Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987_Ni__MO_977363131043_005
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=3.52422046661377
cohesive_energy=4.459348122686658
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=[1.94996111594238e-19, 3.49620576364944e-19, 4.4303388283368e-19, 5.01918680663082e-19, 5.3844350138838e-19, 5.61745558353276e-19, 5.786885762578259e-19, 5.92297464587022e-19, 6.04831292394804e-19, 6.1744683121092e-19, 6.29955024192558e-19, 6.42030629483016e-19, 6.534909989460179e-19, 6.64219173687282e-19, 6.740405164537019e-19, 6.828284552911919e-19, 6.905189031343919e-19, 6.97094236040328e-19, 7.025624648921699e-19, 7.0694441798616e-19, 7.102785475615139e-19, 7.12604908034082e-19, 7.139667581729819e-19, 7.144105611005999e-19, 7.138946602244519e-19, 7.120825984513979e-19, 7.085305728538199e-19, 7.029421807544279e-19, 6.95245324204692e-19, 6.853823248457879e-19, 6.732987086721599e-19, 6.58946410384788e-19, 6.4228857992109e-19, 6.232819585119479e-19, 6.01878480858342e-19, 5.78046103427592e-19, 5.516117911432259e-19, 5.21827327517166e-19, 4.87641684677508e-19, 4.4733572709597e-19, 3.9853022247106196e-19, 3.39539680983816e-19, 2.6836138184173197e-19, 1.81451310330402e-19, 7.370893713548699e-20, -6.5444910057315e-20, -2.5368864822755995e-19, -5.03078656546098e-19, -8.143959961220039e-19, -1.194621350549616e-18, -1.7046358297443e-18, -2.46850558353648e-18, -3.62950685959824e-18, -5.7203313452019e-18]
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: 0.01809517989408862
Energy: 0.4816844375557424
Energy: 0.01856840358321313
Energy: 0.018347259441035383
Energy: 0.48212464623606477
Energy: 0.018528465287764542
Energy: 0.4816844375557424
Energy: 0.16453971158809444
Energy: 0.1645422758068198
Energy: 0.1646822859273148
Energy: 0.1647766668688123
Energy: 0.16454610502956843
Energy: 0.0185684035835431
Energy: 0.16454227580714975
Energy: 0.16493778185711366
Energy: 0.018716256838753383
Energy: 0.16474163242548978
Energy: 0.16543749914205458
Energy: 0.018347259441035383
Energy: 0.1646822859273148
Energy: 0.018716256838753383
Energy: 0.018539900079698576
Energy: 0.16444952189562556
Energy: 0.018556553450776937
Energy: 0.482124646229282
Energy: 0.1647766668700955
Energy: 0.16474163242449985
Energy: 0.1644495218962855
Energy: 0.16526446211489887
Energy: 0.16479931532546852
Energy: 0.018528465286481315
Energy: 0.16454610503085168
Energy: 0.16543749914172456
Energy: 0.01855655345143688
Energy: 0.1647993153264218
Energy: 0.018599009303232848

minimum gb energy = 0.01809517989408862 eV
minimum distance =  2.48927073918039 Angstroms
sigma value = 1


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

Energy: 1.5352712641035555
Energy: 1.2437370525702915
Energy: 1.1967336259005161
Energy: 1.5370367974600663
Energy: 1.4817552896803947
Energy: 1.3129785078898697
Energy: 1.332131952788686
Energy: 1.0517578655044022
Energy: 1.03945283538873
Energy: 1.2703257587571677
Energy: 1.053741016886511
Energy: 1.039855358291695
Energy: 1.3551976090400317
Energy: 1.0593836907856233
Energy: 1.0592833705437803
Energy: 1.320307933085451
Energy: 1.0596102157130471
Energy: 1.059183441041799
Energy: 1.4835078371486348
Energy: 1.304437336903013
Energy: 1.2566485395171487
Energy: 1.1926095219987722
Energy: 1.3146224305177443
Energy: 1.192842750630029
Energy: 1.3424781045400243
Energy: 1.1495628919368384
Energy: 1.1619584259713414
Energy: 1.3474501925114446
Energy: 1.1524001863295024
Energy: 1.163268089749468
Energy: 1.3453889933615166
Energy: 1.1719138777886762
Energy: 1.1652532556288118
Energy: 1.2797850755303253
Energy: 1.1476029540514852
Energy: 1.1648157927338467
Energy: 1.3020666701045642
Energy: 1.2995326671226983
Energy: 1.288148498374474
Energy: 1.2192563294023997
Energy: 1.3007075428794888
Energy: 1.285335259397271
Energy: 1.2825461483325429
Energy: 1.2257832485914046
Energy: 1.2246836859900867
Energy: 1.2867208727219734
Energy: 1.2247763820904016
Energy: 1.2447094171836381
Energy: 1.1372698049112826
Energy: 1.202809138289332
Energy: 1.1625167511687888
Energy: 1.1377025462675066
Energy: 1.1974466958213228
Energy: 1.1617265800683738
Energy: 1.2194390923423344
Energy: 1.207789715957086
Energy: 1.1637191694015083
Energy: 1.2213030185600668
Energy: 1.2095311628109975
Energy: 1.1745111791851583
Energy: 1.1770471587675038
Energy: 1.2012886655132198
Energy: 1.2008258422727172
Energy: 1.1772579260586236
Energy: 1.1990076934281522
Energy: 1.144975035921668
Energy: 1.0776864948143485
Energy: 1.1398141785123335
Energy: 1.0595753118815692
Energy: 1.0597007407520465
Energy: 1.18101164032332
Energy: 1.0591952079076339
Energy: 1.0505162963090835
Energy: 1.1918491425438749
Energy: 1.061546234585192
Energy: 1.0505311078843647
Energy: 1.2591056297401428
Energy: 1.044948244134976
Energy: 1.1951631468368131
Energy: 1.1899620718494566
Energy: 1.1905092550349026
Energy: 1.222312291462082
Energy: 1.1902895497236972
Energy: 1.1267060639829742
Energy: 1.1003248383100523
Energy: 1.1849630961421922
Energy: 1.0958061184316334
Energy: 1.101055698515242
Energy: 1.2026215307196
Energy: 1.1040174768773048
Energy: 1.110023562724603
Energy: 1.2065518581063595
Energy: 1.117524956991659
Energy: 1.1106656702490403
Energy: 1.2055096971181385
Energy: 1.1172709332299045
Energy: 1.3019711006308414
Energy: 1.2465634112059039
Energy: 1.2087580579492287
Energy: 1.3021131785253746
Energy: 1.253467672250932
Energy: 1.1649495715377147
Energy: 1.2831443982927377
Energy: 1.2342478449439716
Energy: 1.234834627145856
Energy: 1.1679122894395086
Energy: 1.304560421900283
Energy: 1.2351809975166996
Energy: 1.2539566615035962
Energy: 1.1915946406629532
Energy: 1.192399375283325
Energy: 1.2190756883580782
Energy: 1.2009828718865865
Energy: 1.194120608186263
Energy: 1.325664780887278
Energy: 1.2135457976471409
Energy: 1.2404287968779573
Energy: 1.3124617123628006
Energy: 1.1943802135332016
Energy: 1.2372543893458317
Energy: 1.5343995996962176
Energy: 1.1085497818770988
Energy: 1.2598135826603256
Energy: 1.1406354154990688
Energy: 1.0926507504958596
Energy: 1.2014192454297357
Energy: 1.3219599247102543
Energy: 1.1048944067828832
Energy: 1.1048647299420131
Energy: 1.322758209580257
Energy: 1.0918889053050373
Energy: 1.104771329594729
Energy: 1.3416990379635505
Energy: 1.0993135938737202
Energy: 1.0990835690995093
Energy: 1.3349688706748493
Energy: 1.10158739035944
Energy: 1.0989388448301225

minimum gb energy = 1.03945283538873 eV
minimum distance =  2.22286138433217 Angstroms
sigma value = 33


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

Energy: 1.7045525533614287
Energy: 1.5004254268507646
Energy: 1.1544803864480198
Energy: 1.1712701124963758
Energy: 1.5006924798521764
Energy: 1.1743892386431447
Energy: 1.2882157075957048
Energy: 1.0320084622145709
Energy: 1.030192575561744
Energy: 1.2401909549305166
Energy: 1.033014059063263
Energy: 1.0292182706474675
Energy: 1.2811094135348233
Energy: 1.031667780507895
Energy: 1.0316221538605166
Energy: 1.2811518446608883
Energy: 1.0321872145779754
Energy: 1.0311241928557
Energy: 1.4349250146036563
Energy: 1.351399751995818
Energy: 1.2571849907956674
Energy: 1.1761990110882057
Energy: 1.3511588220890296
Energy: 1.1574453302525496
Energy: 1.3163063764535121
Energy: 1.014894203596547
Energy: 1.095336264467609
Energy: 1.3164919376214645
Energy: 1.0152526482192952
Energy: 1.0961590635312053
Energy: 1.2918488122660037
Energy: 1.052770625884693
Energy: 1.1326850094154242
Energy: 1.0939625699944007
Energy: 1.0536178243903516
Energy: 1.1327429261059547
Energy: 1.2914878002445476
Energy: 1.2453946926440942
Energy: 1.2473726575528217
Energy: 1.0946036794039131
Energy: 1.2464171542624392
Energy: 1.2549515687882844
Energy: 1.2854035831864097
Energy: 1.1642333799953803
Energy: 1.1640471803622043
Energy: 1.2980818028809737
Energy: 1.1766664609927053
Energy: 1.1634454313526579
Energy: 1.0854593152726384
Energy: 1.175946630836572
Energy: 1.0952108736579298
Energy: 1.0863174932459099
Energy: 1.2288808079766762
Energy: 1.0947590062653378
Energy: 1.1667902803808294
Energy: 1.1871762774704913
Energy: 1.09564154035643
Energy: 1.1679566354284514
Energy: 1.2401979808637111
Energy: 1.095309146815312
Energy: 1.3586871831259655
Energy: 1.0793137899520124
Energy: 1.0796331590070514
Energy: 1.3597182528627916
Energy: 1.0830090274054722
Energy: 1.1637556313959263
Energy: 1.0331284572420458
Energy: 1.1609401152910899
Energy: 1.0308069991666708
Energy: 1.0339837864005963
Energy: 1.243671335259998
Energy: 1.0304434917237677
Energy: 1.0343521744456765
Energy: 1.1867499878201035
Energy: 1.0311224609151624
Energy: 1.0316165468196261
Energy: 1.1878492111538768
Energy: 1.0317080555429974
Energy: 1.0539183635593954
Energy: 1.1582003882123488
Energy: 1.1573766643416499
Energy: 1.5020537506648666
Energy: 1.1581182495822773
Energy: 1.1741775907895657
Energy: 1.1742127644768856
Energy: 1.1858794658721965
Energy: 1.096714765105881
Energy: 1.1618805236247307
Energy: 1.2469268443362902
Energy: 1.0954643186415425
Energy: 1.2105552197832092
Energy: 1.1862036192210834
Energy: 1.1329344153758292
Energy: 1.06912176630846
Energy: 1.0938431686955574
Energy: 1.1332654292000912
Energy: 1.292527335395138
Energy: 1.2554413024380457
Energy: 1.1599438643945437
Energy: 1.289837049360329
Energy: 1.1259264359127874
Energy: 1.240657946837633
Energy: 1.2349958948906554
Energy: 1.2681044647864934
Energy: 1.1273667100644396
Energy: 1.1729964129034147
Energy: 1.2976892130451947
Energy: 1.1635848786922272
Energy: 1.2333495720494223
Energy: 1.0957587573221292
Energy: 1.0947931546963592
Energy: 1.2344337632079765
Energy: 1.0867419904563738
Energy: 1.0951498382142928
Energy: 1.293089687975428
Energy: 1.0949195149324893
Energy: 1.0949600903036714
Energy: 1.2504223083296246
Energy: 1.0958539904517086
Energy: 1.0960904048190259
Energy: 1.7081955582788662
Energy: 1.194676707585083
Energy: 1.1601555467489801
Energy: 1.078644359522992
Energy: 1.196769505866069
Energy: 1.079888773532944
Energy: 1.2778975571054385
Energy: 1.073546280044791
Energy: 1.0740607892414673
Energy: 1.2787783663639862
Energy: 1.0741611193391731
Energy: 1.0309619314524567
Energy: 1.3025619311158327
Energy: 1.0310673422061374
Energy: 1.0312389392380892
Energy: 1.263421197758185
Energy: 1.0336681970534343
Energy: 1.0143035539957543
Energy: 1.4311927602212389
Energy: 1.0738791163195316
Energy: 1.0538974415879727
Energy: 1.4320911446545077
Energy: 1.0889352006244233
Energy: 1.1742366783602662
Energy: 1.3046791053893705
Energy: 1.0950645880736172
Energy: 1.0950208070290344
Energy: 1.305031133097176
Energy: 1.0321896220377198
Energy: 1.0966708661138898
Energy: 1.2866512530455059
Energy: 1.1364661794502127
Energy: 1.134242219208927
Energy: 1.2888530992454412
Energy: 1.137376745785408
Energy: 1.1330311384542742
Energy: 1.2495243947524366
Energy: 1.1511768010055519
Energy: 1.1494790936012729
Energy: 1.1612090153333325
Energy: 1.1466342306758166
Energy: 1.1606631660726776
Energy: 1.2891390260779256
Energy: 1.1643173821056325
Energy: 1.1622444789500583
Energy: 1.2911672336716558
Energy: 1.093844656018765
Energy: 1.125899450877643
Energy: 1.0855822260378238
Energy: 1.1642883227097414
Energy: 1.1637668735030313
Energy: 1.0858676778944307
Energy: 1.0949102467375103
Energy: 1.095504572502248
Energy: 1.1761881817207205
Energy: 1.1861448759559776
Energy: 1.0961484464917277
Energy: 1.177764798166686
Energy: 1.2579655206487266
Energy: 1.0959834942262638
Energy: 1.1694413528478667
Energy: 1.080201753938673
Energy: 1.0798278234845768
Energy: 1.170058263867111
Energy: 1.0803886806287704
Energy: 1.1634104519097404
Energy: 1.074487149821506
Energy: 1.1812986184054706
Energy: 1.1361588617833003
Energy: 1.0744495854822431
Energy: 1.1594238367515903
Energy: 1.0715305020770052
Energy: 1.0311409411027135
Energy: 1.188179814251555
Energy: 1.0147193887692372
Energy: 1.0320369140503711
Energy: 1.2493247820608366
Energy: 1.0143763973168989
Energy: 1.0534529087218276
Energy: 1.1760762383131425
Energy: 1.1754212276685876
Energy: 1.0534533393629002
Energy: 1.2077210509992666
Energy: 1.1753494734802292
Energy: 1.1764513410408404
Energy: 1.190182959288627
Energy: 1.097306573040002
Energy: 1.1761832076150265
Energy: 1.1864421850117544
Energy: 1.0950503550902124
Energy: 1.085420280498428
Energy: 1.186983369590022
Energy: 1.0948979901977127
Energy: 1.0950630079272827
Energy: 1.0948327532192288
Energy: 1.0958067459902814
Energy: 1.1915531957437127
Energy: 1.1615114415684247
Energy: 1.1614594909257074
Energy: 1.1920193401578962
Energy: 1.1600420783300678
Energy: 1.148700227967152
Energy: 1.2254622700127078
Energy: 1.2554645436009528
Energy: 1.1258147858329348
Energy: 1.2254988481987112
Energy: 1.2777223354213814
Energy: 1.125687146603872
Energy: 1.1635220846739838
Energy: 1.0952934355149344
Energy: 1.1110219014669447
Energy: 1.1671499090992332
Energy: 1.0939822199855564
Energy: 1.1646198779196986
Energy: 1.3034930675410996
Energy: 1.095911889812173
Energy: 1.0966064097169153
Energy: 1.2657390007394027
Energy: 1.0957571606838736
Energy: 1.096689069909372
Energy: 1.2775563192625357
Energy: 1.170973389488234
Energy: 1.1704433465246682
Energy: 1.1604899654822152
Energy: 1.1695452879308506
Energy: 1.0407774909784908

minimum gb energy = 1.0143035539957543 eV
minimum distance =  2.29046529987449 Angstroms
sigma value = 51


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

Energy: 1.6115661142941646
Energy: 1.09658404491308
Energy: 1.2458089031490303
Energy: 1.1833270005938796
Energy: 1.0952589608020658
Energy: 1.2204283382203975
Energy: 1.2680379063139913
Energy: 1.0632659645555982
Energy: 1.0632965660855331
Energy: 1.2542574618812827
Energy: 1.0633510949892369
Energy: 1.0631752183626642
Energy: 1.307310168954136
Energy: 1.087525011560243
Energy: 1.0867351871495643
Energy: 1.2502846829878775
Energy: 1.0878661869261081
Energy: 1.0868542711233038
Energy: 1.4537328840379784
Energy: 1.320408946153066
Energy: 1.2388683036894206
Energy: 1.1086332827735073
Energy: 1.3484833101326228
Energy: 1.099198824143275
Energy: 1.2585198407654308
Energy: 1.2220100332688781
Energy: 1.2192159011992652
Energy: 1.2548352327357408
Energy: 1.1474257854584775
Energy: 1.2113750505375895
Energy: 1.2916517815661974
Energy: 1.1516571315018351
Energy: 1.1490427159760348
Energy: 1.1198512988845915
Energy: 1.1657357932338588
Energy: 1.1465877695703433
Energy: 1.2635488583538286
Energy: 1.158621790190297
Energy: 1.2238624553266793
Energy: 1.2354854564294875
Energy: 1.2833262297212211
Energy: 1.2106573111778784
Energy: 1.24152946672366
Energy: 1.08061172070011
Energy: 1.0849068903467685
Energy: 1.2402090627132547
Energy: 1.0758375911236642
Energy: 1.1289675211062293
Energy: 1.0807264294914072
Energy: 1.1901354371448145
Energy: 1.076142812548945
Energy: 1.0809431874803026
Energy: 1.1837703808975168
Energy: 1.0804143944850255
Energy: 1.0646139030158273
Energy: 1.0638567658460607
Energy: 1.0630306872551283
Energy: 1.063072015313242
Energy: 1.187616201951911
Energy: 1.0629179523028887
Energy: 1.310910278406102
Energy: 1.0938837844417286
Energy: 1.3963390815513341
Energy: 1.311009689323548
Energy: 1.1063607336307486
Energy: 1.1809569849137653
Energy: 1.1473023136446556
Energy: 1.1979076450338368
Energy: 1.064849913671665
Energy: 1.144572114701523
Energy: 1.241150402491369
Energy: 1.0650900506625598
Energy: 1.119053949660753
Energy: 1.116531868961743
Energy: 1.1240473408508314
Energy: 1.1239480259089223
Energy: 1.2317584207062195
Energy: 1.12514997897485
Energy: 1.1118555851921716
Energy: 1.2324386327226438
Energy: 1.2481245529759115
Energy: 1.112250781847188
Energy: 1.138259116564557
Energy: 1.2471657465005266
Energy: 1.3316478876837285
Energy: 1.2085857089968508
Energy: 1.1528039416893217
Energy: 1.3257511179334378
Energy: 1.2750144331244486
Energy: 1.2733029370788298
Energy: 1.2922916162728426
Energy: 1.112949198570624
Energy: 1.1132632571608068
Energy: 1.2505908419621907
Energy: 1.1124358388715714
Energy: 1.1600278881627044
Energy: 1.2591091132002346
Energy: 1.1099316138857
Energy: 1.108894659564199
Energy: 1.2522294147535558
Energy: 1.1081230203530363
Energy: 1.107635808568149
Energy: 1.5795530980943306
Energy: 1.102945575898946
Energy: 1.0461377061214494
Energy: 1.073807410254083
Energy: 1.100434236347281
Energy: 1.0971220346618498

minimum gb energy = 1.0461377061214494 eV
minimum distance =  2.23730609570294 Angstroms
sigma value = 19


