1.4428813318244536
Energy: 1.4082665459926607
Energy: 1.4119372628355635
Energy: 1.4047326307369608
Energy: 1.408731078206752
Energy: 1.4080189489987254
Energy: 1.4546768011109492
Energy: 1.4151700727926002
Energy: 1.4179072300024924
Energy: 1.40619035095865
Energy: 1.4161706523826005
Energy: 1.415564564640068
Energy: 1.5344266449286983
Energy: 1.389739934955721
Energy: 1.3919677565325208
Energy: 1.4533241318702506
Energy: 1.3881392014979357
Energy: 1.3881021034068064
Energy: 1.5789866176952452
Energy: 1.3918189330511639
Energy: 1.392545232907932
Energy: 1.396192658581009
Energy: 1.3864870166948264
Energy: 1.393767667562366
Energy: 1.5036171962506935
Energy: 1.4471272226789522
Energy: 1.4015303830171952
Energy: 1.3835953477144118
Energy: 1.4197340476495057
Energy: 1.3985563088621233
Energy: 1.5504413063440285
Energy: 1.4033729335156155
Energy: 1.408850124228767
Energy: 1.3823529302543776
Energy: 1.4043192044550636
Energy: 1.4050155372813617
Energy: 1.5644591886549852
Energy: 1.3926284336786217
Energy: 1.3936348801694356
Energy: 1.399270586321369
Energy: 1.3893400867420669
Energy: 1.3972748776241146
Energy: 1.5488253303967427
Energy: 1.3867898439650086
Energy: 1.3867817674157998
Energy: 1.3890548632537008
Energy: 1.3872249558404195
Energy: 1.38698340940958
Energy: 1.4685368272550354
Energy: 1.4116488481195784
Energy: 1.430581437209825
Energy: 1.3877998422898143
Energy: 1.414402096880145
Energy: 1.4529309106440014
Energy: 1.5329607565406949
Energy: 1.39184430916431
Energy: 1.3897097996351646
Energy: 1.3800819065746364
Energy: 1.3924693754255388
Energy: 1.3919038285881102
Energy: 1.5442527458412114
Energy: 1.3895840420720171
Energy: 1.3903206474439318
Energy: 1.4046786629544321
Energy: 1.382418349121931
Energy: 1.390593310304938
Energy: 1.4545668936932088
Energy: 1.3906616856840357
Energy: 1.3914234480903516
Energy: 1.391538780816466
Energy: 1.38213578123606
Energy: 1.391843045330367
Energy: 1.4087218787418112
Energy: 1.392873987580991
Energy: 1.3921253325102505
Energy: 1.387647113277287
Energy: 1.3956204043684095
Energy: 1.3886411234380502
Energy: 1.4094977119342527
Energy: 1.3954407969112415
Energy: 1.3934396549727321
Energy: 1.4068797286592203
Energy: 1.3970116441986793
Energy: 1.3917246037056672
Energy: 1.4684488831831615
Energy: 1.3801535392346727
Energy: 1.3823430314749094
Energy: 1.4046240245904238
Energy: 1.3785428016299308
Energy: 1.3898864738335261
Energy: 1.5244985128649369
Energy: 1.3834825155887975
Energy: 1.3865248163357669
Energy: 1.4180019367711088
Energy: 1.37636466948465
Energy: 1.3893236266636337
Energy: 1.5100978667160474
Energy: 1.3990771003498998
Energy: 1.3979892047877962
Energy: 1.3857166073091147
Energy: 1.3998165684452692
Energy: 1.3958593011868499
Energy: 1.4642346323503437
Energy: 1.4004126148075993
Energy: 1.399021002308028
Energy: 1.4012336209013743
Energy: 1.3991577652101987
Energy: 1.3955724392963027
Energy: 1.5221003262036177
Energy: 1.4056349764930318
Energy: 1.4048847360199257
Energy: 1.4055026079316175
Energy: 1.408923962431744
Energy: 1.4074214093756556
Energy: 1.5220028737707256
Energy: 1.406651508679898
Energy: 1.4062902469626826
Energy: 1.4091102535532836
Energy: 1.4056110286759929
Energy: 1.4069592903306127
Energy: 1.5315564322078032
Energy: 1.4212224915192615
Energy: 1.4170595873575704
Energy: 1.3748453996902663
Energy: 1.4183612754462147
Energy: 1.3846929471820406

minimum gb energy = 1.3748453996902663 eV
minimum distance =  2.24134068281958 Angstroms
sigma value = 101


