Model name: model_name=EAM_Dynamo_BelandTammMu_2017_FeNiCr__MO_715003088863_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=3.5192936509847637
cohesive_energy=4.450092204567907
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=[2.27094118279794e-19, 3.1441434700942797e-19, 3.73960843788672e-19, 4.19856795646236e-19, 4.576040771432759e-19, 4.895450705187e-19, 5.15384975271852e-19, 5.37671252250792e-19, 5.58300878590176e-19, 5.78252784213378e-19, 5.97890663216316e-19, 6.1663773201075e-19, 6.339604657775579e-19, 6.496409684945159e-19, 6.635302377346619e-19, 6.75482475424302e-19, 6.85480057620462e-19, 6.9362231927445e-19, 7.00082295462738e-19, 7.05044236498236e-19, 7.086699622209779e-19, 7.11108475057926e-19, 7.124895513164339e-19, 7.12926945537516e-19, 7.12483142609898e-19, 7.111228946476319e-19, 7.088173624713059e-19, 7.054223501838599e-19, 7.005917876323499e-19, 6.93788945644386e-19, 6.842784251449619e-19, 6.71230298637666e-19, 6.537793907401379e-19, 6.308442322244279e-19, 6.00966842353596e-19, 5.622037808705999e-19, 5.12433765912024e-19, 4.49452202429484e-19, 3.71363715464958e-19, 2.7737042105471397e-19, 1.6851854054075398e-19, 3.95018251289334e-20, -1.24927319771199e-19, -3.40964016011442e-19, -6.297467412301379e-19, -1.020652205099994e-18, -1.5528311958494338e-18, -2.28050617730292e-18, -3.3066522460809e-18, -4.8161269400376596e-18, -7.149120423870419e-18, -1.090188273192228e-17, -1.71205390755972e-17, -2.5854804995848195e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.018110112925724755
Energy: 0.4746911503294391
Energy: 0.018724119022704128
Energy: 0.018344411439769875
Energy: 0.47395710176856115
Energy: 0.018872061134739604
Energy: 0.4746911503287773
Energy: 0.15399518795221478
Energy: 0.15354375936152975
Energy: 0.15273439107227857
Energy: 0.15191996832100377
Energy: 0.15310527029408266
Energy: 0.018724119022704128
Energy: 0.15354375936186065
Energy: 0.1525998344339458
Energy: 0.01876494482962188
Energy: 0.1517355273878765
Energy: 0.15245933249502347
Energy: 0.018344411439769875
Energy: 0.1527343910735654
Energy: 0.018764944829290985
Energy: 0.018416576625773954
Energy: 0.15193801114877722
Energy: 0.018807881514033283
Energy: 0.4739571017714657
Energy: 0.1519199683190552
Energy: 0.15173552738596463
Energy: 0.15193801114815217
Energy: 0.15199657770604574
Energy: 0.1517880887217326
Energy: 0.018872061134445475
Energy: 0.15310527029441354
Energy: 0.15245933249244983
Energy: 0.018807881514364178
Energy: 0.1517880887207399
Energy: 0.018742565700055037

minimum gb energy = 0.018110112925724755 eV
minimum distance =  2.48414080269265 Angstroms
sigma value = 1


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

Energy: 1.6234483090746863
Energy: 1.0970560230013808
Energy: 1.1782727427297408
Energy: 1.2316436040993863
Energy: 1.0968930336150169
Energy: 1.1800065682905836
Energy: 1.5215079573666044
Energy: 1.1032330619934132
Energy: 1.1026925372320098
Energy: 1.2178022310144954
Energy: 1.1029033680599702
Energy: 1.1029193304656928
Energy: 1.5334965336572832
Energy: 1.0975193311564628
Energy: 1.097446646372116
Energy: 1.236981246798896
Energy: 1.09864295400867
Energy: 1.10155981781494
Energy: 1.5595803809409206
Energy: 1.288782868052806
Energy: 1.2101508740119429
Energy: 1.1228349503268558
Energy: 1.3456070845717065
Energy: 1.206974465224742
Energy: 1.5167407132297217
Energy: 1.2426910712449024
Energy: 1.240291435647908
Energy: 1.2376411908614904
Energy: 1.2440425939092083
Energy: 1.233936509329495
Energy: 1.5101407061292524
Energy: 1.1683032460923608
Energy: 1.1686143182056774
Energy: 1.23845048146616
Energy: 1.1689201415041328
Energy: 1.1683096879115262
Energy: 1.4715381087033041
Energy: 1.3101777640977326
Energy: 1.3088704995067948
Energy: 1.3089066352916807
Energy: 1.3152128203870102
Energy: 1.2630571144231275
Energy: 1.379854418587983
Energy: 1.2317865321747357
Energy: 1.236752366754912
Energy: 1.3121385916714836
Energy: 1.2307281148180433
Energy: 1.2427868494875671
Energy: 1.2540628627180528
Energy: 1.167862391610661
Energy: 1.1678686060707038
Energy: 1.1790638203363244
Energy: 1.1671163700089913
Energy: 1.1679118497096166
Energy: 1.2871993299483833
Energy: 1.1989976564430167
Energy: 1.2337934052720128
Energy: 1.2530554968254077
Energy: 1.2419932544305703
Energy: 1.2333122430048538
Energy: 1.3894184302470494
Energy: 1.2210765373718897
Energy: 1.221276835619779
Energy: 1.3900339759820297
Energy: 1.2212943886900625
Energy: 1.1808030390323856
Energy: 1.1104472391552183
Energy: 1.0966975605288618
Energy: 1.0967301903360158
Energy: 1.0955863997303223
Energy: 1.2501692332944674
Energy: 1.0965530970839008
Energy: 1.0967545524907583
Energy: 1.0984689372605543
Energy: 1.0977619795433453
Energy: 1.0965053503483473
Energy: 1.2025626493275947
Energy: 1.098156211395253
Energy: 1.3515387027679624
Energy: 1.2061929155338373
Energy: 1.2060614847031645
Energy: 1.3511876277866526
Energy: 1.1302568155157704
Energy: 1.2100979613844374
Energy: 1.156487814969541
Energy: 1.1452726839220206
Energy: 1.144546322600568
Energy: 1.1450527819560385
Energy: 1.2345714814841662
Energy: 1.145365010411539
Energy: 1.1502782552947477
Energy: 1.1221815451335262
Energy: 1.1223211011491536
Energy: 1.1285413648983966
Energy: 1.1800253197733288
Energy: 1.1222344331700909
Energy: 1.3973827020792065
Energy: 1.2115411441124588
Energy: 1.212260612271313
Energy: 1.331763355548919
Energy: 1.2114795289497835
Energy: 1.2177025050165333
Energy: 1.3946825867045167
Energy: 1.2692327356104125
Energy: 1.2673115636395804
Energy: 1.2942063781789528
Energy: 1.2598494414438728
Energy: 1.2677263502024554
Energy: 1.3778918161883948
Energy: 1.1977775556199726
Energy: 1.1965284625657888
Energy: 1.2189685418203244
Energy: 1.2003040863117602
Energy: 1.198482027659187
Energy: 1.47582012817041
Energy: 1.303494811108552
Energy: 1.303075307340363
Energy: 1.268603278329246
Energy: 1.303123153201359
Energy: 1.296491619667647
Energy: 1.5247724570563497
Energy: 1.2751445544387305
Energy: 1.2334823489317646
Energy: 1.1630798519838572
Energy: 1.3268386081260526
Energy: 1.2306997846171304
Energy: 1.5413332257652617
Energy: 1.1245782088550504
Energy: 1.1226591777803667
Energy: 1.2733624292886359
Energy: 1.1283828515719407
Energy: 1.1279528870139164
Energy: 1.551128697208625
Energy: 1.1512126777031406
Energy: 1.1508413921686078
Energy: 1.2400385878680051
Energy: 1.1513840443001904
Energy: 1.151031901219497

minimum gb energy = 1.0955863997303223 eV
minimum distance =  2.22426791446638 Angstroms
sigma value = 33


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

Energy: 1.7462521102910127
Energy: 1.6393919046558187
Energy: 1.1506094386874386
Energy: 1.4751544074903604
Energy: 1.1217394325159453
Energy: 1.4798505773281403
Energy: 1.647168419872418
Energy: 1.1234005120478363
Energy: 1.1234452749370356
Energy: 1.2160943333696053
Energy: 1.1233311706540503
Energy: 1.1238676886715626
Energy: 1.382708010881722
Energy: 1.1231227060377573
Energy: 1.1234509027911435
Energy: 1.2009691637530016
Energy: 1.1243101454406128
Energy: 1.1141059422180604
Energy: 1.55206888861799
Energy: 1.1224358418532556
Energy: 1.1221523863296812
Energy: 1.1478351034056196
Energy: 1.2276957925115393
Energy: 1.16308420064621
Energy: 1.5093307122465816
Energy: 1.2160203009071806
Energy: 1.2127998367253527
Energy: 1.2467858021332292
Energy: 1.2275914570625375
Energy: 1.2129845172421985
Energy: 1.5441575479648824
Energy: 1.1471241021971106
Energy: 1.1465673946777635
Energy: 1.318287591154791
Energy: 1.2042346119396514
Energy: 1.1457242376320265
Energy: 1.5458431806312296
Energy: 1.3546816037213516
Energy: 1.3186778608076017
Energy: 1.3188708978672694
Energy: 1.2900670197347321
Energy: 1.2165680961007372
Energy: 1.3817880695884188
Energy: 1.1793391312156296
Energy: 1.1807441866183284
Energy: 1.3136111468940288
Energy: 1.1739167882001191
Energy: 1.181094802304248
Energy: 1.231265988606341
Energy: 1.2453688138253578
Energy: 1.151847822403205
Energy: 1.1526085092596972
Energy: 1.2423707368286196
Energy: 1.142351911336793
Energy: 1.25953614474955
Energy: 1.1723031832576787
Energy: 1.2277359071373608
Energy: 1.2286678969139788
Energy: 1.2099119998690393
Energy: 1.2286306465559427
Energy: 1.2340382999883013
Energy: 1.0836342020415437
Energy: 1.0839682731434817
Energy: 1.2358304000028746
Energy: 1.4715067621152766
Energy: 1.085543020946063
Energy: 1.1227229588858607
Energy: 1.2034133752370548
Energy: 1.1232014929004688
Energy: 1.1232797261729426
Energy: 1.1743089072918045
Energy: 1.123349011691699
Energy: 1.123834098001617
Energy: 1.1243760204007966
Energy: 1.114446924458869
Energy: 1.1400287564488698
Energy: 1.1518121946261513
Energy: 1.1233952818542925
Energy: 1.2351676451920388
Energy: 1.1639295974584094
Energy: 1.163855505078866
Energy: 1.235739013303945
Energy: 1.1493135613438341
Energy: 1.163828491577939
Energy: 1.275589746898722
Energy: 1.2131359333346194
Energy: 1.2130611434293046
Energy: 1.2291313734027776
Energy: 1.212405674517689
Energy: 1.2128762234127675
Energy: 1.2497198028739984
Energy: 1.1467358236848324
Energy: 1.145569415670327
Energy: 1.2043310163349927
Energy: 1.3182558628965766
Energy: 1.146421522355878
Energy: 1.3976108037016366
Energy: 1.1502095198160165
Energy: 1.2162121848124647
Energy: 1.3069302556402695
Energy: 1.2161277170278495
Energy: 1.16951173545723
Energy: 1.3813601906532442
Energy: 1.1666201593455234
Energy: 1.1692582206871425
Energy: 1.1762058754366496
Energy: 1.1786092121416278
Energy: 1.1808227798026598
Energy: 1.3647724230192766
Energy: 1.1531454690857572
Energy: 1.149527782854407
Energy: 1.242437779943039
Energy: 1.1496655950025993
Energy: 1.1405125447011517
Energy: 1.5071437253855098
Energy: 1.2285671080997838
Energy: 1.2305815328503855
Energy: 1.2071228955691804
Energy: 1.2281658069226131
Energy: 1.227826508606896
Energy: 1.750206472821495
Energy: 1.2368775996467283
Energy: 1.0849823411903912
Energy: 1.475686050880594
Energy: 1.2358779038644283
Energy: 1.0851728224570758
Energy: 1.666226274997096
Energy: 1.1221390922526897
Energy: 1.1222963687123535
Energy: 1.3027732195892885
Energy: 1.1222899657962857
Energy: 1.1223535102422868
Energy: 1.5061950377742974
Energy: 1.125482040247072
Energy: 1.1231639946509413
Energy: 1.2493529173301894
Energy: 1.1403005527437249
Energy: 1.1241044234780326
Energy: 1.5498374003859035
Energy: 1.1243649648400085
Energy: 1.1239724212006046
Energy: 1.1504673785773551
Energy: 1.2352245508147366
Energy: 1.1643033780168437
Energy: 1.5066075949499664
Energy: 1.2299810930388957
Energy: 1.2290592755605447
Energy: 1.2486968378048604
Energy: 1.2304243326381417
Energy: 1.1242196380417702
Energy: 1.5191751137135485
Energy: 1.1425664403305609
Energy: 1.144690941256006
Energy: 1.2493030005935903
Energy: 1.1424466036496956
Energy: 1.14648939184254
Energy: 1.4808557293296611
Energy: 1.150086855938636
Energy: 1.1692827292320949
Energy: 1.1514180696255907
Energy: 1.1519123433741743
Energy: 1.1506268386249068
Energy: 1.3947028041738878
Energy: 1.2447778388599113
Energy: 1.2415826666156748
Energy: 1.2842439763388271
Energy: 1.242126365940117
Energy: 1.1706011136029217
Energy: 1.2238546632211995
Energy: 1.2446388119107115
Energy: 1.1872927091676664
Energy: 1.1485020943641084
Energy: 1.2416414899898316
Energy: 1.1467452550755786
Energy: 1.2731896347575338
Energy: 1.1710481118309712
Energy: 1.1716290210521563
Energy: 1.2278408836810457
Energy: 1.2472329939423354
Energy: 1.172231373016494
Energy: 1.2441752929881134
Energy: 1.085493714589938
Energy: 1.0848248754440684
Energy: 1.245604985684912
Energy: 1.0854172512208324
Energy: 1.085240883392773
Energy: 1.1214939270924678
Energy: 1.2024644100871207
Energy: 1.2027379426806222
Energy: 1.1214684390894472
Energy: 1.3025468028541984
Energy: 1.1216683530918656
Energy: 1.1394527048403889
Energy: 1.1240562390527276
Energy: 1.1239685974718083
Energy: 1.1400210279105336
Energy: 1.1243978285706038
Energy: 1.1104601187177958
Energy: 1.1222378829317234
Energy: 1.1486561943716358
Energy: 1.1630237009820419
Energy: 1.122335604815649
Energy: 1.1491118838948213
Energy: 1.1667575384108266
Energy: 1.2768786162385037
Energy: 1.1241936898725746
Energy: 1.1241524244389733
Energy: 1.2280370775886709
Energy: 1.248655483047811
Energy: 1.1236831218442913
Energy: 1.2209686870172514
Energy: 1.1519813178296363
Energy: 1.1506365300385597
Energy: 1.1468844099678224
Energy: 1.249113949094425
Energy: 1.1471539941346127
Energy: 1.225974387121475
Energy: 1.1509646122297519
Energy: 1.1505877600820666
Energy: 1.1535228263206725
Energy: 1.3315620669143469
Energy: 1.170524235701389
Energy: 1.3662252468380682
Energy: 1.1705925474770813
Energy: 1.2146468006998714
Energy: 1.2420845262132831
Energy: 1.2924322139661464
Energy: 1.2147571330900484
Energy: 1.3609034287701116
Energy: 1.150021693406176
Energy: 1.1512248421367084
Energy: 1.1752354655256274
Energy: 1.1503975093640009
Energy: 1.1807180082391913
Energy: 1.5083121950769585
Energy: 1.172238849034753
Energy: 1.1717259700513665
Energy: 1.2487566497362232
Energy: 1.1680827145303192
Energy: 1.1496699289589538
Energy: 1.6350796104368255
Energy: 1.260334600551723
Energy: 1.2034003196562442
Energy: 1.2037457926366724
Energy: 1.2600224311505348
Energy: 1.0847586367164308

minimum gb energy = 1.0836342020415437 eV
minimum distance =  2.31900634191696 Angstroms
sigma value = 51


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

Energy: 1.6638576786394466
Energy: 1.1695083811311815
Energy: 1.3671123270401875
Energy: 1.1678264693710887
Energy: 1.1691967442550861
Energy: 1.1702034801137908
Energy: 1.4586811696978697
Energy: 1.1684814499426883
Energy: 1.168795308561253
Energy: 1.329657242838346
Energy: 1.1817855985005412
Energy: 1.1683127166830058
Energy: 1.5179569400646462
Energy: 1.1712316106259786
Energy: 1.1698335433946725
Energy: 1.3136107212554007
Energy: 1.170385348178705
Energy: 1.128706962475658
Energy: 1.5568082907963974
Energy: 1.3145876517377084
Energy: 1.1541208354120145
Energy: 1.2070994571773523
Energy: 1.4047731263916756
Energy: 1.219304314181852
Energy: 1.4574026550058512
Energy: 1.2683316731542083
Energy: 1.2528324828849173
Energy: 1.2585625117927088
Energy: 1.268384552572177
Energy: 1.2513492394726942
Energy: 1.3549190438795653
Energy: 1.1779604788010205
Energy: 1.1769181765880172
Energy: 1.1952816570740126
Energy: 1.2174666760515327
Energy: 1.1764689898845662
Energy: 1.3922572759702774
Energy: 1.1804496885357896
Energy: 1.2651913490536195
Energy: 1.2777507823509835
Energy: 1.181949947131845
Energy: 1.2644880315789493
Energy: 1.3157413517237906
Energy: 1.1254973193066549
Energy: 1.125695278289121
Energy: 1.3037414441406674
Energy: 1.1258148060567117
Energy: 1.1257102408284365
Energy: 1.1540244266602195
Energy: 1.0797766090495529
Energy: 1.2270455645849123
Energy: 1.1533668677450708
Energy: 1.0799365353802146
Energy: 1.1537998031871635
Energy: 1.1690955733782558
Energy: 1.1435952258910576
Energy: 1.1685116289027866
Energy: 1.1691023053504488
Energy: 1.0977441215840036
Energy: 1.1680200783343717
Energy: 1.1686857244095084
Energy: 1.149276966143442
Energy: 1.1515756140770845
Energy: 1.1683658732800053
Energy: 1.1501564753729818
Energy: 1.2625362174100787
Energy: 1.2503811038508355
Energy: 1.1686031496039826
Energy: 1.168893449510623
Energy: 1.2282636487429452
Energy: 1.2415825253024106
Energy: 1.2288089687630714
Energy: 1.243056078351953
Energy: 1.1196553308260075
Energy: 1.1182436031081404
Energy: 1.2215036963274313
Energy: 1.1196248024503188
Energy: 1.1530162115739204
Energy: 1.1846179385620914
Energy: 1.210616811506759
Energy: 1.2231345016223107
Energy: 1.1573711388145842
Energy: 1.2151536104829037
Energy: 1.2142647322250169
Energy: 1.4763940969043496
Energy: 1.174986494067361
Energy: 1.234442034542112
Energy: 1.1895028387049602
Energy: 1.2186683255252735
Energy: 1.2160087508345252
Energy: 1.4435778436219615
Energy: 1.1544361962779437
Energy: 1.154362365633164
Energy: 1.2586974280563117
Energy: 1.1730353312796953
Energy: 1.2028481960327697
Energy: 1.490450291332926
Energy: 1.1873672207450476
Energy: 1.1814488651606505
Energy: 1.315251783689054
Energy: 1.183446789820609
Energy: 1.180632800268268
Energy: 1.6793445517628893
Energy: 1.2292234484447164
Energy: 1.218637087573427
Energy: 1.1233204521935862
Energy: 1.2304571003943598
Energy: 1.1329821043592143

minimum gb energy = 1.0797766090495529 eV
minimum distance =  2.3065430148451 Angstroms
sigma value = 19