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

Energy: 1.3447916206312687
Energy: 0.9471146598425888
Energy: 0.9629680582325985
Energy: 1.3472500846981963
Energy: 0.9459560323442014
Energy: 0.9654305446827205
Energy: 1.0948262668911202
Energy: 0.9976932006557485
Energy: 0.9977743013099285
Energy: 1.0981661374991383
Energy: 1.0072944719716797
Energy: 0.9981468306782136
Energy: 1.0995202793804342
Energy: 1.0231623058333539
Energy: 1.0232006481213562
Energy: 1.0225812681376432
Energy: 1.023099132948961
Energy: 1.0241090585560984
Energy: 1.1280235268479588
Energy: 0.9887454431266568
Energy: 0.9886860747387046
Energy: 1.1279680651568087
Energy: 1.109677753227713
Energy: 0.9880349089079159
Energy: 1.10759928711154
Energy: 0.9987819270578729
Energy: 0.9983922283443185
Energy: 1.1076439627731756
Energy: 1.0082468336120514
Energy: 0.997666128833737
Energy: 1.145000309903822
Energy: 0.9217860730991014
Energy: 1.1076990593425642
Energy: 1.1447947218317738
Energy: 0.922286366253737
Energy: 1.002518600394974
Energy: 1.1224116916230893
Energy: 1.0891298895963117
Energy: 1.0931588527596512
Energy: 1.1222914380768922
Energy: 1.074713870794994
Energy: 1.047870330283984
Energy: 1.131353998497762
Energy: 0.9185479512047727
Energy: 0.9192610382545294
Energy: 1.1311680272443687
Energy: 0.9174836768117927
Energy: 0.918632980615939
Energy: 1.0078635368875393
Energy: 1.020338185455942
Energy: 1.0200128039827103
Energy: 1.0079241892740642
Energy: 1.1037087959461602
Energy: 1.0199596239310764
Energy: 0.9937506770681023
Energy: 0.9942348944478694
Energy: 0.9937046348149668
Energy: 0.9939137258989272
Energy: 1.1848405717464527
Energy: 0.9939105042899794
Energy: 0.9857502460257773
Energy: 0.9966814092985768
Energy: 0.9965060664420342
Energy: 0.9875366386899598
Energy: 1.1299745346642849
Energy: 0.9869042088521937
Energy: 1.1036659708645629
Energy: 1.0932460855873625
Energy: 1.092599513786761
Energy: 1.1043864422609628
Energy: 1.0170608209785297
Energy: 1.0233799680266553
Energy: 0.9191499679834977
Energy: 1.0197807435916149
Energy: 1.0140041860058373
Energy: 0.9216913056901282
Energy: 0.9937904309933989
Energy: 1.1060112462952634
Energy: 1.0994338989838766
Energy: 1.1611142654575348
Energy: 1.1613682424292189
Energy: 1.1835258320808333
Energy: 1.1652418925809453
Energy: 1.158607732742546
Energy: 0.918105765516402
Energy: 1.12236003256144
Energy: 1.1193698061154898
Energy: 0.9184183161183724
Energy: 1.1197025373418668
Energy: 1.019668292387621
Energy: 1.3490032519092559
Energy: 1.0081776011509367
Energy: 0.9648212580824824
Energy: 1.349892014969129
Energy: 1.0082612236671755
Energy: 0.9192943155066937
Energy: 1.106919045004866
Energy: 1.0074484362638947
Energy: 0.9975264617053256
Energy: 1.1090410900923167
Energy: 1.0073377940542534
Energy: 0.9978022715888982
Energy: 1.1279618890521208
Energy: 0.9883031038758142
Energy: 0.9875751913729127
Energy: 1.0930511526739892
Energy: 0.988381119786932
Energy: 0.9887940983246268
Energy: 1.1279609487674305
Energy: 0.9870084259270698
Energy: 1.0934624792752767
Energy: 0.9966373172040315
Energy: 1.1045805492437117
Energy: 1.0967757755541983
Energy: 1.1004792443849654
Energy: 0.9208240368517919
Energy: 1.1071107068043828
Energy: 1.1014067077289444
Energy: 0.9215631487853782
Energy: 1.0244164981889146
Energy: 1.1418026897295404
Energy: 0.9929866400976644
Energy: 0.9933363370884007
Energy: 1.2045874399785208
Energy: 0.9935170192785783
Energy: 1.0925563466929142
Energy: 1.1005768207223228
Energy: 1.0964998935516999
Energy: 1.2178179915937002
Energy: 1.1192466164210826
Energy: 1.1012741816934395
Energy: 1.21937548049212
Energy: 0.9700466224762465
Energy: 0.9180381161849012
Energy: 0.9646834407369881
Energy: 0.9691539377458989
Energy: 0.9184318856416371
Energy: 0.9628948484148914
Energy: 0.9879777019808669
Energy: 1.0080789614872672
Energy: 0.9986081868582801
Energy: 1.007006977576797
Energy: 0.9172863932720995
Energy: 0.9980147946655523
Energy: 1.0227314745215512
Energy: 1.0976152738986173
Energy: 1.0241790368848231
Energy: 1.022706462528591
Energy: 1.0228326429705736
Energy: 1.0234264509762687
Energy: 1.1066024485686545
Energy: 0.9907691893170641
Energy: 0.9915839153020375
Energy: 1.108531941580966
Energy: 1.0932841382776297
Energy: 0.9875379635704046
Energy: 1.1094977937098336
Energy: 1.106811214238451
Energy: 0.9979748364642532
Energy: 1.008179228573507
Energy: 1.1165427314095064
Energy: 0.9979296665780036
Energy: 0.9224122599837702
Energy: 1.0105529078136657
Energy: 1.0056371603545788
Energy: 0.9222138540509597
Energy: 1.1097377553352559
Energy: 1.0117170789111634
Energy: 1.1086779467074592
Energy: 1.0514796713525085
Energy: 1.0480704827554128
Energy: 1.1163280067050112
Energy: 1.166491533066751
Energy: 1.049335871069131
Energy: 1.3496028716401316
Energy: 1.1317176142618035
Energy: 0.9647403691353146
Energy: 1.3495516010855297
Energy: 1.1330838274385429
Energy: 0.9187091573596826

minimum gb energy = 0.9172863932720995 eV
minimum distance =  2.37988171891508 Angstroms
sigma value = 27


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

Energy: 1.162314041199506
Energy: 0.9996939246226402
Energy: 1.0152131398932438
Energy: 1.1659163212181791
Energy: 0.982174633418682
Energy: 1.08598657986609
Energy: 1.2022288649401227
Energy: 1.0402428869307037
Energy: 1.0406854831671817
Energy: 1.1873541181894514
Energy: 1.059762247627704
Energy: 1.0394599110509524
Energy: 1.0548882791165353
Energy: 1.0258864778837593
Energy: 1.0199552418431257
Energy: 0.9940407172633449
Energy: 1.0347713043846662
Energy: 1.0261145809796666
Energy: 1.1548267686669893
Energy: 1.1730141851506504
Energy: 1.2324197880868408
Energy: 1.0806379213827593
Energy: 1.181551293984346
Energy: 1.2330662617833907
Energy: 1.173601242301201
Energy: 1.0817227599531867
Energy: 1.0943199822029988
Energy: 1.1736776414968688
Energy: 1.1017101430291247
Energy: 1.1572580644037174
Energy: 1.0062107959066775
Energy: 1.1385598955228506
Energy: 1.1324181777550109
Energy: 1.0067613266091657
Energy: 1.142377962408241
Energy: 0.9655293014497324
Energy: 0.9986184526045392
Energy: 1.026351826144745
Energy: 1.0006611069119478
Energy: 0.9990960567767309
Energy: 1.0222665588476516
Energy: 1.0004406995519228
Energy: 1.1750736822115562
Energy: 1.147588312069522
Energy: 1.1475000210049828
Energy: 1.17524947827003
Energy: 1.0892668538573953
Energy: 1.1112821601791218
Energy: 1.125714607680874
Energy: 1.0678477037562686
Energy: 1.0509975932350129
Energy: 1.1259942518536727
Energy: 0.9959313795141485
Energy: 1.122686163570589
Energy: 0.927341855058318
Energy: 1.0428035048018873
Energy: 1.044796229169866
Energy: 1.0480417674519924
Energy: 1.025423839184168
Energy: 1.0447531465193123
Energy: 1.073290692984843
Energy: 1.0478146612826469
Energy: 1.044406224644755
Energy: 0.9862071528642296
Energy: 1.0600480673031283
Energy: 1.0464601737785288
Energy: 1.0860775274211407
Energy: 1.05944015921778
Energy: 1.0392791589724018
Energy: 1.012738507356374
Energy: 1.162704017101065
Energy: 1.0231032443296844

minimum gb energy = 0.927341855058318 eV
minimum distance =  2.28328392624284 Angstroms
sigma value = 9


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

Energy: 1.900682986125081
Energy: 1.2413485801677013
Energy: 0.8961409003053822
Energy: 0.9354325590859173
Energy: 1.2197037077415114
Energy: 0.8967216365940411
Energy: 0.936111908292685
Energy: 1.0165208983097525
Energy: 1.0166303427567902
Energy: 0.8858368865091779
Energy: 1.0170397370733706
Energy: 0.9389676500160137
Energy: 0.9075522138692699
Energy: 0.922374309438762
Energy: 0.9229360510839734
Energy: 0.925698782129568
Energy: 0.9220553380771949
Energy: 0.8732574239711506
Energy: 1.1671887785236623
Energy: 1.0616472731682938
Energy: 1.0442303174781695
Energy: 0.9262131729008367
Energy: 1.0614361688112819
Energy: 1.0798268436388305
Energy: 1.0727085280536857
Energy: 0.9571614700592971
Energy: 0.8629083498650707
Energy: 1.0727589259417154
Energy: 1.0131859759127058
Energy: 1.0423604375674376
Energy: 0.9531355691683623
Energy: 1.2500529259808957
Energy: 0.9096821191222636
Energy: 0.9531012976626276
Energy: 0.8687583155244287
Energy: 0.9093696639334146
Energy: 1.02085397354639
Energy: 1.0251886978730238
Energy: 1.022169657541206
Energy: 1.023663634738272
Energy: 1.0945040948309355
Energy: 1.0213592531797766
Energy: 0.932512187756212
Energy: 1.0747711005795313
Energy: 1.0322254262472028
Energy: 0.9325578505522479
Energy: 0.9205192973734441
Energy: 0.9323580209924682
Energy: 1.1246140228365544
Energy: 0.9253335878219401
Energy: 0.9342770183913185
Energy: 1.1249209533533562
Energy: 0.9526450055675618
Energy: 1.030544935266548
Energy: 1.3672718504264119
Energy: 1.040963429307223
Energy: 1.001583285702752
Energy: 0.8736498091916027
Energy: 1.04103437573289
Energy: 1.034827178996463
Energy: 0.8442898933892958
Energy: 0.9325418628931047
Energy: 0.9324718344124913
Energy: 0.8711155255080854
Energy: 0.9319175340305644
Energy: 0.8832738182483411
Energy: 0.9792202431820538
Energy: 0.9536275933555257
Energy: 0.9528861970618812
Energy: 0.9820541733424395
Energy: 0.9531655185196894
Energy: 0.952955658601072
Energy: 1.1618680573184377
Energy: 0.9752997147113173
Energy: 1.00276357041362
Energy: 1.081639141940169
Energy: 0.9748761242474681
Energy: 1.122073706566981
Energy: 1.0620131006160674
Energy: 0.8862776510835463
Energy: 0.9035593101956074
Energy: 1.0622035812574993
Energy: 1.0974863082914548
Energy: 1.0640651970523596
Energy: 0.9884603825527949
Energy: 0.9722226194254738
Energy: 0.980555823648447
Energy: 0.9877758577083959
Energy: 0.9681621755641141
Energy: 1.1628235888542917
Energy: 0.924553546014652
Energy: 0.9195572564868835
Energy: 0.9208109297582795
Energy: 0.9264569706705619
Energy: 0.9102118328668658
Energy: 0.9210077899696955
Energy: 0.951351496753708
Energy: 0.9261265277919961
Energy: 0.8987321647471235
Energy: 0.9513940675948415
Energy: 0.9838434744615813
Energy: 0.9521993096775829
Energy: 0.9907762546314752
Energy: 0.9333077394260664
Energy: 1.0035822881301864
Energy: 0.9908812930808099
Energy: 0.9100617315994011
Energy: 1.0021504655772802
Energy: 0.9893933948922271
Energy: 1.0595672285071598
Energy: 0.9385827964684832
Energy: 0.9973465768046075
Energy: 0.91969243187448
Energy: 0.8755916806675523
Energy: 0.9029520772721171
Energy: 0.9091719886157739
Energy: 0.9176721935658585
Energy: 0.910064716213802
Energy: 0.9084223683800174
Energy: 0.9179627268310079
Energy: 0.9067269656552769
Energy: 0.9572548561388708
Energy: 0.8751317858892236
Energy: 0.8768544368041389
Energy: 0.9567437438894009
Energy: 0.9109380982569808
Energy: 0.9292120454984056
Energy: 1.0006689240982225
Energy: 1.0211413583485889
Energy: 0.9386866002215742
Energy: 1.0275050226973583
Energy: 0.9067043403215297
Energy: 1.1064329909625286
Energy: 1.016320867900209
Energy: 1.0164821676239582
Energy: 1.1265826090120716
Energy: 1.016242747051277
Energy: 0.9636264493613693
Energy: 0.9067545220821035
Energy: 0.921325920289002
Energy: 0.921808292813973
Energy: 0.912989834604013
Energy: 0.9207610561506364
Energy: 0.9216615142652668
Energy: 1.1986106147430593
Energy: 0.9884748998248777
Energy: 0.9887342075992426
Energy: 0.8916509489163705
Energy: 0.9867784375998646
Energy: 1.1609657158002955
Energy: 0.9853227232057656
Energy: 0.9676907419450536
Energy: 1.2064503060355476
Energy: 0.9857931283681237
Energy: 1.1743853928682961
Energy: 1.0655811307600618
Energy: 0.913962312053487
Energy: 1.192108287262316
Energy: 1.3387190927234185
Energy: 0.9138126432791608
Energy: 1.1700883673151103
Energy: 0.90131306180169
Energy: 0.952578392023099
Energy: 0.9859211702489828
Energy: 0.9538412021993781
Energy: 0.9542134229314371
Energy: 1.0786246788001157
Energy: 0.9530757491237309
Energy: 0.930979860007787
Energy: 0.9146924267029463
Energy: 0.9320649283870789
Energy: 0.932124637319561
Energy: 0.9487366098436397
Energy: 0.9321218464737848
Energy: 1.1242173433568834
Energy: 0.9185997094310326
Energy: 1.080069682420946
Energy: 1.1250163097358896
Energy: 0.9238564962686662
Energy: 0.9671243769893392
Energy: 0.8437641533053563
Energy: 1.1247859652066985
Energy: 1.0567675404410153
Energy: 0.844707230023746
Energy: 1.1243823896983494
Energy: 0.9358831697695357
Energy: 1.3700489798641322
Energy: 0.9323890089231431
Energy: 0.9325476826513283
Energy: 0.8730972248313335
Energy: 0.9323557691200054
Energy: 0.9368935296193619
Energy: 1.019108055930143
Energy: 1.0107890065859324
Energy: 1.0110862119144113
Energy: 1.0250494717296266
Energy: 1.0100500649144994
Energy: 0.9319137488558966
Energy: 1.1495034603203662
Energy: 0.9532312880365233
Energy: 0.9534246710309824
Energy: 0.9055476998314927
Energy: 0.9532441497369227
Energy: 0.976947454413801
Energy: 0.8877447218186194
Energy: 1.0949586957960216
Energy: 0.9025847836729908
Energy: 0.9366260416545491
Energy: 1.095628691892285
Energy: 0.9052181983488384
Energy: 1.0613499206183636
Energy: 0.971806775259606
Energy: 1.0880086635501591
Energy: 1.0612057033201383
Energy: 0.9714545835339037
Energy: 1.084155634036647
Energy: 0.8752834269846753
Energy: 0.9187835836953914
Energy: 1.0167749937114312
Energy: 0.9243705692586054
Energy: 0.9189086207827989
Energy: 0.922299556227298
Energy: 0.9513273150273844
Energy: 1.0162996084965246
Energy: 0.9520344543898456
Energy: 0.9512835915832009
Energy: 1.0627413772341006
Energy: 0.9509255872938941
Energy: 0.944016651932398
Energy: 1.0685095537650997
Energy: 1.1097748172883444
Energy: 0.9441827058702466
Energy: 0.9612718494563119
Energy: 1.0256345870856713
Energy: 0.9918792893488317
Energy: 0.9452073926900529
Energy: 1.0417216656146502
Energy: 0.9918434108421916
Energy: 1.0439927988029056
Energy: 1.041500591881443
Energy: 0.9062801670226033
Energy: 0.9104264831712776
Energy: 0.9379299524841226
Energy: 0.8834399735002058
Energy: 0.9111116293679228
Energy: 0.9107675291682384
Energy: 0.9067561169380808
Energy: 0.911205027876649
Energy: 0.912039125727972
Energy: 0.9135262077494217
Energy: 0.9104529647654775
Energy: 0.9110830114212205
Energy: 1.108301553557565
Energy: 1.0683457994792396
Energy: 0.8899799478027216
Energy: 1.1086964211508186
Energy: 1.067848715388468
Energy: 0.9626518455907801

minimum gb energy = 0.8437641533053563 eV
minimum distance =  2.22031795557382 Angstroms
sigma value = 57


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

Energy: 0.41878484903745267
Energy: 0.48976433913946765
Energy: 0.433584585595076
Energy: 0.42279010021849855
Energy: 0.48969417006974725
Energy: 0.42003456444359705
Energy: 0.5597002400566085
Energy: 0.4893982675053656
Energy: 0.5072700599760269
Energy: 0.48675021057769885
Energy: 0.4884227734404327
Energy: 0.5061767963498035
Energy: 0.5613903497931155
Energy: 0.48997281359175593
Energy: 0.4898733625022209
Energy: 0.5613278478741325
Energy: 0.4901721677089886
Energy: 0.49000614764157086
Energy: 0.5610704555609862
Energy: 0.49034033112026537
Energy: 0.4901826279615008
Energy: 0.4903642740386059
Energy: 0.5599723262033369
Energy: 0.5674748875404383
Energy: 0.5580871067044695
Energy: 0.42029469040716316
Energy: 0.4210999627424096
Energy: 0.559139043256897
Energy: 0.42023723427999865
Energy: 0.4899512264331212
Energy: 0.49000161037761397
Energy: 0.4200317601110715
Energy: 0.4201812491653601
Energy: 0.4899822642309631
Energy: 0.41994478061946483
Energy: 0.4680285330945949
Energy: 0.48481504141537296
Energy: 0.49020559829123345
Energy: 0.5085891941408927
Energy: 0.48536654601922435
Energy: 0.48978996549489184
Energy: 0.5079234667489593
Energy: 0.4897840439833943
Energy: 0.567279052226368
Energy: 0.5674432787208724
Energy: 0.48989273657611504
Energy: 0.567942641563091
Energy: 0.4897587375920982
Energy: 0.5571280709314916
Energy: 0.5678497051066643
Energy: 0.48976422577156814
Energy: 0.5584981062645779
Energy: 0.5609904907658765
Energy: 0.4898825358203351
Energy: 0.4199187965867855
Energy: 0.5606993388507338
Energy: 0.43328063127407757
Energy: 0.41994136288085543
Energy: 0.5610231377949204
Energy: 0.42120276680623053
Energy: 0.42005119355363296
Energy: 0.4903514979108393
Energy: 0.5094688776088688
Energy: 0.4201067584028372
Energy: 0.4897739625395617
Energy: 0.4684729732649252
Energy: 0.5595712437925491
Energy: 0.4890467079165464
Energy: 0.4895751127028758
Energy: 0.5598507489145478
Energy: 0.48886060723708435
Energy: 0.510621732495498
Energy: 0.561058678327155
Energy: 0.5609701995797087
Energy: 0.5679167101955872
Energy: 0.567839757402756
Energy: 0.5610941677256597
Energy: 0.5674426345336718
Energy: 0.5586104911302063
Energy: 0.48883970052413783
Energy: 0.48926789484851674
Energy: 0.5594668133898063
Energy: 0.48822717268967475
Energy: 0.4893427580468455
Energy: 0.44869487126593277
Energy: 0.4198819171590164
Energy: 0.4198256356270377
Energy: 0.44803549813216687
Energy: 0.4198593310267657
Energy: 0.43385667481641393
Energy: 0.48817629082189995
Energy: 0.4888530226497827
Energy: 0.49024963638662683
Energy: 0.4885682940617524
Energy: 0.4200964110680412
Energy: 0.5065389277465389
Energy: 0.4896126462174578
Energy: 0.5683190148055891
Energy: 0.48990853783691374
Energy: 0.48964362105962483
Energy: 0.4895993400298343
Energy: 0.4899921244872933
Energy: 0.5604354687989099
Energy: 0.5675218892182156
Energy: 0.5675164165800431
Energy: 0.5603527476000401
Energy: 0.49080751555062907
Energy: 0.5679591566916584
Energy: 0.42016427215617047
Energy: 0.5599695066611047
Energy: 0.48927885533067705
Energy: 0.4200550490913042
Energy: 0.5592699803671525
Energy: 0.4898265332974712

minimum gb energy = 0.41878484903745267 eV
minimum distance =  2.34982583347711 Angstroms
sigma value = 11


