Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Ni__MO_593762436933_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.519618335366251
cohesive_energy=4.4503470714016675
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=[1.8512349917553e-19, 2.7130137596512197e-19, 3.3901416704786395e-19, 3.97871727874488e-19, 4.49038840857912e-19, 4.92183855434898e-19, 5.282680775858459e-19, 5.58597281267466e-19, 5.8422569870492995e-19, 6.059592247451399e-19, 6.244323213351599e-19, 6.401737067642099e-19, 6.536255817832739e-19, 6.651580491948059e-19, 6.750627051461939e-19, 6.83555843483028e-19, 6.907848644556359e-19, 6.968555117218619e-19, 7.018543028199419e-19, 7.058821748778181e-19, 7.090096236673861e-19, 7.112270361288419e-19, 7.1253601443882e-19, 7.12963795600098e-19, 7.125087774360419e-19, 7.11036377109396e-19, 7.083927856632958e-19, 7.044065701979039e-19, 6.988742542807019e-19, 6.915603179464919e-19, 6.8218277810769e-19, 6.703939624347179e-19, 6.557532723532259e-19, 6.3768232209834e-19, 6.154104647091059e-19, 5.8789468319679e-19, 5.537522991262499e-19, 5.112064986103799e-19, 4.580270517746519e-19, 3.9143898868897797e-19, 3.07951166467872e-19, 2.02934896815708e-19, 6.9843686005962e-20, -1.011159308543544e-19, -3.2419883971326597e-19, -6.194864020660019e-19]
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: 0.018105912042735397
Energy: 0.5710727827541171
Energy: 0.0190611933815359
Energy: 0.018849253795272077
Energy: 0.5693585420866296
Energy: 0.019031842928576074
Energy: 0.5710727827550728
Energy: 0.152804370758752
Energy: 0.15456050910470576
Energy: 0.1529353964125038
Energy: 0.15261974520276908
Energy: 0.15427461884783308
Energy: 0.019061193382491647
Energy: 0.15456050910470576
Energy: 0.15396150669400668
Energy: 0.019067890558779572
Energy: 0.15253787670814037
Energy: 0.15358531590132476
Energy: 0.018849253795272077
Energy: 0.1529353964125038
Energy: 0.019067890557787064
Energy: 0.019043157432120268
Energy: 0.1526650803401297
Energy: 0.019098135898415716
Energy: 0.5693585420866296
Energy: 0.15261974520243823
Energy: 0.15253787670847124
Energy: 0.15266508034046053
Energy: 0.1527840720178402
Energy: 0.15250554378908315
Energy: 0.019031842927914402
Energy: 0.15427461884783308
Energy: 0.1535853159016556
Energy: 0.01909813589808488
Energy: 0.15250554378941403
Energy: 0.01911418635710976

minimum gb energy = 0.018105912042735397 eV
minimum distance =  2.48498209640723 Angstroms
sigma value = 1


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

Energy: 1.61574100803287
Energy: 1.0649456571351192
Energy: 1.108849396221499
Energy: 1.0594736449573967
Energy: 1.6321059927756623
Energy: 1.1085372986182336
Energy: 1.489350343954069
Energy: 1.0383686857905323
Energy: 1.0172160601041584
Energy: 1.0750871237119366
Energy: 1.0608578316025672
Energy: 1.0777524441835795
Energy: 1.0889716660055655
Energy: 1.036917508845774
Energy: 1.0235297841283646
Energy: 1.0570407635037125
Energy: 1.0654906867011857
Energy: 1.0491752722793664
Energy: 1.6311606886532621
Energy: 1.0466650821247023
Energy: 1.024269298488279
Energy: 1.0486639501298791
Energy: 1.0468488585611608
Energy: 1.0481380355500443
Energy: 1.4988690412024823
Energy: 1.0791603223862116
Energy: 1.0796444110513364
Energy: 1.0771379375068049
Energy: 1.0650045660564293
Energy: 1.0811459065128934
Energy: 1.4779730740316728
Energy: 1.0797827317750592
Energy: 1.0799510032242805
Energy: 1.0637528612647333
Energy: 1.0928968312233707
Energy: 1.0795787045989738
Energy: 1.4794482760798806
Energy: 1.0802324066833862
Energy: 1.0806733097749928
Energy: 1.065360472411491
Energy: 1.0671637100657616
Energy: 1.0800960547990048
Energy: 1.4600699525278946
Energy: 1.0851562981048046
Energy: 1.086028858459696
Energy: 1.019681390805631
Energy: 1.063489634014791
Energy: 1.0791052745467156
Energy: 1.1977140055098903
Energy: 1.0647601430292273
Energy: 1.0667815403498453
Energy: 1.092242544322788
Energy: 1.0543236349076903
Energy: 1.0783940058644272
Energy: 1.1976056665847352
Energy: 1.098794614103498
Energy: 1.0967827315111955
Energy: 1.0544633378340986
Energy: 1.0783001498823082
Energy: 1.06127576576878
Energy: 1.2153908351273497
Energy: 1.0596354008512598
Energy: 1.0099339686060251
Energy: 1.1030684640452526
Energy: 1.0593352013486412
Energy: 1.0320072767438295
Energy: 1.0959783704322563
Energy: 1.0465052807042996
Energy: 1.0488710704748743
Energy: 1.0595003153398006
Energy: 1.062122565568297
Energy: 1.0490488330316339
Energy: 1.0961301700796209
Energy: 1.0632897439728661
Energy: 1.063631336265533
Energy: 1.0794169312180657
Energy: 1.0440944823731504
Energy: 1.0814171450289547
Energy: 1.2141752187498818
Energy: 1.048121078023389
Energy: 1.0222882897243828
Energy: 1.0825287515863964
Energy: 1.0483691448131314
Energy: 1.0311986585410557
Energy: 1.122892627267757
Energy: 1.0777883157871202
Energy: 1.0947083774232347
Energy: 1.0654852841312052
Energy: 1.077266415764461
Energy: 1.0179199107524617
Energy: 1.1219264266285538
Energy: 1.0494551406748551
Energy: 1.0489721413023687
Energy: 1.0760700118692643
Energy: 1.0390878974773843
Energy: 1.0489317736451074
Energy: 1.3885121949000319
Energy: 1.0667101706840556
Energy: 1.0769108466637605
Energy: 1.0248116916661325
Energy: 1.0651498958748737
Energy: 1.0492032972615017
Energy: 1.332473386966281
Energy: 1.071920180009045
Energy: 1.091009674750306
Energy: 1.0762909760717398
Energy: 1.0593851036996893
Energy: 1.0909244676817753
Energy: 1.3327637994361392
Energy: 1.0925135217812216
Energy: 1.090448241129922
Energy: 1.0736230133989406
Energy: 1.077287376376538
Energy: 1.089948214036814
Energy: 1.436410623696857
Energy: 1.0915617240009112
Energy: 1.0909688032572873
Energy: 1.0594590892978788
Energy: 1.0756555636439709
Energy: 1.090044147949794
Energy: 1.5445479880651751
Energy: 1.0241178643332207
Energy: 1.0104713684551279
Energy: 1.0593869499342459
Energy: 1.0262096165304384
Energy: 1.036574848668009
Energy: 1.5511442556408297
Energy: 1.0639142410006734
Energy: 1.0489118739886845
Energy: 1.044019920548796
Energy: 1.0750291087275365
Energy: 1.0489111596681127
Energy: 1.4381663276714052
Energy: 1.0356735579538565
Energy: 1.0190235480347003
Energy: 1.0659049771364233
Energy: 1.0637462933115154
Energy: 1.0674432762084904

minimum gb energy = 1.0099339686060251 eV
minimum distance =  2.28596684333911 Angstroms
sigma value = 33


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

Energy: 1.921677480719677
Energy: 1.0943961036199865
Energy: 1.1095275973294378
Energy: 1.1045600887013218
Energy: 1.1419327341402767
Energy: 1.1900387984105418
Energy: 1.194785668723004
Energy: 1.0565105303716413
Energy: 1.0408188760002586
Energy: 1.1247515708755296
Energy: 1.088511376270541
Energy: 1.0683745392310853
Energy: 1.1519710992833083
Energy: 1.0780141425540088
Energy: 1.0808053347145294
Energy: 1.1519006684199053
Energy: 1.113920428134443
Energy: 1.119166212945252
Energy: 1.5784756941328089
Energy: 1.204665540301595
Energy: 1.1123415678049322
Energy: 1.1413875563866966
Energy: 1.109485621185752
Energy: 1.1410426739622308
Energy: 1.160100981362961
Energy: 1.0662903525406444
Energy: 1.0826150419122684
Energy: 1.0688499894046302
Energy: 1.0957918810532645
Energy: 1.0933688189125497
Energy: 1.4931705112392109
Energy: 1.0405998840065465
Energy: 1.088614771322679
Energy: 1.176168980152006
Energy: 1.1185517932886377
Energy: 1.2444806026303508
Energy: 1.4929378577405874
Energy: 1.1459018655010902
Energy: 1.1664342362546427
Energy: 1.184103399073196
Energy: 1.1610383918473992
Energy: 1.176833499846328
Energy: 1.1838309402094866
Energy: 1.185406701943828
Energy: 1.1854437857461408
Energy: 1.1268200149142062
Energy: 1.1861098231351397
Energy: 1.1890265776349092
Energy: 1.2824692693733142
Energy: 1.1854695715447712
Energy: 1.19519073974567
Energy: 1.2154548091752329
Energy: 1.1800303949522348
Energy: 1.1930404832309107
Energy: 1.281930187342838
Energy: 1.1991905637819145
Energy: 1.1837955615474787
Energy: 1.2107770957917674
Energy: 1.2978415979076494
Energy: 1.1731096285067795
Energy: 1.2227398134913174
Energy: 1.0122316425446904
Energy: 1.0122322881320271
Energy: 1.1840589011030056
Energy: 1.0644485440676517
Energy: 1.066540211869846
Energy: 1.171882128898151
Energy: 1.0458601201220714
Energy: 1.1346303115244851
Energy: 1.1828009244932793
Energy: 1.1133705425376117
Energy: 1.1266913598141446
Energy: 1.1831126566262269
Energy: 1.165291737496023
Energy: 1.1952017660917447
Energy: 1.1696242249934343
Energy: 1.157020500269809
Energy: 1.1267798455142817
Energy: 1.1988783477529965
Energy: 1.1408850596708027
Energy: 1.140708640691564
Energy: 1.2577093380937745
Energy: 1.14124520923172
Energy: 1.1266655499558074
Energy: 1.1738370978454387
Energy: 1.1877278319068647
Energy: 1.193920941781175
Energy: 1.1803463298087098
Energy: 1.190041126150324
Energy: 1.1677438062713599
Energy: 1.1909587258450411
Energy: 1.1635395789259697
Energy: 1.1640477936301394
Energy: 1.1869452998600105
Energy: 1.221133449429024
Energy: 1.2436695286552486
Energy: 1.2038155869394187
Energy: 1.219265726413394
Energy: 1.2230614863342952
Energy: 1.2172867098883549
Energy: 1.2183880172235049
Energy: 1.220733095222461
Energy: 1.39156911465095
Energy: 1.2266869917375574
Energy: 1.2135537480357448
Energy: 1.1857458837767234
Energy: 1.1469386608366787
Energy: 1.188393637944416
Energy: 1.1899527753128505
Energy: 1.2799894307095474
Energy: 1.2816404865236997
Energy: 1.1853121999198597
Energy: 1.281871261872823
Energy: 1.2772202994520934
Energy: 1.1974228768996968
Energy: 1.2767445567926687
Energy: 1.2674515619532576
Energy: 1.2711259850417203
Energy: 1.278184779224608
Energy: 1.2552312415048243
Energy: 1.663835889614138
Energy: 1.1529669981961463
Energy: 1.0120048627522498
Energy: 1.0128491898432816
Energy: 1.160832963822552
Energy: 1.0120198028345355
Energy: 1.071400540789105
Energy: 1.2220033281555405
Energy: 1.2187758488885159
Energy: 1.0703586338330464
Energy: 1.2500232615699496
Energy: 1.1971154653384162
Energy: 1.1990761441422488
Energy: 1.2569958616059869
Energy: 1.219507151328292
Energy: 1.2376147668068351
Energy: 1.2589400330154765
Energy: 1.1980559543324152
Energy: 1.6228098216548301
Energy: 1.2635607708592653
Energy: 1.309896177987655
Energy: 1.141826778651593
Energy: 1.2703597433398286
Energy: 1.1481455785813324
Energy: 1.197862227865074
Energy: 1.269755853243896
Energy: 1.236963597622843
Energy: 1.2277767427257644
Energy: 1.1925632761761638
Energy: 1.2383808049319038
Energy: 1.1778290492787797
Energy: 1.2390719336713145
Energy: 1.239792958073035
Energy: 1.1744620083968544
Energy: 1.2696236278868778
Energy: 1.2385344911797012
Energy: 1.1784346879521792
Energy: 1.1390240898444222
Energy: 1.1383035596862414
Energy: 1.167532682286792
Energy: 1.1401495940948818
Energy: 1.1373083343184052
Energy: 1.1827626014214927
Energy: 1.185610740958625
Energy: 1.1886567278204865
Energy: 1.2033030858788416
Energy: 1.1853708720574747
Energy: 1.1971372121907229
Energy: 1.1937737772243768
Energy: 1.185371594891949
Energy: 1.1866842741189867
Energy: 1.2097780578273363
Energy: 1.1852248790451916
Energy: 1.1959870316303363
Energy: 1.2783594303421133
Energy: 1.1825695989571607
Energy: 1.1831914923761977
Energy: 1.1929254088439807
Energy: 1.1683165318575763
Energy: 1.1738348232216
Energy: 1.2778804190760693
Energy: 1.0676545639475057
Energy: 1.0636767584516078
Energy: 1.1528096913780468
Energy: 1.012366831856993
Energy: 1.01184180082857
Energy: 1.1864792004252824
Energy: 1.0657486177360058
Energy: 1.0607507380484917
Energy: 1.1791791988763785
Energy: 1.01436739368315
Energy: 1.1348914474142973
Energy: 1.1870859468686585
Energy: 1.1925360039423731
Energy: 1.167116152462907
Energy: 1.18769356078209
Energy: 1.1562741899259772
Energy: 1.158914139897113
Energy: 1.1855159346537674
Energy: 1.1411535227948304
Energy: 1.1256903577661705
Energy: 1.1884522329871325
Energy: 1.1419244313439825
Energy: 1.1497485280186357
Energy: 1.201314535137772
Energy: 1.2833334621458121
Energy: 1.2091875338758153
Energy: 1.1947355026058493
Energy: 1.1509783332182486
Energy: 1.161385748215652
Energy: 1.197315829906845
Energy: 1.0921683870244796
Energy: 1.0801913176831117
Energy: 1.1866668996643188
Energy: 1.1792220688306052
Energy: 1.1941288794460283
Energy: 1.1930770641088322
Energy: 1.0831870755984607
Energy: 1.0880850774671729
Energy: 1.0915332363574846
Energy: 1.0971658747780468
Energy: 1.0994880925761663
Energy: 1.2085936156639008
Energy: 1.2643234667346412
Energy: 1.113978152719242
Energy: 1.1856938081905952
Energy: 1.1151729980429694
Energy: 1.1911917426210576
Energy: 1.3888714981383907
Energy: 1.1121009782770352
Energy: 1.1154064073823124
Energy: 1.1861316168493377
Energy: 1.1156998427405065
Energy: 1.1874900397801869
Energy: 1.0716134020114865
Energy: 1.1299551514603605
Energy: 1.1005174155284978
Energy: 1.1057565471103497
Energy: 1.1121422308123712
Energy: 1.089188599339404
Energy: 1.1071932973135497
Energy: 1.0837909274577215
Energy: 1.012004252841613
Energy: 1.0125383980456335
Energy: 1.0572946569183364
Energy: 1.1205633611814312

minimum gb energy = 1.01184180082857 eV
minimum distance =  2.2400682392343 Angstroms
sigma value = 51


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

Energy: 1.6772087326170313
Energy: 1.0429174663064424
Energy: 1.0807558356597387
Energy: 1.1075346516882247
Energy: 1.0650151578725717
Energy: 1.119048032272052
Energy: 1.3000744389392147
Energy: 1.1203134260605754
Energy: 1.0717979246274063
Energy: 1.1167215590179895
Energy: 1.1204611720137392
Energy: 1.0716238986396631
Energy: 1.5192750011203946
Energy: 1.1023658679752726
Energy: 1.0737042714313179
Energy: 1.0838791846705274
Energy: 1.1211666207466484
Energy: 1.083549264686878
Energy: 1.516570755645226
Energy: 1.0631528636426428
Energy: 1.0688454779587393
Energy: 1.0754672494560455
Energy: 1.0727030832013882
Energy: 1.074463643812585
Energy: 1.2973710565647827
Energy: 1.1318594603391166
Energy: 1.13301772565164
Energy: 1.113378817628896
Energy: 1.1315844491765703
Energy: 1.110605610265927
Energy: 1.302546882822842
Energy: 1.1339750970711775
Energy: 1.1113012509541265
Energy: 1.1320212821665532
Energy: 1.1321566799356155
Energy: 1.128910097801692
Energy: 1.3024990957935703
Energy: 1.1134081923293349
Energy: 1.1113615529735854
Energy: 1.1320055737535164
Energy: 1.113885540931096
Energy: 1.132131985479879
Energy: 1.3103372059045626
Energy: 1.0468376503769112
Energy: 1.0467797015206297
Energy: 1.0982048456910343
Energy: 1.047726181117521
Energy: 1.0466191334957153
Energy: 1.121811627736431
Energy: 1.0472679151668367
Energy: 1.047211479899016
Energy: 1.1027825976610799
Energy: 1.047705494083329
Energy: 1.0779090413816297
Energy: 1.1208486047193982
Energy: 1.126191443478951
Energy: 1.0926200048206605
Energy: 1.1207381508515075
Energy: 1.1193177579710274
Energy: 1.0491524324202086
Energy: 1.1812595917058195
Energy: 1.0602817047380657
Energy: 1.0603075904705723
Energy: 1.096190491064704
Energy: 1.060604892758849
Energy: 1.0598137827728347
Energy: 1.1567564135691921
Energy: 1.117364510306342
Energy: 1.1358003519321969
Energy: 1.090987501483263
Energy: 1.1057265416112279
Energy: 1.0743905650948018
Energy: 1.156425476284186
Energy: 1.077979941357075
Energy: 1.077449335427328
Energy: 1.1272826470795112
Energy: 1.0785392520731372
Energy: 1.0997906220296743
Energy: 1.1577114596570421
Energy: 1.0826898824420612
Energy: 1.0828622540036095
Energy: 1.0756574147769327
Energy: 1.0830580688734692
Energy: 1.0836310758526435
Energy: 1.3853405920875095
Energy: 1.090555304235993
Energy: 1.0897748853715348
Energy: 1.0967048866616251
Energy: 1.0894964572628765
Energy: 1.0862493863100993
Energy: 1.3888001654389985
Energy: 1.1089836207765047
Energy: 1.090819565293842
Energy: 1.1004759625642047
Energy: 1.1275648466425645
Energy: 1.1000420224721057
Energy: 1.4142224712398186
Energy: 1.1305184793804681
Energy: 1.1279403161968238
Energy: 1.1291905533229378
Energy: 1.1303990056839288
Energy: 1.0890636737311508
Energy: 1.640928784248047
Energy: 1.0909458002040238
Energy: 1.0639912605037212
Energy: 1.0451572192095273
Energy: 1.0911885022707501
Energy: 1.095084613652152

minimum gb energy = 1.0429174663064424 eV
minimum distance =  2.26313535127302 Angstroms
sigma value = 19