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

Energy: 1.5913428827595468
Energy: 1.0917628654548945
Energy: 1.0378256521124307
Energy: 1.24928225972707
Energy: 1.1083228303776305
Energy: 1.407793820630324
Energy: 1.6869133055261476
Energy: 1.1388347081377805
Energy: 1.1327538545054063
Energy: 1.1802547149806428
Energy: 1.1991747291859127
Energy: 1.140874391224729
Energy: 1.3254264563604332
Energy: 1.2006192370231155
Energy: 1.225772249019335
Energy: 1.1662623919299866
Energy: 1.2220835901310396
Energy: 1.2006297962600232
Energy: 1.3838004203355894
Energy: 1.287130892249865
Energy: 1.3767071431443456
Energy: 1.3138768879273315
Energy: 1.3800737205180742
Energy: 1.2496941402948714
Energy: 1.486488641033973
Energy: 1.300635120351958
Energy: 1.2218557515262223
Energy: 1.1567982033292399
Energy: 1.3235061204926075
Energy: 1.2688931074099574
Energy: 1.3633811065588557
Energy: 1.170695078926322
Energy: 1.3374608724815706
Energy: 1.3639795669143746
Energy: 1.1932859219231895
Energy: 1.2456144429629492
Energy: 1.4339701141410106
Energy: 1.3481031001602324
Energy: 1.2928334774855816
Energy: 1.3637474442842898
Energy: 1.2386990044189063
Energy: 1.2929515282283768
Energy: 1.3194877940882568
Energy: 1.233037353740634
Energy: 1.2323658659837642
Energy: 1.3059814507705856
Energy: 1.2504853537511393
Energy: 1.0144303598461781
Energy: 1.2636186686383164
Energy: 1.0956391418922726
Energy: 1.1003212636747697
Energy: 1.264331014225071
Energy: 1.0115642027142198
Energy: 1.019776606505004
Energy: 1.2936131001931919
Energy: 1.2175539580136454
Energy: 1.2437691643751083
Energy: 1.2938874085791625
Energy: 1.2567602424878388
Energy: 1.294113561310016
Energy: 1.3202980192915204
Energy: 1.1816607100057173
Energy: 1.2016944642064142
Energy: 1.3197730244844614
Energy: 1.2929514133872613
Energy: 1.3308306107184504
Energy: 1.3393672512468706
Energy: 1.2809546159079053
Energy: 1.279705476468306
Energy: 1.407778938466503
Energy: 1.2859342159104106
Energy: 1.440900221913125
Energy: 1.1925019076223793
Energy: 1.3492862145774163
Energy: 1.3460004416279405
Energy: 1.1889788936999302
Energy: 1.3948576717892833
Energy: 1.3427160508607763
Energy: 1.256691909065564
Energy: 1.454123529549786
Energy: 1.4468248308815106
Energy: 1.3468494314623594
Energy: 1.4528816548015624
Energy: 1.4489958633713007
Energy: 1.413344056966521
Energy: 1.3839655387459677
Energy: 1.3779490816931603
Energy: 1.0160704338958215
Energy: 1.4339645304254116
Energy: 1.0116209230708935
Energy: 1.4137514910044702
Energy: 1.2012070497843976
Energy: 1.014602416943131
Energy: 1.2501904895943539
Energy: 1.3536443675641912
Energy: 1.1514529959028428
Energy: 1.565486693620935
Energy: 1.40870122736662
Energy: 1.361773225307385
Energy: 1.365272618873171
Energy: 1.4039115028662967
Energy: 1.3702026790323178
Energy: 1.3554222143232637
Energy: 1.4046054562259733
Energy: 1.4177884399099965
Energy: 1.285971738294774
Energy: 1.4044083454637073
Energy: 1.4183409892520074
Energy: 1.3745243573950583
Energy: 1.3508271859338605
Energy: 1.2812081255773424
Energy: 1.1722648390143304
Energy: 1.3446667704531867
Energy: 1.4382303790256878
Energy: 1.64423137583482
Energy: 1.1889199670847013
Energy: 1.2116470820064753
Energy: 1.3649837413167005
Energy: 1.2431842484685927
Energy: 1.3823528420783509
Energy: 1.417928079361362
Energy: 1.261537414161328
Energy: 1.2545312117426024
Energy: 1.3482235799825195
Energy: 1.3468484022365088
Energy: 1.348876426999329
Energy: 1.420065965329152
Energy: 1.2554272954823837
Energy: 1.261270440004433
Energy: 1.279559087204592
Energy: 1.2141798266109107
Energy: 1.2791223212480105
Energy: 1.2744056071075291
Energy: 1.2490443124664736
Energy: 1.2499252354970942
Energy: 1.274790002492554
Energy: 1.3291474691522827
Energy: 1.329261052170034
Energy: 1.3089816728726482
Energy: 1.2001991277042867
Energy: 1.2621999367088186
Energy: 1.3089054645363907
Energy: 1.096129675620161
Energy: 1.2596363014797967
Energy: 1.3098456975794952
Energy: 1.2634482224896053
Energy: 1.3046926704808983
Energy: 1.3099313345945962
Energy: 1.3349874897323564
Energy: 1.3100420344085058
Energy: 1.4568596002920715
Energy: 1.1755684397595476
Energy: 1.1764434583519936
Energy: 1.300368608043204
Energy: 1.321510352635325
Energy: 1.1360846279050645
Energy: 1.1839818850061952
Energy: 1.2748739709247736
Energy: 1.2912906120913523
Energy: 1.1684989814349487
Energy: 1.395335063854702
Energy: 1.121484629214357
Energy: 1.1924051253491603
Energy: 1.2604791140534037
Energy: 1.1587703360208137
Energy: 1.193009468119184
Energy: 1.2552303146726644
Energy: 1.336695648171625
Energy: 1.3241447308886445
Energy: 1.2605593794576584
Energy: 1.179195496491579
Energy: 1.0975066209130913
Energy: 1.2605448589239587
Energy: 1.1772243771955062
Energy: 1.6036279641021092
Energy: 1.2811163454908656
Energy: 1.0142419271222367
Energy: 1.2504841345662472
Energy: 1.1855175863628458
Energy: 1.175170432781185

minimum gb energy = 1.0115642027142198 eV
minimum distance =  2.37202080104704 Angstroms
sigma value = 27


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

Energy: 1.2237899303133168
Energy: 1.1647368136058873
Energy: 1.3334107422404025
Energy: 1.1429747873619376
Energy: 1.180155673343705
Energy: 1.397005593120975
Energy: 1.20257178556945
Energy: 1.1469911384573268
Energy: 1.1462723485726676
Energy: 1.1332818898645418
Energy: 1.147199226037219
Energy: 1.146593244878528
Energy: 1.0988195442347404
Energy: 1.1268591233489464
Energy: 1.0787343207964117
Energy: 1.0396377004420834
Energy: 1.1269304066020687
Energy: 1.054406298654105
Energy: 1.0988299488359048
Energy: 1.0978488875443078
Energy: 1.1048663799897804
Energy: 1.1402649469327333
Energy: 1.1492563116510597
Energy: 1.2366966541970104
Energy: 1.26840159524594
Energy: 1.1261423459255269
Energy: 1.1384864727899258
Energy: 1.1332545104823264
Energy: 1.1275459249805027
Energy: 1.016427244549075
Energy: 1.0722874720063782
Energy: 1.1446157612806562
Energy: 1.1456603496839213
Energy: 1.071922703207316
Energy: 1.1443719736186626
Energy: 0.9588655043824664
Energy: 1.074907878976862
Energy: 1.0347480440122203
Energy: 1.0337735990020143
Energy: 1.0759595161413062
Energy: 1.0809240580287844
Energy: 1.0743832257020822
Energy: 1.1467546885344948
Energy: 1.2109376435978596
Energy: 1.2238674506647134
Energy: 1.1464403913819903
Energy: 1.2238333347893886
Energy: 1.1564264029989972
Energy: 1.1790836417402006
Energy: 1.1938688476933519
Energy: 1.115223372554723
Energy: 1.133432707855796
Energy: 1.1940377745142217
Energy: 1.1758984677701965
Energy: 1.0987177888448705
Energy: 0.998806926025948
Energy: 0.9946784563375529
Energy: 1.0623472697112744
Energy: 1.0519418012699142
Energy: 1.0459126408661115
Energy: 1.097853509973429
Energy: 1.1184372262658175
Energy: 1.0459234541462772
Energy: 1.0519239902970619
Energy: 1.1169088991110339
Energy: 1.050183165906413
Energy: 1.2031138181086989
Energy: 1.1302264918490423
Energy: 1.1301991803233729
Energy: 1.1314780552533958
Energy: 1.1301970060331044
Energy: 1.1316353693555377

minimum gb energy = 0.9588655043824664 eV
minimum distance =  2.2149910962652 Angstroms
sigma value = 9


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

Energy: 1.8361618810938714
Energy: 0.9967378483123974
Energy: 1.0720682466587086
Energy: 1.1443706701976362
Energy: 0.9972591115655354
Energy: 1.283740141598123
Energy: 1.163396554161297
Energy: 0.997712541274421
Energy: 0.9977875595086124
Energy: 1.1513035669386393
Energy: 0.9975833461421908
Energy: 0.9963386182398386
Energy: 0.9411183876885008
Energy: 0.9262009257094094
Energy: 0.9261501682302378
Energy: 1.020426590023073
Energy: 0.9284173599993979
Energy: 0.9262047636545842
Energy: 1.2182274739358534
Energy: 1.0106937396798397
Energy: 1.0970852560556215
Energy: 1.0255833339430678
Energy: 0.9390679334607034
Energy: 1.128573246643179
Energy: 1.2514230709022918
Energy: 1.0746324037598287
Energy: 0.9903087329408067
Energy: 1.136742915058353
Energy: 1.1401451054122074
Energy: 1.0828702889621464
Energy: 1.0005211594927457
Energy: 0.9572078620884897
Energy: 1.157220322731644
Energy: 1.0004309590546305
Energy: 0.9575528030290861
Energy: 0.9907609307663858
Energy: 1.0227735675645804
Energy: 1.1135375110621095
Energy: 1.023890597732337
Energy: 1.0255430250938657
Energy: 1.0872022245502655
Energy: 1.0233950601806474
Energy: 0.995505413508557
Energy: 1.0820913511597516
Energy: 1.178482197822872
Energy: 0.9953875495942387
Energy: 1.1015146065799344
Energy: 1.0018007458172795
Energy: 1.2828708173889396
Energy: 1.0680931868019687
Energy: 1.1331246381507334
Energy: 1.2846875360041112
Energy: 1.066773514961334
Energy: 1.1056811313328547
Energy: 1.4499716011917227
Energy: 1.0403884045653573
Energy: 1.1036304988943604
Energy: 1.0722937437273554
Energy: 1.2139077279910138
Energy: 1.2252218898683938
Energy: 0.8583975363263897
Energy: 1.0020769670449985
Energy: 1.0019612268003988
Energy: 1.073914230261896
Energy: 1.0020514797538533
Energy: 1.0021620971847531
Energy: 1.3229924097813284
Energy: 1.0004557083114394
Energy: 1.0005767931367837
Energy: 1.1871670353243016
Energy: 1.0002652779809869
Energy: 1.0004722754863848
Energy: 1.6288272303471814
Energy: 0.999331035550135
Energy: 1.4260639273177544
Energy: 1.1791341870735104
Energy: 0.9995899520171414
Energy: 1.1813284814039118
Energy: 1.1461363485692306
Energy: 1.0596327434109418
Energy: 1.0598382003131404
Energy: 1.2941534246803188
Energy: 1.0584328075755367
Energy: 1.1878569768657579
Energy: 0.9405911741666864
Energy: 0.9744035730658612
Energy: 0.9879648017701881
Energy: 0.9406079160175395
Energy: 0.9720726018930076
Energy: 1.111524945207318
Energy: 0.9402950468727215
Energy: 1.0769891226091428
Energy: 0.9394959227048182
Energy: 0.94026286323541
Energy: 0.9817921386130217
Energy: 0.9397925081654007
Energy: 0.997626150565383
Energy: 1.080899370886648
Energy: 0.9999170188753241
Energy: 0.9976934996712253
Energy: 1.0726441624332943
Energy: 0.9969355711777179
Energy: 1.1146239666248916
Energy: 0.9719561943972418
Energy: 1.0890811700768261
Energy: 1.1145702111651197
Energy: 1.0004452760293445
Energy: 0.9993923139087691
Energy: 0.9392848860700672
Energy: 0.972385782767424
Energy: 0.9045390375732341
Energy: 0.9164009450395675
Energy: 1.0659223198085328
Energy: 1.028244232964633
Energy: 0.939955443846824
Energy: 0.9195823021132103
Energy: 0.9194003288417925
Energy: 0.9210530793776239
Energy: 0.919607460346607
Energy: 0.9483710532607896
Energy: 0.9453447279212749
Energy: 0.974173890319966
Energy: 0.9738371174018632
Energy: 0.9159006092641576
Energy: 0.9761045963151518
Energy: 0.9388396732485568
Energy: 1.3098765033936868
Energy: 0.9972842461953735
Energy: 1.0035793676008835
Energy: 1.151472194711401
Energy: 0.9449749794985671
Energy: 0.9910966042331786
Energy: 1.380388722205768
Energy: 0.9976754924119666
Energy: 0.9978696543893983
Energy: 1.134573007529774
Energy: 0.9976665123865577
Energy: 1.0873869954434041
Energy: 0.9376645530631619
Energy: 0.9399694570459948
Energy: 0.926066364948403
Energy: 0.912665285432724
Energy: 0.9394918255548899
Energy: 0.9263669520329588
Energy: 1.216851901477776
Energy: 0.9397481314048356
Energy: 1.1698123069828814
Energy: 1.1085101840923468
Energy: 0.9397328220132072
Energy: 1.105834174913455
Energy: 1.2577198226786452
Energy: 0.9952835809223863
Energy: 1.0666426711650672
Energy: 1.1429445009734642
Energy: 1.1928517007771007
Energy: 1.0654872901839705
Energy: 0.9992047484458857
Energy: 1.2319218120715199
Energy: 1.3049806835396964
Energy: 0.9994290268505324
Energy: 1.2265972959335067
Energy: 1.2121822076307638
Energy: 1.002141500204449
Energy: 1.0848662530957114
Energy: 1.0983941471231355
Energy: 0.999856274035072
Energy: 1.1320190733789302
Energy: 1.0007066368737103
Energy: 0.9942512808917873
Energy: 1.1023684776914664
Energy: 1.0022451467103632
Energy: 0.9942423584354626
Energy: 0.9459313065194838
Energy: 1.002435717608219
Energy: 1.331994754973738
Energy: 1.0172206583829821
Energy: 1.0728322008704427
Energy: 1.333576435786855
Energy: 1.0256924043736149
Energy: 1.1030740867598106
Energy: 0.8586025438500509
Energy: 1.0019334571073848
Energy: 1.1045606847506773
Energy: 0.9589413459540321
Energy: 1.3129198714939998
Energy: 1.1637590320506794
Energy: 1.449888387355095
Energy: 1.0025419048845878
Energy: 1.0025037081164092
Energy: 1.0727053220215348
Energy: 1.002599003295572
Energy: 1.108754264642335
Energy: 1.1448257626422003
Energy: 1.0021161727579162
Energy: 1.0026722585662977
Energy: 1.1318181768277382
Energy: 1.0015143036879985
Energy: 1.0161081248958066
Energy: 1.2221709336711883
Energy: 1.0008914920901495
Energy: 1.0006946080687988
Energy: 1.1131264977500743
Energy: 1.0008716133032425
Energy: 1.0047786153411167
Energy: 1.148033006294501
Energy: 0.9991006457081925
Energy: 1.0002169363115538
Energy: 1.1041980115908332
Energy: 1.1388585549633357
Energy: 1.1670284146705316
Energy: 1.1040763519740822
Energy: 0.9670833158112359
Energy: 1.019257259958878
Energy: 1.0942750971809967
Energy: 0.9797602799453985
Energy: 1.1172325134869752
Energy: 0.9280862575010699
Energy: 1.030639039673511
Energy: 0.9395989211752983
Energy: 0.9295767739578215
Energy: 1.0182039468782385
Energy: 0.94017987330586
Energy: 0.9977177631004397
Energy: 1.0508568085554262
Energy: 0.9460910940916898
Energy: 0.9977607649104789
Energy: 1.0893532253238558
Energy: 0.9981536060438214
Energy: 0.9985825262695952
Energy: 1.1796298200015538
Energy: 1.1794655156325462
Energy: 0.9969199732703465
Energy: 1.1783843934177778
Energy: 1.1060442463297522
Energy: 1.1155671305131312
Energy: 0.9749974274970857
Energy: 0.9739188314596305
Energy: 0.9969122848240771
Energy: 1.1063913230450415
Energy: 1.080067209961756
Energy: 0.9387055608509055
Energy: 0.9190786785688365
Energy: 0.9193054960609665
Energy: 0.9198528167432103
Energy: 0.9128902427057496
Energy: 0.9187873645920396
Energy: 0.9393078730453408
Energy: 0.9015231452458976
Energy: 0.9088872852706985
Energy: 0.912367429853566
Energy: 0.921078340401425
Energy: 0.9463717676536795
Energy: 1.3812478622167295
Energy: 0.9962380002518912
Energy: 0.9962266789100948
Energy: 1.1400404479541753
Energy: 0.9961024836800696
Energy: 1.0865585235017625

minimum gb energy = 0.8583975363263897 eV
minimum distance =  2.26122292033391 Angstroms
sigma value = 57


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

Energy: 1.093723080873078
Energy: 0.8887367031361836
Energy: 0.9014569833929023
Energy: 1.095992107313487
Energy: 1.399690420947961
Energy: 1.1138536650816506
Energy: 0.9114096014353908
Energy: 0.9032120897579775
Energy: 0.8150655171312388
Energy: 0.9276834958715722
Energy: 0.9033034411785621
Energy: 0.9112338205639692
Energy: 1.037712945968852
Energy: 0.973472938051675
Energy: 0.9740474983376113
Energy: 0.9973470021894796
Energy: 0.9748527268799567
Energy: 1.0242011817774332
Energy: 0.85490362999634
Energy: 0.8987441187651818
Energy: 0.862235089103611
Energy: 0.8145855613750572
Energy: 0.8683102974763978
Energy: 0.8621411894076517
Energy: 0.856376252060633
Energy: 0.8690887705172943
Energy: 0.87153305277626
Energy: 0.8560433693936071
Energy: 0.8692538757658012
Energy: 0.8641656876364
Energy: 0.8545655930991747
Energy: 0.8691601579637515
Energy: 0.8703573772064274
Energy: 0.8565677935656549
Energy: 0.8688628730483547
Energy: 0.8151851076540366
Energy: 0.8555763459249089
Energy: 0.8160626670505572
Energy: 0.8154183655665974
Energy: 0.8557720222334699
Energy: 0.8685809583342773
Energy: 0.8148474320767989
Energy: 0.9339402558143672
Energy: 1.0600234349239015
Energy: 1.0754253158233467
Energy: 1.054439738509116
Energy: 1.0320457398455063
Energy: 0.9246204299358055
Energy: 0.8424754596403302
Energy: 0.8393007099185464
Energy: 0.8390034310535552
Energy: 0.8425794546929787
Energy: 0.7945710617504519
Energy: 0.8392690671788398
Energy: 0.8431443509652595
Energy: 0.8240390627353336
Energy: 0.8400382340809989
Energy: 0.8432738789526549
Energy: 0.8237834406550751
Energy: 0.8941812878045599
Energy: 0.8430156862411744
Energy: 0.7939092775722971
Energy: 0.794298361627923
Energy: 0.8431018561077074
Energy: 0.8240413541724081
Energy: 0.7946318500403312
Energy: 0.8432368790386098
Energy: 0.7945313054079475
Energy: 0.7941031328117544
Energy: 0.843427638231219
Energy: 0.7943081097547172
Energy: 0.7941217623082911
Energy: 0.97635029458813
Energy: 0.8983473490808289
Energy: 0.8087954312002836
Energy: 1.0249957310547988
Energy: 0.8627436528106086
Energy: 0.861877159881752
Energy: 0.8558583174690522
Energy: 0.8687381211099482
Energy: 0.862117323720901
Energy: 0.8558036118318677
Energy: 0.8687506791009849
Energy: 0.8622893391463872
Energy: 0.8585717227496885
Energy: 0.869022766040135
Energy: 0.8689574226016673
Energy: 0.858976146159759
Energy: 0.8745052480606887
Energy: 0.9162124007104684
Energy: 0.8582776035472941
Energy: 0.8692622532800943
Energy: 0.9180903881045249
Energy: 0.8565727511224246
Energy: 0.8691117747690833
Energy: 0.8160275176660083
Energy: 1.0111889812521064
Energy: 0.9985399531311681
Energy: 0.9584666773800251
Energy: 0.9638444823282114
Energy: 0.9446115553201662
Energy: 0.9592182442429582
Energy: 0.91209247679272
Energy: 1.031280815052471
Energy: 1.0310009854926356
Energy: 0.911298117238267
Energy: 1.0315465828956314
Energy: 1.0586847247866136
Energy: 1.0964740992052
Energy: 0.9227896910680546
Energy: 0.8621055837353649
Energy: 1.0977374342977015
Energy: 0.8877321205796912
Energy: 0.8626825384199637

minimum gb energy = 0.7939092775722971 eV
minimum distance =  2.33442855165016 Angstroms
sigma value = 11


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

Energy: 1.5195010311386374
Energy: 1.3685697720780476
Energy: 1.1461353169842403
Energy: 1.434341357759461
Energy: 1.3767386713095464
Energy: 1.5560376520068917
Energy: 0.8168156740966289
Energy: 0.8576914885109942
Energy: 0.8579615299820236
Energy: 0.8794505144437839
Energy: 0.815803048522028
Energy: 0.8825987690167474
Energy: 0.8199640470786527
Energy: 0.8409636900216644
Energy: 0.840639569831256
Energy: 0.818685791415042
Energy: 0.8466609874146221
Energy: 0.8567790635154408
Energy: 0.8195621401221868
Energy: 0.8891111906681404
Energy: 0.9656200660797478
Energy: 0.8207581671790855
Energy: 0.8166715631441408
Energy: 0.9252586134355629
Energy: 0.8168303539590119
Energy: 0.9187582970366778
Energy: 0.9201002123530491
Energy: 0.8168957046939985
Energy: 1.07640793658172
Energy: 0.8896503598904573
Energy: 1.0737009812767793
Energy: 1.242734807602798
Energy: 1.2509589074679026
Energy: 1.0742684959468531
Energy: 1.2465365471049488
Energy: 0.933490126209634
Energy: 1.0389874199473306
Energy: 0.9828941379601082
Energy: 0.9212677037524128
Energy: 1.0399657961609718
Energy: 1.0295110278277966
Energy: 0.8434239768897523
Energy: 0.8553780868107209
Energy: 0.9162197380608066
Energy: 0.9165723156131993
Energy: 0.8568060990564972
Energy: 0.9180708164187489
Energy: 1.037699653642559
Energy: 1.0578084895330622
Energy: 0.8666310192983206
Energy: 0.851065904669844
Energy: 1.0852008495949845
Energy: 0.8905684667121466
Energy: 0.881159953473219
Energy: 1.2722272162934196
Energy: 0.8684925259414286
Energy: 0.9335986016479626
Energy: 1.0423395540900329
Energy: 1.096075982686621
Energy: 0.9961129976914872
Energy: 1.3299026083322065
Energy: 0.9332331557072622
Energy: 0.9209686619151608
Energy: 1.2051052298715785
Energy: 1.3020753493287691
Energy: 0.9113329188989484
Energy: 1.1679130759041356
Energy: 0.8134563889575565
Energy: 0.8499227832126747
Energy: 1.1772341440916558
Energy: 0.7914870593018544
Energy: 1.0246612755675517
Energy: 1.0204384534290398
Energy: 1.1922525486123534
Energy: 1.1895131415849194
Energy: 1.0217902967617392
Energy: 1.142237288316482
Energy: 1.008998857657696
Energy: 1.0489740810959067
Energy: 0.8535490997554535
Energy: 0.9380101307287608
Energy: 1.0504144752246543
Energy: 0.9962180940545309
Energy: 0.9975103178146328
Energy: 0.9952162759632237
Energy: 1.2582452648377862
Energy: 1.2551087275365804
Energy: 1.047657409577354
Energy: 1.295272681005963
Energy: 1.0481586497049784
Energy: 1.344217598187776
Energy: 0.9396096356381736
Energy: 0.8702161100431424
Energy: 1.299304504029786
Energy: 1.162366645956389
Energy: 1.2163022912670733
Energy: 1.17563866807123
Energy: 1.2821144769095354
Energy: 1.2109697683747316
Energy: 1.153216086637063
Energy: 1.3341995705968868
Energy: 1.21035479027804
Energy: 1.3376100876672128
Energy: 0.9968153978173525
Energy: 0.9984178015572266
Energy: 1.1469702275892129
Energy: 1.049933030208909
Energy: 1.0116334902657977
Energy: 1.2882960491251345
Energy: 0.9893640031106193
Energy: 0.9705059671190869
Energy: 0.969917665704601
Energy: 1.0127362252947711
Energy: 0.9993545368075774
Energy: 1.0204551327410165
Energy: 1.1635060238725636
Energy: 1.2418296449823552
Energy: 1.009019703735134
Energy: 1.151868453754395
Energy: 1.2867987079459131
Energy: 1.2898646441260255
Energy: 1.0551686225605854
Energy: 0.8770110566614455
Energy: 1.2901486240270006
Energy: 1.2199236898074048
Energy: 1.0538755193850333
Energy: 1.2157307131495865
Energy: 1.3903508975794863
Energy: 1.3851225783274699
Energy: 1.271883729552863
Energy: 1.4146770406782925
Energy: 1.036625117924481
Energy: 0.8700048300459652
Energy: 0.8359375911660208
Energy: 0.9093935432500272
Energy: 0.8735947437611034
Energy: 0.8849240920657372
Energy: 0.8955732614457249
Energy: 0.9151546509326977
Energy: 1.0245702262967171
Energy: 1.0554020370791601
Energy: 0.9171266653229913
Energy: 0.9952345697398606
Energy: 0.8898155302754988
Energy: 0.912886090949252
Energy: 0.8165923342488007
Energy: 0.8683932850426587
Energy: 0.9120136665816148
Energy: 0.8183862472341118
Energy: 0.9311360255730151
Energy: 1.3085839220872044
Energy: 0.8569749237826173
Energy: 0.8843448673037693
Energy: 1.2680818195542318
Energy: 1.0423978608502817
Energy: 0.8654276945075461

minimum gb energy = 0.7914870593018544 eV
minimum distance =  2.25108112246986 Angstroms
sigma value = 41