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

Energy: 1.5369677609004018
Energy: 0.8570460386417309
Energy: 1.2491934991834643
Energy: 1.5385120368442087
Energy: 1.0334195570425166
Energy: 1.25007380128453
Energy: 0.7655128636723376
Energy: 0.7658723817379635
Energy: 0.7659280639223413
Energy: 0.7830794231495781
Energy: 0.7706140442433671
Energy: 0.8290884612445666
Energy: 0.7779890424923919
Energy: 0.7795699317199297
Energy: 0.7800145065298443
Energy: 0.7795025208310212
Energy: 0.7800770002576998
Energy: 0.780101819053945
Energy: 0.7776489517702629
Energy: 0.7858112809147318
Energy: 0.8632581303449074
Energy: 0.7789674449961715
Energy: 0.7714493139539639
Energy: 0.7722927546593038
Energy: 0.7715477295166736
Energy: 0.88776613011397
Energy: 0.8026503907320255
Energy: 0.7716906852315851
Energy: 0.9562967569758061
Energy: 0.7696509274787566
Energy: 0.939712352326846
Energy: 0.8846857321771877
Energy: 0.8096942307309266
Energy: 0.9399478236416021
Energy: 0.9185321114315027
Energy: 0.8332767888246018
Energy: 0.8226768235565588
Energy: 0.8153041695948038
Energy: 0.8108880158358673
Energy: 0.8240186168504434
Energy: 0.7896100428010882
Energy: 0.7682175558845203
Energy: 0.8115121683118786
Energy: 0.885267282840518
Energy: 0.8850254568894494
Energy: 0.8126905851525339
Energy: 0.8846134517708865
Energy: 0.9532366213258431
Energy: 0.820519760622369
Energy: 0.8017244438210765
Energy: 0.8026461332079816
Energy: 0.82040591445858
Energy: 0.8008673274100614
Energy: 0.8018150404834086
Energy: 1.1565697286624828
Energy: 0.8023571728811454
Energy: 0.8023312837564808
Energy: 0.9657198054489131
Energy: 0.8025972433513833
Energy: 0.8902296905947785
Energy: 1.1445303733837084
Energy: 1.0184008933851545
Energy: 0.8022672103815557
Energy: 0.9530829679779829
Energy: 1.0220434785300718
Energy: 0.8021757472968789
Energy: 0.939038078057989
Energy: 0.7616834505802937
Energy: 0.7706279855788227
Energy: 0.9397565022843823
Energy: 0.7583972650503196
Energy: 0.8581562859989754
Energy: 0.8665505302291794
Energy: 0.7613216073598529
Energy: 0.7563679275718442
Energy: 0.8694097309864249
Energy: 0.7592624155837523
Energy: 0.8769145666589737
Energy: 0.8897513300382253
Energy: 0.8812117659645505
Energy: 0.8682931478396375
Energy: 0.8898634499764
Energy: 1.0526848159998679
Energy: 0.8907304035108504
Energy: 1.045576157977423
Energy: 0.9374498016670545
Energy: 0.8601987875457006
Energy: 1.0439209560301155
Energy: 1.1038150367208759
Energy: 1.1055262510719637
Energy: 1.1455349719543402
Energy: 0.887199184771083
Energy: 0.8911620826382781
Energy: 1.147805011891223
Energy: 1.0492125236432086
Energy: 0.9493699248725462
Energy: 1.1830559363958157
Energy: 1.0749266394869113
Energy: 1.060489650913562
Energy: 1.1848447286173653
Energy: 1.2009072590365597
Energy: 0.7458063028638965
Energy: 1.1098103671491903
Energy: 0.887540503866369
Energy: 0.8872300188711553
Energy: 1.113315979371131
Energy: 0.8884127951365487
Energy: 0.887829634448535
Energy: 1.1006294600666136
Energy: 0.9370180918965397
Energy: 0.8761860318870388
Energy: 1.1034669718911094
Energy: 0.942482929407452
Energy: 0.8763870106647508
Energy: 0.9990082637669193
Energy: 1.0305214488805716
Energy: 0.9341530926081076
Energy: 0.994905811180337
Energy: 1.122282900377591
Energy: 0.7950008677289029
Energy: 1.1429433897972283
Energy: 0.8843784619012158
Energy: 0.9237396313555087
Energy: 1.0242469881739809
Energy: 1.04250916792376
Energy: 0.8029982848572049
Energy: 0.8017089229561292
Energy: 0.8585537146485306
Energy: 0.7937542799447349
Energy: 0.9611029763435097
Energy: 0.9441009378440715
Energy: 1.0302155665862456
Energy: 0.8026244126246042
Energy: 0.8767988999572063
Energy: 0.8408597327868321
Energy: 0.8021921192168597
Energy: 0.8372577304028577
Energy: 0.8020681249500298
Energy: 0.8342089990690358
Energy: 0.7783309208724553
Energy: 0.8403572932894973
Energy: 0.8085934133098471
Energy: 0.7804058935918011
Energy: 0.8044130975602702
Energy: 0.769823386528071
Energy: 0.7709241248781636
Energy: 0.771052980344621
Energy: 0.7705521200484672
Energy: 0.7796438538411882
Energy: 0.8343828358807103
Energy: 1.086359996100516
Energy: 0.8224347420458047
Energy: 0.7683361478064996
Energy: 1.0566206317614966
Energy: 0.8220253987030645
Energy: 0.7516535996909314

minimum gb energy = 0.7458063028638965 eV
minimum distance =  2.31040980497798 Angstroms
sigma value = 41


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

Energy: 1.4982927542413007
Energy: 1.2039713304254391
Energy: 1.2846342247382478
Energy: 1.4997418935087137
Energy: 1.2039295435270507
Energy: 0.9598289221089743
Energy: 1.004268067010109
Energy: 0.8528316321879613
Energy: 0.8517743845309415
Energy: 1.0242738360763375
Energy: 0.85744327628143
Energy: 0.8763750298301584
Energy: 0.8677731631912567
Energy: 0.8983737300612823
Energy: 0.8982467525441874
Energy: 0.8673811857128089
Energy: 0.8988285400246785
Energy: 0.8668727737487979
Energy: 0.8524326222224576
Energy: 0.8701601851017136
Energy: 0.8878347426086199
Energy: 0.8947893511774011
Energy: 0.853966060542706
Energy: 0.8539425749467564
Energy: 0.853660115338604
Energy: 0.8586619529948765
Energy: 0.8529923555085698
Energy: 0.8664616887463876
Energy: 0.927182781076202
Energy: 0.8506246368765812
Energy: 1.0928752270173043
Energy: 0.9480890373702624
Energy: 0.944361943332512
Energy: 1.0358473723839732
Energy: 0.9270529708384821
Energy: 0.944171676830882
Energy: 0.9373879265626721
Energy: 0.9494608495475634
Energy: 0.8715310722875179
Energy: 0.9366925574034675
Energy: 0.9374605024292707
Energy: 0.8583217549778105
Energy: 0.8971440957185198
Energy: 1.0121361880157158
Energy: 1.0120934987581407
Energy: 0.9105168073077392
Energy: 1.0123245609239782
Energy: 0.9118412630802092
Energy: 1.0357669007548098
Energy: 0.8573904073060433
Energy: 0.857663148494912
Energy: 1.0354678702593985
Energy: 0.8575276629269755
Energy: 0.8576029387528081
Energy: 1.1997304096504937
Energy: 1.0692243257025835
Energy: 1.066958852774179
Energy: 1.2003406857686583
Energy: 1.0678159752250607
Energy: 0.951923727864062
Energy: 1.0331182191142148
Energy: 1.1268776075430755
Energy: 0.8614612759553761
Energy: 0.9296171332768854
Energy: 1.0403298815928503
Energy: 0.8733457232805253
Energy: 1.0379678807239916
Energy: 0.8293313874750678
Energy: 0.8261726588544341
Energy: 1.0385799788650343
Energy: 0.829637674013823
Energy: 0.8568822935649489
Energy: 0.8615542623657142
Energy: 0.8302942116712662
Energy: 0.9217498452912848
Energy: 0.861713287733447
Energy: 0.8295950095889256
Energy: 0.9210004759568131
Energy: 0.8578746042928733
Energy: 0.8654042631721628
Energy: 0.972872078487426
Energy: 0.8619229929088418
Energy: 1.036227986606459
Energy: 0.8622805927811813
Energy: 0.91074805244476
Energy: 0.8971936841076426
Energy: 0.9991866330699612
Energy: 0.9099646745049023
Energy: 0.8978523042565121
Energy: 0.9210884234869287
Energy: 0.8525386418197884
Energy: 0.8576877693609757
Energy: 0.8523746974387474
Energy: 0.8518976696526014
Energy: 0.8504719916946848
Energy: 0.8640198319948875
Energy: 1.4893279334725278
Energy: 1.0351070698894826
Energy: 1.0838010125678685
Energy: 1.4917054524634112
Energy: 1.0345394657447098
Energy: 0.916865421521787
Energy: 1.1793129111264948
Energy: 0.8568534707178415
Energy: 0.8508449114230248
Energy: 1.1041419369577867
Energy: 0.924485156666694
Energy: 0.8301806130956485
Energy: 0.8524844904569719
Energy: 0.8676644659624888
Energy: 0.8533788278824458
Energy: 0.8628207801448642
Energy: 0.8532247955737268
Energy: 0.8896919307392729
Energy: 0.8978445115542286
Energy: 0.8669936609027712
Energy: 0.8789159992462073
Energy: 0.897928661879566
Energy: 0.8670869953945867
Energy: 0.8983788169691579
Energy: 0.8522960992461636
Energy: 0.8713267070506452
Energy: 0.8603031094618483
Energy: 0.8523887331422753
Energy: 0.9481463805852703
Energy: 0.8527967440137245
Energy: 0.9064811062992056
Energy: 0.9483926165730502
Energy: 0.9430718487054901
Energy: 0.9070513463851488
Energy: 0.8964666780766063
Energy: 1.0206064782312798
Energy: 1.035951608453756
Energy: 0.8712674004267642
Energy: 0.8578214324636628
Energy: 0.9307037147754287
Energy: 0.9274023457994385
Energy: 0.8533410108863262
Energy: 0.8970498089207276
Energy: 0.9246113332348249
Energy: 0.8542997025504369
Energy: 0.9104739515966221
Energy: 0.9250563463678289
Energy: 0.912927303426815
Energy: 0.9369527525201404
Energy: 0.8578374833805166
Energy: 0.8574642255854231
Energy: 1.0393674613908033
Energy: 0.8578721643957103
Energy: 0.8579933307469123
Energy: 1.032290390366667
Energy: 0.8619728805455749
Energy: 0.8574040461827623
Energy: 0.8705742371113094
Energy: 0.8618628015625166
Energy: 0.8618071903666416
Energy: 1.1948036360000813
Energy: 1.0388945228116857
Energy: 0.9512405889488461
Energy: 1.1951448580010406
Energy: 1.0382441498336288
Energy: 0.9057226513465455
Energy: 1.0396994610533083
Energy: 0.8296128733207605
Energy: 0.8619073982653854
Energy: 1.039932760435457
Energy: 0.8292167082963346
Energy: 0.8615153811462626
Energy: 0.8628379521610962
Energy: 0.8860749794945809
Energy: 0.9213278141766288
Energy: 0.8578184142060097
Energy: 0.8880316905176199
Energy: 0.913147922542113
Energy: 0.8570726415957302
Energy: 0.8438012207275783
Energy: 0.8446419100742507
Energy: 0.857385017590348
Energy: 1.136872584970664
Energy: 0.8573430693146065
Energy: 0.9106504364256078
Energy: 0.897459609246141
Energy: 0.9546671210292773
Energy: 0.9105040289235329
Energy: 0.8977800046841578
Energy: 0.9105932661601667
Energy: 0.8553718268401628
Energy: 0.852466584239378
Energy: 0.852822902764605
Energy: 0.8556379672673465
Energy: 0.8525737741821497
Energy: 0.9361569073990947
Energy: 1.3482395565870908
Energy: 1.034684633483278
Energy: 0.8991020571368319
Energy: 0.9330243462882296
Energy: 1.034455939562114
Energy: 0.8785103052744543

minimum gb energy = 0.8261726588544341 eV
minimum distance =  2.25869182309552 Angstroms
sigma value = 33


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

Energy: 1.0368844049255852
Energy: 1.0325874117511198
Energy: 1.0040198926640016
Energy: 1.036941013677227
Energy: 1.206671030291
Energy: 1.0024431324776149
Energy: 1.0710527279722595
Energy: 0.9462405185736127
Energy: 0.9475338673606971
Energy: 1.085729146004889
Energy: 0.9467504332048315
Energy: 0.9466030778063299
Energy: 0.9727185686462658
Energy: 0.9747835678453556
Energy: 0.9742148330571668
Energy: 0.9743203208106735
Energy: 0.9749101777297529
Energy: 0.9752486527160666
Energy: 0.9716627416636335
Energy: 0.9749467586279771
Energy: 0.9551423445071304
Energy: 0.9730265124701251
Energy: 0.9656255081209951
Energy: 0.9681833363171938
Energy: 0.953160576529314
Energy: 0.9612287482423247
Energy: 0.9102164548067504
Energy: 0.9533308113953014
Energy: 0.9625821014832868
Energy: 0.9523840171787845
Energy: 1.0067154614103695
Energy: 1.000142471382828
Energy: 1.0018211881572834
Energy: 0.9975211244932168
Energy: 1.0008774845396382
Energy: 1.0326705410344845
Energy: 1.101204571748768
Energy: 0.9219363988421566
Energy: 0.910533231678773
Energy: 1.1008237749117713
Energy: 1.070495427923212
Energy: 0.9522642202993014
Energy: 1.0342758638298695
Energy: 1.1604674551312477
Energy: 0.9739326546036216
Energy: 1.0371426885001043
Energy: 1.1605864609296406
Energy: 1.0113145864267075
Energy: 1.2219770719901986
Energy: 0.9159096646598586
Energy: 0.9148504234598033
Energy: 1.2233845544566095
Energy: 0.9157395512558196
Energy: 0.9150010383549427
Energy: 1.4409071184564481
Energy: 0.9324660608655451
Energy: 0.9324316200821111
Energy: 0.9650955362617905
Energy: 0.9245059300583213
Energy: 0.9327414351516945
Energy: 1.1088088298960055
Energy: 0.9671432085356576
Energy: 0.9177489042804747
Energy: 0.9601889066166008
Energy: 0.9807560910668777
Energy: 0.9539917716695178
Energy: 1.0934434821428796
Energy: 0.9106421712782066
Energy: 0.9542525071722097
Energy: 0.9967684639221068
Energy: 0.911026231105812
Energy: 0.9132198067003954
Energy: 0.9530103416193001
Energy: 0.9110214600386376
Energy: 0.9129613568980566
Energy: 0.9530667273374452
Energy: 0.9111221765232278
Energy: 0.9128740175131426
Energy: 0.9503521747566477
Energy: 0.963418614462826
Energy: 0.9536548292330467
Energy: 0.9503876744445479
Energy: 1.0822100229575595
Energy: 0.9496918091997455
Energy: 0.9472434362226633
Energy: 0.9931996270196826
Energy: 0.9770189597410548
Energy: 0.9846879065722013
Energy: 0.9776598954910627
Energy: 0.9853474865080194
Energy: 0.9483844576212129
Energy: 0.9512733755197231
Energy: 0.9503026471831735
Energy: 1.065443147109162
Energy: 0.9496754427966131
Energy: 0.9535506829490253
Energy: 1.4291744613411095
Energy: 0.95529522482386
Energy: 0.9756528562073232
Energy: 1.4299073145865409
Energy: 0.9552962149758674
Energy: 0.9746741668478266
Energy: 0.9803744512431156
Energy: 0.9528245879664051
Energy: 0.9525076236891703
Energy: 1.0993293146796672
Energy: 1.1063536597581742
Energy: 0.9801986786161402
Energy: 0.9647771917568824
Energy: 1.0079905863040342
Energy: 1.0120401848130922
Energy: 0.9662822693780778
Energy: 1.0107186333646743
Energy: 1.1025076094709463
Energy: 0.9318987697279159
Energy: 1.0087342339943681
Energy: 0.9991554261233301
Energy: 0.9319393929587472
Energy: 1.0107995690557778
Energy: 0.9310527759179421
Energy: 0.9298684451230799
Energy: 1.0092660845891215
Energy: 0.9312858201531511
Energy: 0.9160062842013904
Energy: 0.9502813331511979
Energy: 0.9172908406751409
Energy: 0.9249242736405467
Energy: 0.964405302698521
Energy: 0.9863871048913382
Energy: 0.9251972966892147
Energy: 0.9642074436657333
Energy: 0.9756639935944363
Energy: 1.0695606240337288
Energy: 0.9465675136294283
Energy: 0.947799690647316
Energy: 1.0843337228094643
Energy: 1.1002973071136257
Energy: 0.9097681865128148
Energy: 1.03293345977244
Energy: 0.9935107185705192
Energy: 0.9505764099609542
Energy: 0.9113284718574816
Energy: 0.948292114203471
Energy: 0.91282394856072
Energy: 1.2206290164241171
Energy: 0.9467680167357141
Energy: 0.9485303119762406
Energy: 1.2199715790919337
Energy: 0.9474331499376302
Energy: 0.9487508061789082
Energy: 0.9721936739929702
Energy: 0.9747030050278104
Energy: 0.9749267213939503
Energy: 0.97346329432242
Energy: 0.9751899316701804
Energy: 0.9729971903854492
Energy: 0.9722462814250444
Energy: 0.9634376797618982
Energy: 0.9538096274426248
Energy: 0.9737673416538671
Energy: 0.9638493252600583
Energy: 0.9754414486541358
Energy: 0.9535470747478809
Energy: 0.9117494665910174
Energy: 0.9135716526267681
Energy: 0.9542077397858879
Energy: 0.9559185480582124
Energy: 0.9461966274154777
Energy: 0.9532965538427043
Energy: 1.0012273767721613
Energy: 1.001547670043899
Energy: 0.9532389330772447
Energy: 1.0038319760378362
Energy: 0.9626670674445452
Energy: 1.1041492207975978
Energy: 0.9220986344892352
Energy: 0.9100690862749516
Energy: 1.1051905729958267
Energy: 0.919389237018511
Energy: 1.0308770496381665
Energy: 1.0353745154889127
Energy: 0.9571117701588122
Energy: 0.9739397056922012
Energy: 1.0361108651622448
Energy: 0.9562381614102126
Energy: 1.0277407263843588
Energy: 1.2218140702912257
Energy: 0.9153429086895304
Energy: 0.915436652337146
Energy: 1.2232713822774102
Energy: 0.9154503587695095
Energy: 0.9305017849635473
Energy: 1.1277727801998316
Energy: 0.9321189007456583
Energy: 0.9323511279447896
Energy: 0.9663170870924134
Energy: 0.9319671885097924
Energy: 0.932095860043808
Energy: 1.1274770566030405
Energy: 0.9679093408134849
Energy: 0.927063486655164
Energy: 0.9657399493503187
Energy: 0.9749657581740604
Energy: 0.9873352727179604
Energy: 1.092339324645816
Energy: 0.9106423142099482
Energy: 0.9543142065763133
Energy: 1.0949709772464427
Energy: 0.9165957606723054
Energy: 0.9516648779059231
Energy: 0.9531326188755892
Energy: 0.9113301096123066
Energy: 0.9133880033912928
Energy: 0.9534321183014269
Energy: 0.9112912141371735
Energy: 0.9132497251771667
Energy: 0.9477427225151807
Energy: 0.9098185658358958
Energy: 0.9510278780366092
Energy: 0.9490834062063312
Energy: 1.0833744846605782
Energy: 0.950112818648766
Energy: 0.9428780295336151
Energy: 0.9783827431210543
Energy: 1.0482645919375284
Energy: 0.9461417772666401
Energy: 0.9857754061327315
Energy: 0.9894875145295827
Energy: 0.964932610387785
Energy: 0.9505773635183227
Energy: 0.9502924654303323
Energy: 0.949725714745788
Energy: 0.9517332689787675
Energy: 0.9577599079634186
Energy: 1.4440393068181994
Energy: 0.9536032942898782
Energy: 0.9545686221352188
Energy: 1.4454939941239902
Energy: 0.9535719321727957
Energy: 0.9360155683688258
Energy: 0.9898660991380148
Energy: 0.9530047853356721
Energy: 0.9531239316498475
Energy: 1.1242839259854132
Energy: 0.9970619619633203
Energy: 0.9902573393205898
Energy: 1.0762096575240363
Energy: 1.008541347819785
Energy: 0.9809729493008881
Energy: 1.0774841592444433
Energy: 1.0109519214334468
Energy: 0.9534082938243422
Energy: 0.9316025589694639
Energy: 1.007572523749002
Energy: 1.014121063988023
Energy: 0.9316275188189764
Energy: 1.0111925193633762
Energy: 0.9730929860404184
Energy: 0.9144970562987706
Energy: 0.9973970883157081
Energy: 0.915870242099073
Energy: 0.915905856351638
Energy: 1.1003081794149625
Energy: 0.9154381723721755
Energy: 1.1603776452267924
Energy: 0.9863553743992935
Energy: 0.9857144101294153
Energy: 1.1603455146159134
Energy: 0.9774138048252353
Energy: 0.9331012041854848
Energy: 1.0652686764050783
Energy: 0.9491314949284841
Energy: 0.9497803909854879
Energy: 1.0691892088350992
Energy: 0.950189595476204
Energy: 0.9102896855064444
Energy: 1.8630817991556488
Energy: 0.9932772328845902
Energy: 0.9504981159435867
Energy: 0.9109147680644972
Energy: 0.9930625981738305
Energy: 0.9132929502329209

minimum gb energy = 0.9097681865128148 eV
minimum distance =  2.24084456462512 Angstroms
sigma value = 67


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

Energy: 1.1371109320630128
Energy: 0.9394500596404798
Energy: 0.9345787117395292
Energy: 1.1413083250246103
Energy: 0.9393844299762564
Energy: 0.935481731786992
Energy: 1.2385867097521395
Energy: 0.8271153574452361
Energy: 0.8266785610523752
Energy: 0.9967242486107383
Energy: 0.996947280481026
Energy: 0.8265158368252583
Energy: 0.9844209389837715
Energy: 0.8885470230345524
Energy: 0.8270882139141501
Energy: 0.9846098297027611
Energy: 0.8898534884943167
Energy: 0.8272186662854021
Energy: 0.9724954509585239
Energy: 0.8264106889922131
Energy: 0.8271476655466743
Energy: 0.9727503128064809
Energy: 0.9527554911462595
Energy: 0.8276613551237755
Energy: 0.9310707842862231
Energy: 0.9322290199406285
Energy: 0.9323987952914145
Energy: 0.9312091749106324
Energy: 0.9349844967409259
Energy: 0.9314552032552207
Energy: 0.9318953121387344
Energy: 0.9070571813948424
Energy: 0.9386457883052275
Energy: 0.9315631741878234
Energy: 0.907094434586422
Energy: 0.9326097827292271
Energy: 1.1363789639738737
Energy: 0.826427047569441
Energy: 0.8272506908177819
Energy: 1.136551595054453
Energy: 0.9964643793375461
Energy: 0.8275995094647648

minimum gb energy = 0.8264106889922131 eV
minimum distance =  2.37354336788136 Angstroms
sigma value = 3