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

Energy: 2.0419224567780185
Energy: 1.394919123075553
Energy: 1.3447207080761614
Energy: 1.3183734688093818
Energy: 1.3396649430395262
Energy: 1.3487301759939585
Energy: 1.545694137687567
Energy: 1.3328847916407824
Energy: 1.3317965590745193
Energy: 1.329475112595916
Energy: 1.3385686927430362
Energy: 1.3316391160740357
Energy: 1.5175014062539827
Energy: 1.3294492110723246
Energy: 1.3312931744370406
Energy: 1.339881085263948
Energy: 1.33042910084131
Energy: 1.3473650677949607
Energy: 1.3947592942263036
Energy: 1.332045014750084
Energy: 1.3328765437560155
Energy: 1.3477860460321218
Energy: 1.3307253961861956
Energy: 1.3552986283368447
Energy: 1.3617668634474873
Energy: 1.3442119978395848
Energy: 1.3445314604436625
Energy: 1.3408733950692855
Energy: 1.3448047067379274
Energy: 1.3439862118519472
Energy: 1.38685651265379
Energy: 1.3455864584685941
Energy: 1.3437540420334868
Energy: 1.3370489528674747
Energy: 1.3318330865169805
Energy: 1.3446429791573475
Energy: 1.4163726349539512
Energy: 1.3240745910895544
Energy: 1.3262099925929232
Energy: 1.3721429985309181
Energy: 1.32489405491176
Energy: 1.3262267005043935
Energy: 1.3510961728831667
Energy: 1.3326748053921118
Energy: 1.3344577083438063
Energy: 1.336619200485042
Energy: 1.3275043673212632
Energy: 1.3335219599499921
Energy: 1.349767287794343
Energy: 1.3349261346678238
Energy: 1.3378844106903118
Energy: 1.3341657904167603
Energy: 1.339088968559882
Energy: 1.3331115957104425
Energy: 1.3553882676693108
Energy: 1.3339629563942519
Energy: 1.3342808316864407
Energy: 1.3312468812464056
Energy: 1.3559802115901778
Energy: 1.3340310103192545
Energy: 1.4481212587369896
Energy: 1.3128687289949112
Energy: 1.316200309212289
Energy: 1.3397878822365392
Energy: 1.3129416931237277
Energy: 1.3191033564670989
Energy: 1.4925517746434496
Energy: 1.3326828947521658
Energy: 1.3334253505646643
Energy: 1.3432859702759956
Energy: 1.3329133403878628
Energy: 1.3339507388097782
Energy: 1.392783617620602
Energy: 1.346857332696947
Energy: 1.3496032712309123
Energy: 1.3253120771503375
Energy: 1.3462791262733351
Energy: 1.3468883471286832
Energy: 1.4145682271969164
Energy: 1.3332305017703407
Energy: 1.3457793533611244
Energy: 1.3244027991452527
Energy: 1.3439690716334944
Energy: 1.3422939031213237
Energy: 1.4911996072127782
Energy: 1.3307601304532328
Energy: 1.333132526087699
Energy: 1.3465484083335924
Energy: 1.331381210128481
Energy: 1.338491806559029
Energy: 1.5151483918342976
Energy: 1.3318112182320594
Energy: 1.3330408100401865
Energy: 1.3430025813860604
Energy: 1.338987716394339
Energy: 1.3432815770794204
Energy: 1.416443377327046
Energy: 1.4044654837907404
Energy: 1.3618901942726136
Energy: 1.31001197545221
Energy: 1.411230132743505
Energy: 1.3127563790819716
Energy: 1.5219148796836495
Energy: 1.3327624026213174
Energy: 1.3354140056276682
Energy: 1.3429290520353416
Energy: 1.340412899456383
Energy: 1.3439613758450635
Energy: 1.5143088725167522
Energy: 1.3327920830322564
Energy: 1.3345207218003217
Energy: 1.3391936705457639
Energy: 1.3336023797688026
Energy: 1.3337964270649247
Energy: 1.4611068324004937