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

Energy: 1.4794063639750545
Energy: 0.9115511022114352
Energy: 0.9735791585396854
Energy: 1.4376981734663714
Energy: 0.9117780408816066
Energy: 1.2128932686620877
Energy: 0.910545336433306
Energy: 0.9103155838229555
Energy: 0.9588045013250773
Energy: 1.0946470705126203
Energy: 0.9100431953662647
Energy: 0.9589770717123842
Energy: 0.9210706443802721
Energy: 0.9373209356924742
Energy: 0.9368107035764368
Energy: 0.9165515596076479
Energy: 0.9379394229728846
Energy: 0.9628903918949065
Energy: 0.9188566225803322
Energy: 1.067667320557292
Energy: 1.0455155935618614
Energy: 0.9198359803141433
Energy: 0.9111773365221334
Energy: 0.9136642805665228
Energy: 0.9108078311615461
Energy: 1.1284397205354297
Energy: 1.1279236287033743
Energy: 0.9107383525520236
Energy: 1.1607985391479436
Energy: 0.9663981979771604
Energy: 1.2462144332080507
Energy: 1.1708908509885327
Energy: 1.0369505904106018
Energy: 1.3358573720167386
Energy: 1.1706441807912162
Energy: 1.038363346309793
Energy: 1.2223187690669823
Energy: 1.0420589503723627
Energy: 1.0055931362056891
Energy: 0.9105743321780178
Energy: 1.136497466841021
Energy: 0.9112131495663927
Energy: 0.9647806485786309
Energy: 1.0556436921533074
Energy: 1.0557212830295626
Energy: 0.9649137610864903
Energy: 1.0556094679086296
Energy: 0.9753818596348575
Energy: 1.2288886552469198
Energy: 0.9768653795245883
Energy: 0.990441264056077
Energy: 0.9335812121363951
Energy: 0.9855133707107951
Energy: 0.9411825704599609
Energy: 1.2211251542997656
Energy: 1.055212729437761
Energy: 1.054883211883011
Energy: 1.2011409169666354
Energy: 1.054828706799617
Energy: 0.920131327463565
Energy: 1.2508892944715806
Energy: 1.2832775860695211
Energy: 0.9597980326475686
Energy: 0.9345273135894138
Energy: 1.4222100602080798
Energy: 1.0221696273761296
Energy: 1.4810671206764925
Energy: 0.9261493697314442
Energy: 1.002532520134774
Energy: 1.482570495219948
Energy: 0.9014203585147718
Energy: 0.941655109049102
Energy: 0.9815881281920399
Energy: 1.1296985344244825
Energy: 1.0826822381094994
Energy: 0.9813976425791257
Energy: 1.4208703225028283
Energy: 1.1170259872667063
Energy: 1.0110850382906904
Energy: 0.9661329531211381
Energy: 0.9683435013214383
Energy: 1.0119866479322581
Energy: 0.9833346440064167
Energy: 0.9773207908332345
Energy: 1.0467719926135122
Energy: 1.2186134006049996
Energy: 1.1385722386004957
Energy: 1.0476161297654212
Energy: 1.2175026407238991
Energy: 1.047614893800652
Energy: 1.1691198451423752
Energy: 0.9105603771749454
Energy: 0.9717551124278133
Energy: 1.2057431628499409
Energy: 1.2229903912337095
Energy: 0.9723260614777907
Energy: 1.4810745425179033
Energy: 1.3283106761456989
Energy: 0.8669802275760904
Energy: 1.4142974777381492
Energy: 1.3030146482211882
Energy: 1.1715497132252106
Energy: 1.20694145681139
Energy: 0.9107204954578421
Energy: 0.9583394144925453
Energy: 1.3389202244151428
Energy: 0.9109722275742111
Energy: 0.8888209557328676
Energy: 0.9120863226645104
Energy: 0.9372176664380761
Energy: 0.9369713804384956
Energy: 0.9122473398156592
Energy: 0.9362772140761382
Energy: 0.9970779319570209
Energy: 0.9124875668594206
Energy: 0.9775974422285387
Energy: 0.920662705313799
Energy: 0.9196142970971242
Energy: 0.947810664675928
Energy: 0.9198643381141965
Energy: 0.909945955155047
Energy: 1.0017892605442116
Energy: 0.9979832966588851
Energy: 0.9100057366818415
Energy: 1.1107703612677664
Energy: 0.9513925060960625
Energy: 1.4158870634011143
Energy: 1.396638919518883
Energy: 1.0380645330932035
Energy: 1.4161652716565971
Energy: 1.3968157096443774
Energy: 1.074362680851593
Energy: 1.2297901137165406
Energy: 1.042584516441002
Energy: 1.0039091569763985
Energy: 1.2307722850037537
Energy: 1.1366072295473755
Energy: 0.9512219823117996
Energy: 0.9648733078146153
Energy: 1.075094191517078
Energy: 1.053688326640176
Energy: 0.9659588874970784
Energy: 1.0745270429735247
Energy: 0.9647434690298514
Energy: 1.2224934288794813
Energy: 0.9946483889206623
Energy: 0.9966905740387133
Energy: 0.9104389096765255
Energy: 1.0317655423644672
Energy: 0.9588904943979782
Energy: 1.2298410312864698
Energy: 0.9819052063496433
Energy: 0.9593832795203046
Energy: 0.9372092109270506
Energy: 1.0174778710666759
Energy: 0.9515015791103014
Energy: 1.2187776482898265
Energy: 1.3533487064576408
Energy: 1.055012798150408
Energy: 1.1993468921173345
Energy: 1.4437686418392164
Energy: 0.9585357630467174
Energy: 1.4936990758506117
Energy: 0.9054183474408908
Energy: 0.9585122227651339
Energy: 1.5062692846061387
Energy: 0.8726059168325786
Energy: 0.9993517616729046
Energy: 1.053875202651257
Energy: 1.417258138240659
Energy: 1.1866518186664128
Energy: 1.0540294712243101
Energy: 1.4175637537896992
Energy: 1.1873947116329069
Energy: 0.9838373718033094
Energy: 1.0520082226023144
Energy: 1.0224188233480174
Energy: 0.9845054843686598
Energy: 1.2830352256851627
Energy: 0.9853919364584428
Energy: 1.0424682545292192
Energy: 1.1125373275587642
Energy: 1.0636106148273008
Energy: 1.0423659117149797
Energy: 1.1971206345609802
Energy: 1.0421474915037936
Energy: 1.1667850926294143
Energy: 0.9363096165151579
Energy: 0.9969751272037659
Energy: 1.166735785343973
Energy: 0.9107226050198541
Energy: 0.9972437600416534
Energy: 1.4576643269651413
Energy: 1.282064258098265
Energy: 0.8668965286886365
Energy: 1.4459543712286111
Energy: 1.232837780198653
Energy: 0.8900500414850607

minimum gb energy = 0.8668965286886365 eV
minimum distance =  2.25876713137799 Angstroms
sigma value = 33


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

Energy: 1.1263548025445043
Energy: 1.848520589549364
Energy: 1.4638769432242393
Energy: 1.1286467077418352
Energy: 1.8495296369831529
Energy: 1.1310193487104647
Energy: 1.0178359669899424
Energy: 1.0282725173367984
Energy: 0.9978032892006214
Energy: 1.0121795342030493
Energy: 1.029976395405423
Energy: 1.0018439617910044
Energy: 1.027770174555921
Energy: 1.0269359449586608
Energy: 1.0594034444485902
Energy: 1.0290171623031126
Energy: 1.0337457918097785
Energy: 1.0609311578484493
Energy: 1.0252807504177865
Energy: 1.0914001560390314
Energy: 1.0160159240768252
Energy: 1.026714009877245
Energy: 1.0201119062177002
Energy: 1.0173270484006385
Energy: 1.117760104861251
Energy: 1.3233925463157041
Energy: 0.9729284683991332
Energy: 1.0641933093674956
Energy: 1.3833883231362087
Energy: 1.0585497360237281
Energy: 1.302506882509918
Energy: 1.0572852789619247
Energy: 1.0584616323227523
Energy: 1.3032823151297934
Energy: 1.057222862029072
Energy: 1.0667744246511182
Energy: 1.3669401355190556
Energy: 1.069687834883707
Energy: 1.0274303296193563
Energy: 1.0252150841181336
Energy: 0.9820463129554954
Energy: 1.0255069668798973
Energy: 1.1035611548179673
Energy: 1.210893240336646
Energy: 1.0294234866602185
Energy: 1.1025421880725441
Energy: 1.2146502008251436
Energy: 1.028513404980741
Energy: 1.0734059180665447
Energy: 0.9873843887844191
Energy: 0.9862178050972767
Energy: 1.027356978047479
Energy: 0.9863863837916117
Energy: 0.9858984596708463
Energy: 1.383594601727997
Energy: 1.2107456258053657
Energy: 1.2110203460203954
Energy: 1.059918651182285
Energy: 1.2125495444287095
Energy: 0.9720877070249933
Energy: 1.3656972561971712
Energy: 1.3437153845805203
Energy: 0.9729981030730648
Energy: 1.0239446923997149
Energy: 1.3329612916827978
Energy: 1.0252486374391547
Energy: 1.3552024047638171
Energy: 0.9653709778864612
Energy: 0.9621971057454044
Energy: 1.3554421677019963
Energy: 0.9680774363914988
Energy: 0.9621014025548661
Energy: 1.27016295964812
Energy: 0.9654621513309749
Energy: 0.9650681920756459
Energy: 1.2704925269318417
Energy: 0.9677161021651147
Energy: 0.9668174414900741
Energy: 1.0225678650607508
Energy: 1.0226437461059656
Energy: 1.0221687127697816
Energy: 1.0239530575120857
Energy: 1.0525378749971448
Energy: 0.9970539319541669
Energy: 0.9667193830869172
Energy: 1.029362853889256
Energy: 1.0300562373932336
Energy: 1.037878081633788
Energy: 1.0284558503520502
Energy: 1.003641571642738
Energy: 1.0183134278910804
Energy: 1.02557215637109
Energy: 1.0258624244716763
Energy: 1.0356435324507318
Energy: 1.0170942350023235
Energy: 1.026188467430895
Energy: 1.456416367687598
Energy: 1.2959332368774705
Energy: 1.1818728647934613
Energy: 1.4146098064063481
Energy: 1.295716966767389
Energy: 0.9830140695960224
Energy: 1.0736319205293288
Energy: 1.0834203910291635
Energy: 1.0602518607227778
Energy: 1.023186775003754
Energy: 1.0962973156689702
Energy: 1.0585282733230479
Energy: 1.0398172342223837
Energy: 1.0707827838216508
Energy: 1.0707310084923316
Energy: 1.0405535575352325
Energy: 1.0980365923285822
Energy: 1.0588051297093555
Energy: 1.2113209233668887
Energy: 1.071107344467449
Energy: 1.0555378218642018
Energy: 1.212595260991407
Energy: 1.0975781451556847
Energy: 1.0219201483120701
Energy: 0.9739853627289495
Energy: 0.9999876141409646
Energy: 0.9867075430258874
Energy: 0.9740261716269635
Energy: 1.068573158965631
Energy: 0.9881729523062497
Energy: 1.2219315121467114
Energy: 1.0588675703286874
Energy: 1.0682377280712203
Energy: 1.2225855446661147
Energy: 1.058759105855009
Energy: 1.2002977324460014
Energy: 1.309234799969137
Energy: 1.0270743885697122
Energy: 1.0012222486806088
Energy: 1.3435281229731493
Energy: 1.3650216537586952
Energy: 0.9739016931190285
Energy: 1.1032603682933846
Energy: 1.340142806363929
Energy: 1.442133595732169
Energy: 0.9659273232513356
Energy: 1.2808354835591187
Energy: 0.9648647301015567
Energy: 1.365466952788244
Energy: 1.0275091513007175
Energy: 1.0007747051865383
Energy: 1.3184963636388107
Energy: 1.0191705479474675
Energy: 1.0271828984703182
Energy: 1.0252882258540452
Energy: 1.0270518202308894
Energy: 1.025370249892827
Energy: 1.0270025148699102
Energy: 1.0264920492176512
Energy: 0.9975478084673901
Energy: 1.0269789921077404
Energy: 1.0876145550905822
Energy: 1.0877831295376146
Energy: 1.02841994495119
Energy: 1.041505460348587
Energy: 1.0596432911993257
Energy: 1.0308275615530178
Energy: 0.9746744058730177
Energy: 0.9747523178287191
Energy: 1.031316544344876
Energy: 1.0241767781726927
Energy: 1.0611756639368444
Energy: 1.304959562284444
Energy: 1.4162420757524063
Energy: 1.0703033102728743
Energy: 1.305132537480283
Energy: 1.0573357766147438
Energy: 1.046102652113163
Energy: 1.3629254630833199
Energy: 1.0676500369022885
Energy: 1.1117253114028567
Energy: 1.0263356946998676
Energy: 0.9793377299586692
Energy: 1.0252802753769812
Energy: 1.105022956137562
Energy: 1.2322591040855981
Energy: 0.9740978160467364
Energy: 1.0937079538610373
Energy: 1.2145621198309473
Energy: 0.9739218346062551
Energy: 1.0746795979289272
Energy: 0.9890656122121716
Energy: 0.9867517099626157
Energy: 1.0248360439308966
Energy: 0.9871373333648095
Energy: 0.9894977212306865
Energy: 1.3673055951299165
Energy: 0.9638812423407924
Energy: 0.973857696124208
Energy: 1.027591057392641
Energy: 0.964319134790778
Energy: 0.9859219687781027
Energy: 1.3655541688311503
Energy: 1.3321995176906614
Energy: 0.9742284045680579
Energy: 1.030978391871399
Energy: 1.2958266261835278
Energy: 1.0589613293402695
Energy: 1.3664783494360082
Energy: 0.9646947196826902
Energy: 0.967762212638375
Energy: 1.3664798931386506
Energy: 0.9619811420284836
Energy: 0.9899602735215449
Energy: 1.2714664683002341
Energy: 0.9691698841454875
Energy: 0.9649192178747811
Energy: 1.2715159755818264
Energy: 0.9643811534716903
Energy: 1.2166373070962342
Energy: 1.0252854746645987
Energy: 1.0355927000419927
Energy: 1.0244051139842507
Energy: 1.0264278870798125
Energy: 1.0258974211760203
Energy: 0.998907702589741
Energy: 0.9672393554008454
Energy: 1.0280748995892004
Energy: 0.9961956845467861
Energy: 0.9673224497719543
Energy: 1.0277328710907923
Energy: 1.0034948625677518
Energy: 1.0156570165275427
Energy: 1.025552148392641
Energy: 1.0260291158754258
Energy: 1.03583629682465
Energy: 1.024939108367786
Energy: 1.025696843993943
Energy: 1.4505648571466376
Energy: 1.2946752721212145
Energy: 1.1159385990406152
Energy: 1.4102187386212244
Energy: 1.2953115933960595
Energy: 0.9849472537900509
Energy: 1.3834351750336706
Energy: 1.105510377114061
Energy: 1.0830180062053705
Energy: 1.3983664301910188
Energy: 1.1175890965837765
Energy: 1.0580495808492585
Energy: 1.0163543955351668
Energy: 1.1388121712298471
Energy: 1.0710672906169285
Energy: 1.017457922534967
Energy: 1.0974718034338087
Energy: 1.02667658205122
Energy: 1.2129044508078013
Energy: 1.0703424113552302
Energy: 1.0709623017183867
Energy: 1.2141339623066678
Energy: 1.098972160187205
Energy: 1.0286276391514906
Energy: 0.9842199922258932
Energy: 0.9864246097222954
Energy: 0.9879466632056987
Energy: 0.9861906220651557
Energy: 1.0475507174261203
Energy: 0.9865028794265862
Energy: 1.220381967917244
Energy: 1.0525014519388625
Energy: 1.051376382567986
Energy: 1.2204148157796233
Energy: 1.059003434724112
Energy: 1.2126650444111955
Energy: 1.3073556122161516
Energy: 1.0270998022292863
Energy: 1.0261582063311732
Energy: 1.342828101130482
Energy: 1.026362547147479
Energy: 1.0252951556904761
Energy: 1.8133216550810285
Energy: 1.2598225507325935
Energy: 1.2176365126659932
Energy: 0.9638358103360856
Energy: 1.2597151317938347
Energy: 0.9674182916653565

minimum gb energy = 0.9619811420284836 eV
minimum distance =  2.32417866381361 Angstroms
sigma value = 67


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

Energy: 1.2720976827679848
Energy: 1.1036417012796367
Energy: 0.9911757178862522
Energy: 1.2755926506158761
Energy: 1.104459525843033
Energy: 0.9907054061011469
Energy: 1.338568660987089
Energy: 1.1065378897602978
Energy: 1.013710806216854
Energy: 1.0551291230150868
Energy: 1.106293254417932
Energy: 1.014179845821085
Energy: 1.1709304736942527
Energy: 0.9610867186052399
Energy: 1.0093352406224754
Energy: 1.1723882053792472
Energy: 0.9612900159208496
Energy: 1.0094798715126128
Energy: 1.1655140392855634
Energy: 1.0058671547499647
Energy: 1.005262823004999
Energy: 1.167359365937159
Energy: 1.1336271782016507
Energy: 1.0501781071798184
Energy: 1.1415239274239808
Energy: 1.0568551310231693
Energy: 1.0581389560689833
Energy: 1.141227932263319
Energy: 1.0565154005052466
Energy: 1.1427672153671515
Energy: 1.140081218764369
Energy: 1.0021173083074157
Energy: 1.1016197376795434
Energy: 1.1410504366469936
Energy: 1.001256066787094
Energy: 1.1433221088972858
Energy: 1.4275061462207086
Energy: 1.0134765680440994
Energy: 1.0115172927412224
Energy: 1.1417250572860722
Energy: 1.1007766019072407
Energy: 1.0115327653522195

minimum gb energy = 0.9610867186052399 eV
minimum distance =  2.34913353330021 Angstroms
sigma value = 3