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

Energy: 1.4780337482227552
Energy: 1.3416527477883082
Energy: 1.1008983795185998
Energy: 1.481725928253679
Energy: 1.350722063420283
Energy: 1.1228686055786439
Energy: 1.304695584311914
Energy: 1.0482303656648277
Energy: 1.029056661341658
Energy: 1.2280308922496435
Energy: 1.0596897384363981
Energy: 1.0288143393611713
Energy: 1.2105588278201511
Energy: 0.9499227128896944
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Energy: 1.2110973376545648
Energy: 1.2925788221232353
Energy: 1.1776920349555704
Energy: 0.9696081755560189
Energy: 1.0427215276262902
Energy: 0.9673585590003984
Energy: 0.9713573113446986
Energy: 1.0507944114458208
Energy: 0.9674536931189085
Energy: 0.9568774900061094
Energy: 1.152636226021554
Energy: 0.9570773314946259
Energy: 0.957377972270881
Energy: 1.1110119421473914
Energy: 0.9559529698334036
Energy: 1.1361113270622536
Energy: 1.1608193053707654
Energy: 1.0855632908735464
Energy: 1.1381828197294728
Energy: 1.2221853166418568
Energy: 1.117521617031884
Energy: 1.2481094427563848
Energy: 1.0554123373282727
Energy: 1.0532317335136157
Energy: 1.2335195251614046
Energy: 1.0683865012025082
Energy: 1.1132000932467279
Energy: 1.3835113230257614
Energy: 1.453007819003698
Energy: 1.07341863368171
Energy: 1.3869554529878934
Energy: 1.4350301659731237
Energy: 1.1976951722599598
Energy: 1.228583670047916
Energy: 1.053262374928645
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Energy: 1.2297251334544423
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Energy: 0.9832439777587647
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Energy: 1.4838444070667394
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Energy: 1.0871141222124567
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Energy: 1.0918666817759155
Energy: 1.0469168699764828
Energy: 1.1228155617398414
Energy: 1.0274219196860315
Energy: 1.0471527231225215
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Energy: 1.09266435026172
Energy: 1.142506530315922
Energy: 1.026040742293432
Energy: 1.0254425990774583
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Energy: 1.1193848572083476
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Energy: 1.2127205802380558
Energy: 0.9669750255866469
Energy: 0.967493316419727
Energy: 1.213404910756466
Energy: 0.9692333675429818
Energy: 1.1859648864905028
Energy: 1.2334273335953
Energy: 1.0405641122973288
Energy: 1.0383453431174514
Energy: 1.1600366038100354
Energy: 1.2828476720815303
Energy: 1.0379038863747259
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Energy: 1.053940057763615
Energy: 1.0772731978130077
Energy: 1.2658886114288304
Energy: 1.3847366264573127
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Energy: 1.233589843917019
Energy: 1.0802244395747003
Energy: 1.0388358479241722
Energy: 1.2273958146881674
Energy: 1.063567067855341
Energy: 1.0258630591325282
Energy: 1.0483073390971505
Energy: 1.197503388600347
Energy: 1.1361829640155963
Energy: 1.2727717985188616
Energy: 1.2651395265008345
Energy: 0.9832106696690163
Energy: 1.3052612069593716
Energy: 1.0227781758003278
Energy: 1.0230132436742272
Energy: 1.2727700085084899
Energy: 1.0231213399426988
Energy: 0.9731125845614064
Energy: 1.1863712281449132
Energy: 1.0398200957837256
Energy: 1.0385832328475704
Energy: 1.1864578713859162
Energy: 1.011446883058704
Energy: 1.0279797004317428
Energy: 1.1103079370951396
Energy: 1.1257920038540323
Energy: 1.107749702769727
Energy: 1.1131026027098647
Energy: 1.1275451358453594
Energy: 1.1388166856245387
Energy: 1.0235006152578296
Energy: 1.0287341382985014
Energy: 1.0364746987014652
Energy: 1.0249850316825366
Energy: 1.1203242244628837
Energy: 1.049952319212535
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Energy: 1.15350347668436
Energy: 1.0279805125463461
Energy: 1.390074479095158
Energy: 1.0222888700718473
Energy: 1.2847228966124986
Energy: 1.0287951561402624
Energy: 1.0510379945223833
Energy: 1.2866035971863525
Energy: 1.1216677904462355
Energy: 1.0401084703004204
Energy: 1.2658089661878387
Energy: 1.2634282600004119
Energy: 1.2074697355863047
Energy: 1.0555911209321713
Energy: 1.2552557321030502
Energy: 1.0578372544848578
Energy: 1.066840606348592
Energy: 1.1945147875534985
Energy: 1.2637041243624658
Energy: 1.1132198785960887
Energy: 1.1958564036863844
Energy: 1.0592838330252476
Energy: 1.2609779590146377
Energy: 1.0388670469144112
Energy: 1.0410663730987466
Energy: 1.253833729342834
Energy: 1.0473074127935116
Energy: 1.0413693250148572
Energy: 1.0524134201087363
Energy: 1.0428235057306807
Energy: 1.0438116073747536
Energy: 1.0537201044677005
Energy: 1.294495000024268
Energy: 0.9719301695530776
Energy: 0.9732779334606936
Energy: 0.9504966279642845
Energy: 0.9620998048449181
Energy: 0.9700697162025516
Energy: 1.0477293734038635
Energy: 0.9559199622463247
Energy: 1.100831651105141
Energy: 1.2111911915044338
Energy: 1.0371747758702254
Energy: 1.0973827257686364
Energy: 1.2134308691476259
Energy: 1.0268511270972354
Energy: 1.222676885569232
Energy: 1.0578078258628705
Energy: 1.115366428119308
Energy: 1.2249328886223223
Energy: 1.0639011241660274
Energy: 1.1142607099809672
Energy: 1.3897636357011753
Energy: 1.1211723504699789
Energy: 1.120356364279656
Energy: 1.3912168455641
Energy: 1.1195822074175872
Energy: 1.0660610228804088
Energy: 1.112444459136332
Energy: 1.2614141501147818
Energy: 1.05474845261223
Energy: 1.1347765666201666
Energy: 1.343096619317086
Energy: 1.0962691180333812
Energy: 1.2205658306174783
Energy: 1.0883944610300145
Energy: 1.0871766873750741
Energy: 1.226778021405079
Energy: 1.0631167660279566
Energy: 1.092506043045731
Energy: 1.126677609444482
Energy: 0.9834755277391285
Energy: 1.096875114685835
Energy: 1.126513210578957
Energy: 1.4837640187696992
Energy: 1.1107704138939034
Energy: 1.0515109606976722
Energy: 1.029444970174343
Energy: 1.1033396635073498
Energy: 1.0542001754013397
Energy: 1.2277165035067104
Energy: 1.113772488600771
Energy: 1.137320257456526
Energy: 1.026164510797942
Energy: 1.0911994351041834
Energy: 1.1401149386586023
Energy: 1.0257457020330254
Energy: 1.1143400640134034
Energy: 1.1151171010211793
Energy: 0.9541503847580833
Energy: 0.9547109631907028
Energy: 1.1179399595848594
Energy: 0.9640568179246224
Energy: 0.9567457958854961
Energy: 1.2184282726602225
Energy: 0.9678301075449784
Energy: 0.9694305454315045
Energy: 1.2195921760951436
Energy: 0.9676537818333223
Energy: 0.9695316441502267
Energy: 1.0448444229377878
Energy: 1.1489517869057706
Energy: 0.9702185547348215
Energy: 1.0457211962916193
Energy: 1.2615990707450053
Energy: 1.0432066310158803
Energy: 1.1584810391828315
Energy: 1.0943531694885595
Energy: 1.1081767109864815
Energy: 1.158662467704898
Energy: 1.0697147841213583
Energy: 1.0277311666395514
Energy: 1.3493410822704845
Energy: 1.039833934569551
Energy: 1.134027303136813
Energy: 1.3509499127231508
Energy: 1.3768509757319884
Energy: 1.1511343456916117
Energy: 1.3046598846447355
Energy: 1.0509253862537467
Energy: 1.0400183034147448
Energy: 1.3062117212038176
Energy: 1.2853999429677128
Energy: 1.030450149483966
Energy: 1.287025947177729
Energy: 1.028681239398915
Energy: 1.1003633954643437
Energy: 1.2903930597997066
Energy: 1.0282088032109762
Energy: 1.095754297387719
Energy: 1.1880796613727493
Energy: 1.0233561794638952
Energy: 1.0393614147721295
Energy: 1.189553479898892
Energy: 1.0237232705017352
Energy: 1.04699106218168
Energy: 1.124900241143638
Energy: 1.127630833275402
Energy: 1.1275656486876644
Energy: 1.1274516413713978
Energy: 1.1111338375018625
Energy: 1.1105301063545596
Energy: 1.0063023697142255
Energy: 1.110622523980082
Energy: 1.0262820695223351
Energy: 1.0061491638215707
Energy: 1.1340251829288457
Energy: 1.0266279995426473
Energy: 1.071232625959273
Energy: 1.0413072086315256
Energy: 1.0430406345056964
Energy: 1.0307441000820463
Energy: 1.179266355782579
Energy: 1.0219435064953002
Energy: 1.2803677405212197
Energy: 0.9685407157624947
Energy: 0.9580949938641145
Energy: 1.281665896603762
Energy: 1.0308813768954255
Energy: 1.1371249143820377
Energy: 1.2852503949196015
Energy: 1.1159892744802495
Energy: 1.045730713116922
Energy: 1.2851859637377432
Energy: 1.1162742854144332
Energy: 1.029111230852572

minimum gb energy = 0.9499227128896944 eV
minimum distance =  2.26861845038752 Angstroms
sigma value = 81


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

Energy: 1.5009079591249241
Energy: 0.9905996899396683
Energy: 0.9838060888978405
Energy: 1.5036276203094288
Energy: 0.990810574743579
Energy: 0.9841484875720133
Energy: 1.1421495990057595
Energy: 0.9780355431318278
Energy: 1.0131298961590265
Energy: 1.1118656726037988
Energy: 0.9772537048016098
Energy: 1.0141764094763692
Energy: 1.1336984164219759
Energy: 1.011109698172718
Energy: 1.0186572353410648
Energy: 0.995272739189685
Energy: 1.0109036316847353
Energy: 1.0611835470644775
Energy: 0.9719401854888521
Energy: 1.0121838226063296
Energy: 0.9664322736644522
Energy: 0.9726673759830734
Energy: 1.0113935159900358
Energy: 0.9667293587682301
Energy: 0.9722981328796423
Energy: 1.0312517253240323
Energy: 1.0052939476929124
Energy: 0.9702543329614615
Energy: 0.9913183883607811
Energy: 0.9635880089974357
Energy: 1.0090446355436633
Energy: 1.032180664335155
Energy: 1.032119192786219
Energy: 1.0089534237600801
Energy: 1.0315729178154671
Energy: 1.0091139887081728
Energy: 1.124536853842491
Energy: 0.9893248745671451
Energy: 0.9888320087863973
Energy: 1.1240321474281638
Energy: 0.9893141253230732
Energy: 1.0141786044357706
Energy: 1.2454080978699755
Energy: 1.1184954536507001
Energy: 1.1185823875919136
Energy: 1.2474163126902937
Energy: 1.1181325092642047
Energy: 0.9925337539944454
Energy: 1.1148049753245501
Energy: 1.0012305296599529
Energy: 1.0203469763557154
Energy: 1.116595844661068
Energy: 1.002076795692147
Energy: 1.0178589654519292
Energy: 1.0090138883010984
Energy: 0.9537500622126741
Energy: 0.9547816411433646
Energy: 1.0092714192247592
Energy: 1.2576569810334541
Energy: 0.9857567117920499
Energy: 1.021764193773388
Energy: 0.9549616797333507
Energy: 0.9540528727182641
Energy: 0.9893102380350032
Energy: 1.2374585695413967
Energy: 1.0085624030541427
Energy: 1.0119230147242526
Energy: 0.9960008225547166
Energy: 1.0007506707659095
Energy: 1.0120135123925738
Energy: 1.1353604777318875
Energy: 1.032340318725752
Energy: 1.0103373352624059
Energy: 0.9931463669001745
Energy: 0.9932920373690511
Energy: 1.0133958315139846
Energy: 0.9935595403433766
Energy: 1.1303532048675724
Energy: 1.110386742832805
Energy: 0.968162519196047
Energy: 0.9687528598009915
Energy: 1.110156832354448
Energy: 0.9703542363838715
Energy: 0.9663772424268918
Energy: 1.2614675853426907
Energy: 1.0091319029241936
Energy: 0.9942998325119169
Energy: 1.262314369796457
Energy: 1.0088527840524253
Energy: 1.0013108347453472
Energy: 1.1119458103390547
Energy: 0.9653883676959955
Energy: 1.0154963734386329
Energy: 1.1105358652887638
Energy: 1.1199500596516603
Energy: 1.0163934940445405
Energy: 1.1037650312223817
Energy: 1.2492248832936903
Energy: 0.9924971483582167
Energy: 1.1040216826444322
Energy: 1.2516522514355135
Energy: 0.9922979331910193
Energy: 1.136232093982506
Energy: 1.0143266426092896
Energy: 1.0160799819559874
Energy: 1.136134740604571
Energy: 0.9784140161034912
Energy: 1.0162579175393833
Energy: 1.237999800160746
Energy: 1.0089326785110684
Energy: 0.9537596723643532
Energy: 1.0174157075336456
Energy: 1.0085943506628252
Energy: 0.9538773679860018
Energy: 0.9571083064787225
Energy: 0.9882644423557496
Energy: 0.9553757459809846
Energy: 1.0160707447681343
Energy: 0.9876887463986577
Energy: 0.9540541877181627
Energy: 1.1375449951783254
Energy: 1.0150605175363887
Energy: 1.014775758395311
Energy: 1.1371255783012415
Energy: 0.9779048084345089
Energy: 1.0114300876699143
Energy: 0.9935880691385666
Energy: 1.016874756544476
Energy: 1.1295648422658726
Energy: 0.9937910248910513
Energy: 1.0161142872973397
Energy: 1.1310121224892085
Energy: 0.9708962343345109
Energy: 1.0051609783157236
Energy: 0.9652342628375906
Energy: 0.9723274542773598
Energy: 0.981772737936087
Energy: 0.9651979465539694
Energy: 0.9925825908080866
Energy: 1.03213452106303
Energy: 0.9965625193058075
Energy: 0.9928804780647464
Energy: 1.262932006689234
Energy: 0.9942597283935873
Energy: 1.1261131249211114
Energy: 1.0145122650523615
Energy: 1.0146431723365794
Energy: 1.17434387014497
Energy: 1.11251304773156
Energy: 1.0101776764417842
Energy: 1.243869008553893
Energy: 1.103758840316503
Energy: 1.103962687224433
Energy: 1.2460054832728849
Energy: 1.1036520350189356
Energy: 1.0629430811492278
Energy: 1.0535859399431982
Energy: 0.9878277048336545
Energy: 0.9875547558491559
Energy: 1.0487814357104306
Energy: 1.1366392621394308
Energy: 1.0317559885188274
Energy: 1.1276603892484922
Energy: 0.9555029306223181
Energy: 1.0160797137252675
Energy: 1.1273388381079614
Energy: 1.2378223171248879
Energy: 1.0139562138746572
Energy: 0.9890866450742035
Energy: 0.9545309768615812
Energy: 0.9567843955943631
Energy: 0.9893998053930116
Energy: 1.4936546821797758
Energy: 0.9861021286872442
Energy: 0.9809127803588764
Energy: 1.0180802195257679
Energy: 1.0168640119170835
Energy: 0.9819185643216483
Energy: 0.9776526717715297
Energy: 1.0158389142836257
Energy: 1.0104762397697333
Energy: 0.9944975551094388
Energy: 1.0630454844216763
Energy: 1.0123210678095849
Energy: 0.9947981492199189
Energy: 1.1309432917008237
Energy: 0.9882871206428099
Energy: 0.9685788510668081
Energy: 0.9683932434190817
Energy: 0.9882199292548087
Energy: 0.97025892933173
Energy: 0.9685926325762885
Energy: 1.2588460838422881
Energy: 0.9954563496106807
Energy: 0.9657898088123644
Energy: 0.9881524416781018
Energy: 0.9941045650295984
Energy: 0.9637144169465074
Energy: 0.9983920231733788
Energy: 1.1366462156297579
Energy: 1.0094818817845381
Energy: 1.1030056106747577
Energy: 1.1363889496731505
Energy: 1.0153779584625464
Energy: 0.9884594738047231
Energy: 1.0148952624573064
Energy: 1.0179572122790677
Energy: 0.9885016940809219
Energy: 1.0487367239408156
Energy: 0.999223477116066
Energy: 1.1195617329555982
Energy: 1.0280837407614611
Energy: 1.0271942678908224
Energy: 1.119351172398259
Energy: 0.9835403771333244
Energy: 1.1036868339518764
Energy: 1.1419959201690464
Energy: 0.9776367172355656
Energy: 1.014056758467683
Energy: 1.143108890915824
Energy: 1.1226351866362103
Energy: 1.0153118071262035
Energy: 1.5022408056373198
Energy: 1.0093341471698891
Energy: 0.9840893511039859
Energy: 1.5039319042776773
Energy: 1.0086296060836337
Energy: 0.9843016285147451

minimum gb energy = 0.9537500622126741 eV
minimum distance =  2.33813171173922 Angstroms
sigma value = 43


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

Energy: 1.569951130283649
Energy: 1.31281354756134
Energy: 1.177759416996496
Energy: 1.5730349410824762
Energy: 1.360004272224083
Energy: 1.1340172515824083
Energy: 1.2443950042510261
Energy: 1.110724948614311
Energy: 1.176195769230486
Energy: 1.181335227251124
Energy: 1.0636889485354952
Energy: 1.085524558785594
Energy: 0.9883760893619871
Energy: 0.9832979360568376
Energy: 0.983012316754557
Energy: 0.9882455137429156
Energy: 1.1530930737136085
Energy: 1.1265159032571608
Energy: 0.9875854780056413
Energy: 1.0720294711837308
Energy: 0.9877612765751567
Energy: 0.9886607094201678
Energy: 1.153321975964575
Energy: 0.9865810995431383
Energy: 0.9795000183361646
Energy: 1.102257577082852
Energy: 1.1426444955469337
Energy: 0.9797901993498417
Energy: 1.1143594361737088
Energy: 0.9764407149375
Energy: 1.112932673610561
Energy: 1.085188935926483
Energy: 1.0848309845824828
Energy: 1.1132363199525304
Energy: 1.0839886576080635
Energy: 1.1464364032916958
Energy: 1.193804623255747
Energy: 0.9897095300562827
Energy: 0.9897304901005068
Energy: 1.1685245205291537
Energy: 0.9896232919217419
Energy: 0.9896337553724304
Energy: 1.3014479254547264
Energy: 0.9872427938880325
Energy: 0.9894820153528178
Energy: 1.3028240101293984
Energy: 0.987711431036588
Energy: 1.2643602164288614
Energy: 1.1091019037811118
Energy: 0.9924212095533907
Energy: 0.9928658709240974
Energy: 1.1090511213890106
Energy: 1.2748698129092593
Energy: 1.0849403785602474
Energy: 1.2478624810764123
Energy: 1.0664472251201336
Energy: 1.1466768437172712
Energy: 1.157032238096898
Energy: 0.983896278443373
Energy: 1.1313429626696776
Energy: 1.1301153965499227
Energy: 1.1674733540336586
Energy: 1.1677461040708184
Energy: 1.1298400710180665
Energy: 1.3067113239351258
Energy: 1.098269767678379
Energy: 1.2019264888595556
Energy: 1.1467905800585847
Energy: 1.0179459558078965
Energy: 1.1441516886226197
Energy: 1.23224592385443
Energy: 1.0131142869279348
Energy: 1.3933406702916724
Energy: 1.0443343757159205
Energy: 1.0140462609281675
Energy: 1.0591073764499561
Energy: 1.0436979652318195
Energy: 1.0116698668416173
Energy: 1.1563441597239876
Energy: 1.0574569591168061
Energy: 1.0852665399523327
Energy: 1.1589219328654687
Energy: 1.0573586769943657
Energy: 1.1078122480644172
Energy: 1.0787512527834997
Energy: 1.1745503249932416
Energy: 1.0789479210033837
Energy: 1.0785666535029241
Energy: 1.1160386829660567
Energy: 1.0793179376549011
Energy: 0.9814630674064737
Energy: 0.9678181554627672
Energy: 0.9809828539987493
Energy: 0.9812034388831108
Energy: 1.1485621640725963
Energy: 0.9798576041951381
Energy: 1.0417058601774443
Energy: 0.9689559007432001
Energy: 0.9712327914650247
Energy: 1.0417993028453036
Energy: 1.1767540003581856
Energy: 1.041966733277344
Energy: 1.2233211292094088
Energy: 1.1588254427817932
Energy: 1.1611984106007367
Energy: 1.2233492021613834
Energy: 1.1498781321394318
Energy: 1.0859076360530824
Energy: 1.1577171553782444
Energy: 1.1136508730974921
Energy: 1.1091822814364198
Energy: 1.1580701921126588
Energy: 1.126275202468554
Energy: 1.040508132548705
Energy: 1.2168289316927154
Energy: 1.0418291302596943
Energy: 1.109537415290919
Energy: 1.2151316276365325
Energy: 0.969385874153906
Energy: 1.0339282104132668
Energy: 1.1984036271284975
Energy: 1.170205850104907
Energy: 1.1700481567409233
Energy: 1.1981410533170405
Energy: 1.2459561842672846
Energy: 1.1704441212035435
Energy: 1.1432956218124937
Energy: 1.055517448596805
Energy: 1.2155733168933964
Energy: 1.1438741301904698
Energy: 1.372864262859688
Energy: 1.2124672438917758
Energy: 1.1319333430243006
Energy: 1.094234520557178
Energy: 1.1712188329469257
Energy: 1.131342511083673
Energy: 1.234132156550864
Energy: 1.1708140022262439
Energy: 1.2321843679288307
Energy: 0.9708469982751312
Energy: 1.153660587307604
Energy: 1.2323666519863457
Energy: 0.9707294790621148
Energy: 1.110088643121911
Energy: 1.142093609378037
Energy: 0.9816386748244953
Energy: 0.9816783436842836
Energy: 1.1893682513191042
Energy: 0.9815923804113942
Energy: 0.9679975626817648
Energy: 1.1845774496558394
Energy: 0.956769127835693
Energy: 0.9572035742982877
Energy: 1.1845779352022523
Energy: 0.9566710471777901
Energy: 1.020635050566896
Energy: 1.1804935752239731
Energy: 1.078163832409316
Energy: 1.0953147322593275
Energy: 1.1816320774039144
Energy: 1.1369106995725315
Energy: 1.1938685802274895
Energy: 1.0528717117945974
Energy: 1.1319405941940912
Energy: 1.0838133735167386
Energy: 1.053718562433516
Energy: 1.135358437707941
Energy: 0.9876510964544216
Energy: 0.987550430870732
Energy: 0.9835724455744134
Energy: 1.0527628063802652
Energy: 0.987627900631805
Energy: 1.2994109259363809
Energy: 1.0595770678888605
Energy: 1.2420212079018123
Energy: 1.1099370317308976
Energy: 1.0839263441923863
Energy: 1.2420477559986935
Energy: 1.135962593019572
Energy: 1.0857126305703544
Energy: 1.5617297922065296
Energy: 1.1293422167422031
Energy: 1.1216966958370223
Energy: 1.5650515655691135
Energy: 1.1282646967214756
Energy: 1.1430072087234033

minimum gb energy = 0.9566710471777901 eV
minimum distance =  2.20366869088022 Angstroms
sigma value = 57


