Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_380272712420_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.5402784386331616
mass=63.546
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=[1.91030724425088e-19, 2.5288755991056e-19, 2.99259358228422e-19, 3.36904100420886e-19, 3.6864161736379197e-19, 3.9597955726973396e-19, 4.19835967349994e-19, 4.4082287907876e-19, 4.593760845004799e-19, 4.758192232952219e-19, 4.90397428487988e-19, 5.033077678047599e-19, 5.1471045890893795e-19, 5.24735278107876e-19, 5.33491173412686e-19, 5.410710710681399e-19, 5.475550799059379e-19, 5.53012093521342e-19, 5.57504596803078e-19, 5.610854615800679e-19, 5.638011509746979e-19, 5.65694923756086e-19, 5.66806834340082e-19, 5.67170528436e-19, 5.6677799516067e-19, 5.655042647366399e-19, 5.63182710793974e-19, 5.59617867783324e-19, 5.54571011386224e-19, 5.47753749808554e-19, 5.388184107207359e-19, 5.273404173147599e-19, 5.12797460007942e-19, 4.945454637934139e-19, 4.717801360009079e-19, 4.4349851405754e-19, 4.0842846971591395e-19, 3.6495180457568995e-19, 3.1097928030613195e-19, 2.43793605335976e-19, 1.5981119118795419e-19, 5.42423308147236e-20, -7.94106031229028e-20, -2.50130213923446e-19, -4.70544857816094e-19, -7.588629518109299e-19, -1.1419770307096438e-18, -1.6608483423370797e-18, -2.38014554217138e-18, -3.40648387214544e-18, -4.925090972915999e-18, -7.279890080737499e-18, -1.1166866725419539e-17, -1.81677217235796e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013667490154208735
Energy: 0.7076582112490433
Energy: 0.013988543741720403
Energy: 0.013874923937160128
Energy: 0.7128385140646397
Energy: 0.014012358269810813
Energy: 0.7076582112493571
Energy: 0.10367153916855287
Energy: 0.1037282590930456
Energy: 1.1060520044428896
Energy: 0.40878497967022165
Energy: 0.10368690905320747
Energy: 0.013988543741720403
Energy: 0.10372825909367338
Energy: 0.1046708112701685
Energy: 0.014011043610751225
Energy: 0.40991104122512306
Energy: 0.10465592346944336
Energy: 0.01387492393684623
Energy: 1.106052004437658
Energy: 0.014011043611065123
Energy: 0.013868288992369382
Energy: 1.094246227139372
Energy: 0.013972320189905314
Energy: 0.7128385140652327
Energy: 0.40878497967053556
Energy: 0.4099110412257509
Energy: 1.0942462269000748
Energy: 0.7032601164068344
Energy: 0.4102792413600041
Energy: 0.014012358269496915
Energy: 0.10368690905352136
Energy: 0.10465592346944336
Energy: 0.013972320190219215
Energy: 0.4102792413596902
Energy: 0.014048689307112398

minimum gb energy = 0.013667490154208735 eV
minimum distance =  2.55080065382376 Angstroms
sigma value = 1


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

Energy: 1.2613933629828011
Energy: 1.337003612935898
Energy: 1.183352317987579
Energy: 1.2635060728965348
Energy: 1.4972099224577102
Energy: 1.1786326530820836
Energy: 1.2364232418001222
Energy: 0.8465269138527033
Energy: 0.8455587251866203
Energy: 1.1322269160581888
Energy: 0.8465702869728693
Energy: 0.8320871893778972
Energy: 1.2826000970848017
Energy: 0.858097716985818
Energy: 0.8319744777126264
Energy: 1.2840790175283885
Energy: 0.8578975082026601
Energy: 0.81235821642497
Energy: 1.377080547132023
Energy: 0.9427686289006161