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

Energy: 1.42305008185857
Energy: 1.0458401254716716
Energy: 1.0267145430572104
Energy: 1.0290976852313283
Energy: 1.044419584548215
Energy: 1.0264188778002532
Energy: 1.2939889975970202
Energy: 1.0445980884996284
Energy: 1.0447765110432763
Energy: 1.063024408392329
Energy: 1.0446804600285542
Energy: 1.0447320561077422
Energy: 1.5121159384290028
Energy: 1.0441674130941054
Energy: 1.0443010881286645
Energy: 1.0654432601365744
Energy: 1.044467224358217
Energy: 1.04437504911219
Energy: 1.2173649683150392
Energy: 1.044466439539888
Energy: 1.0444559585767386
Energy: 1.0505368985764456
Energy: 1.044410499014994
Energy: 1.0447834304469221
Energy: 1.2310294922059963
Energy: 1.0442372541584752
Energy: 1.0851359913758531
Energy: 1.0641235938762168
Energy: 1.0440262323464142
Energy: 1.08523320552184
Energy: 1.2310118205902096
Energy: 1.0102419375367575
Energy: 1.0849446673888103
Energy: 1.06389062482751
Energy: 1.0101048405356923
Energy: 1.061959133498386
Energy: 1.2344152596986293
Energy: 1.0845786745544002
Energy: 1.062174110608915
Energy: 1.0632709464273986
Energy: 1.0235539662083266
Energy: 1.061333753915376
Energy: 1.18982475568938
Energy: 0.9641472732897747
Energy: 0.9640238002170961
Energy: 1.0455718989917544
Energy: 0.9637347833518696
Energy: 0.9638909285270583
Energy: 1.0441671093029024
Energy: 0.9640303156348756
Energy: 0.9644949431108102
Energy: 1.0441169957084633
Energy: 0.9639556790281937
Energy: 0.9896017272139501
Energy: 1.0441739898240496
Energy: 1.0273215806061549
Energy: 1.0447894308461065
Energy: 1.0443389294393175
Energy: 1.0640609441545759
Energy: 1.0444621425042535
Energy: 1.0423295704392472
Energy: 1.0510307637772591
Energy: 1.0539249114110407
Energy: 1.042639296450727
Energy: 1.05113985497277
Energy: 1.0441340787633842
Energy: 1.2281554984688836
Energy: 1.0660877072730424
Energy: 1.0829723376337441
Energy: 1.0439906974851836
Energy: 1.063130072422937
Energy: 1.044304533868941
Energy: 1.0097526032333979
Energy: 1.0623309733619077
Energy: 1.0626360476878876
Energy: 1.0101504124381906
Energy: 1.0634068191182022
Energy: 1.0638137446778528
Energy: 1.2287617809188627
Energy: 1.0638819404880389
Energy: 1.0633690774372524
Energy: 1.044394206099441
Energy: 1.0642464276313797
Energy: 1.0620220062942067
Energy: 1.4311448397782986
Energy: 1.0448796110019456
Energy: 1.0490274250614124
Energy: 0.9639989312711352
Energy: 1.044820406933453
Energy: 0.963124007113445
Energy: 1.4269124105666795
Energy: 1.0456453395410759
Energy: 0.9638852264829241
Energy: 0.9640368261808965
Energy: 1.0448614032384238
Energy: 0.9643885098409913
Energy: 1.2310703163203518
Energy: 1.0447133311738248
Energy: 1.044851432452616
Energy: 1.0644695296091256
Energy: 1.0448277328325595
Energy: 1.044649417565597
Energy: 1.2197714694050197
Energy: 1.0445086084974202
Energy: 1.0446853644430787
Energy: 1.050475255761003
Energy: 1.0444924937294513
Energy: 1.0447423445650577
Energy: 1.214411676710881
Energy: 1.0442988048817985
Energy: 1.0445157058725267
Energy: 1.0503524397821762
Energy: 1.04447952639521
Energy: 1.0440927950248216
Energy: 1.2297800941311963
Energy: 1.0102703528682113
Energy: 1.084263857127195
Energy: 1.0637747289168962
Energy: 1.0100628863674466
Energy: 1.084380064843805
Energy: 1.2235090409149638
Energy: 1.0830126436144563
Energy: 1.0618524097975035
Energy: 1.063781214690414
Energy: 1.0451359239144102
Energy: 1.0628264364740405
Energy: 1.2292414019351288
Energy: 1.084602889448805
Energy: 1.084583062777341
Energy: 1.062992932662046
Energy: 1.0237871398000122
Energy: 1.0856440551886708
Energy: 1.1916662573759844
Energy: 0.9657695059048115
Energy: 0.9654695165796212
Energy: 1.1912946047781607
Energy: 0.964508826565259
Energy: 1.0271880182991766
Energy: 1.0448229167311047
Energy: 1.026578395569443
Energy: 1.0470280612096219
Energy: 1.0449820746710479
Energy: 1.039660635555525
Energy: 1.0448077793077857
Energy: 1.044522781734552
Energy: 1.0461402492959933
Energy: 1.0446316903332868
Energy: 1.0444997928479487
Energy: 1.0648569350656905
Energy: 1.044418620323458
Energy: 1.1925817970235577
Energy: 1.050459855987133
Energy: 1.0504626759990447
Energy: 1.0444387498813401
Energy: 1.050506109212164
Energy: 1.0445981267635713
Energy: 1.2287096477746748
Energy: 1.0637093400279602
Energy: 1.0834825594804407
Energy: 1.0442690569310482
Energy: 1.066553770768254
Energy: 1.0842732551030212
Energy: 1.0100902928816848
Energy: 1.0628575053628972
Energy: 1.0607276088051756
Energy: 1.0102271019643934
Energy: 1.0633468920955456
Energy: 1.0859388850057135
Energy: 1.1925938689391837
Energy: 1.0622669808804668
Energy: 1.0613603482712912
Energy: 1.0244429517358973
Energy: 1.0629301074723136
Energy: 1.0611606811063437
Energy: 1.4286766553793426
Energy: 1.0457127000475996
Energy: 0.9848704091800992
Energy: 0.964067274693498
Energy: 1.0460032891306712
Energy: 0.9640866353301484

minimum gb energy = 0.963124007113445 eV
minimum distance =  2.37185828503535 Angstroms
sigma value = 27


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

Energy: 1.2180148221539577
Energy: 1.0334896679291012
Energy: 1.2489876003016167
Energy: 1.0567013168218808
Energy: 1.8146309866923775
Energy: 1.2488344659194164
Energy: 1.2150830629012417
Energy: 1.0573910483672722
Energy: 0.974321290428991
Energy: 0.9756825864669451
Energy: 1.0571595561731804
Energy: 0.972203210952224
Energy: 1.1000773939555313
Energy: 1.0566719070364672
Energy: 0.9980739872105396
Energy: 0.9734718396526266
Energy: 1.0562883549684543
Energy: 0.9994269311737695
Energy: 1.1027064928199772
Energy: 0.9961817759825701
Energy: 0.9959496977921223
Energy: 0.9735456948750938
Energy: 1.0562733176324726
Energy: 0.974145394675635
Energy: 1.2164786150945792
Energy: 0.917510245467772
Energy: 0.9726072116850039
Energy: 1.0317587678885114
Energy: 0.9175476107810788
Energy: 0.972674665356422
Energy: 1.0538166584567261
Energy: 0.9189369648075667
Energy: 0.9171679984441464
Energy: 1.054057416938427
Energy: 0.9199468198458411
Energy: 0.9179058774323312
Energy: 1.0583028029715111
Energy: 0.9730698454960095
Energy: 0.9735577902518207
Energy: 1.058700890104238
Energy: 0.9733424296729111
Energy: 0.9993500877389669
Energy: 1.0575893104220095
Energy: 0.9700412123489796
Energy: 0.9851243131979792
Energy: 1.0575715172093105
Energy: 0.9696762662103332
Energy: 0.9883334732718355
Energy: 1.0997519070987343
Energy: 0.9683418332329342
Energy: 0.9778501913469757
Energy: 1.0577060712968642
Energy: 0.9673629755664788
Energy: 0.9991203860658016
Energy: 1.1025365142547048
Energy: 0.9955784225206914
Energy: 0.9651494374347659
Energy: 0.9966635332594806
Energy: 0.9963074617651271
Energy: 0.9674752913183774
Energy: 1.0999159617219878
Energy: 0.9973680073570304
Energy: 0.9981951350763245
Energy: 0.9964484820193996
Energy: 1.0345194467746066
Energy: 0.9965912802500951
Energy: 1.100447554118997
Energy: 0.9991088826604444
Energy: 0.972615492147765
Energy: 0.9742573796233214
Energy: 1.0011574724001575
Energy: 0.9722429313138944

minimum gb energy = 0.9171679984441464 eV
minimum distance =  2.30649691732576 Angstroms
sigma value = 9


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

Energy: 2.058444042372682
Energy: 0.9355273674075453
Energy: 0.8623100029227925
Energy: 0.9311007945749855
Energy: 1.0131104875868147
Energy: 0.8541331908038992
Energy: 0.9426971504744062
Energy: 0.9051874261711574
Energy: 0.9110606037426051
Energy: 0.8953929709384122
Energy: 0.9209935746446986
Energy: 0.8944695581612472
Energy: 0.9447821633413839
Energy: 0.9219143080498436
Energy: 0.8726466175719905
Energy: 0.9187761983779973
Energy: 0.9207020599078147
Energy: 0.8855617517787976
Energy: 0.9450539008440848
Energy: 0.8831663690331396
Energy: 0.8822892794911473
Energy: 0.9065623500368538
Energy: 0.9027973835327812
Energy: 0.8819622412749908
Energy: 1.017599491980856
Energy: 0.9265875414378633
Energy: 0.9004916505629181
Energy: 0.952745158449067
Energy: 0.9256467427608249
Energy: 0.8844718260854179
Energy: 0.9525628264737936
Energy: 0.9038782398477693
Energy: 0.9024258320472366
Energy: 0.9525853339081276
Energy: 0.8864797644024317
Energy: 0.8526488662807077
Energy: 0.9530679446235869
Energy: 0.8846978708097211
Energy: 0.8836730532570674
Energy: 0.9537100371965579
Energy: 0.8831889470797538
Energy: 0.955813888046935
Energy: 0.9759477443786482
Energy: 0.9116378248685962
Energy: 0.9410700981052986
Energy: 0.9759534699026119
Energy: 0.9045077513990597
Energy: 0.8729733401978232
Energy: 1.1065252604320008
Energy: 0.9395251443580935
Energy: 0.8843116094552679
Energy: 0.9662008767303333
Energy: 0.9395230571092317
Energy: 0.8900670542468518
Energy: 0.8725288706720543
Energy: 0.9286028746441831
Energy: 0.8869290120039057
Energy: 0.8850887502456977
Energy: 0.940230589416624
Energy: 0.9170853342237756
Energy: 0.8729953372415492
Energy: 0.9534765438591712
Energy: 0.9373643306829128
Energy: 0.8902415575904765
Energy: 0.9533081530662091
Energy: 0.8993391761802649
Energy: 1.123563889127801
Energy: 0.9530703442262631
Energy: 0.9535462816057333
Energy: 0.8999459418633617
Energy: 0.9532278256064483
Energy: 0.9099168611215563
Energy: 1.2548651716482813
Energy: 0.9475146517705069
Energy: 0.8980986984151901
Energy: 0.875064506410068
Energy: 1.1208485323286548
Energy: 0.8688270762017019
Energy: 1.120514729583095
Energy: 0.9529304638654202
Energy: 0.9000591273620789
Energy: 0.8999160706135019
Energy: 0.9527044360211675
Energy: 0.9105031541919005
Energy: 0.9208769180548638
Energy: 0.9134357596087047
Energy: 0.9143762494664556
Energy: 0.9208558587408305
Energy: 0.9166822653424954
Energy: 0.9533466388364158
Energy: 0.9207354617108876
Energy: 0.8817908745574085
Energy: 0.882143438090212
Energy: 0.92251814972339
Energy: 0.9292468254682068
Energy: 0.8991319271553334
Energy: 0.9195026311879061
Energy: 0.8976034973413644
Energy: 0.8813307068254886
Energy: 0.9195038678320164
Energy: 0.8974501287825377
Energy: 0.9011358912878528
Energy: 0.943851198535517
Energy: 0.8968402351464311
Energy: 0.8819400481558293
Energy: 0.9192634776222055
Energy: 0.91474382436031
Energy: 0.9114741846366643
Energy: 0.9451456848781565
Energy: 0.8952241354444076
Energy: 0.8953542179768873
Energy: 0.9197987034879339
Energy: 0.8954818346936585
Energy: 0.8854712957403147
Energy: 0.9440426369696551
Energy: 0.903086365224214
Energy: 0.8764415701957031
Energy: 0.9020465463860642
Energy: 0.9023481473705501
Energy: 0.8724689282666925
Energy: 0.9437804034121724
Energy: 0.8759310498738792
Energy: 0.8814999901595499
Energy: 0.9017066530305349
Energy: 0.8993237668218965
Energy: 0.8890732077714631
Energy: 0.9916894501883003
Energy: 0.9130861155567687
Energy: 0.9550576300958307
Energy: 0.9290961169974645
Energy: 0.9202005889232321
Energy: 0.9178581759973916
Energy: 0.9880851715274083
Energy: 0.9022789333979025
Energy: 0.9071653315739329
Energy: 0.9259128989906066
Energy: 0.9210419334012533
Energy: 0.8576706947613533
Energy: 0.9435210385962352
Energy: 0.904359525855059
Energy: 0.8980850244359214
Energy: 0.9393178786544119
Energy: 0.9210940812679074
Energy: 0.8846028440656236
Energy: 1.263940523539117
Energy: 0.9043439093846526
Energy: 0.9120134033353694
Energy: 0.915884493661719
Energy: 0.9223691861483113
Energy: 0.9341571428803653
Energy: 0.9435191614655234
Energy: 0.9002972350896048
Energy: 0.884032453452372
Energy: 0.9539279202311395
Energy: 0.9006572062453123
Energy: 0.9016810307344015
Energy: 0.9392345832359401
Energy: 0.8995523220198677
Energy: 0.8950672348385434
Energy: 0.9396405237525812
Energy: 0.9024157604336311
Energy: 0.9029595908543057
Energy: 0.9530772560904137
Energy: 0.8841225806137459
Energy: 0.8838485178064243
Energy: 0.9528738403466477
Energy: 0.9008544400486248
Energy: 0.9561463845236772
Energy: 0.9532168174788618
Energy: 0.9212602584597487
Energy: 0.8855444009208767
Energy: 0.9531223371498729
Energy: 0.9189506273643216
Energy: 0.938260904522851
Energy: 0.9269506850997213
Energy: 0.9109233766580281
Energy: 0.9402824387605946
Energy: 0.9084691638308755
Energy: 0.9047504967835958
Energy: 0.8835367630285036
Energy: 0.8732158293678144
Energy: 0.9284202069864871
Energy: 0.8856930352775152
Energy: 0.9150340273726116
Energy: 0.9394503959269511
Energy: 0.8948490991315393
Energy: 0.8814397592744186
Energy: 0.9520535223082742
Energy: 0.9366454016834733
Energy: 0.8847247957310033
Energy: 0.9520031517786471
Energy: 0.8993137181311429
Energy: 1.120618085713616
Energy: 0.9530265101777478
Energy: 0.9529867513471952
Energy: 0.9509353688044512
Energy: 0.9539864340188094
Energy: 0.8838461419623018
Energy: 0.9371613989359836
Energy: 0.9532115059422661
Energy: 0.9538088433568063
Energy: 0.9170784422227286
Energy: 0.953064768834964
Energy: 0.8859310834789486
Energy: 0.9315344521466826
Energy: 0.9529048474512187
Energy: 0.9000583531496429
Energy: 0.9145446910931969
Energy: 0.9533996547561336
Energy: 0.9005853573576924
Energy: 0.9337856525129344
Energy: 0.9185694096863121
Energy: 0.8872789948953133
Energy: 0.9347365014671383
Energy: 0.9224794009020859
Energy: 0.8718670766051698
Energy: 0.9198255049575108
Energy: 0.9112339040893785
Energy: 0.8845158581610275
Energy: 0.9210349311110703
Energy: 0.9228756754360149
Energy: 0.88745871172095
Energy: 0.9196339263006026
Energy: 0.8975837198370537
Energy: 0.8903761297135555
Energy: 0.9196249768105267
Energy: 0.8947859185513395
Energy: 0.8954886442729101
Energy: 0.9719185009034977
Energy: 0.8809028765659849
Energy: 0.8753110146448859
Energy: 0.9049939920726823
Energy: 0.8807271971339055
Energy: 0.881657212591699
Energy: 0.9429212951368883
Energy: 0.8930258666574109
Energy: 0.8905460406044615
Energy: 0.9194977933170321
Energy: 0.8964800667172607
Energy: 0.8854786265212479
Energy: 0.9435062951378714
Energy: 0.8912001577656296
Energy: 0.8870278391346066
Energy: 0.8979574010663316
Energy: 0.9043035270554836
Energy: 0.8867797583337436
Energy: 0.9456764800169709
Energy: 0.9042361045426616
Energy: 0.8797928102211716
Energy: 0.8963415286148746
Energy: 0.9039106754748351
Energy: 0.8728178103409788
Energy: 0.9886021670582945
Energy: 0.902544859840681
Energy: 0.8911014802600958
Energy: 0.9259129372590971
Energy: 0.9210476625659642
Energy: 0.8577157965094907

minimum gb energy = 0.8526488662807077 eV
minimum distance =  2.29679188632168 Angstroms
sigma value = 57


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

Energy: 0.4516595892870065
Energy: 0.5132218243563573
Energy: 0.5076050261763841
Energy: 0.4543815840046428
Energy: 0.5137860024148518
Energy: 0.4544779258905358
Energy: 0.8883676588551321
Energy: 0.4803786359564604
Energy: 0.48350589662448734
Energy: 0.5118034876773518
Energy: 0.4805208040930137
Energy: 0.4948435406376764
Energy: 0.5760990875335344
Energy: 0.48038827598172357
Energy: 0.48165430944236265
Energy: 0.5151914684657637
Energy: 0.5160660106425234
Energy: 0.48406436180921264
Energy: 0.5765094231900897
Energy: 0.4775007698253461
Energy: 0.48116452940187115
Energy: 0.5166410519467892
Energy: 0.5169613315897456
Energy: 0.505885692374735
Energy: 0.5714697679794173
Energy: 0.46005459854401115
Energy: 0.4560321880564121
Energy: 0.5171850491100953
Energy: 0.4540883799887385
Energy: 0.4845648279059009
Energy: 0.5150745039740788
Energy: 0.4550556950198357
Energy: 0.45709510988274654
Energy: 0.4776927988906176
Energy: 0.45310437215609495
Energy: 0.4860875626302796
Energy: 0.5082324226437124
Energy: 0.4800228201083722
Energy: 0.48307832768206554
Energy: 0.5102000958294596
Energy: 0.4768087452556239
Energy: 0.49816579579969666
Energy: 0.515539169183808
Energy: 0.4800446142781498
Energy: 0.4820506380327418
Energy: 0.5160634621724107
Energy: 0.48143753392721417
Energy: 0.48226039251374014
Energy: 0.5703113156132779
Energy: 0.4822452194365961
Energy: 0.5001982349167982
Energy: 0.5148968817966662
Energy: 0.5151177103240311
Energy: 0.48269551118709836
Energy: 0.4524692834324234
Energy: 0.4775370665799845
Energy: 0.45562032426787824
Energy: 0.4527411425573154
Energy: 0.5144899196430565
Energy: 0.4849838477969297
Energy: 0.45244380023154895
Energy: 0.4799392850525121
Energy: 0.48482186537396654
Energy: 0.45306529067300644
Energy: 0.47783141891713293
Energy: 0.4566511492168909
Energy: 0.5732389921971945
Energy: 0.5259641594257901
Energy: 0.49523094832351744
Energy: 0.5141656771474289
Energy: 0.5141732274252658
Energy: 0.4949922458531217
Energy: 0.5770990221362224
Energy: 0.5807708571220989
Energy: 0.5251926609782491
Energy: 0.4817675316914238
Energy: 0.5776743903487461
Energy: 0.5229924691604716
Energy: 0.5717584643687341
Energy: 0.519489370836671
Energy: 0.49863875163270394
Energy: 0.5143503372483147
Energy: 0.5140843308965807
Energy: 0.49743439803568684
Energy: 0.5764273844958787
Energy: 0.4538252074403366
Energy: 0.4542027783643886
Energy: 0.5166228691995673
Energy: 0.45776347792096533
Energy: 0.45435824980416395
Energy: 0.5118319998651191
Energy: 0.4834307732093039
Energy: 0.4959202735863035
Energy: 0.5141756713393942
Energy: 0.4545567357630673
Energy: 0.5049304685645739
Energy: 0.5142358241298151
Energy: 0.4671562295395183
Energy: 0.5050914003797251
Energy: 0.5148600957783852
Energy: 0.5162719473382191
Energy: 0.48247613030613534
Energy: 0.5749444711220235
Energy: 0.4803516451815445
Energy: 0.4851894979966216
Energy: 0.5761390728493324
Energy: 0.48285950239461445
Energy: 0.48180311159588773
Energy: 0.45260947920735367
Energy: 0.48047067289145645
Energy: 0.48156374352920106
Energy: 0.45324154297051933
Energy: 0.48136062932309837
Energy: 0.502185531116115

minimum gb energy = 0.4516595892870065 eV
minimum distance =  2.35472677061905 Angstroms
sigma value = 11


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

Energy: 1.7202482728636683
Energy: 0.8046107846905859
Energy: 0.8780130321180638
Energy: 0.8087256174993465
Energy: 0.7700268076280895
Energy: 0.8748201623932742
Energy: 0.7718943500289874
Energy: 0.7861714683505959
Energy: 0.7911655793618001
Energy: 0.7827874752691197
Energy: 0.7725834313613523
Energy: 0.7941590184400291
Energy: 0.7704789451704848
Energy: 0.7820893218388411
Energy: 0.7853251718722211
Energy: 0.7723183227636743
Energy: 0.7808708560060206
Energy: 0.7758757600132752
Energy: 0.7718668332260554
Energy: 0.789135020087421
Energy: 0.7916098302626402
Energy: 0.773303914012971
Energy: 0.7782559007078238
Energy: 0.7859372401272092
Energy: 0.7716666077525695
Energy: 0.8486522539392407
Energy: 0.8472990335177838
Energy: 0.7959622237479718
Energy: 0.831446986446382
Energy: 0.782062138745592
Energy: 0.8305819918413865
Energy: 0.8267592729263803
Energy: 0.824642249673424
Energy: 0.8000128405902198
Energy: 0.7825326148573644
Energy: 0.8485056637259727
Energy: 0.8291002786369912
Energy: 0.7782874950948596
Energy: 0.7814058478579947
Energy: 0.772063779735155
Energy: 0.7824819288483922
Energy: 0.7800629307714617
Energy: 0.7906701219464163
Energy: 0.7847455072924536
Energy: 0.7724188900214676
Energy: 0.8098175348122535
Energy: 0.7840436719287733
Energy: 0.7825546448465733
Energy: 0.8314637813380616
Energy: 0.8090595277139961
Energy: 0.8313412854799129
Energy: 0.7901539768390319
Energy: 0.7751300334549553
Energy: 0.8296179204738042
Energy: 0.8876904149129895
Energy: 0.8149575422950748
Energy: 0.8496948139538799
Energy: 0.7692779784913738
Energy: 0.8178536154121847
Energy: 0.8220549387812199
Energy: 0.8848338262120358
Energy: 0.8149520164997978
Energy: 0.8574246608718177
Energy: 0.7800322995593103
Energy: 0.8157996142144329
Energy: 0.8484795517514749
Energy: 0.8284666171087968
Energy: 0.7586083201233353
Energy: 0.7734170483060131
Energy: 0.781960318429518
Energy: 0.7521591062016422
Energy: 0.7928706873565269
Energy: 0.8889400802016018
Energy: 0.7485595326510633
Energy: 0.7500304517272813
Energy: 0.7901423369093706
Energy: 0.7534013199667864
Energy: 0.7938384299540352
Energy: 0.890427701516766
Energy: 0.8502282086500103
Energy: 0.8498038693417224
Energy: 0.8138742134347757
Energy: 0.8152736000517639
Energy: 0.8500164678707679
Energy: 1.157968095388075
Energy: 0.8022467889297451
Energy: 0.9486517295553816
Energy: 0.8330431734861465
Energy: 0.7936242446787193
Energy: 1.0084941976328012
Energy: 1.1010247655405554
Energy: 0.8521035919510418
Energy: 0.8500073833075278
Energy: 0.8119943452565361
Energy: 0.8553810874664262
Energy: 0.8512670707732664
Energy: 1.2544707422943553
Energy: 0.8156010547270593
Energy: 0.7619962412215627
Energy: 0.7574331722016696
Energy: 0.8338001427437609
Energy: 0.7624911369628684
Energy: 1.3528010229087204
Energy: 0.8137754503826619
Energy: 0.8542883502019986
Energy: 0.8071516231765714
Energy: 0.8120221190927158
Energy: 0.8509558678261135
Energy: 1.1106237197289226
Energy: 0.78526569122991
Energy: 0.8310573924058207
Energy: 0.7880915601613765
Energy: 0.7792526650807731
Energy: 0.8242904609037126
Energy: 1.0342830119719668
Energy: 0.780548010674657
Energy: 0.793576339581802
Energy: 0.7791165878641245
Energy: 0.8963620989557847
Energy: 0.7983821088222371
Energy: 1.1011641107698087
Energy: 0.8527458296041486
Energy: 0.8137538533059461
Energy: 0.8245139819311932
Energy: 0.8459604060285879
Energy: 0.8178111215028072
Energy: 1.0819934308577206
Energy: 0.7969595616622601
Energy: 0.7625480753941201
Energy: 1.108563764981196
Energy: 0.8041070970141856
Energy: 0.8589804525807981
Energy: 0.7726089343043139
Energy: 0.8270236988273283
Energy: 0.8208021224535024
Energy: 0.7860844336529799
Energy: 0.7857791226948739
Energy: 0.8184786057591705
Energy: 0.7763119873262855
Energy: 0.7805227021441505
Energy: 0.7752573015681072
Energy: 0.7775335620553803
Energy: 0.7758864710662753
Energy: 0.7829937603009183
Energy: 0.7706100298610076
Energy: 0.7777997095394066
Energy: 0.7994773247016976
Energy: 0.7756952462609803
Energy: 0.773389981899636
Energy: 0.7933576252673266
Energy: 0.8732616409032639
Energy: 0.7895762077833961
Energy: 0.8339898618374085
Energy: 0.767923525056377
Energy: 0.7829565747720295
Energy: 0.8473921641495116

minimum gb energy = 0.7485595326510633 eV
minimum distance =  2.31213217247555 Angstroms
sigma value = 41