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

Energy: 1.140340327265396
Energy: 1.046510872604781
Energy: 1.0300268776807309
Energy: 1.1417721814661723
Energy: 1.0481357979485357
Energy: 1.0292542898258599
Energy: 1.1310312784202856
Energy: 1.0388231052007848
Energy: 0.9763303224245614
Energy: 1.1310074707773226
Energy: 1.0385964660921287
Energy: 1.0771916228528806
Energy: 1.2176207656694509
Energy: 1.0708652570011619
Energy: 1.0087713266314813
Energy: 1.219056987637598
Energy: 1.141498296595149
Energy: 1.010264148084482
Energy: 0.9614125874891943
Energy: 1.0700584779426836
Energy: 0.9138091782102552
Energy: 0.9617941339209364
Energy: 1.1645496434031728
Energy: 0.9645645310984583
Energy: 0.9747325017383186
Energy: 0.9584377347083534
Energy: 0.9589878282372458
Energy: 0.9747650071349466
Energy: 1.0982744002645028
Energy: 0.9583940370444402
Energy: 1.0829731483818412
Energy: 1.053863219772339
Energy: 0.9590879805227998
Energy: 1.1219122210637824
Energy: 1.1036391372181154
Energy: 1.066021089827356
Energy: 1.1733381750477243
Energy: 0.9641849676565083
Energy: 0.9631336234867053
Energy: 1.1733879496485902
Energy: 0.9649139626792623
Energy: 0.974261176418945
Energy: 1.114255547531722
Energy: 1.247789935422851
Energy: 1.2340683890785749
Energy: 1.1127194281572028
Energy: 1.250620639661103
Energy: 1.2493316778454058
Energy: 1.0490084069387116
Energy: 0.9749100842867813
Energy: 0.9761534880193679
Energy: 1.049168816458498
Energy: 1.0827155577289662
Energy: 1.0290964408189243
Energy: 1.0490672941957586
Energy: 1.0180684775216549
Energy: 1.1023544935636058
Energy: 1.049868003740806
Energy: 1.37050724271514
Energy: 1.1021669282802171
Energy: 1.1332892005424415
Energy: 1.0643897017007533
Energy: 1.0713553760904302
Energy: 1.1325822570253892
Energy: 0.9833521119848613
Energy: 1.0503538591125525
Energy: 0.9172674800223781
Energy: 1.115068882843023
Energy: 1.0512470810240637
Energy: 0.9115818879235544
Energy: 1.1171108522019098
Energy: 1.0051565999980563
Energy: 1.253163898430153
Energy: 1.0494903429927316
Energy: 1.1710625570106743
Energy: 1.0039849824329579
Energy: 1.0490139244025607
Energy: 1.0037855009533874
Energy: 1.1311121541221894
Energy: 0.9825598087332454
Energy: 1.0282442521588342
Energy: 1.1332505845364589
Energy: 0.9816399886665343
Energy: 1.0193306339247625
Energy: 1.023709821861141
Energy: 1.183569572702648
Energy: 1.0423498528699133
Energy: 1.0239482757749436
Energy: 1.1478553381693055
Energy: 1.0435725032591248
Energy: 0.9739206940029096
Energy: 0.958723703515894
Energy: 1.008932516938143
Energy: 0.9742092217638523
Energy: 1.0510115162587186
Energy: 0.9646883314706967
Energy: 1.0968689041500808
Energy: 1.107548143058301
Energy: 1.1055368852324452
Energy: 1.097663213885768
Energy: 1.118303997252198
Energy: 1.0186414932836998
Energy: 1.1213714125122591
Energy: 0.975913651863961
Energy: 0.9753668592345992
Energy: 1.121281132276859
Energy: 0.9749915451951676
Energy: 1.0100497006345426
Energy: 1.0355096433945996
Energy: 0.9621006399522126
Energy: 0.9642219795234291
Energy: 1.036355951633023
Energy: 0.9629744550700179
Energy: 0.9625460587588958
Energy: 1.0356462702531242
Energy: 1.1321135655497803
Energy: 1.0492762874590957
Energy: 1.0365745578576417
Energy: 1.2182393226351185
Energy: 0.963514714055347
Energy: 1.048545488382635
Energy: 0.9749009086183417
Energy: 1.0287661342710281
Energy: 1.0491135018211306
Energy: 1.081296223147557
Energy: 0.9635365047459448
Energy: 1.0257570481855496
Energy: 1.1071782032039241
Energy: 1.030232968666404
Energy: 1.0273830079684108
Energy: 1.367963500160591
Energy: 1.1064946138476837
Energy: 1.131947031962669
Energy: 0.9824797765194956
Energy: 1.0284904078472832
Energy: 1.13165731942894
Energy: 1.0822212605222383
Energy: 1.0777519835360967
Energy: 1.253629276130952
Energy: 1.249202106239211
Energy: 1.0905851453274131
Energy: 1.0037118966312433
Energy: 1.2206259959469639
Energy: 1.003597747333826

minimum gb energy = 0.9115818879235544 eV
minimum distance =  2.30235486820345 Angstroms
sigma value = 17


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

Energy: 1.2614686071536871
Energy: 1.1674843968323618
Energy: 1.2344281946785294
Energy: 1.2628772995483482
Energy: 1.192533909608816
Energy: 1.0137163557538034
Energy: 1.143025246496574
Energy: 1.168437628195249
Energy: 1.0585999897265226
Energy: 1.1411044009717701
Energy: 1.13105896168956
Energy: 1.0584506033309435
Energy: 1.2299518243419962
Energy: 0.9519953721453153
Energy: 0.9543795796944307
Energy: 1.2311437468698312
Energy: 0.9514419064770334
Energy: 1.05236350882023
Energy: 1.0646225484724847
Energy: 0.9517464907020116
Energy: 0.9516516695532331
Energy: 1.0645700692999769
Energy: 1.0261462737772917
Energy: 1.0644475844963786
Energy: 1.012056114213403
Energy: 1.0101069123864939
Energy: 1.05515300622323
Energy: 1.0476441204988318
Energy: 1.071567498093347
Energy: 1.0346966536778917
Energy: 1.1005289304336066
Energy: 0.9188731115231554
Energy: 0.9191628368856982
Energy: 1.1010378777570904
Energy: 0.9193933290037827
Energy: 0.9762216134634544
Energy: 1.133649479263915
Energy: 0.917911988637549
Energy: 0.9181589844030308
Energy: 1.135304674370171
Energy: 0.9194945551521122
Energy: 0.9993772845327206
Energy: 1.074363307284344
Energy: 1.097652739006233
Energy: 1.1220294971022726
Energy: 1.0767225829638547
Energy: 1.0763340575657239
Energy: 1.1213927611345686
Energy: 0.9202291378118862
Energy: 1.0332198954441782
Energy: 0.9992559259656474
Energy: 0.9206529420691089
Energy: 1.1285988546880308
Energy: 0.9193025051659545
Energy: 0.9183334346821843
Energy: 0.9118390337801765
Energy: 0.9191557420728307
Energy: 0.9185429706958782
Energy: 0.9188184461649661
Energy: 0.9190409338927389
Energy: 1.0987952117299218
Energy: 0.9994808220402233
Energy: 1.054517777785595
Energy: 1.0988031733728771
Energy: 1.0105233642450953
Energy: 1.0546032509968928
Energy: 1.1413119179455766
Energy: 1.0637788268249508
Energy: 1.0644554536437796
Energy: 1.141560342547205
Energy: 1.0641857813123923
Energy: 1.0647277395180639
Energy: 1.2062211479225586
Energy: 1.2292602564524553
Energy: 1.2175422196461962
Energy: 1.1997830642752585
Energy: 1.2298457474426892
Energy: 1.0656523589565328
Energy: 1.1300929689562964
Energy: 1.0586496545095094
Energy: 1.0584451256061624
Energy: 1.1632086839781697
Energy: 1.1088078159709038
Energy: 1.0097287004514175
Energy: 1.1660792361018995
Energy: 1.121574367047733
Energy: 1.0960154722291227
Energy: 1.1658704131318751
Energy: 1.4494073349317074
Energy: 1.0957615755352381
Energy: 1.1587490548486774
Energy: 1.0579054200936633
Energy: 1.218860104217952
Energy: 1.158045540702832
Energy: 1.1789405840337681
Energy: 1.0645720559563954
Energy: 1.0696922348479307
Energy: 1.2168675945606757
Energy: 1.2279449641828413
Energy: 1.070933149214337
Energy: 1.23087824295039
Energy: 1.1733791006573993

minimum gb energy = 0.9118390337801765 eV
minimum distance =  2.25860442677264 Angstroms
sigma value = 17


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

Energy: 1.3340128361712427
Energy: 1.1317660619137904
Energy: 0.999725279948049
Energy: 1.3381729764952326
Energy: 1.1317048372899547
Energy: 0.9992155587928505
Energy: 1.1409843237506025
Energy: 1.103422365310936
Energy: 1.0477147151764474
Energy: 1.1382037892265735
Energy: 1.1057711645717945
Energy: 1.0480600691509303
Energy: 1.172016605873822
Energy: 0.8558050628919804
Energy: 0.9551617863005403
Energy: 1.1566472846856017
Energy: 1.14414717138103
Energy: 0.9570218133405392
Energy: 0.9909336568911828
Energy: 0.9551773670881702
Energy: 0.9557069489139162
Energy: 0.9921491098019627
Energy: 1.0861643244703445
Energy: 0.9551756358575454
Energy: 0.991181383605579
Energy: 0.9920228917871436
Energy: 0.9044764429377208
Energy: 0.991741984020802
Energy: 1.0455975553684669
Energy: 0.9078804858351645
Energy: 1.1209205369027717
Energy: 0.9089955617787132
Energy: 0.908923723881165
Energy: 1.1252919698725286
Energy: 0.9091576226718299
Energy: 0.8589124945598391
Energy: 1.0525173093630373
Energy: 0.9099287430738021
Energy: 0.9100261393259789
Energy: 1.0529784143909555
Energy: 0.9127113771221171
Energy: 0.888544990868413
Energy: 1.0108886708541083
Energy: 0.8094859770810983
Energy: 0.8327122423157031
Energy: 1.0111023829495678
Energy: 1.0279866363900447
Energy: 0.8342656235152544
Energy: 0.8466586033121363
Energy: 0.8375489449702718
Energy: 0.8453746690850339
Energy: 0.8481389093168293
Energy: 1.0624659966360952
Energy: 0.8452844831044711
Energy: 0.8332254600965971
Energy: 1.0261077357201043
Energy: 0.9164185575451306
Energy: 0.8224173418316442
Energy: 1.0120940149120892
Energy: 1.0117073260194742
Energy: 1.0187205823557257
Energy: 0.8448739463135847
Energy: 1.0124161559694178
Energy: 1.0135700549053521
Energy: 0.8443489687774788
Energy: 1.0143729988907932
Energy: 1.0477276697626097
Energy: 0.8457439899693293
Energy: 0.8456867359012866
Energy: 1.060973571782571
Energy: 0.8466780729680733
Energy: 0.8400850772142281
Energy: 1.0802831443376726
Energy: 1.0097725231500136
Energy: 0.9190480626918445
Energy: 1.0818167165770172
Energy: 1.011986757792352
Energy: 0.8332671789201126
Energy: 0.9096371438595591
Energy: 0.9384476438201731
Energy: 1.0509563268602455
Energy: 0.9102068223776185
Energy: 1.0588313858400278
Energy: 0.909316496163929
Energy: 0.9092074556726162
Energy: 1.0741116817024179
Energy: 0.8319295985206976
Energy: 0.9082283232636752
Energy: 1.076889674639287
Energy: 0.9098646740181464
Energy: 1.0727200658127638
Energy: 0.9954035997115502
Energy: 1.0173193400632305
Energy: 1.0730797023569274
Energy: 0.9943748009840712
Energy: 0.9192078639335405
Energy: 1.056150693718
Energy: 1.0488754107590796
Energy: 1.049560293139185
Energy: 1.002149933847265
Energy: 1.0492928643615362
Energy: 0.9082922107465663
Energy: 1.0218627570256364
Energy: 1.1690343400237138
Energy: 1.0702317759571254
Energy: 1.0221527412937783
Energy: 1.1705150516705982
Energy: 0.9034955460036318
Energy: 1.0757650821268518
Energy: 1.0342934604340313
Energy: 0.9209163428309053
Energy: 1.07595673800763
Energy: 1.0714073112982985
Energy: 0.9928739812700125
Energy: 1.1301973553239089
Energy: 1.0742921567433186
Energy: 0.9066398129865817
Energy: 1.1312018438929705
Energy: 1.2154717406431927
Energy: 1.1344497988608397
Energy: 1.1315628849544122
Energy: 1.0347191702401088
Energy: 1.0346408155260252
Energy: 1.1333434620466625
Energy: 1.138929554672739
Energy: 1.0485176308238517
Energy: 1.3200088750573302
Energy: 1.1713997303161154
Energy: 1.158525953691538
Energy: 1.3224572121068578
Energy: 1.1733139803144081
Energy: 0.9567687229226378
Energy: 1.1117211266257625
Energy: 1.1331065705778705
Energy: 1.0490485988179183
Energy: 1.1111685673405025
Energy: 1.1359374845709267
Energy: 1.1366195977669291
Energy: 1.1279701342000577
Energy: 0.9555031316377608
Energy: 1.047750746471704
Energy: 1.1303479129154759
Energy: 1.0205245753840293
Energy: 1.0481861598245945
Energy: 1.0558789541702338
Energy: 1.0263850707058921
Energy: 0.9559842424834134
Energy: 1.0486109541310924
Energy: 1.1225887588306507
Energy: 0.9593534893828494
Energy: 0.9945109241446836
Energy: 0.8929063216451846
Energy: 0.8972248121889594
Energy: 0.9940636522918915
Energy: 1.0443820170300997
Energy: 0.9066367826002925
Energy: 1.1176777354554257
Energy: 1.0750633666879574
Energy: 0.9965549323274643
Energy: 1.154100546082756
Energy: 1.0748975329565138
Energy: 0.8579616697665595
Energy: 1.0124318802781407
Energy: 0.9097890636358428
Energy: 0.9094004967354372
Energy: 1.0132259542580804
Energy: 0.911491777478851
Energy: 0.909951893978757
Energy: 1.0105652705769983
Energy: 0.906826792643457
Energy: 0.9542146729741371
Energy: 1.0122647354716268
Energy: 0.9085449019664349
Energy: 0.8370892325188585
Energy: 0.8476551336709558
Energy: 0.8096065903096423
Energy: 0.838442814905
Energy: 0.8475697776740777
Energy: 1.0280796189625294
Energy: 0.8382258437029294
Energy: 0.8453654808939719
Energy: 1.012515951483806
Energy: 0.9940862249221051
Energy: 0.8457675636762431
Energy: 1.0639302442256553
Energy: 0.9294570827130928
Energy: 1.0172033583880518
Energy: 1.0376037306774257
Energy: 0.9164230143480533
Energy: 1.018442001950782
Energy: 1.0115972234239863
Energy: 0.9929364250428213
Energy: 1.0616051365619321
Energy: 0.8459676167857569
Energy: 0.8452219189219974
Energy: 1.06190963073757
Energy: 0.8466395348831977
Energy: 0.8457730022620057
Energy: 1.082076407083853
Energy: 0.9444989543599986
Energy: 0.9549480561007994
Energy: 1.0840697503002805
Energy: 0.9539370163329641
Energy: 0.9510104349805353
Energy: 0.8974106610471916
Energy: 1.025012956989354
Energy: 0.9391473901240853
Energy: 0.8976445339992165
Energy: 1.0106240369653263
Energy: 0.9382517766425156
Energy: 0.9104582766119846
Energy: 0.8301410913021258
Energy: 0.9101586265418665
Energy: 0.9105547718400658
Energy: 1.0955386852193532
Energy: 0.9097405701534848
Energy: 1.0713559143516174
Energy: 0.9189561710938515
Energy: 0.918183045314807
Energy: 1.072806466911275
Energy: 1.022869102491666
Energy: 0.9043470680849998
Energy: 1.091075080564606
Energy: 1.0488425182962382
Energy: 1.0489666123443906
Energy: 1.044313967004167
Energy: 1.0497276165041134
Energy: 1.0487482815829123
Energy: 1.2092794312362485
Energy: 1.1709617407622053
Energy: 0.9070834041560466
Energy: 1.221078649671781
Energy: 1.1729168846669904
Energy: 0.906221730011237
Energy: 1.0471924978597933
Energy: 1.0357135485881623
Energy: 1.048176123691872
Energy: 1.0467843802614534
Energy: 1.1403350217905968
Energy: 1.0472987317705316
Energy: 1.1432646451230826
Energy: 0.9136083308471679
Energy: 1.0727865539313242
Energy: 1.14297702247348
Energy: 1.2145667884647153
Energy: 1.0840907305984278
Energy: 1.1282801592833567
Energy: 1.0458282199911677
Energy: 1.046571953494304
Energy: 1.129184028968159
Energy: 1.0429788317064503
Energy: 1.0479290048773062
Energy: 1.0274557693284119
Energy: 1.16856997339072
Energy: 1.048518281101115
Energy: 1.0206085634375741
Energy: 1.1708118655949202
Energy: 1.136666563406556

minimum gb energy = 0.8094859770810983 eV
minimum distance =  2.23417515969411 Angstroms
sigma value = 57


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

Energy: 1.13884781216796
Energy: 1.060103537166301
Energy: 0.9813658713315636
Energy: 1.1407721061542195
Energy: 1.06642693785637
Energy: 0.974085720741142
Energy: 1.094381010698106
Energy: 1.0358174469413706
Energy: 0.9650549749309056
Energy: 1.0941380067386608
Energy: 1.0432291887330332
Energy: 0.8973502711271429
Energy: 1.119112263526413
Energy: 0.8449484461917679
Energy: 0.8398813735504419
Energy: 1.1080989218079964
Energy: 1.0289453466669918
Energy: 0.9378486356401047
Energy: 0.9655274916223171
Energy: 0.846746259141493
Energy: 0.9374680164181367
Energy: 0.9672379142294202
Energy: 0.9697560485799774
Energy: 0.9374764456889213
Energy: 0.9355700858157325
Energy: 0.9661856133852086
Energy: 0.8966746032986597
Energy: 0.9358862495422205
Energy: 1.0397883164292576
Energy: 0.8997653522914576
Energy: 1.0358547224262817
Energy: 0.8914373226045774
Energy: 0.8808380802398004
Energy: 1.0381227409769642
Energy: 0.8917967481392955
Energy: 0.8402777530899582
Energy: 0.9693161449792471
Energy: 0.8898422491797652
Energy: 0.8909959087784494
Energy: 0.9567384208492106
Energy: 0.8916028126866424
Energy: 0.8781506423647536
Energy: 0.9693270768391469
Energy: 0.7978633169736585
Energy: 0.7867244438215054
Energy: 0.9711872101687467
Energy: 1.022446355779123
Energy: 0.8103528484433911
Energy: 0.8184733741265504
Energy: 0.8262964533869379
Energy: 0.816099215603489
Energy: 0.8205128131185443
Energy: 0.9233553171436677
Energy: 0.815838857388715
Energy: 0.8155877117801019
Energy: 0.9527014573833702
Energy: 0.9221791966701668
Energy: 0.8158361330850131
Energy: 0.9487416044780373
Energy: 0.9491114343384018
Energy: 0.9805910085135244
Energy: 0.7744425054589865
Energy: 0.9385239746012382
Energy: 0.9754483327389947
Energy: 0.7812404274311193
Energy: 0.9431329193923782
Energy: 0.9851224561358299
Energy: 0.7822495243664728
Energy: 0.7822245601699026
Energy: 0.9865303848762476
Energy: 0.7853432510020205
Energy: 0.8572533227956539
Energy: 0.9619476442034205
Energy: 0.940147910299646
Energy: 0.9430717228144102
Energy: 0.9625311218157271
Energy: 0.9655364389739032
Energy: 0.9414174672208513
Energy: 0.7827992015598887
Energy: 0.924492060553362
Energy: 0.7813319824336049
Energy: 0.7857613561992911
Energy: 0.9965156022779974
Energy: 0.7812600246610135
Energy: 0.7838824095725693
Energy: 1.064331155773128
Energy: 0.87344909017066
Energy: 0.7834662024847835
Energy: 1.0077799750893175
Energy: 0.8562580834969964
Energy: 0.9535052046086931
Energy: 0.8049935250213689
Energy: 0.96036583729788
Energy: 0.9545935223312648
Energy: 0.8047827879953176
Energy: 0.9460325017763639
Energy: 1.0200448156539184
Energy: 0.8159561148746145
Energy: 0.8162425531186669
Energy: 1.0197520959631985
Energy: 0.8158254007347219
Energy: 0.8783195643701023
Energy: 0.8884865017967317
Energy: 0.9735727115288966
Energy: 0.8112312992948998
Energy: 0.8893270717955126
Energy: 0.9701305393112885
Energy: 0.8277929021468446
Energy: 0.8890755932880776
Energy: 0.9052077490744391
Energy: 0.8883816580727792
Energy: 0.891677411571851
Energy: 0.9674557045607364
Energy: 0.888541016938522
Energy: 1.0435270366204605
Energy: 0.9147109566342791
Energy: 0.9156214437574494
Energy: 1.011199839582001
Energy: 1.091203209681147
Energy: 0.9639934899522205
Energy: 1.026245800485686
Energy: 0.967038232688883
Energy: 0.964737665305322
Energy: 1.0059574701930856
Energy: 0.9665534779821434
Energy: 0.8964473899862974
Energy: 1.1018881559058589
Energy: 1.0177203563219117
Energy: 0.9398257049484171
Energy: 1.0976041184864855
Energy: 1.0171990929339574
Energy: 0.8894748105959328
Energy: 0.9630431880000697
Energy: 1.118065035307255
Energy: 1.017398284773405
Energy: 0.9630840798877787
Energy: 1.122676635327111
Energy: 1.0170839319452947
Energy: 1.0341076339607114
Energy: 0.8831867162984837
Energy: 0.897896081883113
Energy: 1.035941580121237
Energy: 1.058021402499469
Energy: 0.9651417156340966
Energy: 1.1263867758898718
Energy: 0.8908709429233439
Energy: 0.8923502147527942
Energy: 1.1264577576558377
Energy: 1.0700856485680266
Energy: 1.0170594428393642
Energy: 1.1237133225033509
Energy: 1.0164724983101376
Energy: 1.016429350810325
Energy: 1.1219884846345576
Energy: 1.1063517641172056
Energy: 1.0173631233266072
Energy: 1.1429367605939924
Energy: 1.1196984485420818
Energy: 1.0104731439418184
Energy: 1.1455614375417107
Energy: 1.1214579770015587
Energy: 0.9378868343256939

minimum gb energy = 0.7744425054589865 eV
minimum distance =  2.25049332167426 Angstroms
sigma value = 43