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

Energy: 1.5757230072705517
Energy: 1.619973803795694
Energy: 1.325015663618138
Energy: 1.5779081331673732
Energy: 1.619008883021872
Energy: 1.297918728581939
Energy: 1.2790673426251025
Energy: 1.39944083817719
Energy: 1.272361972001614
Energy: 1.2069267192844044
Energy: 1.4235668914757913
Energy: 1.190233335475307
Energy: 1.1286731593512827
Energy: 1.1704885951318516
Energy: 1.1732988856191853
Energy: 1.1281757278198101
Energy: 1.1844261750545484
Energy: 1.2235420463590303
Energy: 1.12264884055126
Energy: 1.1323981683815105
Energy: 1.1387137795214093
Energy: 1.1261053542652022
Energy: 1.1579627133065413
Energy: 1.138417002824153
Energy: 1.1518744562279128
Energy: 1.200373072985174
Energy: 1.1842933086341287
Energy: 1.1403177955906756
Energy: 1.2254494072078614
Energy: 1.1953442367894866
Energy: 1.274563161751235
Energy: 1.22523481342207
Energy: 1.2210241160899111
Energy: 1.2764727221527286
Energy: 1.2367350928899836
Energy: 1.25375183899603
Energy: 1.239314563021722
Energy: 1.2994407501640362
Energy: 1.2684146507184535
Energy: 1.227422687839793
Energy: 1.346214669466371
Energy: 1.247355183043787
Energy: 1.4856615545582352
Energy: 1.5544375336115432
Energy: 1.3022741407354217
Energy: 1.4877443701671187
Energy: 1.554755100271265
Energy: 1.3462998211579846
Energy: 1.2650428773038331
Energy: 1.2365416378249756
Energy: 1.244312803444334
Energy: 1.2259984664464636
Energy: 1.324923625775634
Energy: 1.2430389089629286
Energy: 1.4806528946653235
Energy: 1.1168803223688937
Energy: 1.1541975438396708
Energy: 1.4817567457598826
Energy: 1.1175098681770692
Energy: 1.317221178458981
Energy: 1.336696689579654
Energy: 1.158295910933458
Energy: 1.122482821561242
Energy: 1.3388288522917384
Energy: 1.2652104180303645
Energy: 1.218199205199919
Energy: 1.3658734308419909
Energy: 1.2621075318417516
Energy: 1.2238602862553505
Energy: 1.234179680395905
Energy: 1.2628675450219138
Energy: 1.2029104173428369
Energy: 1.305879018629985
Energy: 1.18738024851421
Energy: 1.182775082628511
Energy: 1.295710844481822
Energy: 1.1665431866162599
Energy: 1.1971598065674869
Energy: 1.3442383175529165
Energy: 1.1200608051325407
Energy: 1.138814960168905
Energy: 1.2677314442770111
Energy: 1.1227232674632543
Energy: 1.1593005550874784
Energy: 1.3528256611726222
Energy: 1.1288451554502266
Energy: 1.2386889945546131
Energy: 1.3542253930667856
Energy: 1.1288156390935866
Energy: 1.189696189154346
Energy: 1.3572273339756022
Energy: 1.1615214201144304
Energy: 1.1243361151467535
Energy: 1.3591103248827627
Energy: 1.243830058346703
Energy: 1.1848176024054247
Energy: 1.3973380485194646
Energy: 1.207697171640648
Energy: 1.238362530361375
Energy: 1.3988343664316427
Energy: 1.2082480063787286
Energy: 1.4477735941205812
Energy: 1.5320079825011348
Energy: 1.2181719119666674
Energy: 1.2075337367462151
Energy: 1.4375355175962516
Energy: 1.2636944129767307
Energy: 1.2104457280450558
Energy: 1.5733843088346549
Energy: 1.2517128152436579
Energy: 1.1900383868619073
Energy: 1.1178161521846133
Energy: 1.281116345275487
Energy: 1.1547036801026518
Energy: 1.4173908727029898
Energy: 1.2035385721707954
Energy: 1.1536827337155797
Energy: 1.1176494237325885
Energy: 1.2155102289852644
Energy: 1.154148290211494
Energy: 1.3603444647101548
Energy: 1.2025154677494507
Energy: 1.2220349393952779
Energy: 1.245306090150353
Energy: 1.205391686733738
Energy: 1.2279164200033958
Energy: 1.2479052819314276
Energy: 1.2645844763189418
Energy: 1.2650997569693379
Energy: 1.2503283535098593
Energy: 1.2388301139642777
Energy: 1.2521097432378705
Energy: 1.1943055992259033
Energy: 1.1916663940023315
Energy: 1.1919318216843158
Energy: 1.1962486255162805
Energy: 1.3115282047514532
Energy: 1.1919726854896866
Energy: 1.199108818288011
Energy: 1.1781064282772984
Energy: 1.1768134147453606
Energy: 1.1976986330137327
Energy: 1.1537598993012381
Energy: 1.1973620277762225
Energy: 1.2829033502553506
Energy: 1.1320190798437637
Energy: 1.1226232686962467
Energy: 1.2833713694607762
Energy: 1.348676889513905
Energy: 1.122753745475581
Energy: 1.576525401028193
Energy: 1.4576998850186274
Energy: 1.3768241608155545
Energy: 1.1852791138852894
Energy: 1.4436195231720286
Energy: 1.3162043630742815
Energy: 1.4860212876603842
Energy: 1.4119922751125173
Energy: 1.3796189214198145
Energy: 1.3135804504586783
Energy: 1.4394189099975496
Energy: 1.2720457572907584
Energy: 1.2791095890454147
Energy: 1.1350914110534756
Energy: 1.1251091713845642
Energy: 1.2608961623359742
Energy: 1.3581769381020157
Energy: 1.123002734713921
Energy: 1.1326915247011327
Energy: 1.1701305656111332
Energy: 1.1750964085837479
Energy: 1.133735356061344
Energy: 1.184155046559832
Energy: 1.1381285794680736
Energy: 1.1207951820111512
Energy: 1.1292115620318086
Energy: 1.1266262781200063
Energy: 1.1230427904032068
Energy: 1.1964272572485881
Energy: 1.126501269157967
Energy: 1.1764635241280086
Energy: 1.2182183268232465
Energy: 1.218631606855807
Energy: 1.1778435613157383
Energy: 1.2296132503278094
Energy: 1.1956841459482546
Energy: 1.2655436539864438
Energy: 1.2016875367693878
Energy: 1.1963745197792242
Energy: 1.198089334116428
Energy: 1.3480082924292027
Energy: 1.2011953724608286
Energy: 1.4994068397651235
Energy: 1.3739889673465389
Energy: 1.3739162375094753
Energy: 1.1675016495877304
Energy: 1.3742905991398742
Energy: 1.2495635835457866
Energy: 1.5669158167665633
Energy: 1.3253458468179007
Energy: 1.2831105015601152
Energy: 1.2226985319032395
Energy: 1.3288370013373736
Energy: 1.2772870522672934
Energy: 1.4651833208676484
Energy: 1.1224894592967258
Energy: 1.1224262412349206
Energy: 1.466254247283504
Energy: 1.1227720162698696
Energy: 1.2188123070307397
Energy: 1.328302465653837
Energy: 1.116886577356633
Energy: 1.1542180644636384
Energy: 1.282536872752105
Energy: 1.1174436734318869
Energy: 1.3170890301461176
Energy: 1.2608321797200943
Energy: 1.1907730352170847
Energy: 1.1978874668908845
Energy: 1.262183128406106
Energy: 1.2484345311677285
Energy: 1.244905794284315
Energy: 1.297861464007024
Energy: 1.1619867182305064
Energy: 1.211919586771801
Energy: 1.3004062721146372
Energy: 1.1640011822447591
Energy: 1.2613212157388989
Energy: 1.3418381475570582
Energy: 1.1229178671242745
Energy: 1.1222161508032924
Energy: 1.3367932179533302
Energy: 1.1262585922103172
Energy: 1.1280794349246226
Energy: 1.3650099516369891
Energy: 1.1382810924253248
Energy: 1.1382478229697228
Energy: 1.2820538326076392
Energy: 1.13207501264738
Energy: 1.1372790768169794
Energy: 1.5227759396444411
Energy: 1.2088259893605804
Energy: 1.1612411618951761
Energy: 1.1246481329667386
Energy: 1.2674525500197087
Energy: 1.1243942449805011
Energy: 1.5061228479051194
Energy: 1.2891214738222057
Energy: 1.284743037394396
Energy: 1.4870142983915966
Energy: 1.187497801369843
Energy: 1.3597831925607116
Energy: 1.5107127661606097
Energy: 1.2084872920978889
Energy: 1.2458585859479
Energy: 1.5109005666052098
Energy: 1.207351700501295
Energy: 1.4153335291719848
Energy: 1.3712227034791407
Energy: 1.1897096830031046
Energy: 1.1236678365465997
Energy: 1.3071397318063918
Energy: 1.2437645705256364
Energy: 1.1259568100754322
Energy: 1.4085651088067561
Energy: 1.196502390121714
Energy: 1.155274868442863
Energy: 1.4107593519808934
Energy: 1.1962053759228717
Energy: 1.1561430944823772
Energy: 1.3593593412112668
Energy: 1.1405578517389443
Energy: 1.1902851363740916
Energy: 1.3047715783958114
Energy: 1.1940981731997864
Energy: 1.187612180996394
Energy: 1.2620918300750552
Energy: 1.2369394252157335
Energy: 1.254980899287648
Energy: 1.2473918891189906
Energy: 1.230741900160376
Energy: 1.2594347204993748
Energy: 1.2065753828077834
Energy: 1.2636593188447482
Energy: 1.2497619025228224
Energy: 1.2012238947966114
Energy: 1.2720962154863187
Energy: 1.2260422097498267
Energy: 1.1982319510307395
Energy: 1.177970128695144
Energy: 1.1229972620995488
Energy: 1.2004000479479395
Energy: 1.1885693217297368
Energy: 1.1969714587608635
Energy: 1.4152032339547445
Energy: 1.1529537711119389
Energy: 1.1522621413921443
Energy: 1.4029149369538203
Energy: 1.151728415919558
Energy: 1.236010797319449
Energy: 1.2481003778869622
Energy: 1.3968645390276357
Energy: 1.2537322573897447
Energy: 1.221225000183384
Energy: 1.4414440827163246
Energy: 1.1874704581220046

minimum gb energy = 1.1168803223688937 eV
minimum distance =  2.26672091471038 Angstroms
sigma value = 81


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

Energy: 1.609998702164786
Energy: 1.3806378185215993
Energy: 1.087149264837064
Energy: 1.5578056190789018
Energy: 1.426032415117143
Energy: 1.14416009730878
Energy: 1.2482120829334309
Energy: 1.1649767351887823
Energy: 1.1647106515935357
Energy: 1.2000404808004863
Energy: 1.1566056976011538
Energy: 1.2061193307433589
Energy: 1.2414596217289233
Energy: 1.2514314321236644
Energy: 1.27542835467346
Energy: 1.179800172074367
Energy: 1.2275855232784532
Energy: 1.2619385239679812
Energy: 1.184530278786615
Energy: 1.2789976589210352
Energy: 1.271088556040221
Energy: 1.1938571917142153
Energy: 1.2769681139749396
Energy: 1.184379419837134
Energy: 1.2094840768177455
Energy: 1.2351948723851272
Energy: 1.2268405755367782
Energy: 1.211388913329104
Energy: 1.2377944090744204
Energy: 1.2247791113398296
Energy: 1.2518394241322448
Energy: 1.223546888051658
Energy: 1.222836225791794
Energy: 1.2461623017281682
Energy: 1.223218851909799
Energy: 1.2271992642851102
Energy: 1.3139009782897415
Energy: 1.2753958968000232
Energy: 1.230496194603011
Energy: 1.3187381703620948
Energy: 1.2001555890955913
Energy: 1.2506827073368565
Energy: 1.4133059573775644
Energy: 1.5231780458780404
Energy: 1.476885930630219
Energy: 1.4218716595675882
Energy: 1.4978429400669575
Energy: 1.1931514473345064
Energy: 1.355412332916417
Energy: 1.2797098866033243
Energy: 1.2439521867574213
Energy: 1.3194359970926157
Energy: 1.2340693152155537
Energy: 1.2671542580949817
Energy: 1.3120626459009974
Energy: 1.0669514601362695
Energy: 1.0674678952060814
Energy: 1.2293273221170333
Energy: 1.0669661218550583
Energy: 1.0670295437043507
Energy: 1.2948935978763174
Energy: 1.066516279677475
Energy: 1.0667669195192158
Energy: 1.2335547547181926
Energy: 1.0847088256774158
Energy: 1.2104247062362543
Energy: 1.2604927644460786
Energy: 1.2690799454002009
Energy: 1.2686931701612985
Energy: 1.2454184713717051
Energy: 1.2287048157055265
Energy: 1.27685978041903
Energy: 1.249723245067246
Energy: 1.2316807144556126
Energy: 1.2661478718867831
Energy: 1.2513340922676865
Energy: 1.2312799397182665
Energy: 1.2658597730163812
Energy: 1.4972496493813945
Energy: 1.2114085939619652
Energy: 1.2134325281170197
Energy: 1.3357558925140829
Energy: 1.208474754896183
Energy: 1.2158446711956656
Energy: 1.4686276343834583
Energy: 1.2389740229074344
Energy: 1.2398586929531679
Energy: 1.4694697713378662
Energy: 1.2170005772517747
Energy: 1.2182394179562512
Energy: 1.2536960895775564
Energy: 1.2217054184339635
Energy: 1.2185660416340063
Energy: 1.259440129236343
Energy: 1.2333400502140806
Energy: 1.2429691567493746
Energy: 1.4855987311667336
Energy: 1.1937621078221987
Energy: 1.1938829052669104
Energy: 1.484478633055755
Energy: 1.4150939713810438
Energy: 1.1938208246506754
Energy: 1.2522872625487242
Energy: 1.2723101319762085
Energy: 1.2371850341302926
Energy: 1.311667899277861
Energy: 1.2633965952191795
Energy: 1.2372559038865447
Energy: 1.1780757378505802
Energy: 1.2469629590275921
Energy: 1.0665236766492077
Energy: 1.0676320804869601
Energy: 1.23758467796139
Energy: 1.0662607939273983
Energy: 1.5958094482264824
Energy: 1.2231106965314873
Energy: 1.0665601178610875
Energy: 1.0669082619606378
Energy: 1.2154153880097178
Energy: 1.066635088598837
Energy: 1.2407050433815716
Energy: 1.2328907337784314
Energy: 1.2635223834859342
Energy: 1.2270847245316772
Energy: 1.259176613547188
Energy: 1.230399284266012
Energy: 1.2330260530059107
Energy: 1.2661518376965721
Energy: 1.268885972795678
Energy: 1.2324308112427653
Energy: 1.2246049018423153
Energy: 1.2676214809510642
Energy: 1.1994684707320553
Energy: 1.227921601036728
Energy: 1.2149998114794094
Energy: 1.2008098018537567
Energy: 1.264067915851259
Energy: 1.2127189730238639
Energy: 1.2295603213605113
Energy: 1.2341920746933859
Energy: 1.2338435310868838
Energy: 1.222327167813607
Energy: 1.2337025017871364
Energy: 1.211386823577976
Energy: 1.361476867198039
Energy: 1.2195033810401317
Energy: 1.2191284124644177
Energy: 1.3588553750640529
Energy: 1.2890138722781705
Energy: 1.221534018677409
Energy: 1.4451354748185699
Energy: 1.4815246529102655
Energy: 1.4805298833989018
Energy: 1.4611681235156049
Energy: 1.479420748012397
Energy: 1.480577962402968
Energy: 1.2059230342416225
Energy: 1.4803321215152196
Energy: 1.3450645363506721
Energy: 1.202056389649934
Energy: 1.5459263971576276
Energy: 1.2438604366618133
Energy: 1.3447095063220926
Energy: 1.0676358525179404
Energy: 1.2089973239291205
Energy: 1.3407036098336764
Energy: 1.10052023782363
Energy: 1.209986900826641
Energy: 1.2769909907153998
Energy: 1.0672907379924466
Energy: 1.0675888821244195
Energy: 1.2078018674832585
Energy: 1.067533078501576
Energy: 1.1214107976124967
Energy: 1.2303879419689685
Energy: 1.2393764629058848
Energy: 1.2700671314104564
Energy: 1.2377532753823322
Energy: 1.3024682532230165
Energy: 1.1836454326156476
Energy: 1.231758493460671
Energy: 1.3146551458120894
Energy: 1.2711256507352329
Energy: 1.241795147797953
Energy: 1.2331237580276784
Energy: 1.2706173015353994
Energy: 1.2267698104354596
Energy: 1.2007855723366134
Energy: 1.1981726448467849
Energy: 1.2244528767717926
Energy: 1.198261966848569
Energy: 1.1877776955714636
Energy: 1.476402604895248
Energy: 1.2186899721126934
Energy: 1.2177448570613294
Energy: 1.236825887334025
Energy: 1.2180581609625025
Energy: 1.2167559982768374
Energy: 1.4402909383932807
Energy: 1.2580345771222206
Energy: 1.2357537642645984
Energy: 1.235234971990263
Energy: 1.2582282934993592
Energy: 1.2352136311991724
Energy: 1.194275134373662
Energy: 1.1581982080983992
Energy: 1.2455056685352237
Energy: 1.2372945388510455
Energy: 1.4615396384006525
Energy: 1.158122768145104
Energy: 1.355278251363934
Energy: 1.2048620270864856
Energy: 1.192856508217703
Energy: 1.5034475648540075
Energy: 1.202281092950861
Energy: 1.4750450325552338
Energy: 1.2214420341266683
Energy: 1.1823056793072093
Energy: 1.1630163504822082
Energy: 1.2094581609416795
Energy: 1.2571923794987057
Energy: 1.184030532166608
Energy: 1.6110910424279197
Energy: 1.1895866899628518
Energy: 1.087166620153021
Energy: 1.558982578590176
Energy: 1.1798478518358544
Energy: 1.1447583051267733

minimum gb energy = 1.0662607939273983 eV
minimum distance =  2.30276375319167 Angstroms
sigma value = 43


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

Energy: 1.6344679980096766
Energy: 1.5210519253757773
Energy: 1.3401780754900336
Energy: 1.1613636403313652
Energy: 1.5768450645683798
Energy: 1.1608431926268155
Energy: 1.1195996767990422
Energy: 1.2791089996623246
Energy: 1.2373002535432227
Energy: 1.2264424657259432
Energy: 1.2312216652000239
Energy: 1.1373773554055175
Energy: 1.1195411557853798
Energy: 1.0969765648527992
Energy: 1.137484421218126
Energy: 1.1197710586582053
Energy: 1.0968196641766206
Energy: 1.1918245243098695
Energy: 1.1153333226904567
Energy: 1.0962966865758696
Energy: 1.1156409021548246
Energy: 1.1165022404696452
Energy: 1.0966846548162967
Energy: 1.1161026251738566
Energy: 1.1466527715369852
Energy: 1.2857984309842518
Energy: 1.2500992547987078
Energy: 1.1464445179262608
Energy: 1.2889178461828932
Energy: 1.2282503226330659
Energy: 1.2362919165059496
Energy: 1.2513543609280042
Energy: 1.257972017397329
Energy: 1.260153738100857
Energy: 1.2313936320018777
Energy: 1.2556016667164303
Energy: 1.2332377350164414
Energy: 1.125293597321433
Energy: 1.1257698609593318
Energy: 1.2460881615722241
Energy: 1.1253098156224315
Energy: 1.124524610536973
Energy: 1.436738400911997
Energy: 1.1193305023257856
Energy: 1.1163252844147449
Energy: 1.1754641285157834
Energy: 1.120214095074351
Energy: 1.245990663965285
Energy: 1.3093701847763524
Energy: 1.200784352373006
Energy: 1.116662884572326
Energy: 1.3109746102111517
Energy: 1.200649178656791
Energy: 1.1158065073761037
Energy: 1.4505114394902279
Energy: 1.2220158659283602
Energy: 1.2612340358517877
Energy: 1.4901297070717128
Energy: 1.2224839883531227
Energy: 1.2967548025537219
Energy: 1.3629919046119974
Energy: 1.2051629818942142
Energy: 1.1715982332422044
Energy: 1.355770765514092
Energy: 1.334983086301217
Energy: 1.2598219555218695
Energy: 1.3732994445007387
Energy: 1.2007933497420373
Energy: 1.200876774785528
Energy: 1.2236275026084962
Energy: 1.1197153491703489
Energy: 1.1153548975458942
Energy: 1.4909357653888111
Energy: 1.1558592248838533
Energy: 1.1723937548658383
Energy: 1.097024103944378
Energy: 1.1562065630663168
Energy: 1.1723485053048672
Energy: 1.2016310376360129
Energy: 1.2047150776194009
Energy: 1.2321398387185687
Energy: 1.1399645238305742
Energy: 1.1765968998730578
Energy: 1.2378295417211513
Energy: 1.167828022297823
Energy: 1.252570601895
Energy: 1.2056168456842007
Energy: 1.1675776737359649
Energy: 1.2871128055620693
Energy: 1.221164800790152
Energy: 1.114947180324504
Energy: 1.1362852594819597
Energy: 1.114743069966289
Energy: 1.1157778846399937
Energy: 1.300047153287409
Energy: 1.1145868199203983
Energy: 1.12316023891143
Energy: 1.1284278611874512
Energy: 1.1284046761184767
Energy: 1.1234324252772376
Energy: 1.273859960801611
Energy: 1.1275175122102226
Energy: 1.127058674650526
Energy: 1.1835115002884913
Energy: 1.1013418634918788
Energy: 1.1238689436212013
Energy: 1.2593911454221374
Energy: 1.1010883592455412
Energy: 1.4406637960747852
Energy: 1.2745326725618291
Energy: 1.2750584751713063
Energy: 1.262966983456361
Energy: 1.272413733395184
Energy: 1.2203371417154822
Energy: 1.4916098895844951
Energy: 1.3506014734571161
Energy: 1.2745682518021295
Energy: 1.117902186077674
Energy: 1.2886284872843703
Energy: 1.22053494606897
Energy: 1.1245102387713248
Energy: 1.209090885094243
Energy: 1.2080650502817953
Energy: 1.1269682444638272
Energy: 1.3106154301152202
Energy: 1.1854052816467813
Energy: 1.3553622344381064
Energy: 1.175518743596754
Energy: 1.2086846916877794
Energy: 1.3464081141642763
Energy: 1.1394594618137595
Energy: 1.2085358852346524
Energy: 1.2356273921378884
Energy: 1.1014259241016546
Energy: 1.2778691454435873
Energy: 1.2223301728228941
Energy: 1.226548623750232
Energy: 1.2664064893956515
Energy: 1.380491158582728
Energy: 1.1319590253914693
Energy: 1.174100292423482
Energy: 1.2454846461903806
Energy: 1.126117833135455
Energy: 1.20867524228553
Energy: 1.253985812328554
Energy: 1.10020074871268
Energy: 1.1010820328495214
Energy: 1.2653573719623676
Energy: 1.1002822009530018
Energy: 1.1249758236167573
Energy: 1.3454013428789913
Energy: 1.1077360428105907
Energy: 1.189289992668522
Energy: 1.2710422134699788
Energy: 1.108134385488483
Energy: 1.1891703003853977
Energy: 1.3491767894264572
Energy: 1.2779248375036407
Energy: 1.2622584018009215
Energy: 1.269869303488743
Energy: 1.2313875835983452
Energy: 1.272048703609647
Energy: 1.162737380736951
Energy: 1.1377688425476518
Energy: 1.1180128982780295
Energy: 1.1627722462242662
Energy: 1.273963536733672
Energy: 1.1170808484882853
Energy: 1.2146912152620675
Energy: 1.1557417004226636
Energy: 1.155861712740322
Energy: 1.2156360521486234
Energy: 1.1775288126190828
Energy: 1.235259978306456
Energy: 1.1193106864093068
Energy: 1.2513205773644493
Energy: 1.1499509781485489
Energy: 1.2259761774761317
Energy: 1.2448022621641714
Energy: 1.1165832096207657
Energy: 1.639090897321979
Energy: 1.487651300726595
Energy: 1.3835629810916321
Energy: 1.1729219138432032
Energy: 1.502515810703038
Energy: 1.3480640461848505

minimum gb energy = 1.0962966865758696 eV
minimum distance =  2.29646751659315 Angstroms
sigma value = 57