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

Energy: 1.640387062173392
Energy: 0.8870652718136098
Energy: 0.8697682183897198
Energy: 0.8998574158910241
Energy: 1.0430407369963666
Energy: 0.8300754848416141
Energy: 0.8558469269247455
Energy: 0.8590624003400154
Energy: 0.8596005619557089
Energy: 0.8454712016273322
Energy: 0.8430846450020594
Energy: 0.8395429408581391
Energy: 0.8388607489722668
Energy: 0.8426967216125006
Energy: 0.8408864604378262
Energy: 0.8412470443472548
Energy: 0.8459451209063225
Energy: 0.8401186266058716
Energy: 0.8393531055800991
Energy: 0.8550019170495976
Energy: 0.8513197625705267
Energy: 0.8411966639743779
Energy: 0.8442849961042416
Energy: 0.8493897108695821
Energy: 0.8385320521323006
Energy: 0.861397171430176
Energy: 0.8612705476525176
Energy: 0.8539815526651175
Energy: 0.8621029174959545
Energy: 0.8553084080107229
Energy: 0.9279614976047922
Energy: 0.8506703215582322
Energy: 0.8504199646815033
Energy: 0.8543088724062322
Energy: 0.8455235645110517
Energy: 0.8509752824066047
Energy: 0.930427402462281
Energy: 0.8439878315883615
Energy: 0.8486713304494554
Energy: 0.8381594034882428
Energy: 0.8593793718526388
Energy: 0.8490326709219452
Energy: 0.8691587148826776
Energy: 0.8742679967955158
Energy: 0.8754195876310711
Energy: 0.8042140790923589
Energy: 0.873813208394782
Energy: 0.8175265992645737
Energy: 0.9291696790561388
Energy: 0.8487071770125157
Energy: 0.8524937200168088
Energy: 0.8606868352025467
Energy: 0.8472248368980323
Energy: 0.8520080249869753
Energy: 0.9296027110177267
Energy: 0.8534236249542362
Energy: 0.8597648685974196
Energy: 0.839454468098338
Energy: 0.8589542290845686
Energy: 0.8507967634714239
Energy: 0.9302748354371271
Energy: 0.8553752498921579
Energy: 0.8535500410903369
Energy: 0.8418669950852341
Energy: 0.8594493629381923
Energy: 0.851470576697913
Energy: 0.9295085875074385
Energy: 0.8187386550313597
Energy: 0.8040239162456781
Energy: 0.8602110138727995
Energy: 0.8032257400571692
Energy: 0.8508098218276267
Energy: 0.842530674775382
Energy: 0.8025991847765164
Energy: 0.8033581641908428
Energy: 0.8574721584180249
Energy: 0.8034757807586846
Energy: 0.805116510549799
Energy: 0.8421419033439244
Energy: 0.8586675131242734
Energy: 0.8518137751344209
Energy: 0.8457035873918106
Energy: 0.8591222668137599
Energy: 0.8510635353383009
Energy: 0.8745263142218872
Energy: 0.8620782943627165
Energy: 0.8727611162328954
Energy: 0.8745949298318925
Energy: 0.8481867186017609
Energy: 0.8715001149632962
Energy: 0.8369607485744945
Energy: 0.8534792398706211
Energy: 0.8500184285873579
Energy: 0.8596896696334277
Energy: 0.8663054150090649
Energy: 0.8491497102798591
Energy: 1.2710440965321188
Energy: 0.8608862751724227
Energy: 0.8325173315481383
Energy: 0.805653571733135
Energy: 0.863933355848308
Energy: 0.8055341967679528
Energy: 0.8686650064880038
Energy: 0.8611542527782116
Energy: 0.8620450382507161
Energy: 0.8187395987831781
Energy: 0.8649197383802133
Energy: 0.8350999066274883
Energy: 0.8383521886581141
Energy: 0.8450690810643655
Energy: 0.8435971561264952
Energy: 0.8405603595953847
Energy: 0.8445622872595125
Energy: 0.840563111779086
Energy: 0.8386740096114633
Energy: 0.8427661726725687
Energy: 0.8392280644855395
Energy: 0.8412302708196719
Energy: 0.8448889981606051
Energy: 0.8410380145710943
Energy: 0.8373544813276351
Energy: 0.8420590737674382
Energy: 0.8391319218587447
Energy: 0.8652517517968302
Energy: 0.8440384515885732
Energy: 0.8392833327302672
Energy: 1.2915544998589266
Energy: 0.8590366547066095
Energy: 0.8602730491084573
Energy: 1.2910654818419565
Energy: 0.8415827961757204
Energy: 0.8629407068190483
Energy: 0.9292776607987554
Energy: 0.8482585984218667
Energy: 0.8483424168631006
Energy: 0.8530337618763246
Energy: 0.8441683211633859
Energy: 0.8500898911521203
Energy: 0.8687755155688744
Energy: 0.8423751335017342
Energy: 0.8474015226889339
Energy: 0.8657758682947004
Energy: 0.842611989819139
Energy: 0.8179321594794381
Energy: 0.9305643588506267
Energy: 0.8441220186954419
Energy: 0.8487248006814386
Energy: 0.8545270914189037
Energy: 0.8449701732455344
Energy: 0.8511662186714646
Energy: 0.9298318359357357
Energy: 0.8595568993779518
Energy: 0.8540360067258719
Energy: 0.8435922172432023
Energy: 0.8613182109245956
Energy: 0.8414250735439214
Energy: 0.9296152553617355
Energy: 0.85926973835402
Energy: 0.8519066090088758
Energy: 0.8386708558276947
Energy: 0.8605934038387517
Energy: 0.851112774558587
Energy: 1.1838863421097743
Energy: 0.8330121470095188
Energy: 0.9185755262274217
Energy: 0.8591460457468142
Energy: 0.8192933165081049
Energy: 0.8618288413684889
Energy: 0.842908353364866
Energy: 0.8020007518692771
Energy: 0.804320035273275
Energy: 0.8610385368297941
Energy: 0.8026192034849002
Energy: 0.8067989258009727
Energy: 0.9337901670670449
Energy: 0.8600939283324502
Energy: 0.8537436379445202
Energy: 0.8498908981202302
Energy: 0.8600106340208734
Energy: 0.8627240875039034
Energy: 0.8405391007565367
Energy: 0.8402796563027174
Energy: 0.838528914569328
Energy: 0.8405893794311896
Energy: 0.8452884048410185
Energy: 0.8399474431015144
Energy: 0.8369732464778032
Energy: 0.8423976642829751
Energy: 0.8507912244659273
Energy: 0.8459919853372777
Energy: 0.8412336450808665
Energy: 0.8421287892608678
Energy: 0.9866635612271445
Energy: 0.8612518999625866
Energy: 0.8337750185263045
Energy: 0.8103308724602033
Energy: 0.8622009308221535
Energy: 0.8337991044474242

minimum gb energy = 0.8020007518692771 eV
minimum distance =  2.32030456796599 Angstroms
sigma value = 33


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

Energy: 1.0713861681347132
Energy: 0.9704051520155752
Energy: 0.8891809705902438
Energy: 0.8828792105035648
Energy: 0.9019473488190473
Energy: 0.8897688025377478
Energy: 0.9331363315960403
Energy: 0.9197135951413048
Energy: 0.9181783222097444
Energy: 0.8971955345858327
Energy: 0.918182830500249
Energy: 0.8965064830513905
Energy: 0.9164478256916907
Energy: 0.8953301573823935
Energy: 0.8983580972715053
Energy: 0.9166655879766743
Energy: 0.8950964333616229
Energy: 0.9003903942182149
Energy: 0.9200847957252926
Energy: 0.9159295405652699
Energy: 0.8962940868343497
Energy: 0.9216914652147367
Energy: 0.8941724212185531
Energy: 0.8963814138086579
Energy: 0.9191897227429577
Energy: 0.9190775426754825
Energy: 0.8689198247266329
Energy: 0.9403173747555307
Energy: 0.9186144545247777
Energy: 0.8682451261918911
Energy: 0.9615786786764136
Energy: 0.8973041691266018
Energy: 0.8962500460957278
Energy: 0.8720485630563396
Energy: 0.9018297685559844
Energy: 0.8987499266521164
Energy: 0.9601516034410479
Energy: 0.8968112052806368
Energy: 0.8960549129860508
Energy: 0.9153273555394571
Energy: 0.9198438388221606
Energy: 0.8940809994767702
Energy: 0.9565350995972912
Energy: 0.9182676720567333
Energy: 0.8821787078005449
Energy: 0.8658586714118798
Energy: 0.9577503178265979
Energy: 0.8827109381657782
Energy: 0.9589176581786197
Energy: 0.8975698890706723
Energy: 0.8679869722765281
Energy: 0.8736299449935345
Energy: 0.8703611011009512
Energy: 0.8677708218050086
Energy: 1.0412410270584354
Energy: 0.8950413459768365
Energy: 0.8965220843639937
Energy: 0.8976035290757063
Energy: 0.8941895476913888
Energy: 0.900792553771103
Energy: 0.9592889042859178
Energy: 0.8989686401022444
Energy: 0.8965775949732224
Energy: 0.9191747050820894
Energy: 0.921257764244845
Energy: 0.8949409777304099
Energy: 0.9590536749563258
Energy: 0.865162526492065
Energy: 0.8650930768624409
Energy: 0.9401040746741163
Energy: 0.8714805395496121
Energy: 0.8647001084692056
Energy: 0.9719689071085166
Energy: 0.8650525516229602
Energy: 0.8648385421407826
Energy: 0.939665017874877
Energy: 0.8748589008253485
Energy: 0.8644933094589583
Energy: 0.9140185898001434
Energy: 0.8978955332385652
Energy: 0.8955195793319995
Energy: 0.9159265038458234
Energy: 0.8961793918703088
Energy: 0.8941167774003079
Energy: 0.8824651979624145
Energy: 0.8967242843472389
Energy: 0.917418919592089
Energy: 0.8956012273629155
Energy: 0.8967408977333868
Energy: 0.916256800727902
Energy: 0.9143477106313498
Energy: 0.9163204027959505
Energy: 0.8947210599033552
Energy: 0.9219813981828066
Energy: 0.9158376420382528
Energy: 0.8957456054715118
Energy: 0.9619047840574859
Energy: 0.9004224220002155
Energy: 0.8954585228443269
Energy: 0.8945641455202553
Energy: 0.9771243059642861
Energy: 0.9038005317939192
Energy: 0.9603735852135085
Energy: 0.8702533864329818
Energy: 0.8683061495084434
Energy: 0.9402795055358117
Energy: 0.8728609374598134
Energy: 0.8687178850736341
Energy: 0.9180942545103022
Energy: 0.8659797175894229
Energy: 0.8664414000704832
Energy: 0.8985580630650982
Energy: 0.8682359013572036
Energy: 0.8936126642731788
Energy: 0.8689190635308981
Energy: 0.8666403182778945
Energy: 0.8648461237710772
Energy: 0.896936975352845
Energy: 0.8729116141613754
Energy: 0.8983528468020169
Energy: 0.8694711908012274
Energy: 0.8683650425094708
Energy: 0.8687812078681199
Energy: 0.8681656255771119
Energy: 0.8975851934651635
Energy: 0.8684406291345074
Energy: 0.9614460314795258
Energy: 0.901453232677395
Energy: 0.9014628507672335
Energy: 0.9603405754669391
Energy: 0.9024640521095585
Energy: 0.9175904868266693
Energy: 0.913608726504624
Energy: 0.9174214653580645
Energy: 0.9145081736855729
Energy: 0.8930891000270085
Energy: 0.9397529947996882
Energy: 0.8713711180506725
Energy: 0.9602727692980123
Energy: 0.904987833040838
Energy: 0.865644190310938
Energy: 0.8660208779458708
Energy: 0.9075697464125304
Energy: 0.8652451959505938
Energy: 0.9611899285960525
Energy: 0.9212904393792396
Energy: 0.9198818408954327
Energy: 0.8913340892129025
Energy: 0.9205357746531851
Energy: 0.9159196781554789
Energy: 0.9216374241844048
Energy: 0.8963518564790209
Energy: 0.9006231621960097
Energy: 0.9229604056216516
Energy: 0.8956325180708233
Energy: 0.9009602183673442
Energy: 0.9158272877781771
Energy: 0.8969912606928543
Energy: 0.8950990052740958
Energy: 0.918826883681424
Energy: 0.9183143007132358
Energy: 0.8967397628878109
Energy: 0.9165332258629875
Energy: 0.9009425599456998
Energy: 0.8691373427548239
Energy: 0.9155931431404861
Energy: 0.9151356096968948
Energy: 0.8965901312403967
Energy: 1.055095730065275
Energy: 0.8993342727804845
Energy: 0.8995247746970663
Energy: 1.0242862979472511
Energy: 0.9001573642970436
Energy: 0.9017039402806197
Energy: 0.9582698387041322
Energy: 0.9014032950426619
Energy: 0.8683007214853987
Energy: 0.9387750522846122
Energy: 0.8947954335946203
Energy: 0.8941384482802928
Energy: 0.9566912949724884
Energy: 0.9176977323554237
Energy: 0.8818103365705169
Energy: 0.8657983792136302
Energy: 0.9610237261287078
Energy: 0.882918571730791
Energy: 0.9605814780741376
Energy: 0.8927778345883421
Energy: 0.8688569678637849
Energy: 0.8735764736793653
Energy: 0.8709327419466074
Energy: 0.8671506703353588
Energy: 1.0417400323657453
Energy: 0.9002359832417423
Energy: 0.8994537134269317
Energy: 0.9156500179644413
Energy: 0.898312002466945
Energy: 0.8976407165136701
Energy: 1.040501406691228
Energy: 0.9175578095247886
Energy: 0.8983845105217713
Energy: 0.9229426695092381
Energy: 0.8976059320331428
Energy: 0.8968119043368914
Energy: 0.9611213830107255
Energy: 0.9268367194566454
Energy: 0.8641960906947114
Energy: 0.9401189818172778
Energy: 0.9232930655992588
Energy: 0.8678560882387283
Energy: 0.9725623667542703
Energy: 0.8654451505579767
Energy: 0.8650731622258521
Energy: 0.8706022133920162
Energy: 0.8656039802708198
Energy: 0.864563424566231
Energy: 0.912865845863919
Energy: 0.8990731124904052
Energy: 0.8959663646350875
Energy: 0.9146361859565326
Energy: 0.8973057073288981
Energy: 0.8935423173053505
Energy: 0.8961397376998084
Energy: 0.895521066197539
Energy: 0.919906547864055
Energy: 0.8984464764009963
Energy: 0.8949625092284449
Energy: 0.9190463515141312
Energy: 0.9135568557531114
Energy: 0.9154357863843403
Energy: 0.8939990799854437
Energy: 0.896297373612754
Energy: 0.916500147953246
Energy: 0.8942934179415639
Energy: 1.0384279069317905
Energy: 0.8760506749136542
Energy: 0.869237311370321
Energy: 0.9256113610228904
Energy: 0.9412298217204832
Energy: 0.9001664360102992
Energy: 1.0398516137378753
Energy: 0.8718207763337172
Energy: 0.8691011158260136
Energy: 0.9196703303493213
Energy: 0.8731144759298192
Energy: 0.8688227259873448
Energy: 0.9150199690941698
Energy: 0.8687144883336757
Energy: 0.8652140211070015
Energy: 0.8942050778855949
Energy: 0.968292621625866
Energy: 0.896082432597256
Energy: 0.9248910380630808
Energy: 0.8648495210201236
Energy: 0.8978563343814289
Energy: 0.8969616499931986
Energy: 0.8679124328602225
Energy: 0.8672177515347013
Energy: 0.8676550623142659
Energy: 0.8686277077850271
Energy: 0.8684917907036939
Energy: 0.8692206625043736
Energy: 0.868534173911894
Energy: 0.8676744073852268
Energy: 0.9578984554882116
Energy: 0.9026416982854208
Energy: 0.9143436824841914
Energy: 0.9210382883137954
Energy: 0.9014772156006232
Energy: 0.9168165136577573
Energy: 0.9136889327429277
Energy: 0.9171618292005571
Energy: 0.8940283065794473
Energy: 0.9200325801998226
Energy: 0.940121470026355
Energy: 0.8946907691931533
Energy: 1.1139538498107069
Energy: 0.8686348022650286
Energy: 0.8647971026312
Energy: 0.877582968657518
Energy: 0.946719740143829
Energy: 0.8650036097385521

minimum gb energy = 0.8641960906947114 eV
minimum distance =  2.31306190908495 Angstroms
sigma value = 67


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

Energy: 1.250042620637207
Energy: 0.9934820382695636
Energy: 0.9343658581514689
Energy: 0.9448671728718044
Energy: 0.992275275454438
Energy: 0.9344370844154398
Energy: 0.9851360839245747
Energy: 0.9473050525225992
Energy: 0.9452095873176046
Energy: 0.9490676973958597
Energy: 0.9514929967818956
Energy: 0.945559675165597
Energy: 0.9873881094786072
Energy: 0.9037784082789396
Energy: 0.9492315809566183
Energy: 0.9467146872404153
Energy: 0.9033481632959577
Energy: 0.9493491753392411
Energy: 0.9879229989211429
Energy: 0.9434145476328413
Energy: 0.9456396218584541
Energy: 0.9560408842263491
Energy: 0.9455356117905737
Energy: 0.9451786806656254
Energy: 0.979053914862813
Energy: 0.9487666175832536
Energy: 0.9486389002374684
Energy: 0.980004331554307
Energy: 0.9486912836006004
Energy: 0.9492651561805342
Energy: 0.9801555719304547
Energy: 0.9425435506676497
Energy: 0.9527922707635206
Energy: 0.9809847756374288
Energy: 0.9419408154132494
Energy: 0.9539184218614073
Energy: 1.0473985517495206
Energy: 0.9476883380521041
Energy: 0.9465838852511825
Energy: 0.909008193566151
Energy: 0.9524740994450208
Energy: 0.9460386342760968

minimum gb energy = 0.9033481632959577 eV
minimum distance =  2.35631649296454 Angstroms
sigma value = 3