Energy: 1.1327970675897368
Energy: 1.3786190919862027
Energy: 1.0794026424584924
Energy: 1.1217469761566483
Energy: 1.2245047960370263
Energy: 0.9280370580767808
Energy: 0.924887488596492
Energy: 1.223991175566569
Energy: 0.974394057941044
Energy: 0.9269316237183628
Energy: 1.15687944076899
Energy: 0.8693173586261749
Energy: 0.8579305310395866
Energy: 1.158563609545936
Energy: 0.9148040472350242
Energy: 0.8560157728007025
Energy: 1.1518312871131862
Energy: 0.9770152976770113
Energy: 0.8754243688945
Energy: 1.153459754531536
Energy: 1.0592863127982866
Energy: 0.8574709815447814
Energy: 1.0734897104080907
Energy: 0.9720816701534608
Energy: 0.9796342892986822
Energy: 1.1245933915889217
Energy: 1.077115293892623
Energy: 0.9556062368503123
Energy: 0.9142765776674664
Energy: 0.9033983237928394
Energy: 0.888606550892674
Energy: 0.9145812930412986
Energy: 1.094862824864731
Energy: 0.8931448983579066
Energy: 0.9727487560024836
Energy: 0.8507809490749638
Energy: 0.9035848240557807
Energy: 0.9741581290861591
Energy: 0.9067740009109742
Energy: 0.8808923266732736
Energy: 1.103365136644745
Energy: 1.0600670306161013
Energy: 1.0655878386997721
Energy: 1.2135564968916241
Energy: 1.2651185861287817
Energy: 1.1856193292034114
Energy: 0.8682105617391753
Energy: 0.8453506967971672
Energy: 0.8249943612813566
Energy: 0.8683752151859961
Energy: 0.8230104874766009
Energy: 0.8315404329874451
Energy: 0.8578506543617194
Energy: 0.8125333791762156
Energy: 0.8481746052274634
Energy: 0.8559832566206094
Energy: 0.872692476752129
Energy: 0.832295262953923
Energy: 0.8864849164811706
Energy: 1.1212150826616445
Energy: 1.1208530499264222
Energy: 0.8689629778812805
Energy: 1.3792017725999852
Energy: 1.2924084512461058
Energy: 0.8870122753681503
Energy: 0.8338573434235957
Energy: 0.8317682625701068
Energy: 0.8872156161488214
Energy: 0.9610261820352228
Energy: 0.8811672506318972
Energy: 0.8825443256181335
Energy: 0.8671065417429352
Energy: 0.8573179514150525
Energy: 0.8820516632018255
Energy: 0.954155050543075
Energy: 0.8641854395793127
Energy: 1.095638123772498
Energy: 1.0177095210644878
Energy: 1.0183500058227055
Energy: 1.0939517465525863
Energy: 1.1834289531357942
Energy: 0.9383160182637472
Energy: 1.022251411982037
Energy: 0.9089106279161666
Energy: 0.9117335553542255
Energy: 1.022693985827612
Energy: 1.07672989082538
Energy: 0.9095203593252317
Energy: 1.050862030062111
Energy: 0.8735189827449041
Energy: 0.8726817026282327
Energy: 1.05164223673299
Energy: 1.0177560504882206
Energy: 0.8723039834032811
Energy: 1.2375636488712538
Energy: 0.9218833890727984
Energy: 0.9234006074508365
Energy: 1.2387425714370293
Energy: 1.0595953944857521
Energy: 0.9164250259491661
Energy: 1.2643651651955974
Energy: 1.139848733130829
Energy: 1.062896640960705
Energy: 1.2662453529777582
Energy: 1.121396983517912
Energy: 1.0662838380005482
Energy: 1.2104863330258788
Energy: 0.8798903109878959
Energy: 0.8537880498150215
Energy: 1.2124496293954659
Energy: 0.8827856569023557
Energy: 0.8331902573635896
Energy: 1.2370669898067772
Energy: 0.8810450970307145
Energy: 0.8808819210686009
Energy: 1.2332561841915148
Energy: 0.8875117119898234
Energy: 0.8455892469943859