Energy: 1.335763350491024
Energy: 1.3316725913252923
Energy: 1.3309678121055244
Energy: 1.3305886096421624
Energy: 1.333237298213462
Energy: 1.3658767122245448
Energy: 1.3404904293233846
Energy: 1.3361347189624435
Energy: 1.3408944791167365
Energy: 1.3390282292882125
Energy: 1.340698342977351
Energy: 1.4181391007585469
Energy: 1.3324664288655528
Energy: 1.332600358116
Energy: 1.3394962179817778
Energy: 1.331524705246379
Energy: 1.33262380637869
Energy: 1.4622128427452648
Energy: 1.3271658230349528
Energy: 1.329600644594185
Energy: 1.3412858701651258
Energy: 1.327494947127826
Energy: 1.334069430419193
Energy: 1.447328528596203
Energy: 1.3291582976730978
Energy: 1.3312692073983496
Energy: 1.341197630676912
Energy: 1.3294363100074709
Energy: 1.3364709844677414
Energy: 1.3633130778650486
Energy: 1.33231018741056
Energy: 1.3325143487243107
Energy: 1.3307236989320643
Energy: 1.3332802791019742
Energy: 1.331230424695031
Energy: 1.3496668314502922
Energy: 1.333853327493098
Energy: 1.3484997423551746
Energy: 1.3326319189801341
Energy: 1.3331711507289474
Energy: 1.344015037559992
Energy: 1.4002995130199418
Energy: 1.3138057973559523
Energy: 1.316490903022017
Energy: 1.3465665048921793
Energy: 1.3143274576370487
Energy: 1.320750954621715
Energy: 1.4934781194751685
Energy: 1.3131524496780624
Energy: 1.3127972282379754
Energy: 1.346203633175815
Energy: 1.3121493082826596
Energy: 1.3436854972914962
Energy: 1.3933868689899258
Energy: 1.333282962785871
Energy: 1.341877381623548
Energy: 1.3289019154627695
Energy: 1.3467925095745097
Energy: 1.3386993333918538
Energy: 1.394714739811992
Energy: 1.3356319130371623
Energy: 1.3365312957958886
Energy: 1.3272255023859947
Energy: 1.3443038140155161
Energy: 1.338384691804314
Energy: 1.491171868490786
Energy: 1.3363936233639122
Energy: 1.3386371095511596
Energy: 1.3321491197704067
Energy: 1.337455195716537
Energy: 1.343120813596807
Energy: 1.5149600067069433
Energy: 1.3304473168175976
Energy: 1.3322631165304917
Energy: 1.3323638509460545
Energy: 1.3310392069344392
Energy: 1.3337611655346482
Energy: 1.415008012090291
Energy: 1.339906462078991
Energy: 1.3485195842412507
Energy: 1.3137889216166991
Energy: 1.3404346793210309
Energy: 1.3424566099899933

minimum gb energy = 1.31001197545221 eV
minimum distance =  2.24322419956985 Angstroms
sigma value = 33


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

Energy: 0.022490186512518322
Energy: 1.3205118576548405
Energy: 0.023351328692030816
Energy: 0.024998581662163254
Energy: 1.3252993107634707
Energy: 0.023204417957619867
Energy: 0.6928906328830908
Energy: 0.16572222384572816
Energy: 0.16333303838588092
Energy: 0.16675882182354243
Energy: 0.16645254297543854
Energy: 0.16329190717645697
Energy: 1.8582490981206865
Energy: 1.327217494654824
Energy: 1.3255223546343455
Energy: 1.3290717718983938
Energy: 1.330034953958311
Energy: 1.3249415736055121
Energy: 0.023671961004005312
Energy: 0.16572222384572816
Energy: 0.16333303838317242
Energy: 0.16675882182354243
Energy: 0.16645254297861578
Energy: 0.16329190717828002

minimum gb energy = 0.022490186512518322 eV
minimum distance =  2.45260709848655 Angstroms
sigma value = 1