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

Energy: 1.2431978845195755
Energy: 1.2054610216086359
Energy: 1.1070481274372828
Energy: 1.0724075036186143
Energy: 1.20470175749453
Energy: 1.1094197084782667
Energy: 1.0312885431356347
Energy: 1.058788743704304
Energy: 1.0413723711854663
Energy: 1.087078574332674
Energy: 1.0993815506074485
Energy: 1.046232221558056
Energy: 1.0374619277010027
Energy: 1.0403582263206395
Energy: 1.0354547415648914
Energy: 1.0392200870880897
Energy: 1.0402049051624396
Energy: 1.0372273957735718
Energy: 1.0366584812564539
Energy: 1.033241957846127
Energy: 1.0344724842506854
Energy: 1.0365693092033956
Energy: 1.0333249656485937
Energy: 1.0349401153836444
Energy: 1.0439828735664984
Energy: 1.0315813836463892
Energy: 1.0320513225399757
Energy: 1.0452303939204342
Energy: 1.0327498212358823
Energy: 1.0312448803056702
Energy: 1.0301476537586443
Energy: 1.0319934763480585
Energy: 1.0317439400933672
Energy: 1.031727611233975
Energy: 1.0327458870543655
Energy: 1.0311846671819243
Energy: 1.0357997891797945
Energy: 1.0774796976553593
Energy: 1.0790401717141387
Energy: 1.0475223328357324
Energy: 1.1149718351638438
Energy: 1.0758574906752023
Energy: 1.2290871947165651
Energy: 1.0863683313439394
Energy: 1.1110890923465078
Energy: 1.0274266714833036
Energy: 1.1700659784315253
Energy: 1.0541920857447746
Energy: 1.0363554182049364
Energy: 1.0377280504205595
Energy: 1.077240519834321
Energy: 1.051829746880037
Energy: 1.066611902154881
Energy: 1.0769736924480267
Energy: 1.0320415493527038
Energy: 1.0291422463884936
Energy: 1.0304806671513356
Energy: 1.093933278198025
Energy: 1.0291211027296396
Energy: 1.0749478389026725
Energy: 1.0832944618259244
Energy: 1.08207871145206
Energy: 1.0844510370277343
Energy: 1.0848036249980828
Energy: 1.0413043634813743
Energy: 1.0921542822465837
Energy: 1.114340175601221
Energy: 1.0290494303275821
Energy: 1.028161204163426
Energy: 1.0866596839672396
Energy: 1.034077505964355
Energy: 1.0274208353776004
Energy: 1.0872572423576699
Energy: 1.0282073681798407
Energy: 1.0272275745947745
Energy: 1.0576107965074715
Energy: 1.0281585947836118
Energy: 1.0266240806597384
Energy: 1.1051432617325079
Energy: 1.0333395637703797
Energy: 1.0288853163599474
Energy: 1.0552787592075294
Energy: 1.0308555995384783
Energy: 1.0280749393657749
Energy: 1.1349769633994595
Energy: 1.0301708486540042
Energy: 1.109067182880959
Energy: 1.0380934498507528
Energy: 1.0310929058572194
Energy: 1.0333952990802118
Energy: 1.1240236733744464
Energy: 1.0850180683700696
Energy: 1.0839017527813992
Energy: 1.091963916676601
Energy: 1.0886549341090344
Energy: 1.085565354138402
Energy: 1.2095200644733375
Energy: 1.0357180713218792
Energy: 1.0357246408832992
Energy: 1.210776931909174
Energy: 1.0360035990909089
Energy: 1.0494032229539458
Energy: 1.123941006365557
Energy: 1.080998324990768
Energy: 1.1045577537125542
Energy: 1.1094374850775914
Energy: 1.0833464591821544
Energy: 1.0690863095861745
Energy: 1.2162150083275194
Energy: 1.0579721359089784
Energy: 1.0343566365340013
Energy: 1.0266127198199464
Energy: 1.1295772628664764
Energy: 1.0305429644533195
Energy: 1.1824239786590887
Energy: 1.0627259247540624
Energy: 1.0631296675488724
Energy: 1.0295615664344853
Energy: 1.063138813785988
Energy: 1.0302714573915408
Energy: 1.0558059196600695
Energy: 1.064593312882671
Energy: 1.0670020555966842
Energy: 1.0682912163393319
Energy: 1.0652735198911643
Energy: 1.0853528427729306
Energy: 1.0558994349563209
Energy: 1.069633329252444
Energy: 1.0618451269474214
Energy: 1.060208282333423
Energy: 1.0690146026758713
Energy: 1.0607260580959885
Energy: 1.0580146724109194
Energy: 1.0620965318553965
Energy: 1.0778295910455877
Energy: 1.0608555928648253
Energy: 1.030263439853751
Energy: 1.0735622309052197
Energy: 1.0624544905552955
Energy: 1.028762569353189
Energy: 1.0286983459515762
Energy: 1.0621983355734466
Energy: 1.0283566416924586
Energy: 1.0599454592826894
Energy: 1.0486253625444413
Energy: 1.0427824963509231
Energy: 1.0339587502341996
Energy: 1.0536645929344057
Energy: 1.0486522515588805
Energy: 1.0336362093131979
Energy: 1.2492508709106496
Energy: 1.0534589480288286
Energy: 1.058454248610156
Energy: 1.0341283777468349
Energy: 1.1593683395407264
Energy: 1.0344207936539693
Energy: 1.0229461768538315
Energy: 1.0481754616539576
Energy: 1.0824398831547994
Energy: 1.0334400271192317
Energy: 1.1621431227474288
Energy: 1.0336602016089909
Energy: 1.0504360549770835
Energy: 1.0414116977025105
Energy: 1.0335018047374953
Energy: 1.03992106758074
Energy: 1.05149493502712
Energy: 1.0336170504012603
Energy: 1.0463755620234312
Energy: 1.0409412720951678
Energy: 1.0365634530819954
Energy: 1.0460595128573462
Energy: 1.0406895284160773
Energy: 1.0375608906244804
Energy: 1.0423834454753753
Energy: 1.0507063931017
Energy: 1.04701472256949
Energy: 1.0448162807356047
Energy: 1.078047038003365
Energy: 1.0478164836876624
Energy: 1.0411956001203189
Energy: 1.0420688531704307
Energy: 1.0492241894466037
Energy: 1.0482953977567344
Energy: 1.118182883102674
Energy: 1.0498464187821572
Energy: 1.0552090259032827
Energy: 1.0783488148960112
Energy: 1.0774986468270895
Energy: 1.0653983244894871
Energy: 1.0925513799691624
Energy: 1.0730622437265116
Energy: 1.2294294527430676
Energy: 1.0778743794851142
Energy: 1.1011749933786348
Energy: 1.02914268675651
Energy: 1.1268345909258375
Energy: 1.0339878066035444
Energy: 1.118863628056059
Energy: 1.0286209497604597
Energy: 1.028084168327791
Energy: 1.0307044380289416
Energy: 1.111847411864689
Energy: 1.02659442960566
Energy: 1.0474562731615353
Energy: 1.079376475984792
Energy: 1.0789025769814198
Energy: 1.0428090856286567
Energy: 1.0779746276296207
Energy: 1.0792076258758445
Energy: 1.116343658934696
Energy: 1.0289068215057586
Energy: 1.0316200488811516
Energy: 1.1179758414450007
Energy: 1.026880466696526
Energy: 1.074796189217492
Energy: 1.1147925232671376
Energy: 1.0408909182356085
Energy: 1.0400586675873618
Energy: 1.1052446871493506
Energy: 1.0530156201415712
Energy: 1.0910937183503562
Energy: 1.0876044307131616
Energy: 1.0309107527778907
Energy: 1.030654439402313
Energy: 1.0278104774561536
Energy: 1.03401669421146
Energy: 1.02984704398165
Energy: 1.1102874574896302
Energy: 1.026386472786442
Energy: 1.0257624152080305
Energy: 1.0696577048438438
Energy: 1.0312391912041778
Energy: 1.0252506180948258
Energy: 1.1354629821658244
Energy: 1.0338117505956412
Energy: 1.0343495188780634
Energy: 1.037163372702568
Energy: 1.0343103021602373
Energy: 1.0337465368234602
Energy: 1.2064460507023607
Energy: 1.029676967959196
Energy: 1.0292972854089766
Energy: 1.045098845921998
Energy: 1.0806873766623082
Energy: 1.0289375294816858
Energy: 1.1888768023406873
Energy: 1.0692301681074587
Energy: 1.0807490488491738
Energy: 1.1303002153590542
Energy: 1.0321483457389982
Energy: 1.0276920113709775
Energy: 1.2706589863908406
Energy: 1.0358292011873722
Energy: 1.0344161697580037
Energy: 1.206815546696
Energy: 1.0346085251262878
Energy: 1.1118242916354222
Energy: 1.0479539246969145
Energy: 1.0270951153615646
Energy: 1.0277200309133756
Energy: 1.0374919074990365
Energy: 1.040990122518401
Energy: 1.0295752340360247
Energy: 1.4626746923867666
Energy: 1.0580961611488542
Energy: 1.0592548357684703
Energy: 1.1140018288019946
Energy: 1.0571260479702453
Energy: 1.0582287008864903
Energy: 1.0477657608568987
Energy: 1.05515371745682
Energy: 1.0575936149237495
Energy: 1.0584661994277587
Energy: 1.0490862836820274
Energy: 1.05897428122511
Energy: 1.0464770485229076
Energy: 1.0524500730294892
Energy: 1.052854682549416
Energy: 1.0517167187900365
Energy: 1.0582814288204085
Energy: 1.052741526208137
Energy: 1.058403039284755
Energy: 1.0604775408634797
Energy: 1.052591676498657
Energy: 1.059692791104733
Energy: 1.0581009740370144
Energy: 1.0522480349770273
Energy: 1.0479612212716194
Energy: 1.0313543307255986
Energy: 1.0410095216148503
Energy: 1.048413938821162
Energy: 1.0299977868435315
Energy: 1.0377387725189042
Energy: 1.0391612273600208
Energy: 1.0278752004187457
Energy: 1.0282217131146851
Energy: 1.0456697600021954
Energy: 1.0319847494760797
Energy: 1.0375080696512875
Energy: 1.0313504616939242
Energy: 1.0926082613883035
Energy: 1.051957970420306
Energy: 1.0726976416140837
Energy: 1.0419068775616915
Energy: 1.062909992138787

minimum gb energy = 1.0229461768538315 eV
minimum distance =  2.28128224036701 Angstroms
sigma value = 81


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

Energy: 1.7926713628566804
Energy: 1.0775168732164857
Energy: 1.0344988171422067
Energy: 1.006292425069632
Energy: 1.1217044812352295
Energy: 1.034693030890772
Energy: 1.0284495129881777
Energy: 1.0521445251297863
Energy: 1.0551827367035442
Energy: 1.035673940618364
Energy: 1.0071271285459036
Energy: 1.0594851066171675
Energy: 1.0297991965793822
Energy: 1.0528546545772417
Energy: 1.0255329309200556
Energy: 1.0728569448767231
Energy: 1.0330047392958872
Energy: 1.0447583008564871
Energy: 1.0327986683836696
Energy: 1.0244263081524883
Energy: 1.0702989889045775
Energy: 1.0305993613903441
Energy: 1.0350714554530198
Energy: 1.034467000983478
Energy: 1.0322303306716931
Energy: 1.0545854249112223
Energy: 1.0541692907183233
Energy: 1.032431245782635
Energy: 1.05330135194402
Energy: 1.0548172776937441
Energy: 1.029777529764186
Energy: 1.0544757956017736
Energy: 1.0562351514732717
Energy: 1.0535469061956546
Energy: 1.050881991606317
Energy: 1.057340837806731
Energy: 1.0164447506212306
Energy: 1.0423827525601637
Energy: 1.0394108046214279
Energy: 1.0803803526741387
Energy: 1.0382310127000598
Energy: 1.0530781502888764
Energy: 1.1714087260356476
Energy: 1.1109459405441007
Energy: 1.0943134001911243
Energy: 0.9917779551733571
Energy: 1.1313372912977466
Energy: 1.063189310701539
Energy: 1.018094058637863
Energy: 1.0555809344612026
Energy: 1.034972001153419
Energy: 1.0347143982994536
Energy: 1.0057952370315262
Energy: 1.0014684212026275
Energy: 1.0721285272489804
Energy: 0.9732840375264756
Energy: 0.9674970721967983
Energy: 1.0753152311740835
Energy: 0.9670549043486836
Energy: 0.9679069993196203
Energy: 1.024237397684463
Energy: 0.9680033432936311
Energy: 0.9679271786064644
Energy: 1.0251621365858152
Energy: 1.0077111382768857
Energy: 1.0018246080459507
Energy: 1.0175497234740642
Energy: 1.002849862394751
Energy: 1.0029365190216823
Energy: 1.0296787750607672
Energy: 1.0147763188753813
Energy: 1.039987967430771
Energy: 1.0168551486817268
Energy: 1.0571123686171848
Energy: 1.0041991699433914
Energy: 1.0296587299120563
Energy: 1.047705289805366
Energy: 1.0264753651900358
Energy: 1.0501512853051376
Energy: 1.0547453284275894
Energy: 1.0570518776060924
Energy: 1.064475372313512
Energy: 1.0550220584746954
Energy: 1.0560537609650742
Energy: 1.1713141677872239
Energy: 1.1082571494911395
Energy: 1.103068303931105
Energy: 1.0625922538416623
Energy: 1.0563804399243693
Energy: 1.0576653172609678
Energy: 1.0496811477057189
Energy: 1.0557975481231323
Energy: 1.0567836266192925
Energy: 1.0506057071288872
Energy: 1.0555140914590677
Energy: 1.0597280160726528
Energy: 1.1754355118813096
Energy: 0.991898418515404
Energy: 0.9919897577880655
Energy: 1.1754882665933304
Energy: 0.9916378934032098
Energy: 1.0356067284634838
Energy: 1.020717908807467
Energy: 1.0130105534756424
Energy: 1.0545640003820091
Energy: 1.0098375608119206
Energy: 1.076678098442398
Energy: 1.0545922698184578
Energy: 1.141886212276606
Energy: 1.0142226689223794
Energy: 0.9691627991951808
Energy: 0.9659863323529633
Energy: 1.0371156002903459
Energy: 0.9688838531234972
Energy: 1.2226185944342718
Energy: 1.0150819211802777
Energy: 0.9711691932698182
Energy: 0.9695567502299531
Energy: 1.038967809152842
Energy: 0.9705995656676686
Energy: 1.0201393799897407
Energy: 1.0119913368457358
Energy: 1.0547067490547624
Energy: 1.0093049878368379
Energy: 1.0136492496960856
Energy: 1.0215985788155302
Energy: 1.0484612858905822
Energy: 0.9918319189045354
Energy: 1.0781013833983233
Energy: 1.0489424079558407
Energy: 0.9922882601855639
Energy: 1.079659463664913
Energy: 1.0430980797240372
Energy: 1.0581905809754226
Energy: 1.0738618897925793
Energy: 1.045000467914127
Energy: 1.0566315309285796
Energy: 1.054257332419482
Energy: 1.045184933505311
Energy: 1.0608366733116226
Energy: 1.0597974087500264
Energy: 1.0590192234772402
Energy: 1.055646103737354
Energy: 1.0597708645995172
Energy: 1.0503579502395493
Energy: 1.061119105908243
Energy: 1.0569890052222155
Energy: 1.0645852882648879
Energy: 1.0580258119924368
Energy: 1.0570691626915079
Energy: 1.1656506233199784
Energy: 1.1099451373594704
Energy: 1.1044200456836981
Energy: 0.9937142332391133
Energy: 1.114685464882584
Energy: 1.1036843089566886
Energy: 1.1650626564298152
Energy: 1.1034069286095625
Energy: 1.1020758388969987
Energy: 0.9933641211156641
Energy: 1.092827407465396
Energy: 1.0925661415110282
Energy: 1.0188651185073514
Energy: 0.9681435572746809
Energy: 1.002130866354951
Energy: 1.0286415260679693
Energy: 1.0020186088286969
Energy: 1.0028453946695983
Energy: 1.0233688847613565
Energy: 0.9680598376636228
Energy: 0.9754329901329937
Energy: 1.0290898111451334
Energy: 0.9674281954865888
Energy: 0.9746793658231516
Energy: 1.0211988771120712
Energy: 1.0166557299422334
Energy: 1.041710066199279
Energy: 1.0340284038031184
Energy: 1.006244415581348
Energy: 1.0019171089990118
Energy: 1.0177584482429882
Energy: 1.0254904548578767
Energy: 1.0043727843336228
Energy: 1.0342549213983399
Energy: 1.0414571954365888
Energy: 0.9925226070163516
Energy: 1.0215703292309013
Energy: 1.0020849226418722
Energy: 1.0016655728793284
Energy: 1.032986398343181
Energy: 1.0375614105063522
Energy: 1.0022535206252559
Energy: 1.168320452925658
Energy: 1.0520330498729207
Energy: 1.055435190648116
Energy: 1.0419814962932572
Energy: 1.0383853464747266
Energy: 1.0565155162315802
Energy: 1.168004811332882
Energy: 1.0588453003068659
Energy: 1.0592481437457342
Energy: 1.0598133163680798
Energy: 1.055058373634754
Energy: 1.0572932458658104
Energy: 1.170393824364481
Energy: 1.0558527132036384
Energy: 1.0584079268543816
Energy: 1.1119938574845547
Energy: 0.9935285032278245
Energy: 1.0645925387448205
Energy: 1.161109967446641
Energy: 0.9913406003207197
Energy: 0.9910334553801774
Energy: 1.1610853249967183
Energy: 0.9919143808171339
Energy: 1.115618546141531
Energy: 1.0289355915123757
Energy: 1.0505999596115463
Energy: 1.053257434650155
Energy: 1.0757995120396457
Energy: 1.0059464818693034
Energy: 1.0589542551997315
Energy: 1.160310249918392
Energy: 1.1000588744709492
Energy: 1.0367979118273905
Energy: 0.9953686574295759
Energy: 1.098869751402664
Energy: 1.0262786853666794

minimum gb energy = 0.9659863323529633 eV
minimum distance =  2.32485883119198 Angstroms
sigma value = 43


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

Energy: 1.7443205285969134
Energy: 1.1561486970758463
Energy: 1.1074032556699318
Energy: 1.0517342496623847
Energy: 1.2394608410632595
Energy: 1.0462381567981685
Energy: 1.0111183689488952
Energy: 1.0027595589091722
Energy: 1.003014508656224
Energy: 1.0540309465820075
Energy: 1.0066882266779047
Energy: 1.0118305390320252
Energy: 1.024278294541036
Energy: 0.9944155455898982
Energy: 0.9938434847459225
Energy: 1.05637018705306
Energy: 0.9962206889689085
Energy: 1.0129197001450376
Energy: 1.011743922898848
Energy: 0.9951086570347708
Energy: 1.0118498424527738
Energy: 1.011949238153653
Energy: 0.9957854440928234
Energy: 1.01258775774235
Energy: 1.011551409328467
Energy: 1.0383222742330491
Energy: 1.0478395941947796
Energy: 1.0117429929907404
Energy: 1.0522946869343681
Energy: 1.051778289838223
Energy: 1.0125051285775897
Energy: 1.0519060059498548
Energy: 1.0394138154360644
Energy: 1.0564428350810746
Energy: 1.024824469014554
Energy: 1.0471802977438291
Energy: 1.012317121748465
Energy: 1.0117162856344322
Energy: 1.0118471189132505
Energy: 1.0132293616283932
Energy: 1.0126899419895747
Energy: 1.0134909285674791
Energy: 1.1581488234139758
Energy: 1.012990637506605
Energy: 1.0124295274141863
Energy: 1.002580642842944
Energy: 1.0135361004417152
Energy: 1.0124257691646172
Energy: 1.0080316062564494
Energy: 1.013070063398148
Energy: 1.0129781936467515
Energy: 1.0078929144523003
Energy: 1.0128117468015292
Energy: 1.0263687646413537
Energy: 1.2120127503025118
Energy: 1.0129601410663545
Energy: 1.0128365313502163
Energy: 1.1227819707678637
Energy: 1.0132714804353358
Energy: 1.013113622444865
Energy: 1.001107250109949
Energy: 1.0373345878623104
Energy: 1.0423035667573723
Energy: 1.0072194312217815
Energy: 1.0169416278544323
Energy: 1.0194009034254485
Energy: 1.1395748146586622
Energy: 1.0124114819325027
Energy: 1.0123253193491908
Energy: 1.0200052845921896
Energy: 1.0125698659433437
Energy: 1.0123551980755177
Energy: 1.1771156209134912
Energy: 1.0122126292863776
Energy: 1.0277102417943818
Energy: 0.9959518736596003
Energy: 1.013850291110753
Energy: 1.0300112005997264
Energy: 1.001353289998339
Energy: 1.0253053044970744
Energy: 1.0188135206780655
Energy: 1.007585484153181
Energy: 1.0119954150666388
Energy: 1.0032186400771888
Energy: 1.0036710434641856
Energy: 1.0026493706080652
Energy: 1.0131380513746904
Energy: 1.0147454478962785
Energy: 0.9937488125903569
Energy: 1.015871842626228
Energy: 1.0018734148872372
Energy: 1.0560829036043327
Energy: 1.0140966181780846
Energy: 1.0004720143149872
Energy: 1.0130189000502048
Energy: 1.001192332877601
Energy: 1.0021902740044637
Energy: 1.0038327592410292
Energy: 1.0038425536962745
Energy: 1.0022673572038516
Energy: 1.0009872807191758
Energy: 1.0043749311082986
Energy: 1.0010417545320518
Energy: 1.011994874479852
Energy: 1.002887783597775
Energy: 1.044119976536926
Energy: 1.0611611607590083
Energy: 1.0006230698727974
Energy: 1.0091883593287287
Energy: 1.0009380497861913
Energy: 1.0009631689745353
Energy: 1.0129753352910031
Energy: 1.0010653231882762
Energy: 1.0121704049501192
Energy: 1.1270088110078162
Energy: 1.0004681390386125
Energy: 1.0005361248431859
Energy: 1.012613809245546
Energy: 1.0042936768560855
Energy: 1.0122128699958959
Energy: 1.0010417229535005
Energy: 1.0151437807746977
Energy: 1.0043777669007181
Energy: 1.0380761516728012
Energy: 1.0268240042245473
Energy: 1.0028221583902635
Energy: 1.1473422510705722
Energy: 1.0290550501227027
Energy: 1.0317209916951384
Energy: 1.1474321088947506
Energy: 0.9973695456104517
Energy: 1.1508856115363468
Energy: 1.0395176957160595
Energy: 1.0135541911168469
Energy: 1.0152635388011695
Energy: 1.0188681815239706
Energy: 1.0534865858161198
Energy: 1.0332920279241833
Energy: 1.1140111467294342
Energy: 1.0035859068770971
Energy: 1.0034940581255625
Energy: 1.0072567361395086
Energy: 1.0006409396961835
Energy: 1.0234964449723856
Energy: 1.0386973853861736
Energy: 1.0033044058233864
Energy: 1.0039872509803554
Energy: 1.0156576529936576
Energy: 1.003008022692829
Energy: 1.0041624418578083
Energy: 1.0728829542267981
Energy: 1.0011938777200138
Energy: 1.014311795276444
Energy: 1.0039820999084847
Energy: 1.001216884008255
Energy: 1.005218273825422
Energy: 1.0723186409205177
Energy: 1.0137602368433865
Energy: 1.013681445666168
Energy: 1.0673594269214488
Energy: 1.0014804769443522
Energy: 1.0137808630125673
Energy: 1.0580825084680572
Energy: 1.0152460039176014
Energy: 1.02403668978769
Energy: 1.0122065858538314
Energy: 1.0237500263627073
Energy: 1.0247626588498986
Energy: 1.0410601732937417
Energy: 1.0119931190623208
Energy: 1.011933101927023
Energy: 1.0411279053046494
Energy: 1.001380317807206
Energy: 1.0116216170458778
Energy: 1.0109919977902515
Energy: 1.0196236792544782
Energy: 1.0088095645517354
Energy: 1.0546726323343647
Energy: 1.013794474675339
Energy: 1.0130148895671864
Energy: 0.9958770852051365
Energy: 1.0722946380644494
Energy: 1.0535644190704683
Energy: 1.0278997005852444
Energy: 1.0712395597028055
Energy: 0.9949742853426266

minimum gb energy = 0.9937488125903569 eV
minimum distance =  2.30297376523196 Angstroms
sigma value = 57