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

Energy: 1.2975759568392835
Energy: 1.3996872832430698
Energy: 1.1701474210883052
Energy: 1.2985643394868351
Energy: 1.3997055570307106
Energy: 1.1697763659994571
Energy: 1.2584226016856055
Energy: 1.2065303554470317
Energy: 1.111257641004081
Energy: 1.278940733520245
Energy: 1.1139637502177164
Energy: 1.09868973687149
Energy: 1.1028989849264461
Energy: 1.0446094225823825
Energy: 1.1490650854612952
Energy: 1.0947146020070435
Energy: 1.0452893387843456
Energy: 1.149675432965595
Energy: 1.099429971309359
Energy: 1.0408510385731111
Energy: 1.0457278663904008
Energy: 1.10033629595154
Energy: 1.0457513970507006
Energy: 1.0967339506987304
Energy: 1.0839629606090622
Energy: 1.0796472854569865
Energy: 1.0751191226213017
Energy: 1.0847198583286746
Energy: 1.0843832956535022
Energy: 1.0859505277702755
Energy: 1.1147564308697857
Energy: 1.0797116847774502
Energy: 1.0803728512785666
Energy: 1.145371881239007
Energy: 1.0939210733989402
Energy: 1.1702668839808645
Energy: 1.4106327037180322
Energy: 1.091948635218852
Energy: 1.092074350522061
Energy: 1.411973196635199
Energy: 1.0944291230598693
Energy: 1.0923446605915725
Energy: 1.2034149878752527
Energy: 1.204755596825502
Energy: 1.205238630151975
Energy: 1.204613953567533
Energy: 1.099065373522743
Energy: 1.0985219126534511
Energy: 1.1205435167596287
Energy: 1.099641045327859
Energy: 1.0991771365749003
Energy: 1.1218575585755453
Energy: 1.2065292914318988
Energy: 1.100026497535981
Energy: 1.3696416211265083
Energy: 1.098892048274403
Energy: 1.1324824453270457
Energy: 1.36929808548603
Energy: 1.0990168158306182
Energy: 1.1323836636222158
Energy: 1.0944801725253983
Energy: 1.0961571338992824
Energy: 1.1990922171154688
Energy: 1.0939770257496717
Energy: 1.1287223026962825
Energy: 1.1962455969441352
Energy: 1.0443777829274963
Energy: 1.1107317585482337
Energy: 1.195398544247701
Energy: 1.395265543238219
Energy: 1.1606082374101385
Energy: 1.1429574705961225
Energy: 1.2221701534053728
Energy: 1.1960218373489435
Energy: 1.143157320039227
Energy: 1.143172907526284
Energy: 1.117304433350625
Energy: 1.1434435627474628
Energy: 1.11646427048274
Energy: 1.1115704907633048
Energy: 1.1733866539503328
Energy: 1.1317318321670453
Energy: 1.1067978140431947
Energy: 1.0984875500906586
Energy: 1.0940892039686687
Energy: 1.094383395808836
Energy: 1.0944747766913117
Energy: 1.103764347538208
Energy: 1.2098077850699775
Energy: 1.0905654736378954
Energy: 1.0930343417489363
Energy: 1.144427993573236
Energy: 1.1674142955757965
Energy: 1.0936150337176356
Energy: 1.216714726239044
Energy: 1.0929812823715894
Energy: 1.0973480678908965
Energy: 1.17395690013145
Energy: 1.0843331314747604
Energy: 1.1929688202378428
Energy: 1.173736128687904
Energy: 1.0834416486302474
Energy: 1.1978741269523994
Energy: 1.0941392714278737
Energy: 1.0820210385134421
Energy: 1.1980814593395939
Energy: 1.0935240327653852
Energy: 1.0841678865061812
Energy: 1.1158766651726815
Energy: 1.0926934811425095
Energy: 1.0973208045684453
Energy: 1.1148822584629796
Energy: 1.0931312523800694
Energy: 1.0980542673040592
Energy: 1.1142753560302172
Energy: 1.1954352281205722
Energy: 1.0975746340369958
Energy: 1.0936328197356513
Energy: 1.2030852233724643
Energy: 1.093639365153013
Energy: 1.1385757208280352
Energy: 1.173660280104071
Energy: 1.1737418183237553
Energy: 1.135611604613942
Energy: 1.1075071414437745
Energy: 1.0983804976745346
Energy: 1.3958286779878255
Energy: 1.129337173454391
Energy: 1.1295987481463177
Energy: 1.3961491309148184
Energy: 1.2516792552103766
Energy: 1.1294299183888135
Energy: 1.098513973085875
Energy: 1.1119217050780474
Energy: 1.2247408645780462
Energy: 1.131706599390624
Energy: 1.1085660897146314
Energy: 1.1978206532490283
Energy: 1.3656617983943633
Energy: 1.2030249913032913
Energy: 1.1432490386823377
Energy: 1.1432020851163893
Energy: 1.1604888575360233
Energy: 1.1433762150683815

minimum gb energy = 1.0408510385731111 eV
minimum distance =  2.28170317924919 Angstroms
sigma value = 17


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

Energy: 1.4064543793613697
Energy: 1.3164685047039384
Energy: 1.2055479752455573
Energy: 1.4087832931749777
Energy: 1.3152609918020843
Energy: 1.0500382313357401
Energy: 1.2868591777676377
Energy: 1.0918225645870763
Energy: 1.0922032737075873
Energy: 1.1827373751287515
Energy: 1.1817964856702434
Energy: 1.0541107339125477
Energy: 1.2828843413057538
Energy: 1.0071426010484463
Energy: 1.0068429318959489
Energy: 1.2848808148412263
Energy: 1.0401236724485976
Energy: 1.114236758072251
Energy: 1.0917530066459906
Energy: 1.0066417351894301
Energy: 1.0064746052322886
Energy: 1.0922278321914307
Energy: 1.0068581039203126
Energy: 1.0900540356366966
Energy: 1.1516745377243063
Energy: 1.0889042979359056
Energy: 1.091081865574563
Energy: 1.132483284863393
Energy: 1.1823970431103707
Energy: 1.121235321224058
Energy: 1.2108885772522462
Energy: 0.9832192782330846
Energy: 0.9825861584177579
Energy: 1.0236313032033693
Energy: 0.9827315774759029
Energy: 1.0592841084158506
Energy: 1.2404611344329255
Energy: 0.9817982594717987
Energy: 0.9821139378334357
Energy: 1.2410862957220128
Energy: 0.982819158330721
Energy: 1.0756970238775372
Energy: 1.1753053300269556
Energy: 1.1265448097780741
Energy: 1.1279015523657876
Energy: 1.1767182507512064
Energy: 1.1425226278014906
Energy: 1.14457657187827
Energy: 0.9866596518511551
Energy: 1.1260632944740214
Energy: 1.0677951519872406
Energy: 0.9855997503972308
Energy: 1.208230395400111
Energy: 0.9827486324216632
Energy: 0.9823045733154704
Energy: 0.9830215574913727
Energy: 0.9825787839568375
Energy: 0.9820105938351854
Energy: 0.9834870040370983
Energy: 0.9826593022773122
Energy: 1.163308608260708
Energy: 1.1227753691298208
Energy: 1.0895900244994619
Energy: 1.1821263196982903
Energy: 1.1295020848744257
Energy: 1.089908283261161
Energy: 1.2086952852334933
Energy: 1.0896108056986744
Energy: 1.0893157785760825
Energy: 1.2088816789143075
Energy: 1.0924735263524323
Energy: 1.0896175540103255
Energy: 1.1281168131695654
Energy: 1.1971177228889203
Energy: 1.0903382353894482
Energy: 1.0521747944302446
Energy: 1.1827985850325902
Energy: 1.0907591199353757
Energy: 1.286559432156497
Energy: 1.0908793657912992
Energy: 1.0905536046251734
Energy: 1.280228552637617
Energy: 1.0912833914820197
Energy: 1.0929201856876845
Energy: 1.3141974911664074
Energy: 1.136923043325916
Energy: 1.1294585726631838
Energy: 1.3141307939048719
Energy: 1.0902395279101535
Energy: 1.1279932097827736
Energy: 1.2851354760673512
Energy: 1.1088255105841172
Energy: 1.229830721262042
Energy: 1.2853286106078703
Energy: 1.2363761886429283
Energy: 1.0913524781555761
Energy: 1.214920421149587
Energy: 1.1991253257996282
Energy: 1.1710505207078314
Energy: 1.2148901191104058
Energy: 1.1833054577870128
Energy: 1.1711215183214065

minimum gb energy = 0.9817982594717987 eV
minimum distance =  2.25487007639813 Angstroms
sigma value = 17


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

Energy: 1.489213237699074
Energy: 1.2145940549053973
Energy: 1.0221855359900427
Energy: 1.0192972598275156
Energy: 1.214287047865419
Energy: 1.0212908332216126
Energy: 1.202045254658254
Energy: 1.1542543762738509
Energy: 1.1552404585583171
Energy: 1.1413439858389698
Energy: 1.1437925299409322
Energy: 1.020974124924761
Energy: 1.2147526300904137
Energy: 0.905083281177792
Energy: 0.9842938553081327
Energy: 1.2163735464332757
Energy: 0.9062410157737578
Energy: 0.9843559361646473
Energy: 1.0370744848948752
Energy: 0.984128274702807
Energy: 0.9848199087019831
Energy: 1.03587060814098
Energy: 1.1651402785741967
Energy: 0.9839189958343315
Energy: 1.0773060878886676
Energy: 1.0431059801445752
Energy: 0.9461200962788031
Energy: 1.0771113187099581
Energy: 1.1300794167366064
Energy: 0.9611103726404803
Energy: 1.2539809118645242
Energy: 0.9437746782398834
Energy: 0.9979550969743815
Energy: 0.9052796742952846
Energy: 0.9434331597222106
Energy: 0.9992415217982159
Energy: 1.1515294234330482
Energy: 0.9430630751953168
Energy: 0.9430224975483968
Energy: 1.1523020770946344
Energy: 0.9479919585879385
Energy: 1.0124927889004378
Energy: 1.0830719068881316
Energy: 1.032834326759338
Energy: 0.9850865552281971
Energy: 1.0857421773199882
Energy: 1.0293951486605386
Energy: 0.9851099957062018
Energy: 0.8888952108634057
Energy: 0.9649120085804247
Energy: 0.9679040295368282
Energy: 0.8885773572315502
Energy: 1.1322368954767665
Energy: 0.889338808476165
Energy: 0.8869884173302798
Energy: 1.037660283938414
Energy: 1.0394399724629304
Energy: 0.8870986235065673
Energy: 1.037476290657315
Energy: 1.0363101970088404
Energy: 1.1133920434544153
Energy: 0.8867659744085753
Energy: 1.0321641520318097
Energy: 1.0375647520666313
Energy: 0.8871270466858266
Energy: 1.0363545116203512
Energy: 1.1320004464275737
Energy: 0.8878037073589133
Energy: 0.8873511937091506
Energy: 1.126324951340593
Energy: 0.8923342048020669
Energy: 0.9641329396388737
Energy: 0.9426044530686425
Energy: 1.0682498756095753
Energy: 1.0686718807703353
Energy: 1.0204075295084505
Energy: 1.0704860402211125
Energy: 0.976429510257025
Energy: 0.9439132252216557
Energy: 1.069507054889813
Energy: 0.9834023619118222
Energy: 0.9446483443590005
Energy: 1.1248224321639937
Energy: 0.9436568630983879
Energy: 0.9426158041094946
Energy: 1.0540837045135631
Energy: 1.0547191104241749
Energy: 0.9425542935040376
Energy: 1.0772683258607316
Energy: 0.942643020125792
Energy: 1.1247593645459473
Energy: 1.0437211909374013
Energy: 1.0098877753617275
Energy: 1.1240003882886382
Energy: 1.0362379099219003
Energy: 1.0113135271182516
Energy: 1.1138750010263576
Energy: 1.063023448510801
Energy: 1.06382110104827
Energy: 1.137423239280741
Energy: 1.0635298088610032
Energy: 0.9427647313827946
Energy: 1.0334249410197427
Energy: 1.061783624264666
Energy: 1.0619655822438312
Energy: 1.0337682122744118
Energy: 1.219248601398021
Energy: 0.9424410213916318
Energy: 1.1626822653291409
Energy: 1.0619629284221799
Energy: 1.0225616713307568
Energy: 1.1626805129567188
Energy: 1.116315947460981
Energy: 1.0460514114912862
Energy: 1.2959677710810582
Energy: 1.0396904292820273
Energy: 1.0401152534942946
Energy: 1.295270453577169
Energy: 1.0397842871337415
Energy: 1.0616114007810504
Energy: 1.218061194817015
Energy: 1.153558674950651
Energy: 1.06102687455615
Energy: 1.1424087921195956
Energy: 1.1424474466346524
Energy: 1.0635661057209531
Energy: 1.110702795938229
Energy: 1.1563040071229462
Energy: 1.134817674199387
Energy: 1.0498584282766024
Energy: 1.2199508387554665
Energy: 0.9842289824526718
Energy: 1.14995306550562
Energy: 1.1557764963285535
Energy: 1.1557236072769945
Energy: 1.1123934966075475
Energy: 1.1439604570851591
Energy: 1.1337280559877363
Energy: 1.2289799551664635
Energy: 1.0597478515603975
Energy: 1.0642391840503012
Energy: 1.2302893853355517
Energy: 1.1654827685847187
Energy: 1.063944149433997
Energy: 1.0638215826424313
Energy: 0.9972880335881369
Energy: 0.9849184910371358
Energy: 1.0639157178410108
Energy: 0.9074718106626831
Energy: 0.9840527430430398
Energy: 1.0801203905498278
Energy: 1.0434062397974353
Energy: 0.9455148065987822
Energy: 1.081067739254526
Energy: 1.129768902220165
Energy: 1.0110582170877842
Energy: 0.987430371411378
Energy: 1.0404443548979916
Energy: 1.040580361199693
Energy: 0.9661005497722692
Energy: 1.1173562242759414
Energy: 0.9989108594953441
Energy: 1.0629407010539589
Energy: 0.942926550706484
Energy: 0.9428388326087545
Energy: 1.063916305950055
Energy: 0.9444710608447898
Energy: 0.9431919387622686
Energy: 1.0863551646228924
Energy: 1.0399792947084951
Energy: 1.0398210031641013
Energy: 1.0754512544399895
Energy: 0.9453048930539624
Energy: 0.981781666196116
Energy: 0.8881664102108394
Energy: 1.0422402576425938
Energy: 0.9655843826541558
Energy: 0.8881546391743957
Energy: 1.0295463861124692
Energy: 0.9671681975146984
Energy: 0.8941614126106412
Energy: 1.0382386883878545
Energy: 1.0374794154705127
Energy: 0.8887576319116495
Energy: 1.0328959172863224
Energy: 0.9729630808550047
Energy: 1.1102983178691905
Energy: 1.0508106413499392
Energy: 1.0516063913293343
Energy: 1.068152257519925
Energy: 1.0472472445348993
Energy: 1.0508185456339532
Energy: 1.125288720139134
Energy: 0.8872120607733274
Energy: 0.8878980526201737
Energy: 1.1266233904960434
Energy: 0.8883523326850933
Energy: 0.8881695791882166
Energy: 1.2000685494785854
Energy: 0.9644134169872927
Energy: 0.9663691184164885
Energy: 0.9655877700706972
Energy: 0.8857597575888143
Energy: 0.9663135433087204
Energy: 0.9506667779115269
Energy: 1.0753263268046742
Energy: 1.0698303613388753
Energy: 0.9464873575460012
Energy: 1.0697087252510384
Energy: 1.0696728632197283
Energy: 0.9508371264028306
Energy: 0.9648817937853825
Energy: 0.9425769549285352
Energy: 0.9434064213785044
Energy: 0.9656847237509366
Energy: 0.9443945719028202
Energy: 1.1131811441088602
Energy: 1.0274075932960767
Energy: 1.0080595528984901
Energy: 1.1143517326785468
Energy: 1.1514828252395353
Energy: 0.9419491027074216
Energy: 1.1508207006182736
Energy: 1.0620325473761145
Energy: 1.062462505657525
Energy: 1.0502046959583986
Energy: 1.0622733352585263
Energy: 1.0623787799771955
Energy: 1.3488211270671226
Energy: 1.1153265247437016
Energy: 1.0395531698936595
Energy: 0.9432869321937211
Energy: 1.195662126783146
Energy: 1.0393467015327644
Energy: 1.1672799637516014
Energy: 1.061851414213651
Energy: 1.061369480823263
Energy: 1.1603690683776693
Energy: 1.1433305183210294
Energy: 1.0189101504236395
Energy: 1.1509606217184167
Energy: 0.9437368819109104
Energy: 1.0603563531867646
Energy: 1.1472147600666234
Energy: 0.9629482215411957
Energy: 1.0594643762784401
Energy: 1.2274350981688726
Energy: 1.0286749576715575
Energy: 1.0601311449064146
Energy: 1.229248904562524
Energy: 1.1181600775640936
Energy: 1.1556240607995019
Energy: 1.1103844421580744
Energy: 1.1558039573501007
Energy: 1.156194649967894
Energy: 1.1130591241256145
Energy: 1.2148955257983114
Energy: 1.1333571765287171

minimum gb energy = 0.8857597575888143 eV
minimum distance =  2.24675702423853 Angstroms
sigma value = 57


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

Energy: 1.2824637917150365
Energy: 1.1715754926888449
Energy: 0.987407676179421
Energy: 1.0597778650258356
Energy: 1.2545973541512965
Energy: 0.9871762309962195
Energy: 1.1399561606559034
Energy: 1.0772384981651852
Energy: 1.0831047414930286
Energy: 1.089524117461393
Energy: 1.0709120233709146
Energy: 0.9847031252864461
Energy: 1.152768902611074
Energy: 0.9208421212245667
Energy: 0.9308749568374081
Energy: 1.1516582549862087
Energy: 0.9231651508729148
Energy: 0.9535433868214569
Energy: 0.9935661749539885
Energy: 0.9238798022413632
Energy: 0.9536907078222258
Energy: 0.9949502829255563
Energy: 1.011344875084028
Energy: 0.9531944153348814
Energy: 1.0219082408489963
Energy: 1.0024428708516568
Energy: 0.9119253352744456
Energy: 1.0227059801968623
Energy: 1.0792590546581775
Energy: 0.9890650534630862
Energy: 1.1672724676978512
Energy: 0.911328546078104
Energy: 0.957468976140129
Energy: 0.9587537828615974
Energy: 0.9110286240011207
Energy: 0.8667690319336724
Energy: 1.087042803377857
Energy: 0.9239134990556015
Energy: 0.911135742252116
Energy: 1.0581298851366097
Energy: 0.9166094957510341
Energy: 1.006840397143742
Energy: 1.0222453668141005
Energy: 0.9713303291194022
Energy: 0.9714157700704712
Energy: 1.0240785148764178
Energy: 0.9444624837387336
Energy: 0.9462722950031278
Energy: 0.8458100697929174
Energy: 0.9110625499829215
Energy: 0.8444248847267014
Energy: 0.8476394943082403
Energy: 0.960699274536544
Energy: 0.8445879483962482
Energy: 0.8434753885988786
Energy: 0.9859683150070921
Energy: 0.984019789721162
Energy: 0.8434759814464882
Energy: 0.9878839333993333
Energy: 0.9810731169049153
Energy: 1.1030797244634056
Energy: 0.8142377562289304
Energy: 0.9581364974621003
Energy: 0.9532435437077232
Energy: 0.8139984535779536
Energy: 0.9619946708082208
Energy: 1.0390620870188123
Energy: 0.8227717362957438
Energy: 0.8134782273492147
Energy: 1.03933401239272
Energy: 0.8210155586421408
Energy: 0.9600144590893901
Energy: 0.8147229944142879
Energy: 0.9680351134365501
Energy: 0.975520879128494
Energy: 0.8167759512916222
Energy: 0.9592587234129637
Energy: 0.9750981265913529
Energy: 0.8146892746032399
Energy: 0.9715267787752303
Energy: 0.8128059056748594
Energy: 0.8166509903377653
Energy: 1.0389757678482545
Energy: 0.813797244494043
Energy: 0.8129168157139341
Energy: 0.9521985692852903
Energy: 0.9687394244860437
Energy: 0.81294904652906
Energy: 0.9522304607498612
Energy: 0.9652812792497313
Energy: 1.0347178869226215
Energy: 0.847988816051557
Energy: 0.9824900498301614
Energy: 0.9915697726425939
Energy: 0.8537162931948561
Energy: 0.9808805193960852
Energy: 0.9548947607273399
Energy: 0.8451003911991343
Energy: 0.8448176861081252
Energy: 0.9553683029226959
Energy: 0.8524977852437012
Energy: 0.9167981805295822
Energy: 0.9147826819918495
Energy: 1.0146946739152323
Energy: 0.9203289516749918
Energy: 0.9143210220586753
Energy: 1.0140254785845748
Energy: 0.9166976497314103
Energy: 0.9130995788295738
Energy: 0.9877755295443842
Energy: 0.9119745690694409
Energy: 0.9156264609612967
Energy: 1.0591185469309197
Energy: 0.9122375771494653
Energy: 1.0683494931839694
Energy: 0.9467757484842976
Energy: 0.9377736285851449
Energy: 1.0695979680667829
Energy: 0.9400588034637588
Energy: 0.9108513414566397
Energy: 1.0756260249743086
Energy: 1.0090542603111103
Energy: 0.966991373558432
Energy: 1.0818838671306774
Energy: 1.0028465097258832
Energy: 0.9696336695209501
Energy: 1.0011970946824569
Energy: 1.0190486998093327
Energy: 0.9651328336702524
Energy: 0.9772128509705794
Energy: 1.028949698134136
Energy: 0.9118008528427203
Energy: 0.9960190659599742
Energy: 1.0268397956681503
Energy: 1.01823305130718
Energy: 1.0036905408196757
Energy: 1.1372949636263134
Energy: 1.0184355474890392
Energy: 1.0731179784242035
Energy: 1.001099780105982
Energy: 0.9999600854117007
Energy: 1.0660436853709885
Energy: 1.0697124277222398
Energy: 1.0782960492993845
Energy: 1.1545769529111178
Energy: 0.9750925471534966
Energy: 1.002542563105311
Energy: 1.1561557919861156
Energy: 0.9754817620868003
Energy: 1.0177340452631394
Energy: 1.1490622701383897
Energy: 1.0225945960738712
Energy: 1.0182612731101208
Energy: 1.1053139130736789
Energy: 1.1025685507239003
Energy: 1.0199789497452063
Energy: 1.305433963904941
Energy: 1.0892942264946044
Energy: 1.0345310074374117
Energy: 0.9212266898381605
Energy: 1.156452889001004
Energy: 0.9539693225202717

minimum gb energy = 0.8128059056748594 eV
minimum distance =  2.26682372745397 Angstroms
sigma value = 43