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

Energy: 1.0151821469632607
Energy: 0.9638275702273577
Energy: 0.9003241925546756
Energy: 1.018161323487123
Energy: 0.9635140183387081
Energy: 0.824962274657842
Energy: 0.9817435057283252
Energy: 0.8994172797167761
Energy: 0.8653657997150052
Energy: 0.9653959936791777
Energy: 0.8995306893886654
Energy: 0.8649043419653554
Energy: 0.9529997038655522
Energy: 0.7118208284888363
Energy: 0.7639016255475254
Energy: 0.9521215384258281
Energy: 0.9053925825857848
Energy: 0.7667843727763997
Energy: 0.8669960409267209
Energy: 0.7517086785790267
Energy: 0.7657539185165276
Energy: 0.8672785263537505
Energy: 0.8576823180765357
Energy: 0.8464084404563509
Energy: 0.8675872383099585
Energy: 0.8882894809126854
Energy: 0.8079070207984489
Energy: 0.8665524275206172
Energy: 0.899966616081373
Energy: 0.796395609803991
Energy: 0.9448262226153509
Energy: 0.8067244312036592
Energy: 0.796155144822127
Energy: 0.9477395135723138
Energy: 0.8067194407653222
Energy: 0.713410179321221
Energy: 0.8618655467024935
Energy: 0.8053524112849928
Energy: 0.8052721546006615
Energy: 0.8614087002455306
Energy: 0.8066187248978803
Energy: 0.8985104405311284
Energy: 0.8615933159201786
Energy: 0.7247173301854575
Energy: 0.7131721710186012
Energy: 0.8613997971486823
Energy: 0.9059947637535696
Energy: 0.7134267786357208
Energy: 0.742342736734323
Energy: 0.7159020773075504
Energy: 0.73985635398774
Energy: 0.7446348289880347
Energy: 0.8624344102715912
Energy: 0.7398640341464887
Energy: 0.7142954016119087
Energy: 0.8314302338233709
Energy: 0.764491862110174
Energy: 0.7404685108223835
Energy: 0.8330794403386523
Energy: 0.8070948068781915
Energy: 0.8989252614487939
Energy: 0.6971834713635906
Energy: 0.6973622916938049
Energy: 0.894295595603016
Energy: 0.6968228940773024
Energy: 0.8100933487760245
Energy: 0.82301003424971
Energy: 0.6956604754971016
Energy: 0.6954956274406203
Energy: 0.8232450919524519
Energy: 0.6982798788674898
Energy: 0.8024787512649758
Energy: 0.8233139903186263
Energy: 0.7930271957886519
Energy: 0.802217302330025
Energy: 0.8226875792667009
Energy: 0.8931035330651497
Energy: 0.8037758238205626
Energy: 0.6715662694837159
Energy: 0.8327471479351284
Energy: 0.6719829507050281
Energy: 0.6740118736381824
Energy: 0.8619888602253165
Energy: 0.6711341738843299
Energy: 0.7687615167641504
Energy: 0.8296500404676552
Energy: 0.7752984009700348
Energy: 0.7675406523177033
Energy: 0.8323696508620438
Energy: 0.7681325435003744
Energy: 0.895054621008579
Energy: 0.6593296070630164
Energy: 0.6541055556482972
Energy: 0.8789001377099354
Energy: 0.6596172122095755
Energy: 0.7906506397739459
Energy: 0.8481044328306984
Energy: 0.6573879231633
Energy: 0.6588007811447769
Energy: 0.8454993242396968
Energy: 0.6572765326479114
Energy: 0.7712298461818813
Energy: 0.844171566513263
Energy: 0.8130173469249253
Energy: 0.7836252247647169
Energy: 0.8453837552598252
Energy: 0.8524728280471429
Energy: 0.7834061329014893
Energy: 0.6591385457105857
Energy: 0.8560606441895097
Energy: 0.6592441518968257
Energy: 0.6608471702794166
Energy: 0.8569177622439598
Energy: 0.6588833471025456
Energy: 0.826701442320668
Energy: 0.7801406821930262
Energy: 0.7796678751155816
Energy: 0.8270880192795652
Energy: 0.8814503509973697
Energy: 0.7892419965365076
Energy: 0.8299589990716271
Energy: 0.671447880989361
Energy: 0.6701178565594189
Energy: 0.8280278790195478
Energy: 0.6710418625529483
Energy: 0.7886686849057613
Energy: 0.9398695813959266
Energy: 0.6717811101064076
Energy: 0.6717677957515912
Energy: 0.9184201395605759
Energy: 0.6721468182425947
Energy: 0.8108118574058819
Energy: 0.696736178070292
Energy: 0.8225175872982669
Energy: 0.7823920728869062
Energy: 0.6971742735768036
Energy: 0.8235603867453613
Energy: 0.7756578723552122
Energy: 0.6971272327732978
Energy: 0.8643821541122901
Energy: 0.6968541440382693
Energy: 0.6995861044158154
Energy: 0.8648093061375235
Energy: 0.6970461366703226
Energy: 0.8313198380357392
Energy: 0.8025662007653909
Energy: 0.808600499258082
Energy: 0.8313205700452142
Energy: 0.9190128511450383
Energy: 0.809960150784745
Energy: 0.832914471284934
Energy: 0.7412475348917632
Energy: 0.7407197037013264
Energy: 0.8327805645277672
Energy: 0.7412931487960315
Energy: 0.8342712855820005
Energy: 0.924544859392274
Energy: 0.7400034978388366
Energy: 0.7400394825064994
Energy: 0.921231122823882
Energy: 0.7402777875846801
Energy: 0.7719994513361296
Energy: 0.8055494019029272
Energy: 0.8613343046641652
Energy: 0.7415934147917481
Energy: 0.8055998944286367
Energy: 0.8632033357752865
Energy: 0.7371481746809241
Energy: 0.8087222594185448
Energy: 0.738172424804709
Energy: 0.8066486421151323
Energy: 0.810646502954164
Energy: 0.8764138727677238
Energy: 0.8068653484504827
Energy: 0.9194170219780132
Energy: 0.7489975887054277
Energy: 0.7378470031345744
Energy: 0.9159732362987425
Energy: 0.9245861655574578
Energy: 0.7403582682095721
Energy: 0.908103814874345
Energy: 0.8644883082821366
Energy: 0.8072016200980725
Energy: 0.9078604449560755
Energy: 0.8649980274119267
Energy: 0.8404824390836059
Energy: 0.9802893582771495
Energy: 0.9077110736055151
Energy: 0.8068655038190502
Energy: 0.9825151883977321
Energy: 0.9071338227354068
Energy: 0.736897350656267
Energy: 0.864912440133938
Energy: 0.9521669023876103
Energy: 0.9071154712291487
Energy: 0.8652807156291096
Energy: 0.9529873086343231
Energy: 0.9067119627713495
Energy: 0.9168581702655428
Energy: 0.904609738900734
Energy: 0.807158181906818
Energy: 0.9188684788880175
Energy: 0.8600598080820071
Energy: 0.9273787015034646
Energy: 0.9528606073032064
Energy: 0.7334123901171906
Energy: 0.8042175270316598
Energy: 0.9527912092030469
Energy: 0.9353878365220458
Energy: 0.8065669595818871
Energy: 0.9423334329938248
Energy: 0.9410443103568924
Energy: 0.9065167557257386
Energy: 0.9742156730919628
Energy: 0.9658023719706648
Energy: 0.906672860893751

minimum gb energy = 0.6541055556482972 eV
minimum distance =  2.22020203211918 Angstroms
sigma value = 81


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

Energy: 0.2991999843882698
Energy: 0.5979956030033016
Energy: 0.03258755546874235
Energy: 0.034519809934475135
Energy: 0.5983058913429135
Energy: 0.2997075914761223
Energy: 0.7451074580391598
Energy: 0.595837929073091
Energy: 0.5784575627593713
Energy: 0.7669940682683496
Energy: 0.5513346990043011
Energy: 0.5959429715016287
Energy: 0.7453071252890149
Energy: 0.03222146941453928
Energy: 0.03229196965425351
Energy: 0.7651833882807106
Energy: 0.03224729202891378
Energy: 0.09136193941370643
Energy: 0.5745855185763882
Energy: 0.03241571830283457
Energy: 0.03217376126444069
Energy: 0.5866033848384145
Energy: 0.03224566244092478
Energy: 0.09202574910607753
Energy: 0.09099591600800515
Energy: 0.8022321321845868
Energy: 0.7990578730389798
Energy: 0.09270118088220564
Energy: 0.803721780582265
Energy: 0.6375351689609593
Energy: 0.03323409723947244
Energy: 0.5796769466122796
Energy: 0.03228118466677082
Energy: 0.0318951452813841
Energy: 0.5816084456201687
Energy: 0.03237534203067469
Energy: 0.7687377220931116
Energy: 0.5976441964383309
Energy: 0.5951607462903257
Energy: 0.7824353805172247
Energy: 0.5962210734025467
Energy: 0.5806096362698193
Energy: 0.7686994192458523
Energy: 0.0322949339388088
Energy: 0.032328873113841305
Energy: 0.7827797843292262
Energy: 0.03210172231036189
Energy: 0.032564843691863396
Energy: 0.5471828933403736
Energy: 0.03253708225747563
Energy: 0.09215501322175584
Energy: 0.5715191132808695
Energy: 0.03241187195628102
Energy: 0.09076121775919764
Energy: 0.29938493717244224
Energy: 0.7979754729593552
Energy: 0.7835298904331519
Energy: 0.03182812207898656
Energy: 0.7899140202876503
Energy: 0.6468832676096553

minimum gb energy = 0.03182812207898656 eV
minimum distance =  2.31786377161533 Angstroms
sigma value = 3


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

Energy: 1.096865436667353
Energy: 0.9872324760008496
Energy: 0.9734854731547511
Energy: 1.0997471829675534
Energy: 0.9872529514597709
Energy: 0.8657992380035904
Energy: 0.8994402552472629
Energy: 0.9656127404343479
Energy: 0.9256579000388848
Energy: 0.9070367673546075
Energy: 0.9667858445742621
Energy: 0.9131514431230264
Energy: 0.9681351011699567
Energy: 0.839548463981233
Energy: 0.8396052447442588
Energy: 0.9680268115640814
Energy: 0.8259714917476174
Energy: 0.9046607280181654
Energy: 0.9234640416047591
Energy: 0.8319705488721629
Energy: 0.8383951971558202
Energy: 0.9253769564624625
Energy: 0.7903719057958172
Energy: 0.8918822185215463
Energy: 0.7932778501549498
Energy: 0.907952751140872
Energy: 0.9129124784230491
Energy: 0.7570366579903514
Energy: 0.9084205289138647
Energy: 0.903232876803749
Energy: 1.0385662226463042
Energy: 0.9343323113200153
Energy: 0.8529837523848971
Energy: 1.0405535969092699
Energy: 0.9342280994110684
Energy: 0.8377053213397454
Energy: 0.8359309836016503
Energy: 0.7845495371506218
Energy: 0.7846914864979045
Energy: 0.8689265638341838
Energy: 0.7624327993790755
Energy: 0.8653539152748758
Energy: 0.9235703595232447
Energy: 0.8495657278477553
Energy: 0.8508184955677638
Energy: 0.9229668703724121
Energy: 0.9295468978606655
Energy: 0.7813285522300183
Energy: 0.8961982782833575
Energy: 0.8499209185825927
Energy: 0.8305311267340182
Energy: 0.8973425484532959
Energy: 0.7205587180522125
Energy: 0.8213127456739114
Energy: 0.7945495842861408
Energy: 0.7832844650581551
Energy: 0.7880213759476078
Energy: 0.7215105116155281
Energy: 0.8187259080765513
Energy: 0.7902375018434117
Energy: 0.9445774132711284
Energy: 0.8556312365495399
Energy: 0.854337733338358
Energy: 0.9458290995702415
Energy: 0.8419348187493148
Energy: 0.8456004200143209
Energy: 0.7447824957729622
Energy: 0.8275525946798625
Energy: 0.819717262331627
Energy: 0.7415377381468903
Energy: 0.82812432868774
Energy: 0.7227033843255715
Energy: 0.7462932447346751
Energy: 0.8195832060485976
Energy: 0.8501229166001816
Energy: 0.7463995297957076
Energy: 0.8732721686680225
Energy: 0.7898373515613369
Energy: 0.8236550839847714
Energy: 0.7028491880262819
Energy: 0.8263030326426946
Energy: 0.8164282987273739
Energy: 0.704291739723699
Energy: 0.8302916639585886
Energy: 0.8047118444045676
Energy: 0.7058273620423317
Energy: 0.7058369596938777
Energy: 0.8039423094731633
Energy: 0.7064335955711617
Energy: 0.7054895086695427
Energy: 0.878114965205517
Energy: 0.8285873450825246
Energy: 0.8280731967767595
Energy: 0.8789598656088689
Energy: 0.8026297584022897
Energy: 0.8258166546358616
Energy: 0.6873014464001387
Energy: 0.8177290594674471
Energy: 0.8309749908039356
Energy: 0.6805574177093412
Energy: 0.8119606585329417
Energy: 0.6845604342512753
Energy: 0.6849892678872486
Energy: 0.8087453957083858
Energy: 0.8102567506781352
Energy: 0.6851944374254176
Energy: 0.8339531747852829
Energy: 0.8215847348331121
Energy: 0.8514796101509013
Energy: 0.8059219152511949
Energy: 0.8170510895014212
Energy: 0.8518670290924635
Energy: 0.8072753400781414
Energy: 0.8127549078963906
Energy: 0.7854683406056421
Energy: 0.6754244025217577
Energy: 0.6804034964193639
Energy: 0.7843998242607412
Energy: 0.6809639200331027
Energy: 0.6809418521477835
Energy: 0.8089435699582801
Energy: 0.8265149534146947
Energy: 0.8278557124054252
Energy: 0.8090819202966878
Energy: 0.8197840696036597
Energy: 0.825600882778622
Energy: 0.705593789809859
Energy: 0.8280939068814527
Energy: 0.8239378676382123
Energy: 0.7059304863723785
Energy: 0.8288213065780268
Energy: 0.7047667351787338
Energy: 0.6709405550962158
Energy: 0.796585776761558
Energy: 0.8268747455464713
Energy: 0.6712702465934246
Energy: 0.8078720725162993
Energy: 0.832808169244674
Energy: 0.9193315821191088
Energy: 0.7348574485123405
Energy: 0.7910152100309751
Energy: 0.9141405999626114
Energy: 0.7358089772276543
Energy: 0.8333633814889974
Energy: 0.82729465673174
Energy: 0.7200550019754368
Energy: 0.7204590702951668
Energy: 0.8294128390954568
Energy: 0.7195826709433649
Energy: 0.7205742647296395
Energy: 0.8413858792490136
Energy: 0.8610390614135491
Energy: 0.8612074530742362
Energy: 0.8415204082115361
Energy: 0.8773568591344153
Energy: 0.8533769558823368
Energy: 0.8194552794292478
Energy: 0.8616567670194389
Energy: 0.8615975085954521
Energy: 0.8182316950257668
Energy: 0.7695037472023618
Energy: 0.8169963832522484
Energy: 0.777258098038956
Energy: 0.854721655389412
Energy: 0.8377751967983234
Energy: 0.7439155326141285
Energy: 0.8614123336692487
Energy: 0.8559984004813554
Energy: 0.9883254259866446
Energy: 0.9235363926434877
Energy: 0.8310552714175072
Energy: 0.9902621206387401
Energy: 0.9233390497523969
Energy: 0.7948433905197281
Energy: 0.8211657892379843
Energy: 0.8350677957544057
Energy: 0.8355975147437653
Energy: 0.8406844996200395
Energy: 0.8682147401396073
Energy: 0.8643653448400997
Energy: 0.9011639519583374
Energy: 0.8362048586299337
Energy: 0.8373223632609482
Energy: 0.9011467172344398
Energy: 0.9587703802580558
Energy: 0.8270941122430602
Energy: 0.9651727273905818
Energy: 0.8378598887059613
Energy: 0.8527528626452586
Energy: 0.9661446288324589
Energy: 0.7939451090745676
Energy: 0.8271861136944221
Energy: 0.8590854287816859
Energy: 0.8923725848731054
Energy: 0.8365690059031919
Energy: 0.81787457382219
Energy: 0.8923376551908472
Energy: 0.8722959541314118

minimum gb energy = 0.6709405550962158 eV
minimum distance =  2.22532093020945 Angstroms
sigma value = 67


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

Energy: 1.1237804182079154
Energy: 1.1080073416823564
Energy: 1.030442668916444
Energy: 1.125694597848276
Energy: 1.1078948374795201
Energy: 1.0291482091707036
Energy: 1.0879888886081084
Energy: 1.034964334668534
Energy: 1.0174585732209067
Energy: 1.0877331430750006
Energy: 1.0361174309043795
Energy: 1.0182382199016606
Energy: 1.092643209705315
Energy: 0.9825079147624217
Energy: 1.0418426400487923
Energy: 1.0900525679073496
Energy: 1.0662442597983943
Energy: 1.0542905839176016
Energy: 1.0121143316126637
Energy: 1.02730129617443
Energy: 1.0169981315792347
Energy: 1.0144284039956588
Energy: 1.0536177876926747
Energy: 1.0163131390283995
Energy: 0.983482421757422
Energy: 1.0350406256526528
Energy: 1.040643257301422
Energy: 0.9816548681227741
Energy: 1.0303530314781209
Energy: 1.0083083457194455
Energy: 1.0583416883420678
Energy: 1.0662189467770466
Energy: 0.9765978386516944
Energy: 1.2107419522141083
Energy: 1.0678557956376786
Energy: 0.9773485229579553
Energy: 0.9871149470557843
Energy: 0.9524537626811272
Energy: 0.9449788237440565
Energy: 0.9868985436640562
Energy: 0.9482951944507672
Energy: 0.9445018187155512
Energy: 1.015468370422214
Energy: 0.9339095080786072
Energy: 0.8703341215644127
Energy: 1.01340176838688
Energy: 1.0333727886363993
Energy: 0.9770425388040712
Energy: 0.9935483388948868
Energy: 0.9344396815636575
Energy: 0.9148788841832639
Energy: 0.993126976443259
Energy: 0.8535114018053511
Energy: 0.9732501180036238
Energy: 0.9645889655887433
Energy: 0.8909527301810619
Energy: 0.8912615330426652
Energy: 0.9577150947570162
Energy: 0.8928271004471943
Energy: 0.890941029410092
Energy: 1.0601886078935712
Energy: 0.9809461378840516
Energy: 0.9952968424894706
Energy: 1.040203939576933
Energy: 0.9691408254656648
Energy: 0.9928549546253052
Energy: 0.8299915378355418
Energy: 0.9620374199681122
Energy: 0.9995563270717963
Energy: 0.8278805217135566
Energy: 0.9429100323202315
Energy: 0.8274260166975262
Energy: 0.8317934622421064
Energy: 0.9830433351996758
Energy: 0.982425183325178
Energy: 0.831920817898647
Energy: 0.9728408006131454
Energy: 0.8171449146608373
Energy: 0.9749114549019091
Energy: 0.8983023686160099
Energy: 0.9769266180156768
Energy: 0.9766475912713304
Energy: 0.9591319775443005
Energy: 0.9823895390521992
Energy: 0.9381460427111534
Energy: 0.8335085412763938
Energy: 0.8303591866960898
Energy: 0.9372804210940231
Energy: 0.834329369560741
Energy: 0.8316256421088415
Energy: 0.9451899515890517
Energy: 0.9951545757391497
Energy: 0.9999938743132718
Energy: 0.9473487610620577
Energy: 0.9068267921359895
Energy: 0.9962969915675427
Energy: 0.8898875059714548
Energy: 0.9756102323659046
Energy: 0.9730505832761828
Energy: 0.8917019579510893
Energy: 0.9917605899579368
Energy: 0.8880916565706979
Energy: 0.8609733129731927
Energy: 0.9694198090121292
Energy: 0.967609851380392
Energy: 0.8623573421681678
Energy: 0.973119560262086
Energy: 0.9482878698692891
Energy: 1.001493835536344
Energy: 1.0101679489435877
Energy: 0.9444130008043323
Energy: 1.1138193308865518
Energy: 1.0135474744117108
Energy: 0.9080733951509254
Energy: 0.9341388582685465
Energy: 0.934968404694318
Energy: 0.9773454259614128
Energy: 0.9343437021543115
Energy: 0.9597844985753842
Energy: 0.9482625532582089
Energy: 0.9893123502973775
Energy: 0.9940169241484248
Energy: 0.9943836135296693
Energy: 0.9916473036729482
Energy: 0.9020779858631328
Energy: 0.9763677303910386
Energy: 1.092265606441901
Energy: 0.8854424764533748
Energy: 0.9945199836682328
Energy: 1.0898718190255552
Energy: 1.0708005963340652
Energy: 1.00742292066311
Energy: 1.0882273424703444
Energy: 0.9413514699817443
Energy: 0.931174890022576
Energy: 1.0882862324047002
Energy: 0.936386470315355
Energy: 0.9317307292703395

minimum gb energy = 0.8171449146608373 eV
minimum distance =  2.23421793241244 Angstroms
sigma value = 33