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

Energy: 1.3389372549342775
Energy: 1.6044106293849825
Energy: 1.0443725263380634
Energy: 0.9543335675352359
Energy: 1.6026074301648627
Energy: 1.0441396214859564
Energy: 0.9913650570573792
Energy: 1.0039538005291504
Energy: 1.0116900233961144
Energy: 1.0177339997490629
Energy: 1.0168989197013187
Energy: 1.0006317968805314
Energy: 1.0231341096040985
Energy: 0.9757369126639897
Energy: 0.9618084974063308
Energy: 1.0036106769955426
Energy: 0.9745058953597517
Energy: 0.949157234061985
Energy: 1.001219878490862
Energy: 0.9613620217004031
Energy: 0.9484568441771578
Energy: 1.0019283441577946
Energy: 0.9493836339841587
Energy: 1.0025678667153388
Energy: 1.0023555359760599
Energy: 1.000801211069417
Energy: 1.0086812404073753
Energy: 1.0026808040205077
Energy: 1.0075536396870493
Energy: 1.0012820122807822
Energy: 0.9523016250804301
Energy: 1.000081955857265
Energy: 0.9886939689682869
Energy: 0.9918983056225816
Energy: 1.006496533738482
Energy: 0.9891745034842264
Energy: 1.0181962328259357
Energy: 1.0018709968939021
Energy: 1.0026624110390792
Energy: 1.019662267399859
Energy: 1.0022351164234482
Energy: 1.0073121691782034
Energy: 0.9978572935346894
Energy: 1.001637525069271
Energy: 1.0013573759353585
Energy: 0.9860215421678094
Energy: 1.0026015345842816
Energy: 1.0040442008531119
Energy: 1.0160453863243832
Energy: 1.0029749560239751
Energy: 1.0037803726293428
Energy: 1.0166135882044138
Energy: 1.0027568429454825
Energy: 1.0008338224456477
Energy: 1.1887124283332229
Energy: 0.9954574981705337
Energy: 0.9951775332426659
Energy: 1.1237467579912341
Energy: 0.9968584749015729
Energy: 0.9965938560680656
Energy: 1.0097432234267592
Energy: 0.9958758180689861
Energy: 1.0080317027862036
Energy: 1.0196467098753916
Energy: 1.001615620718816
Energy: 1.0024442440339838
Energy: 0.9485147248435989
Energy: 1.0044613864748955
Energy: 1.00262469466432
Energy: 0.9527564077177038
Energy: 1.0190211717089146
Energy: 1.0415067728285137
Energy: 0.9497734467573836
Energy: 1.0031249076157045
Energy: 1.0411737653341764
Energy: 0.9753022555812825
Energy: 1.006191678172092
Energy: 1.0416345831489355
Energy: 1.004618869540024
Energy: 0.9978869552136151
Energy: 0.998641191262899
Energy: 1.0164356629480633
Energy: 1.0173365651709092
Energy: 1.0089161913331937
Energy: 1.0147607778287244
Energy: 0.9506596625448633
Energy: 0.9559645074733821
Energy: 1.0121401963582566
Energy: 0.9496023228528582
Energy: 0.954728398802707
Energy: 1.001650099465041
Energy: 0.9989206429731331
Energy: 0.9980934450429915
Energy: 1.0028555068430534
Energy: 1.0179385309989166
Energy: 1.0064197198261569
Energy: 1.0030683578030226
Energy: 0.9908788826019749
Energy: 1.0033923613524847
Energy: 1.0063812058856763
Energy: 0.990892749875059
Energy: 0.9966329208742847
Energy: 1.0038025219082705
Energy: 1.0100692530202542
Energy: 0.9900514807427323
Energy: 1.009175112595778
Energy: 1.0025095256121173
Energy: 0.9962838098379926
Energy: 1.0193777122258467
Energy: 1.0031632629853522
Energy: 1.0032266512322927
Energy: 1.0202359377264258
Energy: 1.0021179008897392
Energy: 1.0080867438762569
Energy: 1.0177042752790275
Energy: 1.0046238298663486
Energy: 1.0131691570369037
Energy: 1.0199538187798833
Energy: 1.0042668970939528
Energy: 1.0073882572515342
Energy: 1.0166608955121277
Energy: 1.008214860803178
Energy: 0.9924633421393377
Energy: 1.0176254576194532
Energy: 1.008212968968292
Energy: 0.9999034736977394
Energy: 1.1878060724181079
Energy: 0.9945013769935089
Energy: 1.0014407418358582
Energy: 1.1239202872611425
Energy: 0.9949611651224437
Energy: 1.0003942383859858
Energy: 1.0049435869605576
Energy: 1.006040576376218
Energy: 0.9945959457944799
Energy: 1.0162688400598565
Energy: 1.017068735643283
Energy: 0.9995111088761964
Energy: 0.9499668567064863
Energy: 1.003239041480789
Energy: 1.0412308400861683
Energy: 0.9762701736783739
Energy: 1.0063270606800956
Energy: 1.041452021456107

minimum gb energy = 0.9484568441771578 eV
minimum distance =  2.28290227222046 Angstroms
sigma value = 17


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

Energy: 1.5431837759819047
Energy: 1.0167952895088563
Energy: 1.1733934152863745
Energy: 0.9314474962274842
Energy: 1.0161377315618227
Energy: 0.9306020199565457
Energy: 1.1459532078410664
Energy: 1.0336579148196823
Energy: 1.0092146424680073
Energy: 1.0608563934659856
Energy: 1.033695135520007
Energy: 0.9868353306546782
Energy: 1.2539094947462355
Energy: 0.9596950603381375
Energy: 0.9594385782933553
Energy: 1.034334890553232
Energy: 0.9597360933565309
Energy: 0.932907314861662
Energy: 1.0311144745484735
Energy: 0.9462227612815797
Energy: 0.9323930969556578
Energy: 1.030546660318923
Energy: 0.9567785364911127
Energy: 1.0257780607251232
Energy: 0.9183690017146646
Energy: 0.9466148025743264
Energy: 0.9597984738415452
Energy: 0.9193218376987864
Energy: 0.9461053527380623
Energy: 0.9600185103468767
Energy: 0.9324246629670782
Energy: 0.9543457734537273
Energy: 0.9595025125337963
Energy: 0.9110330907377555
Energy: 0.9043707143991213
Energy: 0.9439917452091034
Energy: 0.9043809258363495
Energy: 0.9031222445350783
Energy: 0.9036204916528547
Energy: 0.9040468694651077
Energy: 0.9040234717410734
Energy: 0.9276519870000071
Energy: 0.9042577552697537
Energy: 0.9530159404659736
Energy: 0.9538454915738396
Energy: 0.9510014202401047
Energy: 0.9519644295001856
Energy: 0.9512230557277936
Energy: 0.9066564996454629
Energy: 0.9510248046866084
Energy: 0.9494954694341774
Energy: 0.9085812135724778
Energy: 0.9515351594158326
Energy: 0.9072085083185016
Energy: 0.9036927208813489
Energy: 0.9602176652684644
Energy: 0.9598346578473274
Energy: 0.9039260802218391
Energy: 0.9601696252601043
Energy: 0.9495730804778887
Energy: 0.9055444449098096
Energy: 0.960605173298906
Energy: 0.9596329623951537
Energy: 0.9463698818578101
Energy: 1.0322060564748037
Energy: 0.9478230500704443
Energy: 1.0286195654072938
Energy: 1.030786499487381
Energy: 1.0309224506185093
Energy: 1.0283308424526776
Energy: 1.0328669302729203
Energy: 1.0332557567807061
Energy: 1.0291854304401056
Energy: 1.0278769407637396
Energy: 1.0437837886187504
Energy: 0.9590670408411357
Energy: 1.025898708779886
Energy: 1.0442870628789724
Energy: 1.0489070131483156
Energy: 1.0331532078932952
Energy: 1.0319166802449231
Energy: 1.0451960536515426
Energy: 1.033968397162403
Energy: 0.9748710561502543
Energy: 1.0329389537806108
Energy: 1.0224086621026909
Energy: 1.05605814344712
Energy: 1.0257252131670633
Energy: 1.0213770247470404
Energy: 1.0970407096696682
Energy: 1.034491294936753
Energy: 1.0606892598214923
Energy: 1.0009169070272663
Energy: 1.0333236940885213
Energy: 1.0607407235892468
Energy: 1.0329598767906012
Energy: 1.0148050108180555
Energy: 1.0341477849092984
Energy: 1.1304495115539703
Energy: 0.9311353981412683
Energy: 1.035469611887984
Energy: 1.1306856185587502

minimum gb energy = 0.9031222445350783 eV
minimum distance =  2.28371675732189 Angstroms
sigma value = 17


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

Energy: 1.6339035232872106
Energy: 1.0288628754611042
Energy: 0.9841051484882612
Energy: 0.9246484844461665
Energy: 1.0288749274512117
Energy: 0.9830550189868245
Energy: 1.1006286484578984
Energy: 1.0151171109367774
Energy: 0.9154311411979399
Energy: 1.0136634448704926
Energy: 1.0167160221671832
Energy: 0.9555329251731366
Energy: 1.1980118264598303
Energy: 0.8909658864782269
Energy: 0.9335335505168374
Energy: 1.0137151857285425
Energy: 0.891700749224524
Energy: 0.9288743508503908
Energy: 1.0183025515393713
Energy: 0.9283215779155609
Energy: 0.9238046111066576
Energy: 1.0196047386086815
Energy: 0.8987208961640669
Energy: 0.922983012730729
Energy: 0.8927952959471122
Energy: 0.9144086328442488
Energy: 0.917928390489016
Energy: 0.8936386761460634
Energy: 0.9198050906822103
Energy: 0.90967660413612
Energy: 0.9380920638134504
Energy: 0.878224026752525
Energy: 0.8895735093280835
Energy: 0.8906304214586975
Energy: 0.8788635908437453
Energy: 0.8904016538406272
Energy: 0.8182278531621145
Energy: 0.8791574262076557
Energy: 0.878613514608475
Energy: 0.8529461577810907
Energy: 0.8822542630025711
Energy: 0.8809167754889632
Energy: 0.819370370590254
Energy: 0.8778107918344547
Energy: 0.881026314442615
Energy: 0.8655529133100764
Energy: 0.8706294007907248
Energy: 0.8816682525192363
Energy: 0.8203412090253672
Energy: 0.8803616362575412
Energy: 0.8205917211859325
Energy: 0.8219161923145946
Energy: 0.8524305679759719
Energy: 0.8197619073498802
Energy: 0.8199371954002621
Energy: 0.8758678901266727
Energy: 0.8760980832393126
Energy: 0.819605263393414
Energy: 0.8748862006839709
Energy: 0.8758135615735201
Energy: 0.8386785114448966
Energy: 0.8188823414313287
Energy: 0.8744641267989025
Energy: 0.8741685838707656
Energy: 0.8198374119348169
Energy: 0.8742165739116293
Energy: 0.8226787555482485
Energy: 0.8201142902144305
Energy: 0.8193398951252844
Energy: 0.8216564921327537
Energy: 0.8204345296382985
Energy: 0.8595988885812942
Energy: 0.8786685146998067
Energy: 0.8847633272335651
Energy: 0.8824498875432313
Energy: 0.880245067867083
Energy: 0.8620052859621858
Energy: 0.8812369758211424
Energy: 0.8804768047398939
Energy: 0.8929526372985054
Energy: 0.8867974851828512
Energy: 0.8796500687035529
Energy: 0.8822036424824022
Energy: 0.878674638913566
Energy: 0.8789858136173555
Energy: 0.8734863912771326
Energy: 0.8741921746510436
Energy: 0.8787364532827769
Energy: 0.8805706901000921
Energy: 0.9158465049667832
Energy: 1.0120139006309345
Energy: 0.9157636184031722
Energy: 0.9124260172925062
Energy: 0.9118314796517977
Energy: 0.8948470317443789
Energy: 0.9122093176494915
Energy: 0.8193971467426763
Energy: 1.015429183847223
Energy: 1.0152443302678453
Energy: 0.8370913272837425
Energy: 1.0148321167174812
Energy: 0.8779383091405883
Energy: 0.8963219668820792
Energy: 1.0154953358509373
Energy: 1.0180291031341153
Energy: 0.8957397064536518
Energy: 1.0138393196139368
Energy: 0.9100690287362698
Energy: 1.120915781133135
Energy: 1.017266007788847
Energy: 0.9694707042021922
Energy: 1.0153044165084064
Energy: 0.9128494705977183
Energy: 0.9127488750694897
Energy: 1.2063953141708135
Energy: 0.9044747510583031
Energy: 0.9033908941705306
Energy: 1.0153069738665723
Energy: 0.8785500644986278
Energy: 1.0200427350012242
Energy: 1.1077646284125664
Energy: 0.9931577241874435
Energy: 1.0025118659770187
Energy: 1.015653391804461
Energy: 1.0154524526273372
Energy: 1.0141715467999202
Energy: 0.8321549470450887
Energy: 1.0288489040416888
Energy: 1.1026439608777332
Energy: 0.9237563762902196
Energy: 1.0214338968017462
Energy: 0.9234797375880788
Energy: 0.8373028234068345
Energy: 1.020822082342496
Energy: 1.0192200212567546
Energy: 0.8395790354962311
Energy: 1.014815167801212
Energy: 0.9800473943567094
Energy: 1.1885824483944634
Energy: 0.9267258363052803
Energy: 0.9156041516282216
Energy: 1.016290300276645
Energy: 0.8319962203838686
Energy: 0.9927590322756068
Energy: 1.0144723323539249
Energy: 0.8968249394247196
Energy: 0.933814297689506
Energy: 1.0146332170433887
Energy: 0.8945419515298835
Energy: 0.9297667003474516
Energy: 0.8973435193971886
Energy: 0.9174205534365317
Energy: 0.9136734735080746
Energy: 0.8974243586871222
Energy: 0.8800810498267654
Energy: 0.9154440707445485
Energy: 0.943221512067301
Energy: 0.9180001312256582
Energy: 0.9160102029456254
Energy: 0.8917091043550872
Energy: 0.9182966588650919
Energy: 0.8897377244794368
Energy: 0.8051676214596691
Energy: 0.8793705668411329
Energy: 0.879189221497187
Energy: 0.8066066845208355
Energy: 0.881608407915352
Energy: 0.879184396989365
Energy: 0.8229908275901563
Energy: 0.8827009781041866
Energy: 0.8832734191534618
Energy: 0.8812057280170258
Energy: 0.8780037734478424
Energy: 0.8833310468397095
Energy: 0.8203132132937485
Energy: 0.8700039159876946
Energy: 0.8802210032196267
Energy: 0.8203178944682208
Energy: 0.8704473073115558
Energy: 0.8800335491278033
Energy: 0.8255636168387409
Energy: 0.8757735167722126
Energy: 0.8752745907583983
Energy: 0.8269893640877486
Energy: 0.8768065866816908
Energy: 0.852971428555493
Energy: 0.8209519053677834
Energy: 0.876139639062579
Energy: 0.8751338919640002
Energy: 0.8736370845729211
Energy: 0.8766005537214109
Energy: 0.8749644842307409
Energy: 0.8329440115652554
Energy: 0.8203330112898769
Energy: 0.8200095274626107
Energy: 0.8333723745550383
Energy: 0.8207283007211258
Energy: 0.819767801532411
Energy: 0.9020817034880146
Energy: 0.8920832242119127
Energy: 0.8835035620247343
Energy: 0.883386177558799
Energy: 0.8587309555600464
Energy: 0.8834173091252796
Energy: 0.8874909408299476
Energy: 0.8861497549709945
Energy: 0.8815646827266125
Energy: 0.8793077367719149
Energy: 0.8593490800710151
Energy: 0.8838189164983176
Energy: 0.8798661594662506
Energy: 0.8807843435252571
Energy: 0.9112694364497622
Energy: 0.8797897330287513
Energy: 0.881080571749086
Energy: 0.9121005868961647
Energy: 1.1243210361202225
Energy: 0.9086624505646493
Energy: 0.9145087020500516
Energy: 0.8816055925818439
Energy: 0.9283010256400568
Energy: 0.9121621224904608
Energy: 0.818328511236921
Energy: 1.014102825122118
Energy: 1.0138538789071865
Energy: 0.8850456781629907
Energy: 1.0163640106783143
Energy: 0.9144973527529996
Energy: 0.8846500669972653
Energy: 1.0103826080855616
Energy: 0.9214145461612898
Energy: 0.9158339657314489
Energy: 1.0118295137081712
Energy: 0.9037206671009534
Energy: 0.8782715073066871
Energy: 1.0137147297621358
Energy: 0.9925950935997901
Energy: 0.8950336257880378
Energy: 1.0193354530922725
Energy: 0.9549158089093722
Energy: 1.1281170075724785
Energy: 0.8938377932786165
Energy: 1.0175249188241349
Energy: 1.0221744650287146
Energy: 0.910519293220938
Energy: 1.0137118005711163
Energy: 1.1874852579653026
Energy: 0.9609906900460221
Energy: 0.9155128922955357
Energy: 1.017185774654542
Energy: 0.8942483712177409
Energy: 0.9959537036824718
Energy: 0.839123876973569
Energy: 1.0205246053239443
Energy: 1.018706996857158
Energy: 0.8318433008100357
Energy: 1.0182897818918255
Energy: 0.9780788227955666

minimum gb energy = 0.8051676214596691 eV
minimum distance =  2.30691311598566 Angstroms
sigma value = 57


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

Energy: 0.7671222005110339
Energy: 1.2884286426073592
Energy: 0.945164321982162
Energy: 0.8496239772856827
Energy: 1.308900470164681
Energy: 0.933179868686485
Energy: 0.9819826505091472
Energy: 0.8768592864973234
Energy: 0.8724092630980541
Energy: 0.963249303689908
Energy: 0.9833466555246476
Energy: 0.9213329089070684
Energy: 1.136425371826231
Energy: 0.8472944141263367
Energy: 0.8483759173189535
Energy: 0.9902570066446985
Energy: 0.846486276091125
Energy: 0.9044552005673818
Energy: 0.9847428980201525
Energy: 0.8466969379808255
Energy: 0.8957034629073651
Energy: 0.9851878126039543
Energy: 0.8340464987851876
Energy: 0.9018554390020945
Energy: 0.8474390281215205
Energy: 0.8777031294572127
Energy: 0.8718829489066964
Energy: 0.8482231894142676
Energy: 0.8599043393995787
Energy: 0.8696729166415561
Energy: 0.8328933975835187
Energy: 0.8574229319734017
Energy: 0.8469611093087627
Energy: 0.823614153868809
Energy: 0.8576219836565947
Energy: 0.8475034619117866
Energy: 0.7862369187070897
Energy: 0.8659316129749499
Energy: 0.8570038477823048
Energy: 0.8329962409641584
Energy: 0.8646339561342967
Energy: 0.8351435671186316
Energy: 0.9177379235568589
Energy: 0.8149433614883165
Energy: 0.8207621378121873
Energy: 0.7916722580308301
Energy: 0.8143502558073402
Energy: 0.8319305020318608
Energy: 0.7913271719473822
Energy: 0.8196491754434038
Energy: 0.7871915534640012
Energy: 0.7932665716587243
Energy: 0.7960611613547416
Energy: 0.7871149364759942
Energy: 0.787502491543942
Energy: 0.8174415583239611
Energy: 0.8182482810351058
Energy: 0.7874693532434305
Energy: 0.8149728160893231
Energy: 0.8191124517795431
Energy: 0.7649636980273514
Energy: 0.7546542511696938
Energy: 0.8220236266476179
Energy: 0.8126429367942298
Energy: 0.7559933050032865
Energy: 0.8096947964698142
Energy: 0.7921723846758896
Energy: 0.7655216891462803
Energy: 0.7550116541653713
Energy: 0.8051111134772595
Energy: 0.7621719348812541
Energy: 0.7955865164828814
Energy: 0.7543363609972685
Energy: 0.8489602577305717
Energy: 0.8455501646313597
Energy: 0.8145712859064439
Energy: 0.8151292364807193
Energy: 0.81458963000329
Energy: 0.75572782316879
Energy: 0.8120134005505106
Energy: 0.7549381403778453
Energy: 0.7580562224221189
Energy: 0.8005658957788363
Energy: 0.7555901825959185
Energy: 0.7554962386489154
Energy: 0.8142473162429165
Energy: 0.8108679085176128
Energy: 0.7552763136057605
Energy: 0.8383388959370184
Energy: 0.8097782905428682
Energy: 0.8078176326679334
Energy: 0.7867841483279219
Energy: 0.8174005997708474
Energy: 0.8468309659841249
Energy: 0.7876594421687382
Energy: 0.8154700042128706
Energy: 0.7998377564622536
Energy: 0.7876085749664551
Energy: 0.7871713242120139
Energy: 0.8154587216754958
Energy: 0.7965931790536284
Energy: 0.8200846115536994
Energy: 0.7591283880258486
Energy: 0.8231887397502718
Energy: 0.8391687770578226
Energy: 0.8038014697670844
Energy: 0.8222398311207879
Energy: 0.8423422479543722
Energy: 0.8573224750711304
Energy: 0.8343689770147429
Energy: 0.8461207657427201
Energy: 0.8597682314535071
Energy: 0.8380601453730941
Energy: 0.8574867202846962
Energy: 0.8595433934380071
Energy: 0.8398733436246477
Energy: 0.8447383780045579
Energy: 0.8986412352874187
Energy: 0.8347857174437
Energy: 0.8813811113855382
Energy: 1.064521496064433
Energy: 0.8805672502912004
Energy: 0.8802097626831143
Energy: 0.8826286069492839
Energy: 0.8628926428714817
Energy: 0.880288033111072
Energy: 0.7558226106478764
Energy: 0.9818564115778269
Energy: 0.8571321281379554
Energy: 0.832450688055916
Energy: 0.9947758306551014
Energy: 0.8794122027987773
Energy: 0.7941279024054576
Energy: 0.9908933830917588
Energy: 0.9500886064477988
Energy: 0.7898870210394603
Energy: 0.9869285853825069
Energy: 0.9485590362488238
Energy: 1.060517426976969
Energy: 0.8578605315275946
Energy: 0.8675229630805018
Energy: 0.9147973478260185
Energy: 0.8918651697981919
Energy: 0.8923711244816751
Energy: 1.1419239893264157
Energy: 0.8628684106464939
Energy: 0.8632548228137216
Energy: 0.9920636980220918
Energy: 0.8768881179669856
Energy: 0.9757371209747918
Energy: 1.135185252044764
Energy: 0.971466249416102
Energy: 0.9527898959801293
Energy: 0.9583997166758506
Energy: 0.9590541488338106
Energy: 0.9298279108566321
Energy: 0.7631191423586678
Energy: 0.9914012213049996
Energy: 0.9033423295954032
Energy: 0.8494145137751213
Energy: 0.9919490913219602
Energy: 0.9046059120159686

minimum gb energy = 0.7543363609972685 eV
minimum distance =  2.27799915467938 Angstroms
sigma value = 43