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

Energy: 1.169447751237625
Energy: 1.027981137429875
Energy: 0.8962766373927459
Energy: 0.9064172695259075
Energy: 1.028238658191733
Energy: 0.8266994706310523
Energy: 0.9861855225867213
Energy: 0.9380724427981323
Energy: 0.9410972265155679
Energy: 0.955616749616572
Energy: 0.9361881352918154
Energy: 0.8485134344582096
Energy: 1.0042601440797543
Energy: 0.7912322447040623
Energy: 0.7817297781665038
Energy: 0.9535866161896316
Energy: 0.8438784054108365
Energy: 0.7816096709628741
Energy: 0.8792208125758665
Energy: 0.798121598321615
Energy: 0.7843108383460513
Energy: 0.8800760152252025
Energy: 0.8501662066162464
Energy: 0.8531609001887648
Energy: 0.9292088236348429
Energy: 0.8882928634213777
Energy: 0.8167078589709054
Energy: 0.9293918272136457
Energy: 0.9341902658795099
Energy: 0.8483222545168125
Energy: 1.0907686385919546
Energy: 0.8163493038505616
Energy: 0.8484275054582234
Energy: 0.8225869502251921
Energy: 0.8159129808255701
Energy: 0.7830645596333677
Energy: 0.9230601200104372
Energy: 0.8162430299120553
Energy: 0.8161737113486092
Energy: 0.9220517743814622
Energy: 0.8198975783028574
Energy: 0.8771433825333963
Energy: 0.9008785389126301
Energy: 0.8212962596735928
Energy: 0.7781583452073516
Energy: 0.9022582513831691
Energy: 0.8228116706442525
Energy: 0.7788828723633101
Energy: 0.7593411361738113
Energy: 0.8241849687397966
Energy: 0.757462602578174
Energy: 0.7613171690233024
Energy: 0.9060561638469405
Energy: 0.7579310390446575
Energy: 0.7597814199752131
Energy: 0.8719556390245605
Energy: 0.8396657604733022
Energy: 0.759860344491396
Energy: 0.867570765013659
Energy: 0.8462821999861366
Energy: 0.9692920325616474
Energy: 0.7192924111685619
Energy: 0.7831837589680347
Energy: 0.8102425384949588
Energy: 0.7194121766314964
Energy: 0.8235252560470794
Energy: 0.899457115941398
Energy: 0.7192305829978394
Energy: 0.718943970658193
Energy: 0.9019106025856449
Energy: 0.7201251766834006
Energy: 0.8480366930497945
Energy: 0.8962986880915214
Energy: 0.8091103042075882
Energy: 0.8116401367796322
Energy: 0.8988327440102921
Energy: 0.8098846384059343
Energy: 0.8053136630087318
Energy: 0.6962598114398834
Energy: 0.8881826781533649
Energy: 0.6954176821377541
Energy: 0.6984169780577391
Energy: 0.8882663223683812
Energy: 0.6959226778471841
Energy: 0.696069047442306
Energy: 0.7995335851607273
Energy: 0.7933037585302206
Energy: 0.6960117609573478
Energy: 0.8371318231009157
Energy: 0.797841039285278
Energy: 0.7908886848735905
Energy: 0.6828351070810883
Energy: 0.6852360634576374
Energy: 0.8178144260290424
Energy: 0.6828097026587625
Energy: 0.8214492468082112
Energy: 0.8829594029999307
Energy: 0.6844973773892665
Energy: 0.6842133379310299
Energy: 0.8827234149557824
Energy: 0.6847381809352601
Energy: 0.8202363441172124
Energy: 0.8851802236413319
Energy: 0.8025853741977638
Energy: 0.7942802634066155
Energy: 0.793051010207007
Energy: 0.8024318871596795
Energy: 0.7905239509066733
Energy: 0.6851113667169766
Energy: 0.8827382986148523
Energy: 0.6844669364315312
Energy: 0.6860520779487427
Energy: 0.8876034445484554
Energy: 0.6849007479483442
Energy: 0.8868309003756982
Energy: 0.7994681055845922
Energy: 0.802810734471337
Energy: 0.8890135453913334
Energy: 0.8005657340886071
Energy: 0.7944055575225086
Energy: 0.8923982433095652
Energy: 0.6954156475461462
Energy: 0.6954764938624229
Energy: 0.8679167276341312
Energy: 0.6955459920269029
Energy: 0.8281522733873148
Energy: 0.8881350086808336
Energy: 0.6960284201915646
Energy: 0.6965377951203808
Energy: 0.82393873111644
Energy: 0.6955354980830475
Energy: 0.8240698843008658
Energy: 0.7205828412732471
Energy: 0.8496230228530708
Energy: 0.8479656013179674
Energy: 0.7206516529672673
Energy: 0.8513999271201388
Energy: 0.812622109072468
Energy: 0.720150183533962
Energy: 0.8994306246823578
Energy: 0.7193045735394644
Energy: 0.7221518275422995
Energy: 0.8995089323566676
Energy: 0.7193949015763199
Energy: 0.9040506958874104
Energy: 0.8190376309189399
Energy: 0.8154083268547555
Energy: 0.9052497769266237
Energy: 0.8162613763161832
Energy: 0.81541919537345
Energy: 0.9191692079543142
Energy: 0.7586368439237035
Energy: 0.7584951765680298
Energy: 0.899897910220711
Energy: 0.758980418936528
Energy: 0.8672056198433836
Energy: 0.9265617115773903
Energy: 0.7580438480710211
Energy: 0.7576387987120545
Energy: 0.8185668421917898
Energy: 0.7578204467762305
Energy: 0.8518839588432733
Energy: 0.8579106389647176
Energy: 0.8957811938487523
Energy: 0.8016561770019041
Energy: 0.8579863372223671
Energy: 0.8935401670184354
Energy: 0.8350141892913286
Energy: 0.818367612375578
Energy: 0.8061466288640942
Energy: 0.8174598626903067
Energy: 0.820590570436164
Energy: 0.9189393768739964
Energy: 0.8178538377001658
Energy: 0.9409190787307994
Energy: 0.777102697628204
Energy: 0.8077374331592765
Energy: 0.9322224440119808
Energy: 0.774108146833021
Energy: 0.8019832732895944
Energy: 0.9370986560531557
Energy: 0.8818610778106347
Energy: 0.8838945506045529
Energy: 0.9363157726756551
Energy: 0.8802322292069433
Energy: 0.8626951798386677
Energy: 1.1303233386412046
Energy: 0.8991525606041113
Energy: 0.817128580519525
Energy: 0.8364057821937492
Energy: 0.8989898588394349
Energy: 0.7765367655870197
Energy: 0.9276666694942204
Energy: 0.900119697621162
Energy: 0.8997208659254883
Energy: 0.9275994553999461
Energy: 0.9605982417046488
Energy: 0.8993899656748182
Energy: 0.9339027988107772
Energy: 0.8247564007187151
Energy: 0.8189745541422341
Energy: 0.9346742527380435
Energy: 0.8862979051148508
Energy: 0.8998185547034219
Energy: 1.0037833579494602
Energy: 0.8248530059773374
Energy: 0.8210562990885628
Energy: 0.9522406589983977
Energy: 0.8166404646467063
Energy: 0.8200970599596472
Energy: 0.986078058380268
Energy: 0.9537618896672694
Energy: 0.9590985037098594
Energy: 0.9556339678461561
Energy: 0.9571163210444588
Energy: 0.8997544951633434

minimum gb energy = 0.6828097026587625 eV
minimum distance =  2.23726172055716 Angstroms
sigma value = 81


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

Energy: 0.07898386445062207
Energy: 0.13087149394646416
Energy: 0.07987666798894467
Energy: 0.08195319044799267
Energy: 0.1308920464597458
Energy: 0.07978332752169856
Energy: 0.13361553704568205
Energy: 0.08026398977377619
Energy: 0.08058443412401682
Energy: 0.13476448135255456
Energy: 0.0849986941341746
Energy: 0.08141314791063807
Energy: 0.4052111859744587
Energy: 0.07964571905931189
Energy: 0.07958553369237431
Energy: 0.40830958053462596
Energy: 0.07941557894072201
Energy: 0.13131651206951672
Energy: 0.08351379592104058
Energy: 0.07960228988976865
Energy: 0.07929614371716309
Energy: 0.08596240270458048
Energy: 0.07954349582734493
Energy: 0.13225439274817918
Energy: 0.1312311114943664
Energy: 0.40935635637687656
Energy: 0.13262223005495805
Energy: 0.13283568069076757
Energy: 0.40137123784234835
Energy: 0.1329008128945896
Energy: 0.08028237768963795
Energy: 0.0804600443304703
Energy: 0.07954544793292938
Energy: 0.08233411134385235
Energy: 0.08016451453582661
Energy: 0.07948773442498802
Energy: 0.13213023269893154
Energy: 0.08060516597161602
Energy: 0.08077310531005559
Energy: 0.13296427309306325
Energy: 0.08507462904408307
Energy: 0.0803970360033061
Energy: 0.4187190890387337
Energy: 0.07948241146403189
Energy: 0.07945309427603142
Energy: 0.1305756600525243
Energy: 0.07965553510873408
Energy: 0.13269864761554134
Energy: 0.08249511702886635
Energy: 0.07951465696632176
Energy: 0.13314914387356674
Energy: 0.0836254453223736
Energy: 0.07952941938707653
Energy: 0.13456305841022556
Energy: 0.07959961622514879
Energy: 0.40873846177468165
Energy: 0.13224138192202364
Energy: 0.07943994071852538
Energy: 0.40100848862623123
Energy: 0.132098090074865

minimum gb energy = 0.07898386445062207 eV
minimum distance =  2.46198166490367 Angstroms
sigma value = 3


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

Energy: 0.9609490376208504
Energy: 1.0999208754798298
Energy: 0.9927469021803647
Energy: 0.8436749213466039
Energy: 1.0998091258931797
Energy: 0.9396328783578232
Energy: 1.006552491401967
Energy: 1.0062371136759989
Energy: 0.9928284526166303
Energy: 1.006553086304692
Energy: 1.0125658058091913
Energy: 0.901807574532384
Energy: 1.010921841883298
Energy: 0.8679108293759229
Energy: 0.895794555116166
Energy: 1.011201856772745
Energy: 0.8677715449724478
Energy: 0.9418414281438965
Energy: 0.906646170131437
Energy: 0.8951979484343018
Energy: 0.8963389209123995
Energy: 0.9086613396072448
Energy: 0.885665552988919
Energy: 0.9412948675350584
Energy: 0.8132694766702332
Energy: 1.006534005556778
Energy: 0.9516981225024855
Energy: 0.8127608984189927
Energy: 1.0109032256235713
Energy: 0.9501075415833602
Energy: 0.9174342171701325
Energy: 0.9784236898842653
Energy: 0.936386169672536
Energy: 0.8545548827599224
Energy: 1.0064718781012723
Energy: 0.8460132723527116
Energy: 0.9197112088220256
Energy: 0.9064818729923456
Energy: 0.875906520296452
Energy: 0.8984129282351521
Energy: 0.8093533948450412
Energy: 0.886736672755078
Energy: 0.9063913548579179
Energy: 0.8720424224158552
Energy: 0.8589451790441497
Energy: 0.9063062265355064
Energy: 0.8682612644779202
Energy: 0.8262329039225573
Energy: 0.8946763892164058
Energy: 0.8719846190738135
Energy: 0.9303414303194166
Energy: 0.8942657414045457
Energy: 0.7393413235106748
Energy: 0.8782929961520637
Energy: 0.7422048330224432
Energy: 0.8123786148929844
Energy: 0.8125359138786513
Energy: 0.742326108205489
Energy: 0.81811085021185
Energy: 0.8130441811874526
Energy: 0.7883985778590336
Energy: 0.8897955113804581
Energy: 0.8891704231148544
Energy: 0.8628803725508694
Energy: 0.8755291424385581
Energy: 0.8638250091090383
Energy: 0.745030160415398
Energy: 0.8950779302053009
Energy: 0.8981913125353825
Energy: 0.7452708288344833
Energy: 0.8792128050656246
Energy: 0.7434272736307603
Energy: 0.7524863880804138
Energy: 0.8453913268094232
Energy: 0.8641152776607909
Energy: 0.749502411197443
Energy: 0.8487891523945966
Energy: 0.820354104628273
Energy: 0.8557128325236188
Energy: 0.7107255133643543
Energy: 0.8584057836960463
Energy: 0.8440965647010094
Energy: 0.710751114305587
Energy: 0.8602726875525118
Energy: 0.8476096266478393
Energy: 0.723003611298659
Energy: 0.7230850719455127
Energy: 0.8476178747283398
Energy: 0.7224329716161073
Energy: 0.7232844667141767
Energy: 0.7742570366033145
Energy: 0.840870392221608
Energy: 0.844062451390305
Energy: 0.8480780636067325
Energy: 0.8524950559539435
Energy: 0.84173443361
Energy: 0.6937699240280454
Energy: 0.8469656816005345
Energy: 0.8483664521781882
Energy: 0.6943572138464547
Energy: 0.843315953108488
Energy: 0.6948213891244611
Energy: 0.6930388698543932
Energy: 0.838126265661625
Energy: 0.8420578815047313
Energy: 0.6931023418965355
Energy: 0.8375888751548055
Energy: 0.8400140576270417
Energy: 0.9215556539281187
Energy: 0.846742411355679
Energy: 0.8353627991169356
Energy: 0.8377877970020755
Energy: 0.8487807846918409
Energy: 0.8353782983911526
Energy: 0.8390678084055408
Energy: 0.6970399056758291
Energy: 0.6966198328577027
Energy: 0.8413429554946308
Energy: 0.7016938398994867
Energy: 0.7018405237565868
Energy: 0.8519485522124446
Energy: 0.8404431646194489
Energy: 0.8445233664716678
Energy: 0.8540066088921344
Energy: 0.864030783150866
Energy: 0.8409988334241019
Energy: 0.7162860025264821
Energy: 0.8441218933508495
Energy: 0.857051666409341
Energy: 0.717652295869253
Energy: 0.8624645644147919
Energy: 0.7133938833956368
Energy: 0.7098129692449978
Energy: 0.8452717889370065
Energy: 0.8451915454877563
Energy: 0.7098159961097108
Energy: 0.8471181356295582
Energy: 0.8476312436350772
Energy: 0.9311430603749018
Energy: 0.7486974914720597
Energy: 0.7537556191490548
Energy: 0.8580086724738497
Energy: 0.7487551104962901
Energy: 0.8518331684113368
Energy: 0.8680254229517926
Energy: 0.7468770391462459
Energy: 0.7447439733436952
Energy: 0.8700785358252282
Energy: 0.7460778599851688
Energy: 0.7461575868779462
Energy: 0.8837312223211784
Energy: 0.867976645998553
Energy: 0.8684312987918549
Energy: 0.8656870471139486
Energy: 0.8543829504363074
Energy: 0.8879143478259752
Energy: 0.8121314847203325
Energy: 0.8704655111004267
Energy: 0.8706723799142755
Energy: 0.814133781203885
Energy: 0.8005859040843176
Energy: 0.8108382763688873
Energy: 0.7623920584927223
Energy: 0.9320300858399643
Energy: 0.8789284645826375
Energy: 0.7625244114899049
Energy: 0.8936966607062103
Energy: 0.8796232019812573
Energy: 0.9289283377475134
Energy: 0.9059382655389125
Energy: 0.8794202886661361
Energy: 0.8664325532981771
Energy: 0.9060959936242402
Energy: 0.8145001370424153
Energy: 0.899654143901245
Energy: 0.906055765149549
Energy: 0.9054106585790255
Energy: 0.8942723638111735
Energy: 0.9196215139460987
Energy: 0.8873388761040196
Energy: 1.0057998037981826
Energy: 0.871011349851086
Energy: 0.8710226658292903
Energy: 0.9787384754716549
Energy: 0.8612078857872374
Energy: 0.8600070174840749
Energy: 1.0085113541292468
Energy: 0.8878391959995005
Energy: 0.914230817009007
Energy: 1.0111362165469662
Energy: 0.8209678266065054
Energy: 0.950508660548044
Energy: 0.8599093472073407
Energy: 0.9959677402336916
Energy: 0.9950079435505624
Energy: 0.859730360833028
Energy: 0.9963783162316052
Energy: 1.0188202595831213

minimum gb energy = 0.6930388698543932 eV
minimum distance =  2.29861927306583 Angstroms
sigma value = 67


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

Energy: 1.2186119430414855
Energy: 1.2460153589349914
Energy: 1.1377772497846597
Energy: 1.2208798950704303
Energy: 1.2461676132549215
Energy: 1.1438867484667965
Energy: 1.150073653117596
Energy: 1.1024019648526628
Energy: 1.1011172113674554
Energy: 1.157166434292574
Energy: 1.147622598381999
Energy: 1.1055080688921832
Energy: 1.1487208281979473
Energy: 1.0705165504005458
Energy: 1.0839088187451469
Energy: 1.149885564060221
Energy: 1.0906896353019468
Energy: 1.084466498667414
Energy: 1.123003220737494
Energy: 1.0841372587556322
Energy: 1.084409824644979
Energy: 1.089267846517433
Energy: 1.0183866124506036
Energy: 1.0853578119076814
Energy: 1.0173399706096107
Energy: 1.1263481092653087
Energy: 1.120890290712187
Energy: 1.0174749368088694
Energy: 1.1464070576762926
Energy: 1.1171186272314255
Energy: 1.0964746932347214
Energy: 1.1187888805158712
Energy: 1.0554097077440139
Energy: 1.0187982324993685
Energy: 1.118462245571682
Energy: 1.0564021924007587
Energy: 1.0167897111903406
Energy: 1.0112778626052077
Energy: 1.1235841998766491
Energy: 1.017258903358409
Energy: 0.9937626348048303
Energy: 1.0163646359563279
Energy: 1.0140113052311233
Energy: 1.0054537736356073
Energy: 1.0258993670202199
Energy: 1.0153488102764963
Energy: 1.022169184040955
Energy: 1.0053207506238186
Energy: 1.0373237339391825
Energy: 1.0478780613253884
Energy: 1.0560209269971323
Energy: 1.0397058284766838
Energy: 0.9069601081859602
Energy: 1.0509791027225108
Energy: 1.0275483749187304
Energy: 0.9111341007258833
Energy: 0.9063546668636676
Energy: 1.0289094964828105
Energy: 0.9087821451743323
Energy: 0.9053374033009565
Energy: 0.8603133350225481
Energy: 1.0124964971447974
Energy: 1.0112827716610873
Energy: 1.0049397747199778
Energy: 1.0166929356298566
Energy: 1.013120959746644
Energy: 0.8651406565025026
Energy: 1.0192923243655807
Energy: 1.0192638349795535
Energy: 0.8627470765012856
Energy: 1.010184812807387
Energy: 0.8597019835129397
Energy: 0.8628873257874896
Energy: 1.0172230671957907
Energy: 1.0160670112101522
Energy: 0.8609404215644911
Energy: 1.0134952600424068
Energy: 0.9381500303537353
Energy: 1.0220881064374416
Energy: 0.9957328302043107
Energy: 0.9921193787741824
Energy: 0.9933345743509095
Energy: 0.932131787677996
Energy: 0.99144450417462
Energy: 0.9938809373645732
Energy: 0.8630954487469585
Energy: 0.8579272076437356
Energy: 0.9931171870780405
Energy: 0.8600308152927488
Energy: 0.8566634040408035
Energy: 1.016228663930569
Energy: 1.013056034311838
Energy: 1.0074915223343224
Energy: 1.0162522953293125
Energy: 0.8619067778407189
Energy: 1.0061780820275394
Energy: 0.9041712621719428
Energy: 0.9913376598296989
Energy: 1.0053609036202467
Energy: 0.9059304086460127
Energy: 1.0032992585214753
Energy: 0.9027822783749202
Energy: 0.9096715233471865
Energy: 1.0493145005140416
Energy: 1.052729260970318
Energy: 0.9104314177580859
Energy: 1.0314299927884318
Energy: 0.9957305560403946
Energy: 1.0706318339998586
Energy: 1.0529637774796803
Energy: 0.9878823071539086
Energy: 1.0243632779060945
Energy: 1.052225180211352
Energy: 0.987589533051268
Energy: 0.9992917940944426
Energy: 1.011206809220677
Energy: 1.0137518890013872
Energy: 0.9994152487502955
Energy: 1.0163015184809405
Energy: 1.0101850055241932
Energy: 1.1060248067933403
Energy: 1.0700366240583523
Energy: 1.0408221805043723
Energy: 1.1059342653810313
Energy: 1.0517908813508967
Energy: 1.0697812652903387
Energy: 1.1485091814197208
Energy: 1.0208289250641978
Energy: 1.0699292443983022
Energy: 1.1495305152358863
Energy: 1.04233004406161
Energy: 1.012484466589083
Energy: 1.085370460262485
Energy: 1.1269061073985749
Energy: 1.121090160136731
Energy: 1.0851013063996287
Energy: 1.1222708871667004
Energy: 1.1198424908997855

minimum gb energy = 0.8566634040408035 eV
minimum distance =  2.26326509144398 Angstroms
sigma value = 33