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

Energy: 1.3051968973422163
Energy: 1.2487264396315105
Energy: 1.240173951891097
Energy: 1.3082930971725666
Energy: 1.248993962446538
Energy: 1.0730801073580118
Energy: 1.1581164902366081
Energy: 1.1177173532107938
Energy: 1.1618380654389637
Energy: 1.159225305838586
Energy: 1.119995908244864
Energy: 1.1615838553381896
Energy: 1.126173261296685
Energy: 1.1078983382141077
Energy: 1.1132984696286656
Energy: 1.1275929446621655
Energy: 1.0899375868073193
Energy: 1.1323531605933659
Energy: 0.9879124944548565
Energy: 1.0754888324636518
Energy: 1.0699333827527016
Energy: 0.988413324474625
Energy: 1.017241509989202
Energy: 1.0765467582381576
Energy: 1.0323115659037658
Energy: 1.1429524567367506
Energy: 1.1545515557975388
Energy: 1.0324494549263266
Energy: 1.1627659671155035
Energy: 1.0880512173739163
Energy: 1.1820216004983064
Energy: 1.1584446857194561
Energy: 1.1634803502823854
Energy: 1.1837389688329238
Energy: 1.1590613072396954
Energy: 1.0496622851835038
Energy: 1.0330396802285509
Energy: 0.9871385101358341
Energy: 0.9864034133526177
Energy: 1.0329763537107601
Energy: 0.9889410366499851
Energy: 0.9931933946951206
Energy: 1.0354111137301192
Energy: 0.9659988282532402
Energy: 0.9745110410025413
Energy: 1.0102895350430763
Energy: 0.9662074956862862
Energy: 0.9942956808789577
Energy: 1.0347996673870326
Energy: 1.066127948972464
Energy: 1.0564021742229581
Energy: 1.0354477268756916
Energy: 0.9203068161113596
Energy: 1.058023831532703
Energy: 1.0160469824199436
Energy: 0.92418479779584
Energy: 0.92332679133877
Energy: 1.0169527243497563
Energy: 0.9263071045131038
Energy: 0.9224134409474617
Energy: 1.0598826313914926
Energy: 0.9622106095415796
Energy: 1.0631630575968318
Energy: 1.0622022857768152
Energy: 0.9621922864330248
Energy: 1.071228433467153
Energy: 0.9222431758640653
Energy: 1.0570097211230873
Energy: 1.091229390909531
Energy: 0.9224349383564686
Energy: 1.006789265533525
Energy: 0.9229669901930557
Energy: 0.9193573986635524
Energy: 1.0068401102908229
Energy: 1.0559374063958835
Energy: 0.9194227103006984
Energy: 1.0096624557227414
Energy: 0.902390511809598
Energy: 1.0922406550116064
Energy: 1.0521778402172839
Energy: 1.0649855182213257
Energy: 1.0943276567499278
Energy: 1.0547499306286316
Energy: 1.0714401614447386
Energy: 0.9612570203226332
Energy: 1.0319533747786962
Energy: 1.008288694995933
Energy: 0.9611999295306146
Energy: 1.036216809301785
Energy: 0.9989133823848431
Energy: 0.9740739434893367
Energy: 1.016765361064323
Energy: 1.037233405660518
Energy: 0.9736787679337507
Energy: 0.9083359896021941
Energy: 0.9640027073165249
Energy: 1.1548935005552992
Energy: 1.0171728245178797
Energy: 1.0279234953253507
Energy: 1.1271833834568532
Energy: 1.0170646661509195
Energy: 1.0494790843191424
Energy: 1.1591083475580974
Energy: 0.9920439242542153
Energy: 0.9930166861090456
Energy: 1.1588446910153183
Energy: 0.9914776897237757
Energy: 1.0577373772209275
Energy: 1.2788743851481814
Energy: 1.158062327458692
Energy: 1.170603344766968
Energy: 1.2805035893999404
Energy: 1.1570904486165499
Energy: 1.0514080271568182
Energy: 1.1103254421743864
Energy: 1.156416777101895
Energy: 1.1317519711461013
Energy: 1.1108747761918123
Energy: 1.1601792525934094
Energy: 1.1322278154440746
Energy: 1.1429257583623937
Energy: 1.075489235564558
Energy: 1.0700026128800204
Energy: 1.1437590357230163
Energy: 1.017474678603676
Energy: 1.1000180430876016
Energy: 1.137209067967196
Energy: 1.1074389350846003
Energy: 1.1014845609710195
Energy: 1.1382200608745425
Energy: 1.0748210606199335
Energy: 1.0776698601257826
Energy: 1.0311871485873347
Energy: 1.156807267005386
Energy: 1.1620105242219425
Energy: 1.032002208839154
Energy: 1.1185653017200297
Energy: 1.0885555954138233
Energy: 1.200287643566334
Energy: 1.1587495388577491
Energy: 1.1407304118931778
Energy: 1.197667022719036
Energy: 1.158119066030068
Energy: 1.0605178147007224
Energy: 1.0338949111213387
Energy: 0.9912242840951813
Energy: 0.9878631899220994
Energy: 1.0341789753276587
Energy: 0.9887178048648473
Energy: 1.0782075048903843
Energy: 1.00738154888222
Energy: 0.967054685822895
Energy: 0.9741970959903661
Energy: 1.0090994990961033
Energy: 0.9656403153001245
Energy: 1.0083726095285963
Energy: 1.0532423249427267
Energy: 1.044386099080246
Energy: 1.0561707294703342
Energy: 1.0548056735886795
Energy: 0.9198963743738628
Energy: 1.0448877713463864
Energy: 1.015276685541857
Energy: 0.9240611779763807
Energy: 0.924180036239851
Energy: 1.006165225239768
Energy: 0.9274388789494482
Energy: 0.9238194749848687
Energy: 1.059125723068018
Energy: 0.9626224808562707
Energy: 1.0706166403791664
Energy: 1.0611114717595054
Energy: 0.9622101595388537
Energy: 1.0620730664814821
Energy: 0.9218957405619328
Energy: 1.0570938599414224
Energy: 1.0841120113515794
Energy: 0.9219410624035755
Energy: 0.9985297667804994
Energy: 1.0188073222285428
Energy: 0.9220914769703089
Energy: 1.0070468318447638
Energy: 1.0215549740471543
Energy: 0.9232152818511629
Energy: 1.0095309876133307
Energy: 0.9024487620680628
Energy: 1.0776047437736538
Energy: 1.0744954625813936
Energy: 1.0649834364279167
Energy: 1.0790272417639195
Energy: 1.0647163199990852
Energy: 1.0480658686684967
Energy: 1.0351618889719825
Energy: 1.0072343885072548
Energy: 1.007003328376881
Energy: 1.0352495891094213
Energy: 1.0354090552957076
Energy: 0.9865220685378515
Energy: 0.9908862686753259
Energy: 0.9059344285516313
Energy: 0.9773640697194708
Energy: 0.9909476856854968
Energy: 0.9059169953372378
Energy: 0.9768500536184886
Energy: 1.1190711230551862
Energy: 1.01734629971716
Energy: 1.0282898439014538
Energy: 1.1196985878021448
Energy: 1.0859423223748492
Energy: 1.0280566714138466
Energy: 1.1566895160135695
Energy: 0.9923068987447401
Energy: 1.0903715115085297
Energy: 1.1582554022532416
Energy: 0.9921137815464971
Energy: 1.1088714959954344
Energy: 1.2830508689917879
Energy: 1.1582693539708162
Energy: 1.1901436924269269
Energy: 1.2851132896598847
Energy: 1.157240409130608
Energy: 1.0272786271383816

minimum gb energy = 0.902390511809598 eV
minimum distance =  2.22553998539773 Angstroms
sigma value = 41


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

Energy: 1.2061983097495785
Energy: 1.2651466359138894
Energy: 1.2436701568252764
Energy: 1.2076057544126748
Energy: 1.2064659316271116
Energy: 1.2433579032696591
Energy: 1.1551162846638803
Energy: 1.126554417554726
Energy: 1.1284540671467826
Energy: 1.1554630724908759
Energy: 1.1530443637734202
Energy: 1.1678021709064965
Energy: 1.1632090979462317
Energy: 1.1244092183120515
Energy: 1.227812378173538
Energy: 1.1645508294050244
Energy: 1.236032895906754
Energy: 1.1917377013388828
Energy: 1.1824972348924434
Energy: 1.107347329415601
Energy: 1.1082746421634633
Energy: 1.1840992417578347
Energy: 1.0523042020964684
Energy: 1.1678405633092788
Energy: 1.017664247178349
Energy: 1.1627696156729375
Energy: 1.1541927758713653
Energy: 1.0174364442484958
Energy: 1.1646420253183372
Energy: 1.213625840304463
Energy: 1.1256860819526517
Energy: 1.1815982428308078
Energy: 1.1818603257497597
Energy: 1.1271049618426856
Energy: 1.181372301967568
Energy: 1.1862692262892331
Energy: 1.0178487229624826
Energy: 1.113359737070502
Energy: 1.1113165071572233
Energy: 1.017010828840798
Energy: 1.1129103000355243
Energy: 1.0543610436492428
Energy: 1.053593261646992
Energy: 1.149181607222906
Energy: 1.112667577811692
Energy: 1.055199157797318
Energy: 1.1228098956908208
Energy: 1.0524015867842558
Energy: 1.079854837906032
Energy: 1.074027742034632
Energy: 1.1650650675026122
Energy: 1.0831458727769798
Energy: 1.0727943104456334
Energy: 1.1235149334843701
Energy: 1.0482208446567387
Energy: 1.0501716865728474
Energy: 1.0477666522935265
Energy: 1.0488194819585175
Energy: 1.0514273481790044
Energy: 1.1100872772319195
Energy: 1.0872065175974759
Energy: 1.0191551601305808
Energy: 1.1104106509569582
Energy: 1.086298404682023
Energy: 0.986615932692877
Energy: 1.1109863097127641
Energy: 1.2200083594849336
Energy: 1.1832303961189707
Energy: 1.1234015025576456
Energy: 1.1620727149815648
Energy: 1.2278371590219952
Energy: 1.1222249324197069
Energy: 1.1264381945406265
Energy: 1.1291008070309094
Energy: 1.1278719607641354
Energy: 1.1280929503994332
Energy: 1.1265250880082713
Energy: 1.1677382123738962
Energy: 1.2216093458358825
Energy: 1.1725934522172146
Energy: 1.3182142069037408
Energy: 1.2242348429270444
Energy: 1.158158392979141
Energy: 1.2080509311865193

minimum gb energy = 0.986615932692877 eV
minimum distance =  2.24477429929448 Angstroms
sigma value = 11


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

Energy: 1.630169694034939
Energy: 1.2122266398466215
Energy: 1.164542078091296
Energy: 1.6327926391813894
Energy: 1.1149715896898376
Energy: 1.2877013266556323
Energy: 1.251486609615042
Energy: 1.1097584912999072
Energy: 1.119670124114469
Energy: 1.2532011655799293
Energy: 1.1137002429858482
Energy: 1.110394529095177
Energy: 1.2694043615167059
Energy: 1.2003152342446806
Energy: 1.1273605542359069
Energy: 1.2706038437729892
Energy: 1.229193508345646
Energy: 1.2820525661707924
Energy: 1.2142917443708419
Energy: 1.205703917589483
Energy: 1.1573420097488067
Energy: 1.2163782107120837
Energy: 1.1541719261232604
Energy: 1.2132778731934917
Energy: 1.1456793758621235
Energy: 1.1025200715010115
Energy: 1.111362602673387
Energy: 1.1471739880069773
Energy: 1.102289743421868
Energy: 1.1188780131449985
Energy: 1.215952360380152
Energy: 1.148467239652808
Energy: 1.147702363839463
Energy: 1.2182580999170902
Energy: 1.1483653415604942
Energy: 1.147849728282162
Energy: 1.155647998642678
Energy: 1.1868900104330296
Energy: 1.221782889977174
Energy: 1.1481415201349114
Energy: 1.1605284306249972
Energy: 1.1476135497052282
Energy: 1.1073937189684333
Energy: 1.146273039766341
Energy: 1.2032340282897749
Energy: 1.1079074091636654
Energy: 1.1481808702572924
Energy: 1.1148529731928623
Energy: 1.147717388599841
Energy: 1.1885835271017327
Energy: 1.1871414384972117
Energy: 1.1480423802568964
Energy: 1.1860889096446479
Energy: 1.2017764906386028
Energy: 1.1477954845537317
Energy: 1.3181549341904415
Energy: 1.2462098849349057
Energy: 1.1482736295617053
Energy: 1.3161315877101352
Energy: 1.2022533599907244
Energy: 1.1300137973403668
Energy: 1.1478858325061556
Energy: 1.1539367816300137
Energy: 1.1065175092902453
Energy: 1.122218006252025
Energy: 1.1107956154789367
Energy: 1.112765782522905
Energy: 1.206877705255535
Energy: 1.215542073452008
Energy: 1.1136164872313474
Energy: 1.5050148062210222
Energy: 1.2373941079764212
Energy: 1.118961692240271
Energy: 1.1509730902166428
Energy: 1.1510461391102398
Energy: 1.1190844919834777
Energy: 1.2487746109165707
Energy: 1.109628699806728
Energy: 1.338395439742722
Energy: 1.3216098627208392
Energy: 1.3229169885960468
Energy: 1.3317624463685558
Energy: 1.3290269310831198
Energy: 1.2434148404664696
Energy: 1.11127910768769
Energy: 1.2108942403916887
Energy: 1.1196594612598079
Energy: 1.111274778526739
Energy: 1.234072565052622
Energy: 1.117272923213915
Energy: 1.1077710899124042
Energy: 1.115053542672088
Energy: 1.185392099419845
Energy: 1.1070843531059797
Energy: 1.1147083781171812
Energy: 1.1052139356737902
Energy: 1.107729961369931
Energy: 1.1097337033662589
Energy: 1.1097979275180192
Energy: 1.1053697328977503
Energy: 1.1096942846402167
Energy: 1.1430538858907016
Energy: 1.2450866916429024
Energy: 1.1752801713026673
Energy: 1.1755630659449279
Energy: 1.2570487403843584
Energy: 1.1911728807086452
Energy: 1.158347707533699
Energy: 1.1493883062200738
Energy: 1.133779111756885
Energy: 1.1473353062904423
Energy: 1.1489634553648105
Energy: 1.1180699989041825
Energy: 1.1474154843370095
Energy: 1.1454293854028665
Energy: 1.17034392420944
Energy: 1.199849781244237
Energy: 1.1449976659550152
Energy: 1.223098102475302
Energy: 1.173521653401005
Energy: 1.1464075517478978
Energy: 1.2542287989633387
Energy: 1.1423392180325618
Energy: 1.1599114472855583
Energy: 1.1938802706412237
Energy: 1.1111972042662988
Energy: 1.1119512881755014
Energy: 1.1277435966495235
Energy: 1.1407578152760711
Energy: 1.1124376483148375
Energy: 1.1480891094231513
Energy: 1.1421080464552145
Energy: 1.513565598675719
Energy: 1.1414010354254494
Energy: 1.2163538147398076
Energy: 1.5160954438276635
Energy: 1.1418439885340288
Energy: 1.216971873493483
Energy: 1.123860408994559
Energy: 1.1497965115512812
Energy: 1.1483327297795056
Energy: 1.1247431436351147
Energy: 1.1493565537478097
Energy: 1.1474334142188474
Energy: 1.186073775611366
Energy: 1.243477699822624
Energy: 1.1769716339689276
Energy: 1.1875674801582363
Energy: 1.1956858927212688
Energy: 1.20313333522175
Energy: 1.206935006549346
Energy: 1.1054857635549546
Energy: 1.1435353303125233
Energy: 1.2062529177844306
Energy: 1.1055847930026346
Energy: 1.1425205849259013
Energy: 1.1112417706399258
Energy: 1.1046234603495106
Energy: 1.1046266535936502
Energy: 1.1135184953924209
Energy: 1.1049209540675797
Energy: 1.1757292927680898
Energy: 1.2433031967225687
Energy: 1.111339144585022
Energy: 1.117425206256815
Energy: 1.1185083420809485
Energy: 1.11157588804373
Energy: 1.1179459415021908
Energy: 1.297462559617205
Energy: 1.2006417273834862
Energy: 1.1525662310974245
Energy: 1.2769637603085595
Energy: 1.2396776133098155
Energy: 1.2127680646129122
Energy: 1.2240711360920307
Energy: 1.12037139615688
Energy: 1.1106722364137382
Energy: 1.2250912379400927
Energy: 1.1203223262368218
Energy: 1.151481538896931
Energy: 1.606059435586092
Energy: 1.1123118328281165
Energy: 1.198768843637916
Energy: 1.6072988275498383
Energy: 1.1126330255274972
Energy: 1.190948173678229

minimum gb energy = 1.102289743421868 eV
minimum distance =  2.2648945317458 Angstroms
sigma value = 57


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

Energy: 1.5032185090701298
Energy: 1.1029362715751851
Energy: 1.1919988353330029
Energy: 1.505938879367067
Energy: 1.1023239384950103
Energy: 1.1915598885374974
Energy: 1.174429028863719
Energy: 1.0979419812724864
Energy: 1.0456942074540543
Energy: 1.1756595660923188
Energy: 1.1608188857166375
Energy: 1.0471561641106397
Energy: 1.202558848472675
Energy: 1.0962805096509105
Energy: 1.098041330218429
Energy: 1.2027753045580947
Energy: 1.2298763246752018
Energy: 1.1050576154231144
Energy: 1.0991112598755035
Energy: 1.0450196541407413
Energy: 1.1522141430519859
Energy: 1.100069982033458
Energy: 1.314984975754566
Energy: 1.0997270423161385
Energy: 1.043809454286899
Energy: 1.1564741721095841
Energy: 1.0986274691693674
Energy: 1.0436636361318778
Energy: 1.2017730086188019
Energy: 1.0989138919805477
Energy: 1.2384008201282588
Energy: 1.116700181977239
Energy: 1.116814843823414
Energy: 1.2403760615813069
Energy: 1.1187638280364225
Energy: 1.116862292293142
Energy: 1.1183358406384243
Energy: 1.0027530014294086
Energy: 1.0029304719822392
Energy: 1.11976151072702
Energy: 1.0065377523781518
Energy: 1.117385584525364
Energy: 1.1092729008632727
Energy: 1.0446310953878553
Energy: 1.0441667208416248
Energy: 1.1111211226466768
Energy: 1.0440345138287517
Energy: 1.0145052746278214
Energy: 1.2934620201286569
Energy: 1.0982328607033172
Energy: 1.248171097300719
Energy: 1.2939147861336344
Energy: 1.0986113699012259
Energy: 1.1521810264939587
Energy: 1.2934777495372134
Energy: 1.2006885632631126
Energy: 1.249202904967642
Energy: 1.293812299686483
Energy: 1.2043493402315533
Energy: 1.151766471752314
Energy: 1.109182774886263
Energy: 1.0448066038056258
Energy: 1.044282744886632
Energy: 1.1109897017096746
Energy: 1.0453466579699588
Energy: 1.0142323789570054
Energy: 1.1058491516939692
Energy: 1.2425317436904615
Energy: 1.095011381696555
Energy: 1.1069151933087857
Energy: 1.241326371606805
Energy: 1.1030879942725385
Energy: 1.0137706015115626
Energy: 1.0450979076645626
Energy: 1.0451983740132769
Energy: 1.0140668071192704
Energy: 1.1553348455969001
Energy: 1.0443295720601502
Energy: 1.2412110492255948
Energy: 1.1168935560352478
Energy: 1.1175229311895254
Energy: 1.2402695775282857
Energy: 1.1944711561728443
Energy: 1.1039134290679349
Energy: 1.1169871930212283
Energy: 1.0685241680062287
Energy: 1.1188852331225325
Energy: 1.1174973315921526
Energy: 1.070940450683286
Energy: 1.1348409573500406
Energy: 1.1956912929217849
Energy: 1.002502163781804
Energy: 1.0029962064267446
Energy: 1.1967558204740663
Energy: 1.002705056077316
Energy: 1.1037621442898256
Energy: 1.0333475229107036
Energy: 1.045405603168137
Energy: 1.0448130036673766
Energy: 1.0335889467860706
Energy: 1.0967376596560499
Energy: 1.0468863966108746

minimum gb energy = 1.002502163781804 eV
minimum distance =  2.18632990441022 Angstroms
sigma value = 9