minimum gb energy = 0.81235821642497 eV
minimum distance =  2.39363261408348 Angstroms
sigma value = 33


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

Energy: 1.6831250467399221
Energy: 1.3302207001320934
Energy: 1.3298255060926203
Energy: 1.685128625251168
Energy: 1.3665486704974419
Energy: 1.329783801709011
Energy: 1.3218947515851
Energy: 0.8895611080953479
Energy: 0.8897286919874022
Energy: 1.2895146139130085
Energy: 0.8896942801101207
Energy: 0.858610653275733
Energy: 1.2867581699867692
Energy: 0.8848075635030108
Energy: 0.8850218344039773
Energy: 1.28841243643548
Energy: 0.8847979978576805
Energy: 0.8676163927498037
Energy: 1.337034318808779
Energy: 1.0740011612841225
Energy: 0.9770757948869065
Energy: 1.3387480369659785
Energy: 1.0633152533644326
Energy: 1.1103919262974749
Energy: 1.2635140748174587
Energy: 0.9229370194482577
Energy: 0.9231552131526319
Energy: 1.2383326352415274
Energy: 0.9463329151279964
Energy: 0.9175562614784457
Energy: 1.1913481209737584
Energy: 0.9270674316003674
Energy: 0.8971620277864647
Energy: 1.192345274173882
Energy: 0.9468590162531517
Energy: 0.866817939794354
Energy: 1.1848990955272536
Energy: 0.90583730637436
Energy: 0.8954417716239501
Energy: 1.1861136172833668
Energy: 1.2180738977494345
Energy: 0.8956717505573266
Energy: 1.1506227753341656
Energy: 1.0094760775386982
Energy: 1.0095527401692368
Energy: 1.151238490950689
Energy: 1.1218473382121872
Energy: 1.0111104111501423
Energy: 0.9320599474411289
Energy: 0.9253035064634665
Energy: 0.9147590495920659
Energy: 0.9314306415217798
Energy: 1.1493591874422593
Energy: 0.9307434967510761
Energy: 0.9796832791916082
Energy: 0.9037579842068549
Energy: 0.8477037509010866
Energy: 0.9799795981412605
Energy: 0.8738010558451272
Energy: 0.9174246175118757
Energy: 1.2282551987841606
Energy: 1.2640166436025173
Energy: 1.2637859400590494
Energy: 1.226514520888728
Energy: 1.5878962645588337
Energy: 1.2639346485137204
Energy: 0.9016258550456178
Energy: 0.8239729635649303
Energy: 0.825012596421581
Energy: 0.9016476845187507
Energy: 1.2014022864524576
Energy: 0.8460760000441134
Energy: 0.8865905059475554
Energy: 0.8826610218908647
Energy: 0.8732582911310608
Energy: 0.8865654606090947
Energy: 0.9209173015946901
Energy: 0.8835001372119435
Energy: 1.4575731633004283
Energy: 1.1098870392217481
Energy: 1.1102630415023185
Energy: 1.456911318784501
Energy: 1.3380703898317372
Energy: 1.1135527124996398
Energy: 0.9710055536619516
Energy: 0.8880727186846875
Energy: 0.9141264775689127
Energy: 0.9714236684085252
Energy: 1.0516531045159287
Energy: 0.8956248453019569
Energy: 0.965643479638812
Energy: 0.8809730898494086
Energy: 0.8629843790423809
Energy: 0.9658706041284327
Energy: 1.2081054998849121
Energy: 0.8928935631379614
Energy: 1.1746886645854424
Energy: 0.884001335225187
Energy: 0.8837748925558733
Energy: 1.1748607281110326
Energy: 1.1515688266581676
Energy: 0.8838185841024393
Energy: 1.095150687495766
Energy: 1.008847659793173
Energy: 0.9997063475305878
Energy: 1.0956732643870943
Energy: 1.119206678630896
Energy: 0.9262495045625219
Energy: 1.1572548650878092
Energy: 0.9264143927717108
Energy: 0.9435091125493107
Energy: 1.158192715455292