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

Energy: 0.6645029185098701
Energy: 1.0024141866043064
Energy: 0.842065564016099
Energy: 0.7387680829213712
Energy: 0.8976916465190737
Energy: 0.8066098135122208
Energy: 0.9237704605859289
Energy: 0.7780020497291353
Energy: 0.7560002740928867
Energy: 0.8575285682469033
Energy: 0.7791682862153502
Energy: 0.7514000208588908
Energy: 0.9882502997965059
Energy: 0.7178657408565927
Energy: 0.7219658272476449
Energy: 0.8733325966706412
Energy: 0.7174157685247496
Energy: 0.7437006748285625
Energy: 0.8672014371974711
Energy: 0.7217229642562605
Energy: 0.7448594453057513
Energy: 0.7794667603320362
Energy: 0.7397234825972849
Energy: 0.8138044770981164
Energy: 0.7792425506209248
Energy: 0.7833630913914476
Energy: 0.7557526549503267
Energy: 0.7916308118045292
Energy: 0.7801337395577406
Energy: 0.7642548201078837
Energy: 0.6425392091642903
Energy: 0.7762724653054983
Energy: 0.7403736740532901
Energy: 0.7043690657823609
Energy: 0.7763529365119101
Energy: 0.7147177645384684
Energy: 0.9048805045994114
Energy: 0.7759738081787093
Energy: 0.7760086402465517
Energy: 0.72267793468342
Energy: 0.7763117122066115
Energy: 0.7212108331494946
Energy: 0.901668345426026
Energy: 0.6953128414314792
Energy: 0.7086068078767568
Energy: 0.7173485777097064
Energy: 0.6950409317367263
Energy: 0.7079722665829528
Energy: 0.7168987210363611
Energy: 0.7073589993110526
Energy: 0.7145039163978059
Energy: 0.7191264781801455
Energy: 0.658401815024478
Energy: 0.7137661283626748
Energy: 0.7149707942040096
Energy: 0.6986881725446786
Energy: 0.6988760386208681
Energy: 0.7145645813454479
Energy: 0.6979746389523983
Energy: 0.6987662980097463
Energy: 0.6369165958171673
Energy: 0.6741657400776906
Energy: 0.6983283151061236
Energy: 0.7126007421265593
Energy: 0.6743465172697974
Energy: 0.691052155633039
Energy: 0.7144348087379163
Energy: 0.6744397300817667
Energy: 0.6739245516149627
Energy: 0.721224169921231
Energy: 0.674941176821845
Energy: 0.6937797285390997
Energy: 0.8611913986079036
Energy: 0.7124846682436417
Energy: 0.723488919220028
Energy: 0.7203691887407833
Energy: 0.7119066238674959
Energy: 0.7234465437797675
Energy: 0.6510505856684501
Energy: 0.6766038201385578
Energy: 0.6505821114819915
Energy: 0.6529740911097786
Energy: 0.6398155243149346
Energy: 0.650674178656378
Energy: 0.6505044559005639
Energy: 0.6822622757193361
Energy: 0.681517222556085
Energy: 0.6504052973098514
Energy: 0.6831935491341785
Energy: 0.681172490994652
Energy: 0.6440655999582102
Energy: 0.6396882817310947
Energy: 0.6410024275092313
Energy: 0.6974367835498154
Energy: 0.6397538748517725
Energy: 0.683533825307351
Energy: 0.6551367252208181
Energy: 0.6396624700418004
Energy: 0.6396680059321612
Energy: 0.6969798906397074
Energy: 0.639770332026751
Energy: 0.6853932349147229
Energy: 0.6392088537580798
Energy: 0.7102288018872962
Energy: 0.6853082716077185
Energy: 0.640349133805346
Energy: 0.7082074463026162
Energy: 0.684831006867874
Energy: 0.640003150438374
Energy: 0.6729201384609339
Energy: 0.6393738133192098
Energy: 0.6415954473670863
Energy: 0.7716710067395793
Energy: 0.6399601549806996
Energy: 0.6400362752912447
Energy: 0.710630418457162
Energy: 0.7030515234787708
Energy: 0.6399145367603684
Energy: 0.7096168474312806
Energy: 0.6924500358490862
Energy: 0.6783917714884761
Energy: 0.6508517433236387
Energy: 0.6507240100430938
Energy: 0.7101626595994823
Energy: 0.6510847278501865
Energy: 0.6926090656044448
Energy: 0.6451798859457596
Energy: 0.650774551909993
Energy: 0.6513445530538237
Energy: 0.6869806824762722
Energy: 0.6509753154896614
Energy: 0.6884323602326643
Energy: 0.6739980304599045
Energy: 0.6873266635777228
Energy: 0.6866096818396789
Energy: 0.673939012950548
Energy: 0.6878731977183594
Energy: 0.6867359202204165
Energy: 0.6745267202535653
Energy: 0.7018507153414143
Energy: 0.6744828479960276
Energy: 0.676664632198416
Energy: 0.6521520986531454
Energy: 0.6743150538244407
Energy: 0.8776764941785318
Energy: 0.7066563337665736
Energy: 0.7190112298456727
Energy: 0.6963343084702068
Energy: 0.7064197346231532
Energy: 0.7179584286955132
Energy: 0.8163794496360738
Energy: 0.7139886840932744
Energy: 0.7138038657291947
Energy: 0.7192850645360563
Energy: 0.7141628200010668
Energy: 0.6981777419528987
Energy: 0.6404355156119137
Energy: 0.7139025194478327
Energy: 0.7266699090861231
Energy: 0.7081877344507034
Energy: 0.7139473130781536
Energy: 0.7018376604982263
Energy: 0.7387785265351882
Energy: 0.7265260122646108
Energy: 0.7244105528937453
Energy: 0.740130065294681
Energy: 0.7259999025055154
Energy: 0.7215155400252055
Energy: 0.7793285564471164
Energy: 0.7270700586784189
Energy: 0.7764092150244781
Energy: 0.7817138743189673
Energy: 0.6881464866027596
Energy: 0.7761733397771089
Energy: 0.9353419478626741
Energy: 0.7071921762599588
Energy: 0.7266376785351651
Energy: 0.7780872735225248
Energy: 0.7072375013964971
Energy: 0.7275496623904458
Energy: 0.9328782449595435
Energy: 0.7779183306380095
Energy: 0.7793893741817527
Energy: 0.7780390741335507
Energy: 0.7779935821402837
Energy: 0.7827427227555279
Energy: 0.6524635700120696
Energy: 0.873302471533563
Energy: 0.7530300234272129
Energy: 0.7156480561804269
Energy: 0.8734001370058512
Energy: 0.7332714903685923
Energy: 0.8016720419917516
Energy: 0.8488489391374398
Energy: 0.8042929273750178
Energy: 0.7793878291116948
Energy: 0.8581329744880051
Energy: 0.8012534306673995
Energy: 0.9336766059640087
Energy: 0.7567974720223205
Energy: 0.7644616344798882
Energy: 0.7796541208985038
Energy: 0.7815750613509959
Energy: 0.8418238539320482
Energy: 0.9882865850680184
Energy: 0.7386911207000002
Energy: 0.7830343248073057
Energy: 0.8735107221654002
Energy: 0.7382989626210977
Energy: 0.7863208986710528
Energy: 0.9236405851535257
Energy: 0.8428296746674515
Energy: 0.8048185716148837
Energy: 0.8561203715869653
Energy: 0.8579258504854043
Energy: 0.7536875591796335

minimum gb energy = 0.6369165958171673 eV
minimum distance =  2.33549299555677 Angstroms
sigma value = 81


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

Energy: 0.07025033972422298
Energy: 0.07288085051216388
Energy: 0.07020642334769868
Energy: 0.07290425562966596
Energy: 0.07341697835688339
Energy: 0.07071115570125584
Energy: 0.12428359903830996
Energy: 0.07284362594246771
Energy: 0.07296309600730436
Energy: 0.12290325482942241
Energy: 0.07847149963744281
Energy: 0.07309756840953685
Energy: 0.12324304134127946
Energy: 0.07071680440882633
Energy: 0.07062272922687733
Energy: 0.12297881208895331
Energy: 0.07067030660711794
Energy: 0.12203391052402209
Energy: 0.07686957635507922
Energy: 0.07084545151465914
Energy: 0.07057013350398027
Energy: 0.07568244159952817
Energy: 0.07062278568103594
Energy: 0.12250489387785493
Energy: 0.1217993912092619
Energy: 0.1230113498553822
Energy: 0.12291691259122253
Energy: 0.12320999770859495
Energy: 0.12265287816078366
Energy: 0.12357861586305652
Energy: 0.07132284647123689
Energy: 0.07330059248397354
Energy: 0.0705291445262718
Energy: 0.07331216531419518
Energy: 0.07297008896380394
Energy: 0.07084897762474818
Energy: 0.12333051628331772
Energy: 0.07280605825356781
Energy: 0.0730864343493635
Energy: 0.12327524155720308
Energy: 0.07265471354221104
Energy: 0.07320565724886512
Energy: 0.12326625112974599
Energy: 0.07055774052112956
Energy: 0.07109195668958052
Energy: 0.12377427740353233
Energy: 0.07086248167919765
Energy: 0.12339953489577149
Energy: 0.07443937722124307
Energy: 0.07020724204361352
Energy: 0.12209746105993712
Energy: 0.07589007399289772
Energy: 0.07097444968487691
Energy: 0.12473438911389166
Energy: 0.07136332805067584
Energy: 0.12259508402109373
Energy: 0.12249995968963551
Energy: 0.07036758739203328
Energy: 0.1224371500802662
Energy: 0.12269119048938822

minimum gb energy = 0.07020642334769868 eV
minimum distance =  2.46430797190313 Angstroms
sigma value = 3


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

Energy: 0.8348994200411082
Energy: 0.8152581295633462
Energy: 0.8249659245879221
Energy: 0.7447546926311329
Energy: 0.8115728578933195
Energy: 0.7460875705592397
Energy: 0.8381480774804377
Energy: 0.8126778751096695
Energy: 0.8223915908238936
Energy: 0.8131234178705932
Energy: 0.8140708374531125
Energy: 0.8207458305031615
Energy: 0.8330684144653782
Energy: 0.764273858299536
Energy: 0.763598488365779
Energy: 0.8138506010954958
Energy: 0.7641284485359868
Energy: 0.8091079221263345
Energy: 0.7742983747311315
Energy: 0.7653123252867216
Energy: 0.7645527635304245
Energy: 0.7741375963222553
Energy: 0.6985056541909053
Energy: 0.8123541960900823
Energy: 0.7073295529378066
Energy: 0.8230866435959813
Energy: 0.8220639534868549
Energy: 0.7073473369945644
Energy: 0.8137909838372969
Energy: 0.8226866124697947
Energy: 0.7886934682501038
Energy: 0.8208154665893328
Energy: 0.774247129235407
Energy: 0.6572823475192955
Energy: 0.820356514897375
Energy: 0.7008813255245833
Energy: 0.7746185898851857
Energy: 0.7189658792190625
Energy: 0.7180231944529927
Energy: 0.775499397980594
Energy: 0.7204930765058258
Energy: 0.7831170777497476
Energy: 0.7752407733306543
Energy: 0.7243365653017716
Energy: 0.7076722583254327
Energy: 0.7752370204604522
Energy: 0.62697538756167
Energy: 0.7093974483729207
Energy: 0.7351475985383277
Energy: 0.7075194284727252
Energy: 0.7833697216157639
Energy: 0.8063600105428221
Energy: 0.6615253405025389
Energy: 0.7810359561585403
Energy: 0.6694764837068877
Energy: 0.7156861034823826
Energy: 0.7156429305976133
Energy: 0.6685783834828198
Energy: 0.7211124964595831
Energy: 0.7187199637445756
Energy: 0.773783270206115
Energy: 0.7208955863560925
Energy: 0.7204104090560768
Energy: 0.6354292121376296
Energy: 0.7781385608873536
Energy: 0.6636558046188235
Energy: 0.6668810646851271
Energy: 0.7205978337948734
Energy: 0.7191468199019352
Energy: 0.6669597355145369
Energy: 0.670120478183577
Energy: 0.6669391076928697
Energy: 0.6692527220859659
Energy: 0.6154851516705325
Energy: 0.6701328441076566
Energy: 0.6694857349689936
Energy: 0.6151161802454645
Energy: 0.6700366803287232
Energy: 0.7645857835612307
Energy: 0.7186831360561062
Energy: 0.6681752385645046
Energy: 0.672109267223662
Energy: 0.6352272432889137
Energy: 0.6704277762677295
Energy: 0.7599603994722922
Energy: 0.6344276867313535
Energy: 0.6341615802717467
Energy: 0.7596851682205568
Energy: 0.6400768798470352
Energy: 0.6353643428458263
Energy: 0.7600766651426584
Energy: 0.6357405826638182
Energy: 0.6373044937711007
Energy: 0.619852511604456
Energy: 0.7536107110126644
Energy: 0.6396651914912748
Energy: 0.6182408381620876
Energy: 0.6363247144003579
Energy: 0.7373212316528731
Energy: 0.6179652383874513
Energy: 0.6367710198417407
Energy: 0.6176610941616314
Energy: 0.6192811402561847
Energy: 0.6896536186474003
Energy: 0.6881643898221802
Energy: 0.6193236083799551
Energy: 0.6196322487596629
Energy: 0.6895003990777627
Energy: 0.7495823114868548
Energy: 0.6944072378899858
Energy: 0.7396332135906095
Energy: 0.6199845449396415
Energy: 0.6184404545504174
Energy: 0.7309681890815818
Energy: 0.7525735599014841
Energy: 0.6178408355447551
Energy: 0.6176765045038668
Energy: 0.7545183676029502
Energy: 0.624105057633519
Energy: 0.6186258063610816
Energy: 0.7533798927987281
Energy: 0.7382855255058686
Energy: 0.7393941982604617
Energy: 0.7534848203462005
Energy: 0.7410873050110804
Energy: 0.7365922812949988
Energy: 0.63751989798417
Energy: 0.7388842839336625
Energy: 0.6360163798080372
Energy: 0.6350618322022009
Energy: 0.7395299817139495
Energy: 0.6344894027160477
Energy: 0.6348968499538347
Energy: 0.669636681027521
Energy: 0.6707509145162723
Energy: 0.6349471934671868
Energy: 0.6704047938406349
Energy: 0.6713562978545152
Energy: 0.7636589064969688
Energy: 0.6699031302530237
Energy: 0.6684920931087185
Energy: 0.6218284596353402
Energy: 0.6684595631118627
Energy: 0.6482443831788716
Energy: 0.7071174781372837
Energy: 0.6669835317148456
Energy: 0.6667408280549879
Energy: 0.705690562651096
Energy: 0.6675783637805986
Energy: 0.6678049297147066
Energy: 0.7830113654250688
Energy: 0.6878004536500323
Energy: 0.6851626670873017
Energy: 0.7783569602437078
Energy: 0.7410708677928347
Energy: 0.7193527925349642
Energy: 0.7203501228271255
Energy: 0.6859741855668958
Energy: 0.6839948302604789
Energy: 0.7191674665472035
Energy: 0.7867778581283756
Energy: 0.7181873183625277
Energy: 0.6839791869410208
Energy: 0.78418511644001
Energy: 0.7849018522644756
Energy: 0.6840769810809293
Energy: 0.8180269357045622
Energy: 0.7841259586966622
Energy: 0.7811354221596516
Energy: 0.7756720456956069
Energy: 0.741630721631804
Energy: 0.6406877069633344
Energy: 0.7753965596520422
Energy: 0.6808643978768226
Energy: 0.7164922867403817
Energy: 0.7833016148044563
Energy: 0.7843032435486339
Energy: 0.7165607940342682
Energy: 0.7752119792015862
Energy: 0.7849035378779633
Energy: 0.7849349960366296
Energy: 0.6795013506800386
Energy: 0.7307101953982108
Energy: 0.7848207131125393
Energy: 0.6359397184015959
Energy: 0.7323948801624292
Energy: 0.8576644113019716
Energy: 0.7273460060152396
Energy: 0.8175840862344149
Energy: 0.8106255024959873
Energy: 0.6784217182370147
Energy: 0.7529909702153832
Energy: 0.7275450958107895
Energy: 0.7744660904115221
Energy: 0.7746357747300399
Energy: 0.7276017243272928
Energy: 0.781001425318575
Energy: 0.7746314087301653

minimum gb energy = 0.6151161802454645 eV
minimum distance =  2.2722000887146 Angstroms
sigma value = 67


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

Energy: 1.0033238028870715
Energy: 1.0008610628703964
Energy: 0.9797863325097131
Energy: 0.794959072965563
Energy: 1.1132200359853637
Energy: 0.9825937433350309
Energy: 1.0012132651342238
Energy: 0.9749742963019513
Energy: 0.9624366839249047
Energy: 0.9634897939186513
Energy: 0.9701081242959746
Energy: 0.9647314366872989
Energy: 0.9869755925224369
Energy: 0.8869910984403725
Energy: 0.9634646835705488
Energy: 0.9590543966507129
Energy: 0.8905173107330172
Energy: 0.9657908393307157
Energy: 0.9005356136641584
Energy: 0.9604520565150323
Energy: 0.9638097097172181
Energy: 0.9014827154952437
Energy: 0.9018471847150646
Energy: 0.9641600546164478
Energy: 0.8942257951725028
Energy: 0.9733688069843328
Energy: 0.9675712339608864
Energy: 0.8944218591851092
Energy: 0.9687583641204507
Energy: 0.9665831927132468
Energy: 0.9248012308099958
Energy: 0.9606235553355998
Energy: 0.8932120271535232
Energy: 0.8211010988402663
Energy: 0.9598705774256858
Energy: 0.8937530411434315
Energy: 0.8957199315000213
Energy: 0.9079169485869694
Energy: 0.9002125078119589
Energy: 0.8963633258643682
Energy: 0.9035350173843126
Energy: 0.8297058884576943
Energy: 0.8983891319348823
Energy: 0.7855442501304216
Energy: 0.8170696702820094
Energy: 0.8977083470982159
Energy: 0.777822044372521
Energy: 0.8284786931905277
Energy: 0.9291454685046749
Energy: 0.9019310589098766
Energy: 0.8233658782758019
Energy: 0.8243192021995945
Energy: 0.8188260061487842
Energy: 0.8254372448584643
Energy: 0.8586764116538557
Energy: 0.8245221217866749
Energy: 0.8209511829625065
Energy: 0.9364774687060095
Energy: 0.8221194660177186
Energy: 0.8199132772308055
Energy: 0.9321885468713453
Energy: 0.8202443798905754
Energy: 0.8188480572435555
Energy: 0.7796383479302443
Energy: 0.9129734894694811
Energy: 0.8764591202185097
Energy: 0.7784841401728221
Energy: 0.8282516687805169
Energy: 0.820860150031665
Energy: 0.7784827164010031
Energy: 0.8228827327560135
Energy: 0.776574111608843
Energy: 0.7787358704955388
Energy: 0.7892756400051908
Energy: 0.7791217151878763
Energy: 0.7776346550831204
Energy: 0.7818136076339754
Energy: 0.7763924238676111
Energy: 0.908669144066644
Energy: 0.780852572567277
Energy: 0.7800818754848183
Energy: 0.7791680102511842
Energy: 0.8509353955966036
Energy: 0.7822802329186314
Energy: 0.9089795403542287
Energy: 0.7825083976216684
Energy: 0.778647247935326
Energy: 0.9101179419772946
Energy: 0.7822270934169719
Energy: 0.7786484812961794
Energy: 0.9095458228476089
Energy: 0.8553751461301649
Energy: 0.9062584572203022
Energy: 0.8572756803866743
Energy: 0.8562646693332255
Energy: 0.821306581035354
Energy: 0.8256546739497471
Energy: 0.776198972820156
Energy: 0.7984713265441922
Energy: 0.8201346221296762
Energy: 0.7683640026503333
Energy: 0.8194673766966545
Energy: 0.8207649410675899
Energy: 0.8221487596486364
Energy: 0.8986222336187771
Energy: 0.8208096133343618
Energy: 0.9029979835393603
Energy: 0.8192886533923305
Energy: 0.9077376863588457
Energy: 0.9281275953319517
Energy: 0.8477786124918719
Energy: 0.7917991083852589
Energy: 0.9287227509436603
Energy: 0.8473934604439752
Energy: 0.8201157503498003
Energy: 0.901412730481173
Energy: 0.8988776442169142
Energy: 0.9010679818623658
Energy: 0.9019462470550561
Energy: 0.8976850962231183
Energy: 0.9042327261951972
Energy: 0.9198328983996572
Energy: 0.9441583885195652
Energy: 0.9048167170092287
Energy: 0.9220250000189179
Energy: 0.9431106747230128
Energy: 0.9864983210585297
Energy: 0.7824667234407462
Energy: 0.9434688460392674
Energy: 0.9613922249057337
Energy: 0.7870045538951643
Energy: 0.9426508392234759
Energy: 0.9342393165177326
Energy: 0.9045651859897389
Energy: 0.8952099176387179
Energy: 0.9364296279720369
Energy: 0.9005080178528153
Energy: 0.898526192145829

minimum gb energy = 0.7683640026503333 eV
minimum distance =  2.26499678008207 Angstroms
sigma value = 33