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

Energy: 1.3541918927219978
Energy: 1.1680823178749735
Energy: 1.1677874093169829
Energy: 1.0963330035469065
Energy: 1.1701723226892304
Energy: 1.1651435229495672
Energy: 1.2920881992219366
Energy: 1.0997306635626047
Energy: 1.1023579643266446
Energy: 1.2928619953588865
Energy: 1.1261311494876998
Energy: 1.1021513263243081
Energy: 1.1581855489318726
Energy: 1.1460968634537223
Energy: 1.1328213533323594
Energy: 1.1587815071544993
Energy: 1.2879102799230897
Energy: 1.1874418122919743
Energy: 1.1321752338230215
Energy: 1.1037207743939428
Energy: 1.1025739559938745
Energy: 1.1325469952416756
Energy: 1.1029280567623425
Energy: 1.1340147807393832
Energy: 1.168230173636183
Energy: 1.1305783282821757
Energy: 1.1034036470300352
Energy: 1.1696624684080703
Energy: 1.1317730606928054
Energy: 1.0581837641891285
Energy: 1.0836384668551216
Energy: 1.0850085680783497
Energy: 1.0937390364002881
Energy: 1.087324620618584
Energy: 1.1634323604237826
Energy: 1.1876259296046412
Energy: 1.1225260375389041
Energy: 1.245639654969511
Energy: 1.0887083569647633
Energy: 1.1231244486798047
Energy: 1.3416459741716331
Energy: 1.1355116241212824
Energy: 1.2543103377504965
Energy: 1.0570368580549236
Energy: 1.094882586516283
Energy: 1.2558693302754829
Energy: 1.0563672526098207
Energy: 1.07767730863552
Energy: 1.3233984472896057
Energy: 1.1282983229082484
Energy: 1.117803181581946
Energy: 1.3238728702107545
Energy: 1.1279579227517533
Energy: 1.1661063713738855
Energy: 1.2999508446280013
Energy: 1.0787160228582897
Energy: 1.078857143084336
Energy: 1.3013223042319428
Energy: 1.0799987249124547
Energy: 1.077925703648778
Energy: 1.1306289510580538
Energy: 1.1686685466524653
Energy: 1.1384369382874462
Energy: 1.1311396055712692
Energy: 1.1692814199166153
Energy: 1.0769032568068337
Energy: 1.1265452089537573
Energy: 1.1726824182667341
Energy: 1.101372277288826
Energy: 1.1276987266029825
Energy: 1.1678216011165088
Energy: 1.1034779653589863
Energy: 1.4005098611070432
Energy: 1.1330642561179738
Energy: 1.1331658894994185
Energy: 1.4024858201511188
Energy: 1.1346982577228049
Energy: 1.2091439349975035
Energy: 1.3396788736106295
Energy: 1.1576805981560252
Energy: 1.1719413706445034
Energy: 1.3214170030645158
Energy: 1.1571274310636903
Energy: 1.175421246318382
Energy: 1.1375463735959404
Energy: 1.134881865024212
Energy: 1.1364579869293718
Energy: 1.1325009558359078
Energy: 1.1691905757084886
Energy: 1.104171803413151
Energy: 1.103466130636001
Energy: 1.1448596760552732
Energy: 1.075052140009775
Energy: 1.1041969011172736
Energy: 1.2862107713672044
Energy: 1.1255008577045373
Energy: 1.1712498780083977
Energy: 1.1760666025066095
Energy: 1.1502863997893322
Energy: 1.1712520503119295
Energy: 1.1898655530724906
Energy: 1.104603976818888
Energy: 1.3011443081416567
Energy: 1.1580797190259997
Energy: 1.158097548278322
Energy: 1.3028454595753811
Energy: 1.1598154254020268
Energy: 1.151457599353364
Energy: 1.1579912307209386
Energy: 1.2060770009084467
Energy: 1.1590255783724062
Energy: 1.1582328437454585
Energy: 1.2202639399877104
Energy: 1.1596810380367264
Energy: 1.1586077446649108
Energy: 1.31272988694988
Energy: 1.2338967308941038
Energy: 1.15903593442257
Energy: 1.309077589315897
Energy: 1.188619247048629
Energy: 1.242698294890304
Energy: 1.0993079487037178
Energy: 1.099758127731754
Energy: 1.2497393696848051
Energy: 1.1023658872661235
Energy: 1.1032556207953879

minimum gb energy = 1.0563672526098207 eV
minimum distance =  2.19835750852082 Angstroms
sigma value = 27


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

Energy: 1.5924022117709173
Energy: 1.3821278362811413
Energy: 1.3023958500342512
Energy: 1.4876435824458283
Energy: 1.65480881038103
Energy: 1.3813818254029389
Energy: 1.3097669242357615
Energy: 1.1979694175778248
Energy: 1.1990354760041642
Energy: 1.1707413462205951
Energy: 1.2149005443246974
Energy: 1.1955763879082588
Energy: 1.3946828528591289
Energy: 1.198491123066693
Energy: 1.2389378755762743
Energy: 1.225663349461629
Energy: 1.1807331514324253
Energy: 1.2324860756401759
Energy: 1.3190724784180212
Energy: 1.22647752502845
Energy: 1.221007242654731
Energy: 1.335123961552801
Energy: 1.3081165308344436
Energy: 1.1623853444188958
Energy: 1.2201580519125184
Energy: 1.2405791086106774
Energy: 1.2206610929613577
Energy: 1.221421728602394
Energy: 1.2204451425946239
Energy: 1.2181994616926404
Energy: 1.3752806379585334
Energy: 1.2202614941338619
Energy: 1.2259596973994975
Energy: 1.3428963530719238
Energy: 1.2193245442267129
Energy: 1.2289756389698312
Energy: 1.312986194031044
Energy: 1.317483114674774
Energy: 1.2381609681392989
Energy: 1.1553674266866796
Energy: 1.3103236782479184
Energy: 1.2412300484851508
Energy: 1.2578102276628569
Energy: 1.2091175679553563
Energy: 1.2225883128393313
Energy: 1.2576321859044783
Energy: 1.2158450843243889
Energy: 1.2279791694639268
Energy: 1.3686608932105433
Energy: 1.2756884714566765
Energy: 1.2760008135013285
Energy: 1.3116033176891622
Energy: 1.277988361392061
Energy: 1.269965457899986
Energy: 1.4261868004819451
Energy: 1.2496877489216123
Energy: 1.239456124554379
Energy: 1.3637559548724243
Energy: 1.2543662197071672
Energy: 1.2375067928302448
Energy: 1.272248937295822
Energy: 1.1769079017117992
Energy: 1.3219715944030666
Energy: 1.2918901697279872
Energy: 1.1781254243192827
Energy: 1.231048533284906
Energy: 1.1534371531579724
Energy: 1.169038922317728
Energy: 1.1393872150241025
Energy: 1.153742608488171
Energy: 1.169301717193494
Energy: 1.1553157240435967
Energy: 1.3274739029887754
Energy: 1.177254087274246
Energy: 1.1772510460102328
Energy: 1.330959099083683
Energy: 1.177208710709323
Energy: 1.1754722957713835
Energy: 1.2543795659465136
Energy: 1.1831942784497094
Energy: 1.170199836570766
Energy: 1.2543794662387993
Energy: 1.1832882096721133
Energy: 1.169459814162417
Energy: 1.2107861031356169
Energy: 1.195419292715253
Energy: 1.1931436925815104
Energy: 1.210034953423432
Energy: 1.2396498254081125
Energy: 1.2091527805682634
Energy: 1.287709301624352
Energy: 1.2495288764483599
Energy: 1.2497340165567086
Energy: 1.2770265658368245
Energy: 1.2478064613144055
Energy: 1.2492448641851799
Energy: 1.2375692278468868
Energy: 1.2089367501977173
Energy: 1.1964815317467303
Energy: 1.2389806322033905
Energy: 1.2086873324681262
Energy: 1.1969502010147546
Energy: 1.2753417361494115
Energy: 1.2200834522711843
Energy: 1.21934720734473
Energy: 1.2575105910539313
Energy: 1.22219611663001
Energy: 1.2253753144232815
Energy: 1.2793547593752994
Energy: 1.2237518837688013
Energy: 1.1363776842459177
Energy: 1.2804073450465996
Energy: 1.3082175448746307
Energy: 1.1511000672745306
Energy: 1.2445037492724884
Energy: 1.2236184205830023
Energy: 1.1360841262704253
Energy: 1.068940745996526
Energy: 1.308728129674745
Energy: 1.1204809270183924
Energy: 1.4707237800671522
Energy: 1.220371558676947
Energy: 1.2558942600677174
Energy: 1.4574480795944067
Energy: 1.2210563571050972
Energy: 1.2136687850706327
Energy: 1.1754157211379568
Energy: 1.2463830589743863
Energy: 1.252959937673942
Energy: 1.1755855856845296
Energy: 1.253175508885661
Energy: 1.246830101539665
Energy: 1.3397912996949821
Energy: 1.170694040649817
Energy: 1.0485076522029528
Energy: 1.176176480875588
Energy: 1.1395587161713543
Energy: 1.240906488566687
Energy: 1.3385726843379686
Energy: 1.174532798462833
Energy: 1.3380032241030986
Energy: 1.1708952616023296
Energy: 1.2159366226904043
Energy: 1.1432241378124566
Energy: 1.270404344570295
Energy: 1.1997765616979725
Energy: 1.197417851899328
Energy: 1.1999411864271368
Energy: 1.1999934430569126
Energy: 1.1500624124842744

minimum gb energy = 1.0485076522029528 eV
minimum distance =  2.15333226210205 Angstroms
sigma value = 19


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

Energy: 1.840303800662642
Energy: 1.2767232954924947
Energy: 1.8100935580636655
Energy: 1.5526652457680834
Energy: 1.353557219171389
Energy: 1.8107821002832254
Energy: 1.1917521532520174
Energy: 1.120423241497798
Energy: 1.1207802587364892
Energy: 1.1914503165530546
Energy: 1.1047313147964282
Energy: 1.0835932148792473
Energy: 1.1078313140171654
Energy: 1.1825066758099092
Energy: 1.1836624703347145
Energy: 1.107921138931498
Energy: 1.182795383801
Energy: 1.0892018300574842
Energy: 1.1046967933827407
Energy: 1.0837013035457028
Energy: 1.0851840379680797
Energy: 1.1045612698236484
Energy: 1.1134464106218025
Energy: 1.0831973159762693
Energy: 1.206868461648872
Energy: 1.110779938269884
Energy: 1.1112522829800684
Energy: 1.2100213471599808
Energy: 1.108449226772723
Energy: 1.0986991998666134
Energy: 1.1317674389125612
Energy: 1.0893910401580171
Energy: 1.0835858336054898
Energy: 1.1311354062540866
Energy: 1.1163829374867018
Energy: 1.0876664370857483
Energy: 1.2129998908238797
Energy: 1.2232969429450027
Energy: 1.0940678595081303
Energy: 1.21258537817765
Energy: 1.2243110041668797
Energy: 1.1380215988922173
Energy: 1.1216178226702505
Energy: 1.1084376301498693
Energy: 1.1438407827245258
Energy: 1.1217119493474066
Energy: 1.0944124561777155
Energy: 1.1456105023864374
Energy: 1.181558413647898
Energy: 1.1114793863854093
Energy: 1.1113820286017995
Energy: 1.1821438240478905
Energy: 1.108438128887999
Energy: 1.0928881836421291
Energy: 1.1496721694679615
Energy: 1.0823020937233545
Energy: 1.0778293411953652
Energy: 1.167175109707834
Energy: 1.123854957847864
Energy: 1.0833888557329012
Energy: 1.2091400477346779
Energy: 1.1557312272645963
Energy: 1.0880338218524028
Energy: 1.2112067413309386
Energy: 1.1558908877859044
Energy: 1.0735054633718641
Energy: 1.0802087476157736
Energy: 1.0819823557775294
Energy: 1.082350958828425
Energy: 1.079894690796751
Energy: 1.1816623677687832
Energy: 1.0639257981057193
Energy: 1.2535057392006295
Energy: 1.181523982111709
Energy: 1.1252317202639461
Energy: 1.1752606478611398
Energy: 1.19785746032326
Energy: 1.0759131752518005
Energy: 1.1300371871661172
Energy: 1.144914262737682
Energy: 1.1081748738337482
Energy: 1.1303898210080343
Energy: 1.14553370960762
Energy: 1.1212774376801413
Energy: 1.0771781799373625
Energy: 1.1527031396687215
Energy: 1.152142269029802
Energy: 1.0774174299561345
Energy: 1.1518632340896615
Energy: 1.0798488551844778
Energy: 1.077748181127495
Energy: 1.129123829785228
Energy: 1.1556058286215418
Energy: 1.077877112185633
Energy: 1.1607651862246504
Energy: 1.0600292772182653
Energy: 1.1779264203785087
Energy: 1.115833519196671
Energy: 1.0946264335857827
Energy: 1.1734846368605898
Energy: 1.1155982988660635
Energy: 1.0908154474781626
Energy: 1.1840075913411647
Energy: 1.0781839544027436
Energy: 1.0648768175108332
Energy: 1.1812555441674348
Energy: 1.0772655753348521
Energy: 1.0591566681048863
Energy: 1.1180025201947223
Energy: 1.2382738767697317
Energy: 1.0598712739902134
Energy: 1.1193221583835797
Energy: 1.1849383834482035
Energy: 1.1152019075721533
Energy: 1.09979206434851
Energy: 1.1638135692245068
Energy: 1.0597102115635497
Energy: 1.0997263880719983
Energy: 1.1846376330662602
Energy: 1.09449025544932
Energy: 1.1512952266803518
Energy: 1.0780881859189044
Energy: 1.065364113044922
Energy: 1.1515340668483958
Energy: 1.0772740284554077
Energy: 1.0599619022451519
Energy: 1.1522899556989759
Energy: 1.0785974215945975
Energy: 1.080054248592417
Energy: 1.1523490238834386
Energy: 1.0774818189022375
Energy: 1.0640679660947445
Energy: 1.1469461346880063
Energy: 1.14921338052894
Energy: 1.0665702475030974
Energy: 1.1472484460409578
Energy: 1.178580543610514
Energy: 1.1356254439239744
Energy: 1.181345956916168
Energy: 1.0577501965095266
Energy: 1.129902251862243
Energy: 1.1837233170871178
Energy: 1.0564218842835735
Energy: 1.1355914375862657
Energy: 1.2330859212990288
Energy: 1.139172847710469
Energy: 1.1460800885142801
Energy: 1.2195908502756219
Energy: 1.1386463688403525
Energy: 1.0671109194161923
Energy: 1.1961824566468402
Energy: 1.0871452241820596
Energy: 1.0870121746011832
Energy: 1.1797241614741636
Energy: 1.087682672393692
Energy: 1.0848775843260834
Energy: 1.1238635269055486
Energy: 1.1850835905872767
Energy: 1.0817596490188144
Energy: 1.1256841781214546
Energy: 1.1844002660933153
Energy: 1.082174706445414
Energy: 1.10691996533718
Energy: 1.1944407857852177
Energy: 1.220865206740818
Energy: 1.107148514344169
Energy: 1.1828907292781814
Energy: 1.0908456251221605
Energy: 1.1966261020297835
Energy: 1.1918793106277619
Energy: 1.1918696850448938
Energy: 1.1076422103561838
Energy: 1.191438170269801
Energy: 1.1259177646941134

minimum gb energy = 1.0564218842835735 eV
minimum distance =  2.22706791482979 Angstroms
sigma value = 101


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

Energy: 1.7005439786929408
Energy: 1.11772729224944
Energy: 1.9095637366382108
Energy: 1.7082338042231393
Energy: 1.1664463279096788
Energy: 1.0412784577638472
Energy: 1.0810983616679517
Energy: 1.042655243016003
Energy: 1.084590144737937
Energy: 1.0813528451618968
Energy: 1.0681401988283747
Energy: 1.1279730768179776
Energy: 1.0809797120373559
Energy: 1.1424354624127204
Energy: 1.1332540109502076
Energy: 1.0821361024884149
Energy: 1.143490769868811
Energy: 1.0512313399431805
Energy: 1.0666776743723192
Energy: 1.0433518179216266
Energy: 1.042641024195162
Energy: 1.066958705531616
Energy: 1.064214382554978
Energy: 1.0435646138666324
Energy: 1.170022448789096
Energy: 1.0805339147332749
Energy: 1.0806650087815284
Energy: 1.1728882363084001
Energy: 1.0821906806244863
Energy: 1.1697287619733678
Energy: 1.1803261834533085
Energy: 1.0991931981495897
Energy: 1.0437632338841059
Energy: 1.1828630814742025
Energy: 1.080782928132671
Energy: 1.0429078593379955
Energy: 1.056358464302932
Energy: 1.1515647042205939
Energy: 1.1043439230849332
Energy: 1.0563737073118493
Energy: 1.0970082702131971
Energy: 1.1198014074934126
Energy: 1.1706520229610105
Energy: 1.0938469480845616
Energy: 1.146256760939397
Energy: 1.1649783172234531
Energy: 1.0859012650353188
Energy: 1.1177210577084422
Energy: 1.1409611709664909
Energy: 1.0809215559495304
Energy: 1.0827225157427647
Energy: 1.142777913155946
Energy: 1.0802769984314409
Energy: 1.141844671614023
Energy: 1.1539711776867316
Energy: 1.0474173053968467
Energy: 1.0482974641439071
Energy: 1.1541254364838776
Energy: 1.1168633471040932
Energy: 1.0469096714808197
Energy: 1.2617365908880454
Energy: 1.106385082128332
Energy: 1.0247688083471755
Energy: 1.2635300066217738
Energy: 1.1117584530959377
Energy: 1.255586832684904
Energy: 1.1184834902117868
Energy: 1.0578295614635205
Energy: 1.0912495506992028
Energy: 1.120159659015924
Energy: 1.1204425395285091
Energy: 1.0481652124208996
Energy: 1.1714853086769779
Energy: 1.0582923057072773
Energy: 1.0585398246322855
Energy: 1.172901996968669
Energy: 1.0607439820789952
Energy: 1.0893405198482937
Energy: 1.0571716650671381
Energy: 1.0914495346764528
Energy: 1.0931297549618941
Energy: 1.0571212764262048
Energy: 1.0998312826519054
Energy: 1.0902755956307393
Energy: 1.0837677495588338
Energy: 1.1425233933453898
Energy: 1.1427441128694995
Energy: 1.082233147885356
Energy: 1.145454369147061
Energy: 1.0661794230487605
Energy: 1.0817875792978964
Energy: 1.0958266927685971
Energy: 1.0840272105600253
Energy: 1.081186823012395
Energy: 1.1018767548557031
Energy: 1.043535264619471
Energy: 1.1725226645111073
Energy: 1.1931244369050187
Energy: 1.0575352529820539
Energy: 1.174262409667651
Energy: 1.1956088833883907
Energy: 1.0383032143611512
Energy: 1.1090322948517888
Energy: 1.0947632251808783
Energy: 1.0846697588143852
Energy: 1.1096243010349196
Energy: 1.0941170335206278
Energy: 1.125117405215267
Energy: 1.079041068441996
Energy: 1.1410754018716274
Energy: 1.1537615597750255
Energy: 1.0793329695093334
Energy: 1.1412546186421495
Energy: 1.047873106639304
Energy: 1.067344336570245
Energy: 1.1034385835471276
Energy: 1.0437777354159727
Energy: 1.0686517950296555
Energy: 1.1044743499827658
Energy: 1.0438842742443297
Energy: 1.1702747266412277
Energy: 1.0692228529142378
Energy: 1.069728003848937
Energy: 1.1681214639837996
Energy: 1.0740784391138474
Energy: 1.0407565810578545
Energy: 1.1572760176580708
Energy: 1.0800400530071474
Energy: 1.0435102078894865
Energy: 1.156762839284103
Energy: 1.0806759471914913
Energy: 1.0877223196323145
Energy: 1.1461543732640234
Energy: 1.0969064724260043
Energy: 1.0293939584511491
Energy: 1.1431516251040779
Energy: 1.1295448904349064
Energy: 1.033612342022944
Energy: 1.1187721419481402
Energy: 1.1543744096794228
Energy: 1.079140846872565
Energy: 1.119559470556362
Energy: 1.1287667309915514
Energy: 1.1181935511926122
Energy: 1.1412110733751548
Energy: 1.081612234334855
Energy: 1.0739342006174502
Energy: 1.1414002450069949
Energy: 1.0799694175610295
Energy: 1.0879368655267312
Energy: 1.1466980379163263
Energy: 1.0867622978212805
Energy: 1.0466678883971356
Energy: 1.146914510739771
Energy: 1.1211011130681832
Energy: 1.0487506014653196
Energy: 1.0432401120743426
Energy: 1.1065820058315001
Energy: 1.0239759607233812
Energy: 1.0442121985162982
Energy: 1.1118867461137631
Energy: 1.0442227664778763
Energy: 1.0876430553871705
Energy: 1.107090863845917
Energy: 1.0252560301284792
Energy: 1.0889612566644555
Energy: 1.1067812794739362
Energy: 1.047123691977819
Energy: 1.1477713122367301
Energy: 1.1346600326653487
Energy: 1.13386949879002
Energy: 1.1497463552895428
Energy: 1.142235155146896
Energy: 1.0899777138142823
Energy: 1.1700384116323703
Energy: 1.0897458459023783
Energy: 1.090357889780755
Energy: 1.1738572978549902
Energy: 1.0892171576370226
Energy: 1.0906652872548184
Energy: 1.0861023590070724
Energy: 1.1476771583212357
Energy: 1.1186896833431672
Energy: 1.0866259095628383
Energy: 1.1465076430299412
Energy: 1.0722125299430887
Energy: 1.0797721384389658
Energy: 1.1002013502841816
Energy: 1.1109485233002006
Energy: 1.0800804632863557
Energy: 1.1432590960079976
Energy: 1.0670493953065239
Energy: 1.0892404248606065
Energy: 1.0835040567244067
Energy: 1.1394882794431196
Energy: 1.0886436346480854
Energy: 1.0811927873306215
Energy: 1.12612286045863

minimum gb energy = 1.0239759607233812 eV
minimum distance =  2.22915387519663 Angstroms
sigma value = 33


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

Energy: 0.02047235902916912
Energy: 1.1005244643318752
Energy: 0.021192260957289027
Energy: 0.023129348587473644
Energy: 1.0990383003749538
Energy: 0.021130206123375263
Energy: 0.4662470400761973
Energy: 0.1836346574936107
Energy: 0.18217619457510237
Energy: 0.18106035732667178
Energy: 0.18122642465245978
Energy: 0.1814496635741292
Energy: 1.4110056879717137
Energy: 1.1014505089971884
Energy: 1.1033350720046398
Energy: 1.102690023340628
Energy: 1.0994411556913992
Energy: 1.1018425195957873
Energy: 0.46624704007941203
Energy: 0.1836346574936107
Energy: 0.18217619457603568
Energy: 0.18106035732620512
Energy: 0.18122642464976357
Energy: 0.18144966357371442

minimum gb energy = 0.02047235902916912 eV
minimum distance =  2.46103889055988 Angstroms
sigma value = 1