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

Energy: 1.4047971051512071
Energy: 1.3505925827066285
Energy: 1.2635582741495348
Energy: 1.4075918958060345
Energy: 1.3504387445552806
Energy: 1.1933975683507252
Energy: 1.1812558601276384
Energy: 1.1781328148019539
Energy: 1.1768938735036472
Energy: 1.179615833019556
Energy: 1.2144124986997844
Energy: 1.1766824324097414
Energy: 1.211662893629512
Energy: 1.1798888300742787
Energy: 1.180122194451888
Energy: 1.2131913019415692
Energy: 1.1781394412254018
Energy: 1.1732509418028616
Energy: 1.176123342697498
Energy: 1.1802688017920355
Energy: 1.180432628586669
Energy: 1.1771672378159916
Energy: 1.1427393395175311
Energy: 1.179947067648759
Energy: 1.0534684703968775
Energy: 1.1773971251319553
Energy: 1.1762738254632472
Energy: 1.0538712217629918
Energy: 1.213896168718518
Energy: 1.1744846305115044
Energy: 1.3008250089933684
Energy: 1.1942547783624016
Energy: 1.18933805441639
Energy: 1.2579874193782923
Energy: 1.1940812612171015
Energy: 1.1060987009060235
Energy: 1.0634828135853425
Energy: 1.1760262795608463
Energy: 1.175756547867033
Energy: 1.0639271236666303
Energy: 1.15579852588962
Energy: 1.0616830469564182
Energy: 1.0502483391426274
Energy: 1.1146855039289918
Energy: 1.1152805322919854
Energy: 1.0517451286297397
Energy: 1.1149789960462195
Energy: 1.0501643882407365
Energy: 1.1071532706751948
Energy: 1.1081042397039294
Energy: 1.113951755321182
Energy: 1.1013138910722007
Energy: 0.9640404670898871
Energy: 1.1097419654343421
Energy: 1.0952733941658628
Energy: 0.9578922332221409
Energy: 0.9553305961257809
Energy: 1.0973415009724008
Energy: 0.9577781122022254
Energy: 0.9560676835242511
Energy: 1.0201924575702634
Energy: 1.0851816804305994
Energy: 1.0853855973889783
Energy: 1.0825152322606244
Energy: 1.0210688073375553
Energy: 1.0847590505258944
Energy: 0.9552362446187727
Energy: 1.1165245813463023
Energy: 1.051616036732113
Energy: 0.9553074168164789
Energy: 1.0968928557121447
Energy: 0.9564122238661964
Energy: 0.9633860181301012
Energy: 1.1133577841315796
Energy: 1.1156368943763937
Energy: 0.9634200669379971
Energy: 1.0997922901919652
Energy: 0.9637075497857427
Energy: 1.1730260278614657
Energy: 1.1144544717549947
Energy: 1.108640697935056
Energy: 1.1054152447200682
Energy: 1.1265655452000425
Energy: 1.03651303798208
Energy: 1.0323547369090296
Energy: 1.051752128722121
Energy: 1.051696819756746
Energy: 1.0325046615709577
Energy: 1.0554768083411294
Energy: 1.0612051229322823
Energy: 1.1456747070525592
Energy: 1.128223011927792
Energy: 1.1284507737091962
Energy: 1.1456568850459496
Energy: 0.9929603024755898
Energy: 1.1642051938746163
Energy: 1.217801478867611
Energy: 1.1310939895414103
Energy: 1.12935117629036
Energy: 1.2193867248821884
Energy: 1.1310857415216775
Energy: 1.131354451907857
Energy: 1.2157564094539013
Energy: 1.1773832522926007
Energy: 1.177204623640197
Energy: 1.1798943725545896
Energy: 1.179962744338084
Energy: 1.1823680021799865
Energy: 1.40353634453761
Energy: 1.1770963806528825
Energy: 1.2735057318398424
Energy: 1.1296043338067507
Energy: 1.1780542249619799
Energy: 1.1315627567359454
Energy: 1.1231746529829876
Energy: 1.1779207803516165
Energy: 1.1764370081301696
Energy: 1.12473408017094
Energy: 1.2144173566105771
Energy: 1.1767465232872567
Energy: 1.2096932858792482
Energy: 1.1788295693576767
Energy: 1.1793016385964388
Energy: 1.2111588678285001
Energy: 1.1585714620268002
Energy: 1.1730916812367052
Energy: 1.1755025110391812
Energy: 1.179942303105015
Energy: 1.1802639961586099
Energy: 1.1769982896088589
Energy: 1.1799939479968284
Energy: 1.1808322035627106
Energy: 1.06156239058489
Energy: 1.1767764880292215
Energy: 1.1777505022393342
Energy: 1.0523328882748142
Energy: 1.2150035859790702
Energy: 1.1754040997805966
Energy: 1.3030524548725144
Energy: 1.1941978540768645
Energy: 1.1906929773396984
Energy: 1.3038302467458391
Energy: 1.1939326056124921
Energy: 1.106601040238647
Energy: 1.064001569097398
Energy: 1.176130010274937
Energy: 1.1757064865691027
Energy: 1.0643507418643363
Energy: 1.1578820484064172
Energy: 1.1587785418856917
Energy: 1.0497547514494485
Energy: 1.1077641399834826
Energy: 1.1088230652319941
Energy: 1.050800094302546
Energy: 1.1076972861413692
Energy: 1.0503728161708483
Energy: 1.10937012024562
Energy: 1.1078204409727868
Energy: 1.1085431537651829
Energy: 1.1110029169766842
Energy: 0.9562339885346726
Energy: 1.1157917971109899
Energy: 1.0912162663659104
Energy: 0.9565608704988199
Energy: 0.9556708949529633
Energy: 1.0973029935656393
Energy: 0.9597880165625919
Energy: 0.9563281902264124
Energy: 1.1517832869691718
Energy: 1.0347823581469426
Energy: 1.0835488483317643
Energy: 1.0826081665097245
Energy: 1.0233284659945507
Energy: 1.088193231958041
Energy: 0.9554000679496849
Energy: 1.0937445687574863
Energy: 1.1097141805670383
Energy: 0.9553830291811056
Energy: 1.097590284067392
Energy: 1.0509111343166497
Energy: 0.9693627529777102
Energy: 1.1221860873200002
Energy: 1.0532015769457206
Energy: 0.970081189186567
Energy: 1.1068039414160316
Energy: 0.9557309032362755
Energy: 1.036797387431946
Energy: 1.1263779802483143
Energy: 1.1255716239873539
Energy: 1.105641604617307
Energy: 1.1258504233714404
Energy: 1.1060664488618566
Energy: 1.0362313101908671
Energy: 1.053049106737111
Energy: 1.051583620637309
Energy: 1.0324020317826375
Energy: 1.0537144602107527
Energy: 1.0609616240184139
Energy: 1.0423402253079495
Energy: 1.128786053757912
Energy: 1.16330935927097
Energy: 1.043520327747794
Energy: 0.9793611606330038
Energy: 1.164106820192979
Energy: 1.2202406064542664
Energy: 1.1299774100628839
Energy: 1.1293606910375624
Energy: 1.2207732081457627
Energy: 1.1056680269802697
Energy: 1.1320565714338278
Energy: 1.218548909136601
Energy: 1.1741824874609514
Energy: 1.1766904146903403
Energy: 1.1793511561467274
Energy: 1.1763960427522262
Energy: 1.177134553283021
Energy: 1.3408989311857131
Energy: 1.176973774484574
Energy: 1.2274222683332183
Energy: 1.1951273927370256
Energy: 1.1785690325658726
Energy: 1.131604759427659

minimum gb energy = 0.9552362446187727 eV
minimum distance =  2.25879665264647 Angstroms
sigma value = 41


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

Energy: 1.3504269414254155
Energy: 1.4826730132320296
Energy: 1.342652742817087
Energy: 1.3516500019853388
Energy: 1.482926815165473
Energy: 1.3342909133041085
Energy: 1.2836741253628543
Energy: 1.224706195173338
Energy: 1.2198108840700246
Energy: 1.2220890013304233
Energy: 1.2892575675768114
Energy: 1.2189388677895299
Energy: 1.311163662634872
Energy: 1.2627887282789259
Energy: 1.2971158332545734
Energy: 1.3126114882634825
Energy: 1.2977047768903252
Energy: 1.2295574179472137
Energy: 1.255468519899992
Energy: 1.258042765803601
Energy: 1.2582969328903029
Energy: 1.256757929760977
Energy: 1.3427615598600908
Energy: 1.2205876004939606
Energy: 1.1072083092349536
Energy: 1.2259711640336153
Energy: 1.2188572230597925
Energy: 1.106875460132031
Energy: 1.2850101711334188
Energy: 1.240444568204683
Energy: 1.2750099813153601
Energy: 1.2623650088933671
Energy: 1.2902237426660417
Energy: 1.276535649018776
Energy: 1.2629898811517848
Energy: 1.273228553376587
Energy: 1.1070840704172704
Energy: 1.2306889690148808
Energy: 1.235689082816532
Energy: 1.1062150484538815
Energy: 1.231168354368946
Energy: 1.1049594124908964
Energy: 1.1102102628319297
Energy: 1.2196841196226953
Energy: 1.1082357824678553
Energy: 1.1117420844488786
Energy: 1.214236598557862
Energy: 1.1048984223403238
Energy: 1.2267705128493096
Energy: 1.218041183511131
Energy: 1.212456656692497
Energy: 1.2040620513472957
Energy: 1.1395182459229374
Energy: 1.212716443197619
Energy: 1.1467563139671326
Energy: 1.1118464221348743
Energy: 1.1056364090724153
Energy: 1.1471152319163112
Energy: 1.1061872496581406
Energy: 1.1478645248167851
Energy: 1.2536362000598842
Energy: 1.210043954073516
Energy: 1.2069762510634874
Energy: 1.2537643570333756
Energy: 1.0526701922972748
Energy: 1.2408554775306604
Energy: 1.3122565649017177
Energy: 1.1898521803881599
Energy: 1.1890511681787506
Energy: 1.3134197470073046
Energy: 1.2171942704761989
Energy: 1.2478954715888173
Energy: 1.3099948929227105
Energy: 1.2206988898366473
Energy: 1.220098450818085
Energy: 1.221412131718736
Energy: 1.2266282404603908
Energy: 1.2188698606142945
Energy: 1.3540270260079061
Energy: 1.2391629810930738
Energy: 1.3321024258249774
Energy: 1.336450457458831
Energy: 1.2400268236964467
Energy: 1.3083045804337017

minimum gb energy = 1.0526701922972748 eV
minimum distance =  2.30187911868252 Angstroms
sigma value = 11


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

Energy: 1.6403498610886922
Energy: 1.7667157284029318
Energy: 1.5569121718841765
Energy: 1.64282983482261
Energy: 1.7666706667325776
Energy: 1.382900333898794
Energy: 1.4829498599563007
Energy: 1.3507673539036713
Energy: 1.2137561533598853
Energy: 1.3161827485469417
Energy: 1.3519433264858167
Energy: 1.2361790293615424
Energy: 1.532909310761167
Energy: 1.3317781373973892
Energy: 1.3328767047447205
Energy: 1.5347976701463713
Energy: 1.3350121002243496
Energy: 1.4315361647132685
Energy: 1.3513535036036517
Energy: 1.383700446562753
Energy: 1.3451716584040672
Energy: 1.3529311299026832
Energy: 1.3389718815957015
Energy: 1.3455016086085223
Energy: 1.2745544381987017
Energy: 1.2126271939512758
Energy: 1.2124813637814942
Energy: 1.2756063633964603
Energy: 1.2126776762553386
Energy: 1.2133694524337277
Energy: 1.3635963948412557
Energy: 1.238112492019318
Energy: 1.2995912811614387
Energy: 1.3650652953783329
Energy: 1.2413069070052671
Energy: 1.3042042840163117
Energy: 1.2369748260422997
Energy: 1.3048800746729148
Energy: 1.3048418678531482
Energy: 1.238670806273536
Energy: 1.33280140168047
Energy: 1.298367675822499
Energy: 1.2280203669667555
Energy: 1.2746523502703941
Energy: 1.2330891788024503
Energy: 1.2282774053042556
Energy: 1.278667818339413
Energy: 1.2315809591599591
Energy: 1.2302338011200995
Energy: 1.337667207004747
Energy: 1.3443333849004115
Energy: 1.3242620685124828
Energy: 1.3374707397076493
Energy: 1.382890609357025
Energy: 1.229059026706818
Energy: 1.352814672002054
Energy: 1.3685960722446204
Energy: 1.2747029124641935
Energy: 1.415150872559866
Energy: 1.3833431973880244
Energy: 1.3207976783289344
Energy: 1.3262818806211465
Energy: 1.3551049261056798
Energy: 1.3178065221723285
Energy: 1.2670677047381929
Energy: 1.2816067479566187
Energy: 1.4380715321738797
Energy: 1.4268986581287009
Energy: 1.4314671368617806
Energy: 1.4389881827366608
Energy: 1.5648862378461363
Energy: 1.4512054586882803
Energy: 1.2920029917283193
Energy: 1.3212401807645744
Energy: 1.3498328764335248
Energy: 1.2920564500642981
Energy: 1.2767531442846227
Energy: 1.396296165464004
Energy: 1.440938420677477
Energy: 1.3480062994939541
Energy: 1.3892801797785503
Energy: 1.3948987641277026
Energy: 1.3480296555582147
Energy: 1.369193767054959
Energy: 1.200610283374914
Energy: 1.360879196648462
Energy: 1.3541523419679617
Energy: 1.2006075532725449
Energy: 1.3608800014611295
Energy: 1.3563125985103428
Energy: 1.2017640518251775
Energy: 1.2944664682855396
Energy: 1.3343426231715265
Energy: 1.2004748722210041
Energy: 1.2791832275249637
Energy: 1.1999617140449912
Energy: 1.2017077123315465
Energy: 1.3194613409475153
Energy: 1.3198485071285748
Energy: 1.2018846562634826
Energy: 1.3244356058537043
Energy: 1.3209304172492145
Energy: 1.3963937477192168
Energy: 1.29510726357653
Energy: 1.2954785787434928
Energy: 1.3945934061394054
Energy: 1.2955819455291095
Energy: 1.2876162738675965
Energy: 1.2716813481213836
Energy: 1.2837453746934646
Energy: 1.3180505318953446
Energy: 1.271029194658928
Energy: 1.2691666126443053
Energy: 1.3231557146033144
Energy: 1.4316430784714047
Energy: 1.3687986183430323
Energy: 1.3861388450649506
Energy: 1.4318923628359796
Energy: 1.3677249553980866
Energy: 1.4739429715292973
Energy: 1.3080755182166393
Energy: 1.2673592588780114
Energy: 1.3040562977799606
Energy: 1.3077450818777034
Energy: 1.2668488005829752
Energy: 1.262055664845538
Energy: 1.3164413997524091
Energy: 1.3361176145657672
Energy: 1.3375331650047124
Energy: 1.2944704883250693
Energy: 1.3390151711616933
Energy: 1.3369297996238398
Energy: 1.5746650113150975
Energy: 1.3456864226942735
Energy: 1.4516463821580448
Energy: 1.470060556462769
Energy: 1.3459002393300734
Energy: 1.4454624489503125
Energy: 1.354175054526558
Energy: 1.270467907451985
Energy: 1.3222805511194502
Energy: 1.2965824508634738
Energy: 1.2655817492185018
Energy: 1.3212392680424037
Energy: 1.311214724453414
Energy: 1.2634081390342438
Energy: 1.2901935982092367
Energy: 1.3069650499395107
Energy: 1.349225004083032
Energy: 1.2982700972004098
Energy: 1.2864263586945688
Energy: 1.2023626110888297
Energy: 1.3216404943277253
Energy: 1.325194202939812
Energy: 1.2024314986574918
Energy: 1.32268803989725
Energy: 1.2683277991810435
Energy: 1.1996845112391976
Energy: 1.2002268132686236
Energy: 1.2709144336068068
Energy: 1.2004361121846592
Energy: 1.30979334452255
Energy: 1.3484180233399148
Energy: 1.2048997590620676
Energy: 1.356595386424467
Energy: 1.36151945044846
Energy: 1.200726551546988
Energy: 1.3569904336840561
Energy: 1.3709577475162047
Energy: 1.3202278837229307
Energy: 1.31979178164896
Energy: 1.3710545151248206
Energy: 1.381175411015755
Energy: 1.3376184920094305
Energy: 1.4775866931818744
Energy: 1.2317934535744213
Energy: 1.2135516959849055
Energy: 1.276670916361965
Energy: 1.350788668581527
Energy: 1.3574160144397733
Energy: 1.6393990110673446
Energy: 1.520514574673637
Energy: 1.5036517331905501
Energy: 1.5938588354212666
Energy: 1.5208083655413505
Energy: 1.47094306398946

minimum gb energy = 1.1996845112391976 eV
minimum distance =  2.24849718454007 Angstroms
sigma value = 57


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

Energy: 1.473775296492507
Energy: 1.5380813635811497
Energy: 1.3162556106619212
Energy: 1.477305138129092
Energy: 1.6264294436424853
Energy: 1.3165318227280978
Energy: 1.4063617583666819
Energy: 1.2500564058410315
Energy: 1.3041282311245528
Energy: 1.4051328697840546
Energy: 1.2497864433212236
Energy: 1.3618112284196402
Energy: 1.5443517705240855
Energy: 1.2668239479235754
Energy: 1.2636124418153094
Energy: 1.5450219581967248
Energy: 1.3345851946210974
Energy: 1.248388666459278
Energy: 1.481069467039278
Energy: 1.309303421298353
Energy: 1.2651412497030217
Energy: 1.4830798107809837
Energy: 1.402413583773735
Energy: 1.2641943007261505
Energy: 1.1911575777956127
Energy: 1.25040710537408
Energy: 1.3064798044271242
Energy: 1.2667507086395966
Energy: 1.3089608171798335
Energy: 1.3048179300020661
Energy: 1.3382011767853954
Energy: 1.2574145586858254
Energy: 1.2577389172369668
Energy: 1.3399445785049635
Energy: 1.2597464506793097
Energy: 1.3575807088552878
Energy: 1.2553472797867093
Energy: 1.254491021726772
Energy: 1.307017119537354
Energy: 1.2564015526334325
Energy: 1.205438148599573
Energy: 1.3136508242585427
Energy: 1.3734364640074457
Energy: 1.2668634726228105
Energy: 1.2633902065667957
Energy: 1.1929206827831405
Energy: 1.2199091707212597
Energy: 1.2188339476680043
Energy: 1.3848314805080735
Energy: 1.2491647350341983
Energy: 1.2979345141913499
Energy: 1.3967385206119751
Energy: 1.252040577284196
Energy: 1.3972032564374524
Energy: 1.384421410000611
Energy: 1.2791003015802873
Energy: 1.2988822054784759
Energy: 1.3966040318895059
Energy: 1.3033737536501753
Energy: 1.396883905526293
Energy: 1.374055271099187
Energy: 1.3091159696398178
Energy: 1.383442031688005
Energy: 1.267465482459395
Energy: 1.2188647872805463
Energy: 1.3370627041801215
Energy: 1.4814864832487051
Energy: 1.395554611745797
Energy: 1.309201173756109
Energy: 1.4821817596383138
Energy: 1.330394692849322
Energy: 1.4883090070484601
Energy: 1.2758426401976874
Energy: 1.2644687538088313
Energy: 1.2665235739389713
Energy: 1.1919034595208158
Energy: 1.2666030564558015
Energy: 1.3089517975856053
Energy: 1.410013617914359
Energy: 1.2558378401282864
Energy: 1.2567519663927884
Energy: 1.3407500874884757
Energy: 1.2558237143691373
Energy: 1.250919992369535
Energy: 1.256495152624973
Energy: 1.2458101616881465
Energy: 1.2655007432478722
Energy: 1.256683909955831
Energy: 1.2479167478275228
Energy: 1.3166396668164735
Energy: 1.256583255509283
Energy: 1.254018250044131
Energy: 1.255604842568608
Energy: 1.2567221889440485
Energy: 1.2014517304710215
Energy: 1.2526990142865861
Energy: 1.188647866896917
Energy: 1.264520089103982
Energy: 1.2658822013450395
Energy: 1.1889097931574846
Energy: 1.2173075669294082
Energy: 1.3097003446794346

minimum gb energy = 1.188647866896917 eV
minimum distance =  2.2467093577053 Angstroms
sigma value = 9