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

Energy: 1.136675255426809
Energy: 1.0917820466067598
Energy: 1.1315986777093783
Energy: 0.9193614083081051
Energy: 1.0990735721054166
Energy: 1.0534194370006182
Energy: 1.0662773718908432
Energy: 1.0648624796896036
Energy: 0.9696292325046206
Energy: 0.9665086919368779
Energy: 0.9750198926105234
Energy: 0.9653807121002331
Energy: 1.0962842018102175
Energy: 0.9609068446089428
Energy: 1.0228225781185276
Energy: 0.9751471461821032
Energy: 0.9624659894615472
Energy: 1.0479142502266894
Energy: 0.968520910041109
Energy: 1.022976098867729
Energy: 1.0249943737460467
Energy: 0.9681864340237892
Energy: 0.96597611403266
Energy: 1.0478890914720373
Energy: 0.9690258883859073
Energy: 0.9750491483098783
Energy: 0.8906865085279826
Energy: 0.9691199732620007
Energy: 0.9734716467504267
Energy: 0.968468649155553
Energy: 1.0467684919939528
Energy: 0.8896297615794007
Energy: 0.8910219852858607
Energy: 0.8929513414309007
Energy: 0.8953002406600838
Energy: 0.8895783059580542
Energy: 0.9699725245488489
Energy: 0.9754891006945059
Energy: 0.8910903927145698
Energy: 0.9692196638641389
Energy: 0.8913854305792652
Energy: 0.9670191017753819
Energy: 0.9701249723170657
Energy: 0.8879889209622395
Energy: 0.8902894426109045
Energy: 0.9700301886097755
Energy: 0.8955512307317338
Energy: 0.9674170578792491
Energy: 1.0122560436164987
Energy: 0.9791873392570561
Energy: 0.9701109836214773
Energy: 0.9009516178400231
Energy: 0.8906854196928933
Energy: 0.9699557272317224
Energy: 1.0117962305086121
Energy: 0.8906608318239733
Energy: 0.8899475498127727
Energy: 1.0137850284967698
Energy: 0.8907959486785947
Energy: 0.8902407973791491
Energy: 1.0134054482680412
Energy: 0.8900294078771821
Energy: 0.89013651931053
Energy: 0.8935231197136496
Energy: 0.955427685704212
Energy: 0.8903571468261964
Energy: 0.8893788036507971
Energy: 0.889801769003909
Energy: 0.8955856426841141
Energy: 0.8893757287413201
Energy: 0.906249574963271
Energy: 0.8893314142113987
Energy: 0.888968478505049
Energy: 0.968861003675121
Energy: 0.936581311809332
Energy: 0.8890622685546024
Energy: 0.8987114486820811
Energy: 0.8892458972613808
Energy: 1.015877214562866
Energy: 0.9680138916469081
Energy: 0.9670556771173883
Energy: 0.871042973751289
Energy: 1.0108334339773777
Energy: 0.8660765103032022
Energy: 0.9487436859955348
Energy: 0.9693770987315158
Energy: 0.9652608933526364
Energy: 0.9517532147798535
Energy: 0.9697062490773125
Energy: 0.966731609790376
Energy: 0.968440370375138
Energy: 0.9886413071576133
Energy: 0.9908663201862212
Energy: 0.9696810420679968
Energy: 0.906515903196429
Energy: 0.9646601909022352
Energy: 1.0986333247963327
Energy: 0.906192300121527
Energy: 0.9082367428230044
Energy: 0.9750788199207041
Energy: 0.9132404257118518
Energy: 0.9499306856736719
Energy: 1.0997290836816027
Energy: 0.9700903567559899
Energy: 0.898854258396409
Energy: 0.9663639408161537
Energy: 0.9707511369882234
Energy: 1.050936459043725
Energy: 1.072649363291098
Energy: 0.9760386451473325
Energy: 1.0873982178767443
Energy: 0.9024998149005774
Energy: 0.9755776418258904
Energy: 0.8634255074697433
Energy: 1.017365561058801
Energy: 0.9748333188627438
Energy: 1.0579590771657483
Energy: 1.0191244662691743
Energy: 0.973712294403839
Energy: 0.9680117063586744
Energy: 1.099739078293525
Energy: 1.0252329678718497
Energy: 1.0261247780969553
Energy: 0.9745129102562782
Energy: 0.9746970748973957
Energy: 1.0482201692541901
Energy: 0.9763620198324587
Energy: 0.9606550441504279
Energy: 1.023518143419157
Energy: 0.9769144176958794
Energy: 0.9615755313655782
Energy: 1.0479946694646696
Energy: 0.9689186302468186
Energy: 0.9772181145332786
Energy: 0.9006734551052994
Energy: 0.9688738518470836
Energy: 0.9747266092087506
Energy: 0.9659124259165266
Energy: 1.0466544509173452
Energy: 0.8920234040104814
Energy: 0.8923404586755131
Energy: 0.8854873946559549
Energy: 0.8919299391166263
Energy: 0.9611167016119739
Energy: 0.96916281399155
Energy: 0.9740606565496891
Energy: 0.9742673677773672
Energy: 0.9691194730093863
Energy: 0.8927033641567292
Energy: 0.9668449686347361
Energy: 0.9697266558830859
Energy: 0.8875167671525759
Energy: 0.8901551954325633
Energy: 0.9697396528478979
Energy: 0.8947255450393385
Energy: 0.9676446946826368
Energy: 1.0119215820257799
Energy: 0.8914856933967228
Energy: 0.8911752530309214
Energy: 0.9031389098189847
Energy: 0.913207660524046
Energy: 0.9029780996876289
Energy: 1.0110852452428456
Energy: 0.8906374194920733
Energy: 0.8899916676713234
Energy: 1.0134859165187111
Energy: 0.8913983269998753
Energy: 0.8901216256859412
Energy: 1.0133902891523014
Energy: 0.9611287136855093
Energy: 0.8913537529966223
Energy: 0.8951436479746755
Energy: 0.8916924919281598
Energy: 0.8904138805579919
Energy: 0.8890670820041444
Energy: 0.8905446612909299
Energy: 0.8916026038804948
Energy: 0.8891250632593176
Energy: 0.9098270472482705
Energy: 0.8891389447532132
Energy: 0.8924608107716646
Energy: 0.8994437641818019
Energy: 0.890339700056601
Energy: 0.8898701640547765
Energy: 0.9690048363583716
Energy: 0.889810699244145
Energy: 1.0176809540406413
Energy: 0.9674642511406252
Energy: 0.9674142104016016
Energy: 0.8707708587021965
Energy: 1.0148338831192927
Energy: 0.865756029904191
Energy: 1.0169157105732327
Energy: 0.9695051120240353
Energy: 0.9656279022977609
Energy: 1.019762059365747
Energy: 0.9705065018232576
Energy: 0.9389169926973531
Energy: 0.9671211449381268
Energy: 0.9871136904560033
Energy: 0.9646996101698921
Energy: 0.9677548913925257
Energy: 0.906786754481701
Energy: 0.9662630408094804
Energy: 1.1468703292606957
Energy: 0.9057448780793722
Energy: 0.9078597985846744
Energy: 0.97763949114911
Energy: 0.871680933741499
Energy: 1.033735140798855
Energy: 1.1029595227948554
Energy: 0.9682350633337435
Energy: 1.0494224981812352
Energy: 0.9765829798517358
Energy: 0.9709616995023092
Energy: 0.9658509940160444
Energy: 1.073857473046937
Energy: 0.9770566557457827
Energy: 1.0870514393659103
Energy: 0.9105084984395277
Energy: 0.9769540401006069
Energy: 0.863291993195224

minimum gb energy = 0.863291993195224 eV
minimum distance =  2.2876440130489 Angstroms
sigma value = 41


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

Energy: 1.247928472238833
Energy: 1.1375774616790824
Energy: 1.0374549180608656
Energy: 1.0350812914535101
Energy: 1.1395816715290479
Energy: 1.0403501752545483
Energy: 1.227075313663047
Energy: 1.0897575498202952
Energy: 1.089901257553758
Energy: 1.0871708391670647
Energy: 1.0893420579775297
Energy: 1.0642954112920102
Energy: 1.229941884630958
Energy: 1.0403866098236474
Energy: 1.0363769120835327
Energy: 1.0871100115428016
Energy: 1.0749064184907091
Energy: 1.0379865306464502
Energy: 1.0838562597451342
Energy: 1.0400090214274014
Energy: 1.0371148262823109
Energy: 1.0841016101336054
Energy: 1.0417084615326122
Energy: 1.0526646173105556
Energy: 1.0670970576356356
Energy: 1.0904637050701198
Energy: 1.0631136065462838
Energy: 1.067559746929702
Energy: 1.090002093226368
Energy: 1.041836193443586
Energy: 1.1602313898249008
Energy: 1.0438381485274324
Energy: 1.041490534780732
Energy: 1.0463885190626998
Energy: 1.140927502875424
Energy: 1.0404992605571761
Energy: 1.065523746864129
Energy: 1.0417804518737688
Energy: 1.0625192041016736
Energy: 1.0656964146870926
Energy: 1.0409324471078758
Energy: 1.0448578369204686
Energy: 1.071734626799578
Energy: 1.04295424928556
Energy: 1.0417981974554398
Energy: 1.0731445626059173
Energy: 1.051510741656149
Energy: 1.0675347374867379
Energy: 1.1293844442483263
Energy: 1.0438355248714506
Energy: 1.0395764461990593
Energy: 1.1314368451649335
Energy: 1.0624377270502439
Energy: 1.0398640563962869
Energy: 1.0948585640973656
Energy: 1.073705066441535
Energy: 1.0840461239236563
Energy: 1.0785256674826824
Energy: 1.0681978315183225
Energy: 1.0411102778288188
Energy: 1.165046061737803
Energy: 1.0975545134053442
Energy: 1.045589603104424
Energy: 1.1654752770147971
Energy: 1.0161494550253425
Energy: 1.133425363007396
Energy: 1.2289121645166767
Energy: 1.0161590178878481
Energy: 1.0167581346885786
Energy: 1.0873515564758134
Energy: 1.0155205419981441
Energy: 1.0899817668101723
Energy: 1.2328008436788995
Energy: 1.07077952199958
Energy: 1.0637516625621037
Energy: 1.088132277247149
Energy: 1.0686219087696167
Energy: 1.0648437851025645
Energy: 1.1768082836218685
Energy: 1.0693741624669053
Energy: 1.0164850113636206
Energy: 1.02115238134429
Energy: 1.0867912957086923
Energy: 1.0173182036194435

minimum gb energy = 1.0155205419981441 eV
minimum distance =  2.28227566202779 Angstroms
sigma value = 11


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

Energy: 1.745080020645659
Energy: 1.2684555551682783
Energy: 1.2435974484311578
Energy: 1.2459296354912532
Energy: 1.279968814370234
Energy: 1.2316032588895085
Energy: 1.3886324701517136
Energy: 1.19431372842764
Energy: 1.1952261771361428
Energy: 1.2318780503811257
Energy: 1.193993250521747
Energy: 1.2210112502310166
Energy: 1.387438912904572
Energy: 1.1837227094363498
Energy: 1.2192360963499507
Energy: 1.1975257948272477
Energy: 1.1826294367517822
Energy: 1.2226612515651745
Energy: 1.2543050730820486
Energy: 1.1827121591022818
Energy: 1.2087771959567475
Energy: 1.2001469492576429
Energy: 1.1823728818476302
Energy: 1.221153684742614
Energy: 1.223865915884296
Energy: 1.194310467473212
Energy: 1.196910047587704
Energy: 1.223446222839347
Energy: 1.1931277640125217
Energy: 1.2278717089799664
Energy: 1.2527690352234462
Energy: 1.2253060083314198
Energy: 1.2155181156134423
Energy: 1.1957018167385305
Energy: 1.2132435222520757
Energy: 1.2146155720752845
Energy: 1.2129967535987227
Energy: 1.2128635050167214
Energy: 1.2132628380115809
Energy: 1.2127171264510166
Energy: 1.2129196165215625
Energy: 1.2075742509227632
Energy: 1.2115249809794715
Energy: 1.1961770905318028
Energy: 1.2271732174724732
Energy: 1.193318177676331
Energy: 1.231832959954085
Energy: 1.2177758920625426
Energy: 1.2202283768108173
Energy: 1.1974463577828576
Energy: 1.2215060751359645
Energy: 1.1775369100376851
Energy: 1.193996931939962
Energy: 1.2145808829052074
Energy: 1.2074360347791426
Energy: 1.1973348452397554
Energy: 1.2200747118548512
Energy: 1.177820922728597
Energy: 1.1943565202669864
Energy: 1.2154789290639858
Energy: 1.2128298312861852
Energy: 1.2000058544110939
Energy: 1.2250498446813205
Energy: 1.193581338524538
Energy: 1.2000055061822104
Energy: 1.197527047133564
Energy: 1.1973092093753457
Energy: 1.191268854026287
Energy: 1.2203250087692308
Energy: 1.1974278907507687
Energy: 1.2104376491556512
Energy: 1.2169761306650806
Energy: 1.193545580296932
Energy: 1.2096427211805583
Energy: 1.2113358409876913
Energy: 1.1937297881874145
Energy: 1.2093353340616195
Energy: 1.2147536029395256
Energy: 1.200644883155215
Energy: 1.194925596850073
Energy: 1.2210576555079062
Energy: 1.1833744607201173
Energy: 1.2444971282026764
Energy: 1.2209470425971891
Energy: 1.1941789580072661
Energy: 1.2096421368036554
Energy: 1.216701354658075
Energy: 1.1875150659607332
Energy: 1.2058049569317117
Energy: 1.2203763555143896
Energy: 1.1862111472416865
Energy: 1.2114806008019736
Energy: 1.2202980183261236
Energy: 1.18775121903434
Energy: 1.2062943593490822
Energy: 1.1851956045231156
Energy: 1.1845074619105762
Energy: 1.199702639559782
Energy: 1.2195342745986562
Energy: 1.1851195120334792
Energy: 1.1957408709574988
Energy: 1.218426119860846
Energy: 1.2301960332031552
Energy: 1.2577521516732455
Energy: 1.2484034626136364
Energy: 1.200145627264902
Energy: 1.2798347529959486
Energy: 1.2010206201170612
Energy: 1.201412256166253
Energy: 1.1938263943280436
Energy: 1.2008789675801486
Energy: 1.2018080740193497
Energy: 1.194421380822878
Energy: 1.2200868776414646
Energy: 1.2205446987875201
Energy: 1.1851868168867106
Energy: 1.2209484377240503
Energy: 1.2013397901936516
Energy: 1.1852784416467044
Energy: 1.1928746895243485
Energy: 1.2873326296985652
Energy: 1.1847515133276283
Energy: 1.211583392598318
Energy: 1.1954999278545269
Energy: 1.1846762571206944
Energy: 1.1946097537167153
Energy: 1.243023255366942
Energy: 1.193707469583763
Energy: 1.1968181374445863
Energy: 1.2074413537151143
Energy: 1.1958079108781277
Energy: 1.215949132667075
Energy: 1.2186935676110635
Energy: 1.2031612735852502
Energy: 1.2168350391124012
Energy: 1.1818222590283616
Energy: 1.2027300827654543
Energy: 1.22076148006623
Energy: 1.2817995357101726
Energy: 1.2027887123841563
Energy: 1.219224883104622
Energy: 1.1929517266486163
Energy: 1.2023754172517755
Energy: 1.2024499267882618
Energy: 1.2769061490205793
Energy: 1.2116156097936641
Energy: 1.2004280715686677
Energy: 1.2785419754391154
Energy: 1.2214261561600768
Energy: 1.203958176622089
Energy: 1.2719762281814164
Energy: 1.2297226065187363
Energy: 1.2175077383937478
Energy: 1.1952985189525427
Energy: 1.2171691472641026
Energy: 1.22090358754907
Energy: 1.2705933949030401
Energy: 1.1843855836808383
Energy: 1.1846773415128093
Energy: 1.2012391706658103
Energy: 1.1880098719559864
Energy: 1.2213358997784616
Energy: 1.2716015698773864
Energy: 1.18657357004924
Energy: 1.2212540906667877
Energy: 1.2002358150080958
Energy: 1.1863171109097688
Energy: 1.2191258582054565
Energy: 1.2761291544420923
Energy: 1.212122363805217
Energy: 1.2139088043942077
Energy: 1.2193138885588777
Energy: 1.2189103626476168
Energy: 1.1979395695380357
Energy: 1.3867719451476466
Energy: 1.1953691323823736
Energy: 1.2465470983605098
Energy: 1.2142137608224404
Energy: 1.1933356537714956
Energy: 1.2140631272970892
Energy: 1.2440659048257892
Energy: 1.1990350036584438
Energy: 1.1905302791621815
Energy: 1.1851452976439028
Energy: 1.197096852811334
Energy: 1.2036974369018145

minimum gb energy = 1.1775369100376851 eV
minimum distance =  2.27502037095076 Angstroms
sigma value = 57


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

Energy: 1.5869539455136141
Energy: 1.733579886542228
Energy: 1.3301474688159836
Energy: 1.3268741550000223
Energy: 1.7301060530640846
Energy: 1.3308938626034779
Energy: 1.2732731007009441
Energy: 1.2221793297834478
Energy: 1.2237365366717172
Energy: 1.223259742644528
Energy: 1.2199181512659927
Energy: 1.2235785517679783
Energy: 1.2797761369299052
Energy: 1.2264157316024455
Energy: 1.2209015424321537
Energy: 1.2820561934557426
Energy: 1.2112814011727182
Energy: 1.2235798420756485
Energy: 1.210580525379803
Energy: 1.219204051706521
Energy: 1.2232284274960383
Energy: 1.21502362691559
Energy: 1.201289353285741
Energy: 1.223461234231754
Energy: 1.2204165254154027
Energy: 1.219552438724625
Energy: 1.2213113903628496
Energy: 1.2156069532738814
Energy: 1.2165832222881805
Energy: 1.2234939147137438
Energy: 1.210231604203124
Energy: 1.2197826810723378
Energy: 1.2221197314303032
Energy: 1.2216125076073643
Energy: 1.2232944200809917
Energy: 1.2233240153520386
Energy: 1.2744699925651854
Energy: 1.2197813121619845
Energy: 1.2244942288147205
Energy: 1.2756300245552168
Energy: 1.2117526522705526
Energy: 1.224717581423801
Energy: 1.275886862955418
Energy: 1.2169101170863288
Energy: 1.224084055272556
Energy: 1.2194660029474562
Energy: 1.211215940913312
Energy: 1.2230896271436902
Energy: 1.1901964962413105
Energy: 1.2180396565450713
Energy: 1.2245411494031286
Energy: 1.1913108390444802
Energy: 1.2130366319698818
Energy: 1.2222988006409032
Energy: 1.2549676457636894
Energy: 1.216777804982443
Energy: 1.2247933203986296
Energy: 1.1912062577179061
Energy: 1.2108255736777342
Energy: 1.2218007652057863
Energy: 1.2747748046631215
Energy: 1.2159733305581584
Energy: 1.2184239685768152
Energy: 1.2200645170424211
Energy: 1.2116614565708879
Energy: 1.2226978439663958
Energy: 1.2609239972134638
Energy: 1.2250291164353198
Energy: 1.2202619785978108
Energy: 1.261614523173158
Energy: 1.2305206839129412
Energy: 1.22159774718568
Energy: 1.2233750720373013
Energy: 1.222707202637166
Energy: 1.220728168092206
Energy: 1.222792102299965
Energy: 1.221630067261509
Energy: 1.22286567091026
Energy: 1.2093188713200909
Energy: 1.28302968949288
Energy: 1.2138630554243
Energy: 1.2236575234548845
Energy: 1.2769309211565778
Energy: 1.220711455135473
Energy: 1.2190879118908704
Energy: 1.2200186346028334
Energy: 1.2241344093463826
Energy: 1.2187636986194883
Energy: 1.2192124065076466
Energy: 1.2228746402811657
Energy: 1.280778311856454
Energy: 1.2210541781738
Energy: 1.2198408852784137
Energy: 1.2760732218761603
Energy: 1.2197542309273057
Energy: 1.2235324854829763
Energy: 1.1898473635136313
Energy: 1.221656976916607
Energy: 1.223331400977246
Energy: 1.1911841471414946
Energy: 1.2204083274413131
Energy: 1.223117531881475

minimum gb energy = 1.1898473635136313 eV
minimum distance =  2.28842813810556 Angstroms
sigma value = 9


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

Energy: 1.9340152334085319
Energy: 1.308365690881737
Energy: 1.2829466004826033
Energy: 1.2840096512890382
Energy: 1.3237493514114653
Energy: 1.284376214927019
Energy: 1.2983148322032962
Energy: 1.2795072331946475
Energy: 1.2807944698644964
Energy: 1.2789999021273162
Energy: 1.2526806250980802
Energy: 1.2836764837061896
Energy: 1.3008280536328363
Energy: 1.2858098166066019
Energy: 1.2838082857395297
Energy: 1.2514584571597336
Energy: 1.2935628834723132
Energy: 1.2814472067627563
Energy: 1.2746764315185057
Energy: 1.2901569698524356
Energy: 1.2874710151810285
Energy: 1.2789793735399508
Energy: 1.281651979055926
Energy: 1.2856504917699998
Energy: 1.2998563995336605
Energy: 1.2550426562432158
Energy: 1.248607626471955
Energy: 1.2475818066422346
Energy: 1.2527930455033782
Energy: 1.2496857522660134
Energy: 1.2765548964671318
Energy: 1.2765067487883623
Energy: 1.2741080450956042
Energy: 1.2792702526431174
Energy: 1.2794605571309923
Energy: 1.2759906368532148
Energy: 1.2716707380079217
Energy: 1.2698672045684676
Energy: 1.2902767468474081
Energy: 1.2481588348455632
Energy: 1.274020729251368
Energy: 1.2892368100778204
Energy: 1.3192106340868766
Energy: 1.2854474055097387
Energy: 1.2781459391770496
Energy: 1.2778714945574634
Energy: 1.2681146019926055
Energy: 1.2760947041506618
Energy: 1.3197232425308458
Energy: 1.2534179028229797
Energy: 1.2557238705222278
Energy: 1.2959084472659528
Energy: 1.2505237897125092
Energy: 1.2800959104392637
Energy: 1.321483743934851
Energy: 1.2538566475632233
Energy: 1.25516657171828
Energy: 1.295768003877225
Energy: 1.2703698572522533
Energy: 1.2502036711774804
Energy: 1.319167169363354
Energy: 1.2641118469828923
Energy: 1.26171041138129
Energy: 1.2762233481924978
Energy: 1.2664773909503368
Energy: 1.2610464343440355
Energy: 1.3215414289775849
Energy: 1.259962014615937
Energy: 1.285847494811761
Energy: 1.3009689920759306
Energy: 1.2597822586202856
Energy: 1.2833874840315198
Energy: 1.4782765372095237
Energy: 1.279283718332735
Energy: 1.2805190662872081
Energy: 1.2804095090544791
Energy: 1.2775468866173276
Energy: 1.2720000721930218
Energy: 1.3279965936882236
Energy: 1.2859368784091063
Energy: 1.2852652475519923
Energy: 1.284670068469993
Energy: 1.2784108422963343
Energy: 1.2863242409946511
Energy: 1.3168077488434125
Energy: 1.257837767835203
Energy: 1.2534982760933482
Energy: 1.2955728103151558
Energy: 1.2618072025414666
Energy: 1.2540367099410266
Energy: 1.2971779255212035
Energy: 1.2856854354719796
Energy: 1.2478125685977737
Energy: 1.2496165827011338
Energy: 1.293293439021679
Energy: 1.2560207952211913
Energy: 1.3033893579680855
Energy: 1.2920530830454955
Energy: 1.2879981243850889
Energy: 1.277843061817541
Energy: 1.2917912144287118
Energy: 1.28532897209991
Energy: 1.397833671540763
Energy: 1.280598378317325
Energy: 1.2507994551005914
Energy: 1.3005504936886916
Energy: 1.2758106058561107
Energy: 1.2499756223127312
Energy: 1.297160866014698
Energy: 1.2892346793005105
Energy: 1.2858530791272913
Energy: 1.2496403774663585
Energy: 1.2840340194944662
Energy: 1.282780863015763
Energy: 1.2998145862294739
Energy: 1.2908577097134386
Energy: 1.2851663626827485
Energy: 1.2493794133788219
Energy: 1.2832794395560563
Energy: 1.2819812888339537
Energy: 1.3036953712165054
Energy: 1.2542606891894206
Energy: 1.2505164098107948
Energy: 1.2673230480692574
Energy: 1.2982642513415679
Energy: 1.2507585970219186

minimum gb energy = 1.2475818066422346 eV
minimum distance =  2.27512326469897 Angstroms
sigma value = 27


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

Energy: 1.8323724639673251
Energy: 1.8027954553677223
Energy: 1.2396609093097728
Energy: 1.2418197326982467
Energy: 1.8120306530836165
Energy: 1.239269564298273
Energy: 1.3567063679863172
Energy: 1.2506316786001752
Energy: 1.251251798173365
Energy: 1.2589084297573487
Energy: 1.262935941564063
Energy: 1.2532811592050102
Energy: 1.2671398745784508
Energy: 1.2556965409854948
Energy: 1.2592854779917795
Energy: 1.2454330168883747
Energy: 1.2366906353607903
Energy: 1.3130129409393279
Energy: 1.2725472017434756
Energy: 1.246220896754371
Energy: 1.25069515408028
Energy: 1.2623782531495176
Energy: 1.2433986886150494
Energy: 1.254947476111155
Energy: 1.246035170534749
Energy: 1.2464737600770923
Energy: 1.251161333222809
Energy: 1.2435117312043178
Energy: 1.2504302615196534
Energy: 1.2520805883894155
Energy: 1.269320098333378
Energy: 1.2585627332300018
Energy: 1.2567185408822925
Energy: 1.2592020447833643
Energy: 1.2598628146558806
Energy: 1.2562588960927021
Energy: 1.2666437637578825
Energy: 1.2551759811493821
Energy: 1.253563206232538
Energy: 1.2513814453726682
Energy: 1.2566183056504363
Energy: 1.2551662406154984
Energy: 1.3149232788171668
Energy: 1.2505405085320331
Energy: 1.2673463352060017
Energy: 1.2731685311138727
Energy: 1.251158052656221
Energy: 1.2670509611362073
Energy: 1.2764042929834873
Energy: 1.2476698482525082
Energy: 1.243562987360569
Energy: 1.2549660600041395
Energy: 1.2463370308545836
Energy: 1.2441959886095513
Energy: 1.2727524821002514
Energy: 1.2696800234588
Energy: 1.2676280031092422
Energy: 1.252865485885614
Energy: 1.2774266393048195
Energy: 1.2647440460111083
Energy: 1.313956051032023
Energy: 1.2532941240351763
Energy: 1.2642404529249422
Energy: 1.2537159979209027
Energy: 1.2486969007845827
Energy: 1.2551274080536952
Energy: 1.306253817818533
Energy: 1.2706654408258915
Energy: 1.2687469920957892
Energy: 1.2747414341931176
Energy: 1.2715854640602442
Energy: 1.2692760168751398
Energy: 1.3579929973182945
Energy: 1.2548643636886248
Energy: 1.2535035277278725
Energy: 1.2635226658193743
Energy: 1.2491046327429918
Energy: 1.2627778880638845
Energy: 1.3534701119223431
Energy: 1.2718167202028285
Energy: 1.2689076334841083
Energy: 1.2614069375603854
Energy: 1.2668637026246856
Energy: 1.268244654687508
Energy: 1.301947204319289
Energy: 1.2684498415203522
Energy: 1.268249341022123
Energy: 1.277684887810113
Energy: 1.2691635111642787
Energy: 1.2709800264377298
Energy: 1.2814776724312822
Energy: 1.2534415683569209
Energy: 1.2542758806187502
Energy: 1.2631186542790371
Energy: 1.2689348887660892
Energy: 1.2555349800773554
Energy: 1.2424609790034338
Energy: 1.2661440494863512
Energy: 1.2646174623835846
Energy: 1.244186453762335
Energy: 1.2653128695323943
Energy: 1.264635195043351
Energy: 1.2684642312983916
Energy: 1.260401001130838
Energy: 1.2526619262048282
Energy: 1.2545298133318998
Energy: 1.26375719672622
Energy: 1.2540795585413398
Energy: 1.2650576525726716
Energy: 1.2550775144540436
Energy: 1.2533628700699178
Energy: 1.2635777697622084
Energy: 1.2569218466870213
Energy: 1.252460925887988
Energy: 1.2666425548753422
Energy: 1.2551116446821944
Energy: 1.253413829759741
Energy: 1.248621162549259
Energy: 1.2573608107097796
Energy: 1.2514551195936223
Energy: 1.2920318591842572
Energy: 1.2549689706239116
Energy: 1.2528847346234318
Energy: 1.2583618231701976
Energy: 1.2633389479036468
Energy: 1.2533319097111446
Energy: 1.2378526720234841
Energy: 1.2464499182274236
Energy: 1.2472413289361253
Energy: 1.2372418507917666
Energy: 1.2475873178787151
Energy: 1.2549367016001365
Energy: 1.3048066977810997
Energy: 1.2429810288363352
Energy: 1.2575617338948828
Energy: 1.2513604754967538
Energy: 1.2541802883889133
Energy: 1.2578568217486283
Energy: 1.2666060917151343
Energy: 1.2519111025752607
Energy: 1.254165444997822
Energy: 1.2483890977279697
Energy: 1.2495649422075366
Energy: 1.2546870173339117
Energy: 1.3632251283721022
Energy: 1.2858491952199997
Energy: 1.2825932686496784
Energy: 1.2387157737891539
Energy: 1.261109899004758
Energy: 1.2427184211889295

minimum gb energy = 1.2366906353607903 eV
minimum distance =  2.25383524160573 Angstroms
sigma value = 19


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

Energy: 1.2907099697588253
Energy: 1.2797992981834168
Energy: 1.2705503453363292
Energy: 1.2323279966524971
Energy: 1.2661168033965522
Energy: 1.2713181237805338
Energy: 1.2853505827619514
Energy: 1.230711619159517
Energy: 1.2270663851397172
Energy: 1.2239086384810767
Energy: 1.2346362061023322
Energy: 1.2253165899777725
Energy: 1.2748398239561727
Energy: 1.224837341409169
Energy: 1.2273064997709577
Energy: 1.2400395395662573
Energy: 1.222021692810868
Energy: 1.229965110085637
Energy: 1.269930471560632
Energy: 1.2260363315807499
Energy: 1.2261151489378554
Energy: 1.2299998389970341
Energy: 1.2261881482527415
Energy: 1.2248251408693949
Energy: 1.2300766937630576
Energy: 1.2320593774610344
Energy: 1.2329451831845646
Energy: 1.2348259752267017
Energy: 1.2397723673942496
Energy: 1.2285989561070862
Energy: 1.2488618314822404
Energy: 1.2268383972173917
Energy: 1.2263724815347092
Energy: 1.2221225516947714
Energy: 1.2278123943660801
Energy: 1.2253594453880534
Energy: 1.2320401939623231
Energy: 1.2198015496762984
Energy: 1.2212735688008125
Energy: 1.2239628922338814
Energy: 1.2205585396166116
Energy: 1.2236211536483417
Energy: 1.2668624381915528
Energy: 1.2247826049815442
Energy: 1.2266531901899558
Energy: 1.235406003618452
Energy: 1.219590408425563
Energy: 1.2312400963483026
Energy: 1.2122094207382015
Energy: 1.2309163941506815
Energy: 1.2277156304381445
Energy: 1.2212810420828553
Energy: 1.2282002761931972
Energy: 1.2290621938487887
Energy: 1.213174440151937
Energy: 1.2353809121575883
Energy: 1.2317883140251846
Energy: 1.2240745454875386
Energy: 1.2386520036208546
Energy: 1.2309866216654084
Energy: 1.2735290096892617
Energy: 1.2068329460665572
Energy: 1.2095818583113556
Energy: 1.2278095187729907
Energy: 1.2020916576305203
Energy: 1.2126726585974819
Energy: 1.2728166756915327
Energy: 1.2068868949732339
Energy: 1.2067686086950424
Energy: 1.2136319133275464
Energy: 1.2025416413489982
Energy: 1.2068694493550918
Energy: 1.2609727007619653
Energy: 1.218317192114461
Energy: 1.227944172361134
Energy: 1.2126297441461755
Energy: 1.219972961935164
Energy: 1.2095858864809033
Energy: 1.3052894999983482
Energy: 1.2402959485996001
Energy: 1.2270234302752792
Energy: 1.1966423614989752
Energy: 1.23917185546143
Energy: 1.226832666772777
Energy: 1.2707276972210988
Energy: 1.200728705464493
Energy: 1.2119549122848883
Energy: 1.2125892319123228
Energy: 1.1967762695715276
Energy: 1.2122483537130397
Energy: 1.283682447214383
Energy: 1.2070707660540607
Energy: 1.2154151175343266
Energy: 1.208967720413531
Energy: 1.1963842120921042
Energy: 1.2167680306971307
Energy: 1.2328363455071136
Energy: 1.23033457867526
Energy: 1.2411199662341312
Energy: 1.190709338424136
Energy: 1.2409479360864328
Energy: 1.2414519429651212
Energy: 1.278607858639037
Energy: 1.2105306033764092
Energy: 1.210629902542738
Energy: 1.192519771604829
Energy: 1.2088964001360152
Energy: 1.2081654008633498
Energy: 1.28048495293726
Energy: 1.2034930464961708
Energy: 1.1975864947856736
Energy: 1.2455594164737414
Energy: 1.1930489048860822
Energy: 1.2385150197819872
Energy: 1.259043664036037
Energy: 1.1959377436672831
Energy: 1.197368704812791
Energy: 1.239891461498708
Energy: 1.1932122886068217
Energy: 1.211092205448249
Energy: 1.1931554438694068
Energy: 1.2114344961604824
Energy: 1.2111755941427709
Energy: 1.1994335400618776
Energy: 1.2110175622477206
Energy: 1.2083890437445919
Energy: 1.190140698018104
Energy: 1.2127216106572596
Energy: 1.2106337852174651
Energy: 1.1916565685021177
Energy: 1.2163257248005899
Energy: 1.209624831135461
Energy: 1.2399536550834571
Energy: 1.1989272999498606
Energy: 1.2036983003209487
Energy: 1.2364636500830661
Energy: 1.1881575269914784
Energy: 1.2158895016033273
Energy: 1.275170871733518
Energy: 1.200592381198412
Energy: 1.2078879055784588
Energy: 1.2511720270333981
Energy: 1.1875242862635027
Energy: 1.211421404039149
Energy: 1.2752649213822194
Energy: 1.2149135061622574
Energy: 1.2116082081247106
Energy: 1.198781980524114
Energy: 1.2043483945541393
Energy: 1.21001463791666
Energy: 1.231411158916104
Energy: 1.2282583798016662
Energy: 1.2289767716990625
Energy: 1.215997714988829
Energy: 1.228435331930205
Energy: 1.2272946473297601
Energy: 1.2752834658275092
Energy: 1.2257801592013897
Energy: 1.2254044808434836
Energy: 1.225551707667947
Energy: 1.2223169824865576
Energy: 1.227171679771024
Energy: 1.2743512919540612
Energy: 1.223798861604406
Energy: 1.225276907888573
Energy: 1.2299723423132818
Energy: 1.2224419910017383
Energy: 1.2258176033601333
Energy: 1.283159868683645
Energy: 1.2742250549413343
Energy: 1.272933784538797
Energy: 1.1764740414506984
Energy: 1.2672718832354521
Energy: 1.2100069184965803

minimum gb energy = 1.1764740414506984 eV
minimum distance =  2.26407916250723 Angstroms
sigma value = 101


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

Energy: 1.7728193574493776
Energy: 1.192926123430394
Energy: 1.1851416638619177
Energy: 1.120242071958762
Energy: 1.1922843823176343
Energy: 1.1806819572453984
Energy: 1.342401734639912
Energy: 1.1576909377129139
Energy: 1.186008800265104
Energy: 1.157170501334339
Energy: 1.1560527301960233
Energy: 1.18293708674529
Energy: 1.2559005155469354
Energy: 1.1650227232387256
Energy: 1.1706280161956921
Energy: 1.1891061494813366
Energy: 1.1565947420045446
Energy: 1.1853184025105576
Energy: 1.2367884459672995
Energy: 1.1733505085659344
Energy: 1.1843239569664872
Energy: 1.1806191534659756
Energy: 1.161859087090847
Energy: 1.182766827295906
Energy: 1.1675229540810599
Energy: 1.188720018191675
Energy: 1.1877931617389876
Energy: 1.1721853012269767
Energy: 1.1892607667906214
Energy: 1.1840104236351643
Energy: 1.181214235788902
Energy: 1.1776816632926774
Energy: 1.1818149148575658
Energy: 1.1501590443531144
Energy: 1.1737384195781528
Energy: 1.1832001860934727
Energy: 1.2353588551403152
Energy: 1.1529754475865706
Energy: 1.1517030951442018
Energy: 1.1934384041978308
Energy: 1.1496098495391152
Energy: 1.180814213699029
Energy: 1.1977714673559716
Energy: 1.1602601089824185
Energy: 1.1689015968047973
Energy: 1.1917094941363908
Energy: 1.157869740541896
Energy: 1.1601081923351604
Energy: 1.150775282488843
Energy: 1.1828547060019232
Energy: 1.1750359493257352
Energy: 1.1556015580236583
Energy: 1.1837437020306862
Energy: 1.1708307424832551
Energy: 1.148197906806211
Energy: 1.1970736341017219
Energy: 1.1931619064450796
Energy: 1.1563684373418732
Energy: 1.1945302675722846
Energy: 1.1916291851410508
Energy: 1.246605245404824
Energy: 1.1181156357287734
Energy: 1.119547896194932
Energy: 1.1835997604464552
Energy: 1.1238615693499274
Energy: 1.178142735897977
Energy: 1.262647500038637
Energy: 1.165934680392882
Energy: 1.1719660466587325
Energy: 1.165679201201402
Energy: 1.1558281556833243
Energy: 1.1695153822672009
Energy: 1.18077683018333
Energy: 1.1824491900134935
Energy: 1.1836959130882774
Energy: 1.148998003515144
Energy: 1.1832316223051662
Energy: 1.1729863785457184
Energy: 1.1799653997811868
Energy: 1.1620339990704005
Energy: 1.1867024484300361
Energy: 1.1583231918352912
Energy: 1.1889224605955213
Energy: 1.1833390451022414
Energy: 1.2570792590864213
Energy: 1.161531691897826
Energy: 1.1691838527596432
Energy: 1.1888200325058578
Energy: 1.1565214918371662
Energy: 1.1800627522441596
Energy: 1.256403708002111
Energy: 1.1661016779494806
Energy: 1.182274830767723
Energy: 1.1836993899696668
Energy: 1.161023356819768
Energy: 1.1832871105710954
Energy: 1.1884233798446402
Energy: 1.1841647498097738
Energy: 1.1881489732548975
Energy: 1.1177063569043615
Energy: 1.1863245068120565
Energy: 1.1150672171060492
Energy: 1.3018637930703745
Energy: 1.1833786693111732
Energy: 1.1879090250000877
Energy: 1.1855733219759699
Energy: 1.1831913650215413
Energy: 1.1852311974303793
Energy: 1.254794110509584
Energy: 1.1640044035774242
Energy: 1.1705327929504363
Energy: 1.1859375044858527
Energy: 1.155162495530071
Energy: 1.1595198494776058
Energy: 1.2345544813361524
Energy: 1.1652580372252954
Energy: 1.1601764939724946
Energy: 1.1836752287880483
Energy: 1.1556834754801606
Energy: 1.180880163726582
Energy: 1.17050431267304
Energy: 1.1821798447092675
Energy: 1.1836623737095282
Energy: 1.1762643367312002
Energy: 1.1829258853775952
Energy: 1.1824088664202148
Energy: 1.1824949376346467
Energy: 1.1577964645273962
Energy: 1.184503652096617
Energy: 1.1601270950785154
Energy: 1.1573921629128163
Energy: 1.1615746903218283
Energy: 1.2009923331032917
Energy: 1.1572345632725143
Energy: 1.1499456952286962
Energy: 1.1883712643455044
Energy: 1.1541600647697785
Energy: 1.149225809345861
Energy: 1.2191964449913575
Energy: 1.1613146646120067
Energy: 1.147664509523166
Energy: 1.1917898926833888
Energy: 1.1567860318971024
Energy: 1.1888069248085102
Energy: 1.1585440054553646
Energy: 1.1599076445544998
Energy: 1.182732502852917
Energy: 1.161119787938904
Energy: 1.1826452350419792
Energy: 1.1595353702586748
Energy: 1.1505473252466414
Energy: 1.160144472106779
Energy: 1.1867201907258642
Energy: 1.1567521785256147
Energy: 1.1610263667145335
Energy: 1.183128297842224
Energy: 1.1860549072015567
Energy: 1.1189387439817884
Energy: 1.1192241000517296
Energy: 1.1581350919037388
Energy: 1.123440989174278
Energy: 1.1195904284890108
Energy: 1.2556554632880388
Energy: 1.122080832684166
Energy: 1.122832923477674
Energy: 1.1882127095579087
Energy: 1.1247705958610132
Energy: 1.1840707347564043
Energy: 1.1797415404137717
Energy: 1.1893576075579986
Energy: 1.1839900702861488
Energy: 1.1496669401461335
Energy: 1.1901513556402183
Energy: 1.1802183593936584
Energy: 1.1832344592796553
Energy: 1.155963487352239
Energy: 1.1844553522124681
Energy: 1.1502236440067808
Energy: 1.158170028571831
Energy: 1.182004073964698
Energy: 1.2557119036738602
Energy: 1.1569440109728064
Energy: 1.1781429006141992
Energy: 1.1646323908270815
Energy: 1.1548623212403926
Energy: 1.1831206152706695
Energy: 1.2566587597943182
Energy: 1.1581929122550185
Energy: 1.160020248626835
Energy: 1.1831894722737801
Energy: 1.1603976344963252
Energy: 1.1817418971202127
Energy: 1.1912383609582053
Energy: 1.160121702702901
Energy: 1.1696805348194248
Energy: 1.1153303275432194
Energy: 1.1539398020253158
Energy: 1.1866026199206823

minimum gb energy = 1.1150672171060492 eV
minimum distance =  2.2540644107843 Angstroms
sigma value = 33


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

Energy: 0.020484501074402462
Energy: 1.1492144683141428
Energy: 0.02208856030453401
Energy: 0.02386102901797434
Energy: 1.1517825549506202
Energy: 0.021882301896616656
Energy: 0.599494306405657
Energy: 0.16865797739849492
Energy: 0.16607082566843473
Energy: 0.16740959646639217
Energy: 0.16822064894209782
Energy: 0.16579247834043864
Energy: 1.5891124743593685
Energy: 1.1532900699782913
Energy: 1.150405243583595
Energy: 1.1469113445015637
Energy: 1.1512867125451298
Energy: 1.1503157620211821
Energy: 0.022189722535871058
Energy: 0.16865797739896282
Energy: 0.16607082566796685
Energy: 0.16740959646821166
Energy: 0.16822064894209782
Energy: 0.16579247833997077

minimum gb energy = 0.020484501074402462 eV
minimum distance =  2.45653596197894 Angstroms
sigma value = 1