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

Energy: 1.7307086940807026
Energy: 1.7618189561701811
Energy: 1.512485024096229
Energy: 1.7061283732007513
Energy: 1.7626164257486707
Energy: 1.5024619652854323
Energy: 1.4710830423085377
Energy: 1.384825760005685
Energy: 1.3130069341462771
Energy: 1.4028794231270227
Energy: 1.3922030836180443
Energy: 1.326860443598525
Energy: 1.4039259120264893
Energy: 1.3425115956384668
Energy: 1.27985883320532
Energy: 1.4054588730026845
Energy: 1.335511548111085
Energy: 1.438768581076104
Energy: 1.2781556796165634
Energy: 1.3133519450467337
Energy: 1.3401060531670248
Energy: 1.2788914149669237
Energy: 1.2832710103283604
Energy: 1.3386668751512576
Energy: 1.2609426437433753
Energy: 1.2794476911181092
Energy: 1.254014695808271
Energy: 1.2589508464579966
Energy: 1.296359053766931
Energy: 1.283027190882081
Energy: 1.2743487252421442
Energy: 1.3018361126115845
Energy: 1.2775753574495443
Energy: 1.2764347060781402
Energy: 1.2596690773438828
Energy: 1.2733867234512668
Energy: 1.407500178876275
Energy: 1.4077685230926043
Energy: 1.4844510198643375
Energy: 1.4199603843065423
Energy: 1.398117160436583
Energy: 1.5065236795148347
Energy: 1.395902380291887
Energy: 1.3176119990371178
Energy: 1.3339165809477027
Energy: 1.3270226838825154
Energy: 1.3203108238712762
Energy: 1.3260858811818121
Energy: 1.527115269681056
Energy: 1.4158211874818567
Energy: 1.3121411574555648
Energy: 1.3403876771311252
Energy: 1.397735350979208
Energy: 1.4690321049010517
Energy: 1.4472304052051077
Energy: 1.3150130313446025
Energy: 1.312363143486101
Energy: 1.3398162767704032
Energy: 1.3144169409814848
Energy: 1.3962004387884779
Energy: 1.2890117819327158
Energy: 1.31599875271225
Energy: 1.3246893837408917
Energy: 1.286714789671691
Energy: 1.314983361649006
Energy: 1.3223711926837307
Energy: 1.3138724533805595
Energy: 1.300514751386804
Energy: 1.3481024061053186
Energy: 1.283701948598105
Energy: 1.2692630215766614
Energy: 1.3336936263038446
Energy: 1.4013904909653407
Energy: 1.2841220367512096
Energy: 1.2782814324087424
Energy: 1.410088707594789
Energy: 1.2820433810062766
Energy: 1.328364825241645
Energy: 1.4770945539098956
Energy: 1.2906260486658374
Energy: 1.2921053813557548
Energy: 1.4105911867222627
Energy: 1.3044912404600912
Energy: 1.3924684417557076
Energy: 1.3890560325052916
Energy: 1.3987934261536876
Energy: 1.3914319444687195
Energy: 1.3902813824723463
Energy: 1.3696818584659838
Energy: 1.314211207170743
Energy: 1.314397601593231
Energy: 1.4896130267090069
Energy: 1.30384560039172
Energy: 1.3828180829106653
Energy: 1.5248572670949365
Energy: 1.5726095149963206
Energy: 1.3241866945311136
Energy: 1.291777171391421
Energy: 1.3897809914808315
Energy: 1.316877823335274
Energy: 1.2903670027968954
Energy: 1.3894497426622192
Energy: 1.33369006637104
Energy: 1.3091201092119644
Energy: 1.3031179421722432
Energy: 1.335102366637145
Energy: 1.312584559108188
Energy: 1.2969257290822493
Energy: 1.3124675947400726
Energy: 1.3357027119395357
Energy: 1.3068615427995325
Energy: 1.3132985034923168
Energy: 1.2747842345422697
Energy: 1.3063245158247894
Energy: 1.3102772562602945
Energy: 1.3851231323751245
Energy: 1.3596445848306273
Energy: 1.3014754218546585
Energy: 1.3419137080288461
Energy: 1.2791735354297045
Energy: 1.3929518815366786
Energy: 1.3761577951426955
Energy: 1.408529070906024
Energy: 1.2830845922995417
Energy: 1.3927823339798568
Energy: 1.348196957749672

minimum gb energy = 1.254014695808271 eV
minimum distance =  2.25584347163081 Angstroms
sigma value = 27


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

Energy: 1.2098154207664606
Energy: 1.7749441780438435
Energy: 1.167029740220332
Energy: 1.1147724554993448
Energy: 1.7664681836659908
Energy: 1.286577658659844
Energy: 1.4307739726096917
Energy: 1.2751500715587125
Energy: 1.3130493059824004
Energy: 1.3353391625255553
Energy: 1.2242105393986722
Energy: 1.3098004691687422
Energy: 1.42927317692636
Energy: 1.387997567888843
Energy: 1.2887316012564924
Energy: 1.3722138174103025
Energy: 1.1744484791214669
Energy: 1.3870543598876284
Energy: 1.355060194268896
Energy: 1.332380351979072
Energy: 1.3908612149185946
Energy: 1.339784972507355
Energy: 1.3945198345967127
Energy: 1.3578945956372561
Energy: 1.2002074608392352
Energy: 1.2581859268248576
Energy: 1.3856822453186015
Energy: 1.2014845805324792
Energy: 1.265612119796719
Energy: 1.3772866341856191
Energy: 1.3415596868441269
Energy: 1.3113284677549248
Energy: 1.3601733141340018
Energy: 1.3218512813510768
Energy: 1.380283445403077
Energy: 1.3530173762858182
Energy: 1.3388044109748307
Energy: 1.1141284943195384
Energy: 1.2507016728466063
Energy: 1.3082686853723766
Energy: 1.1165156616220822
Energy: 1.2500028233892984
Energy: 1.354853477463879
Energy: 1.1718798676558282
Energy: 1.3633709383030526
Energy: 1.3418507239841275
Energy: 1.1734316920650394
Energy: 1.3462002567722422
Energy: 1.5349745991928871
Energy: 1.3838514651559577
Energy: 1.3792046207791602
Energy: 1.309143105666203
Energy: 1.3994738800361408
Energy: 1.3572708601249521
Energy: 1.536415068960643
Energy: 1.3465209461904244
Energy: 1.3504953793497774
Energy: 1.389512584230652
Energy: 1.3509512014335647
Energy: 1.3654750392644903
Energy: 1.3541778076455613
Energy: 1.281252770290409
Energy: 1.3792583205871431
Energy: 1.3545008575171416
Energy: 1.2023702713921798
Energy: 1.3993763735058609
Energy: 1.3953510514375433
Energy: 1.3130655298144625
Energy: 1.3718321905376847
Energy: 1.3749137543131498
Energy: 1.3224331543014485
Energy: 1.3689476123115507
Energy: 1.1124933249259428
Energy: 1.3444358032339805
Energy: 1.1696385646757583
Energy: 1.1130744223366125
Energy: 1.3454721491423365
Energy: 1.2462032205763034
Energy: 1.1138111475081371
Energy: 1.3153846466345402
Energy: 1.3716235470002764
Energy: 1.1139904791868305
Energy: 1.3551341862384738
Energy: 1.2458081927209015
Energy: 1.3612666677911263
Energy: 1.383077154529168
Energy: 1.3802527753224605
Energy: 1.3567053211811815
Energy: 1.378835016283669
Energy: 1.3627060382382596
Energy: 1.3969408508268777
Energy: 1.325810527589254
Energy: 1.3923575732314961
Energy: 1.3957501365958946
Energy: 1.389246613655951
Energy: 1.3919249026852893
Energy: 1.2021207416954909
Energy: 1.396778947237343
Energy: 1.3945074806714486
Energy: 1.2037038004023035
Energy: 1.3391861315124935
Energy: 1.3914358149525878
Energy: 1.3225831790471012
Energy: 1.3480721387489851
Energy: 1.3189907711869522
Energy: 1.3074660358721906
Energy: 1.340789866822085
Energy: 1.3756036758494312
Energy: 1.3355895260146187
Energy: 1.188465348940701
Energy: 1.2520742640639948
Energy: 1.3377703859067105
Energy: 1.114149186887936
Energy: 1.2508114674980901
Energy: 1.3577341517561032
Energy: 1.1805475402191155
Energy: 1.2527558537851973
Energy: 1.3442172540581814
Energy: 1.1141410120320423
Energy: 1.251436889420962
Energy: 1.551750006489323
Energy: 1.3161627260236268
Energy: 1.301675661949482
Energy: 1.3575192117828727
Energy: 1.333068318187477
Energy: 1.3847504197412126
Energy: 1.1712297947505488
Energy: 1.305619348235396
Energy: 1.4054365517312786
Energy: 1.171516872929831
Energy: 1.331697737631935
Energy: 1.3012659716832025
Energy: 1.356389612206145
Energy: 1.3695695058021475
Energy: 1.3756585509324764
Energy: 1.3092516265772458
Energy: 1.2298980982268002
Energy: 1.372142396618847
Energy: 1.3550966755913618
Energy: 1.3184984458321567
Energy: 1.2294039882423868
Energy: 1.3156876183159314
Energy: 1.2297509803852549
Energy: 1.3818821414803635
Energy: 1.211429369546041
Energy: 1.2280217921379177
Energy: 1.2774264147679164
Energy: 1.1141956697300255
Energy: 1.2383906394304351
Energy: 1.3212424486186074

minimum gb energy = 1.1124933249259428 eV
minimum distance =  2.25860860712791 Angstroms
sigma value = 19


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

Energy: 1.7361642929888326
Energy: 1.490263181248573
Energy: 1.3811071908430326
Energy: 1.719423641525432
Energy: 1.4902135998409258
Energy: 1.3833011759333453
Energy: 1.2549479788504347
Energy: 1.3133182900643312
Energy: 1.3325841692617342
Energy: 1.4878153707692507
Energy: 1.338148707989392
Energy: 1.3314273626621713
Energy: 1.258410368319773
Energy: 1.1723647709395462
Energy: 1.1726580961875215
Energy: 1.2492718818340254
Energy: 1.1730446777127697
Energy: 1.2953118202497167
Energy: 1.2450859309176716
Energy: 1.3237920524241786
Energy: 1.2430930734406394
Energy: 1.2376195433843868
Energy: 1.2395030387086592
Energy: 1.252208819504649
Energy: 1.1866549747854633
Energy: 1.2428012478825832
Energy: 1.2451268609500563
Energy: 1.1891010092821264
Energy: 1.2499493058304887
Energy: 1.2496216177753106
Energy: 1.2599292134829236
Energy: 1.2764498013915404
Energy: 1.2751116038516381
Energy: 1.2868689143480097
Energy: 1.259119846886324
Energy: 1.2755001318286585
Energy: 1.273240853393888
Energy: 1.261482915856343
Energy: 1.2533824469486186
Energy: 1.2734265990943983
Energy: 1.2928200392521378
Energy: 1.3307116157944192
Energy: 1.3560669234879155
Energy: 1.318746247062384
Energy: 1.3678789923698884
Energy: 1.3454070785714565
Energy: 1.3071798376761787
Energy: 1.3788996455899412
Energy: 1.1725451667183837
Energy: 1.2623961965386687
Energy: 1.2422942778870856
Energy: 1.1725227840556367
Energy: 1.250101208233756
Energy: 1.269975746202779
Energy: 1.1717736916768717
Energy: 1.23431765233117
Energy: 1.235266920956119
Energy: 1.1722462378663254
Energy: 1.2342767605272351
Energy: 1.2339578632934614
Energy: 1.2101478744632246
Energy: 1.1523438066848783
Energy: 1.2091507480028463
Energy: 1.2100246087139745
Energy: 1.156090399996386
Energy: 1.2367815495585608
Energy: 1.3852007048427275
Energy: 1.2098059846206666
Energy: 1.209275191350081
Energy: 1.3851742596508516
Energy: 1.2219210173473805
Energy: 1.2407671397832947
Energy: 1.2550139990155635
Energy: 1.3629583785739852
Energy: 1.3435372219254706
Energy: 1.148278917080743
Energy: 1.3628742824720488
Energy: 1.3298187042168415
Energy: 1.3134885693507368
Energy: 1.257676065554706
Energy: 1.2550171382695101
Energy: 1.2538838087744917
Energy: 1.3112230111027672
Energy: 1.3222746217195795
Energy: 1.2372747415535201
Energy: 1.1510188144257074
Energy: 1.1516958839933986
Energy: 1.2366682639152344
Energy: 1.1506544618195391
Energy: 1.1531681364508617
Energy: 1.2751925983954124
Energy: 1.2697823981170508
Energy: 1.2165349714645222
Energy: 1.274499610815376
Energy: 1.1512070739893785
Energy: 1.2197931262490007
Energy: 1.2191530365074335
Energy: 1.2976605914151211
Energy: 1.2320413886029846
Energy: 1.1528528294033134
Energy: 1.299430882519681
Energy: 1.2117879885583613
Energy: 1.291359547776232
Energy: 1.2292107581850853
Energy: 1.2209048701544758
Energy: 1.2146166490730783
Energy: 1.2994762902884613
Energy: 1.2204938085882828
Energy: 1.3583289796004525
Energy: 1.1495127106303238
Energy: 1.226579738413886
Energy: 1.3620064701374448
Energy: 1.1491897216440958
Energy: 1.2754246885211906
Energy: 1.3105310915379993
Energy: 1.1498689886183695
Energy: 1.2145285523793523
Energy: 1.3111237761131536
Energy: 1.1487074608147605
Energy: 1.2749321503951365
Energy: 1.1509038848427537
Energy: 1.2304133390734904
Energy: 1.2510556299211981
Energy: 1.150321019998484
Energy: 1.225251532401012
Energy: 1.235933192832045
Energy: 1.178887072578851
Energy: 1.245631698509064
Energy: 1.2501259455857852
Energy: 1.1505375318825894
Energy: 1.2257036052442412
Energy: 1.254559024522035
Energy: 1.2465172122407635
Energy: 1.2786164816137633
Energy: 1.2430064739851756
Energy: 1.2487654549764142
Energy: 1.1430192318657408
Energy: 1.1812134214046697
Energy: 1.3781845507785189
Energy: 1.1434686968105305
Energy: 1.2142152324643807
Energy: 1.3544127373883474
Energy: 1.143935584441394
Energy: 1.2141862036296278
Energy: 1.2606938206427576
Energy: 1.2510923203915933
Energy: 1.2264570548495113
Energy: 1.1505959213308425
Energy: 1.2372120930960862
Energy: 1.2266188359907622
Energy: 1.2038280489533788
Energy: 1.2457648973295756
Energy: 1.2696569920873613
Energy: 1.168967288539812
Energy: 1.2414053921996193
Energy: 1.2717974135947556
Energy: 1.2505375384458026
Energy: 1.207100839818042
Energy: 1.2338477421952685
Energy: 1.2409060460103905
Energy: 1.1732209987393183
Energy: 1.2396022315043094
Energy: 1.2495726267319889
Energy: 1.2195279860298047
Energy: 1.234068947413279
Energy: 1.2477241060617463
Energy: 1.203220998952017
Energy: 1.2564371309923916
Energy: 1.2886295196755546
Energy: 1.3139158966804272
Energy: 1.3122614383554767
Energy: 1.1430378105355148
Energy: 1.36475912369583
Energy: 1.1952781007991171

minimum gb energy = 1.1430192318657408 eV
minimum distance =  2.22357746902819 Angstroms
sigma value = 101


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

Energy: 1.669819269853705
Energy: 1.5496336852639117
Energy: 1.4538685270693923
Energy: 1.6479632955622328
Energy: 1.549649493092157
Energy: 1.194039673753753
Energy: 1.3714687083536627
Energy: 1.2430885704698549
Energy: 1.2643295601116566
Energy: 1.337937896440598
Energy: 1.2449248555715222
Energy: 1.264972914670814
Energy: 1.2299461966972869
Energy: 1.1265087915714511
Energy: 1.1284996713197528
Energy: 1.2279439918143031
Energy: 1.1291043304651756
Energy: 1.2111921560556256
Energy: 1.2084186655938727
Energy: 1.2755599656191263
Energy: 1.2169870646635013
Energy: 1.2097986458493422
Energy: 1.2128642375728624
Energy: 1.213801679133851
Energy: 1.1450809542038265
Energy: 1.216471488340234
Energy: 1.219187559982252
Energy: 1.1475893258917487
Energy: 1.229301283963401
Energy: 1.1461353027490302
Energy: 1.2697942408152292
Energy: 1.2135344432576511
Energy: 1.2141514799407551
Energy: 1.2703170560900554
Energy: 1.3597492518524896
Energy: 1.2274546110639852
Energy: 1.279717993059587
Energy: 1.2402962503299095
Energy: 1.2403481232193367
Energy: 1.2797362208751422
Energy: 1.2005529259662355
Energy: 1.2989160048297812
Energy: 1.2954281145239264
Energy: 1.331851520751067
Energy: 1.278445005726601
Energy: 1.3031079620369226
Energy: 1.2017214512557497
Energy: 1.2715169182100328
Energy: 1.1279236484192148
Energy: 1.216787900011259
Energy: 1.1276786877628324
Energy: 1.129287690200854
Energy: 1.2273783041477497
Energy: 1.1277763257151208
Energy: 1.1264865920172513
Energy: 1.2142348654855466
Energy: 1.2160446929156459
Energy: 1.126134802331113
Energy: 1.2113193155637385
Energy: 1.2164596210695269
Energy: 1.1918977721620116
Energy: 1.0998592854044413
Energy: 1.100156121703207
Energy: 1.1923568984099462
Energy: 1.1052988347811978
Energy: 1.2099373995156701
Energy: 1.3349904930924772
Energy: 1.2128312494399023
Energy: 1.2154938264666493
Energy: 1.3367332855038903
Energy: 1.2312907783556248
Energy: 1.2159005524338604
Energy: 1.1807509102219005
Energy: 1.2064936408888436
Energy: 1.207491829183306
Energy: 1.1238389796142618
Energy: 1.2068459136348608
Energy: 1.2158114574048853
Energy: 1.181791389360967
Energy: 1.2618015676857854
Energy: 1.2162689700286051
Energy: 1.1795046478754183
Energy: 1.2732931370082796
Energy: 1.2128964759226426
Energy: 1.2409571544247282
Energy: 1.1267005153323193
Energy: 1.1275527551708862
Energy: 1.2281356735963642
Energy: 1.1300408121142416
Energy: 1.1899110067767582
Energy: 1.2279115960875058
Energy: 1.1797872099523492
Energy: 1.2119878258881822
Energy: 1.2403334603293033
Energy: 1.1731118664304676
Energy: 1.2202940092272776
Energy: 1.20995925124242
Energy: 1.3166819061150847
Energy: 1.204008089923781
Energy: 1.1020944940248896
Energy: 1.3234274856652601
Energy: 1.2078583772837372
Energy: 1.3749408012524358
Energy: 1.1280165869439354
Energy: 1.336199732273476
Energy: 1.3232608490336824
Energy: 1.1849575401053394
Energy: 1.259149824849359
Energy: 1.2275900888590547
Energy: 1.1819939562275825
Energy: 1.2144026485756143
Energy: 1.2276225458265462
Energy: 1.1262414960662301
Energy: 1.2226389887003564
Energy: 1.216157661647675
Energy: 1.212274194531707
Energy: 1.2193160686313487
Energy: 1.2035373056186018
Energy: 1.1811061187434742
Energy: 1.2226894733918632
Energy: 1.1479631130340588
Energy: 1.2027446814521079
Energy: 1.2137991697078987
Energy: 1.1457339460175155
Energy: 1.200627323724175
Energy: 1.2010786408638876
Energy: 1.1885218875712962
Energy: 1.2119208702558317
Energy: 1.214411100037566
Energy: 1.1840464034146863
Energy: 1.2304643030933964
Energy: 1.2266466450774567
Energy: 1.2282822473937987
Energy: 1.2423831373242031
Energy: 1.2495514726388954
Energy: 1.2286347775544617
Energy: 1.291947511412185
Energy: 1.2735137442839013
Energy: 1.3064849164084076
Energy: 1.2495502847554982
Energy: 1.2492377352549267
Energy: 1.305929877648956
Energy: 1.2016399832768128
Energy: 1.3189337393655987
Energy: 1.1259090801132428
Energy: 1.2437123772893846
Energy: 1.2157603308155986
Energy: 1.125944946895575
Energy: 1.2291584991636033
Energy: 1.181681847672501
Energy: 1.1277790021240217
Energy: 1.2114011404803742
Energy: 1.2135926438489688
Energy: 1.1262032003177735
Energy: 1.2203158292642324
Energy: 1.2151517529799696
Energy: 1.2094375407623708
Energy: 1.1008464166432388
Energy: 1.188278208397749
Energy: 1.210796027233518
Energy: 1.10492765718475
Energy: 1.188543506978327
Energy: 1.3283658033842538
Energy: 1.1016335093347107
Energy: 1.1873265372636912
Energy: 1.3274464525258083
Energy: 1.1015277965220405
Energy: 1.2178091911075482
Energy: 1.18054979142441
Energy: 1.2230137369728795
Energy: 1.2135615895831202
Energy: 1.1223235242130472
Energy: 1.3436778397627716
Energy: 1.2159307185755999
Energy: 1.1804583261062895
Energy: 1.2200811133307237
Energy: 1.2538427268647765
Energy: 1.122838378300259
Energy: 1.2110707844711093
Energy: 1.172189333885743
Energy: 1.2300785583967566
Energy: 1.1277434755238196
Energy: 1.1894288284352148
Energy: 1.2289814750395405
Energy: 1.1261419449966357
Energy: 1.2165277373962027
Energy: 1.2278759341651182
Energy: 1.1800224975669968
Energy: 1.1812392455095957
Energy: 1.2271362491676556
Energy: 1.1269625436211281
Energy: 1.1836845210502505
Energy: 1.213086081941327
Energy: 1.3368378696871333
Energy: 1.1031852299996012
Energy: 1.0986482330405938
Energy: 1.3232922425832263
Energy: 1.2189210228319218

minimum gb energy = 1.0986482330405938 eV
minimum distance =  2.26603972303295 Angstroms
sigma value = 33


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

Energy: 0.02048925376662768
Energy: 1.170937598478398
Energy: 0.02146044066534511
Energy: 0.0232379377183926
Energy: 1.1623811303785105
Energy: 0.02132057658007152
Energy: 0.7806103411904164
Energy: 0.16681875575039934
Energy: 0.16464141789252582
Energy: 0.164261272321195
Energy: 0.16582522765942362
Energy: 0.1642479038053444
Energy: 1.7836440520613035
Energy: 1.1708306786067626
Energy: 1.1674217455456213
Energy: 1.1655670562508793
Energy: 1.1737163018286145
Energy: 1.1668364220753509
Energy: 0.023576993290460105
Energy: 0.1668187557522712
Energy: 0.16464141789158987
Energy: 0.16426127232301482
Energy: 0.16582522766077548
Energy: 0.1642479038044605

minimum gb energy = 0.02048925376662768 eV
minimum distance =  2.45438746480711 Angstroms
sigma value = 1