Energy: 0.9430468835213685
Energy: 0.9158247934837492
Energy: 1.2733805598202907
Energy: 0.9614135189823886
Energy: 0.9237979672264004
Energy: 1.27349220091087
Energy: 0.9855466379455023
Energy: 0.9235077487757639
Energy: 1.5859762516891531
Energy: 1.2608981604037732
Energy: 1.2655916453345675
Energy: 1.5867581079402915
Energy: 1.2883349024980317
Energy: 1.2653022940410699
Energy: 1.3271963001396265
Energy: 0.8975813784830811
Energy: 0.8742028643892256
Energy: 1.3272676033478334
Energy: 0.9007852957204918
Energy: 0.8157019634984173
Energy: 1.2391154034719847
Energy: 0.8855503600286645
Energy: 0.8854534509384822
Energy: 1.2408506930048793
Energy: 0.8904213045944296
Energy: 0.8868871181114699
Energy: 1.3344744746805326
Energy: 1.4629164704169602
Energy: 1.455463910530668
Energy: 1.336200769501725
Energy: 1.467817316082933
Energy: 1.1099326383668011
Energy: 1.2518250810184846
Energy: 0.9191938708147724
Energy: 0.8977152535725929
Energy: 1.2539924729103589
Energy: 0.9723876975028479
Energy: 0.897530157984221
Energy: 1.2405684448242522
Energy: 0.931873685704668
Energy: 0.934847105200289
Energy: 1.2322213973227694
Energy: 0.9606786135102412
Energy: 0.8933006288529121
Energy: 1.2228785543459189
Energy: 1.107999214504854
Energy: 1.0520080788610637
Energy: 1.2238872694400966
Energy: 1.1732036186975885
Energy: 1.0637118770201328
Energy: 1.2031834050088872
Energy: 0.9108561301813857
Energy: 0.8964746153494436
Energy: 1.2044234572788497
Energy: 1.156587262915941
Energy: 0.9136882672867626
Energy: 1.029235397130703
Energy: 0.8977149241311859
Energy: 0.8908164357128608
Energy: 1.0306037072320273
Energy: 1.1265715047094247
Energy: 0.9210851929883359
Energy: 0.9779170044303819
Energy: 0.9129072578498973
Energy: 0.9230817188099152
Energy: 0.9777123760786753
Energy: 1.1416943641351538
Energy: 0.9146945847101787
Energy: 1.3508816881971701
Energy: 1.2645229754409715
Energy: 1.2642732465463906
Energy: 1.2893331226744593
Energy: 1.5185319410944729
Energy: 1.2642056765737208
Energy: 0.8944630037417375
Energy: 0.8242094742642949
Energy: 0.824667748402352
Energy: 0.8945320442026963
Energy: 1.3068282084364093
Energy: 0.8301636377546497
Energy: 0.878774593087922
Energy: 0.8524290039102482
Energy: 0.8678313624841562
Energy: 0.8790553995619945
Energy: 1.0698799323749926
Energy: 0.8771954259108911
Energy: 1.4607971397361301
Energy: 1.1099666230617102
Energy: 1.110057871802057
Energy: 1.4612353231512596
Energy: 1.3372846394153788
Energy: 1.1133871559827337
Energy: 0.9852826632827444
Energy: 0.904513003128049
Energy: 0.8906997943729076
Energy: 0.985404101583675
Energy: 1.015712352830967
Energy: 0.8906744946916547
Energy: 0.9531516760307454
Energy: 0.8974772096501489
Energy: 0.8975690467422517
Energy: 0.9550103643696928
Energy: 1.2285520061818276
Energy: 0.9398557948193064
Energy: 1.1819187371382631
Energy: 1.059231902652944
Energy: 1.058633474239608
Energy: 1.1227438580626858
Energy: 1.203322916797578
Energy: 1.0594803632260992
Energy: 1.1397291606368543
Energy: 1.003677596088624
Energy: 0.9525958087375694
Energy: 1.1409944592836136
Energy: 1.0359861579029965
Energy: 0.9263417323367074
Energy: 1.1218817059302069
Energy: 0.9506274169645579
Energy: 0.934148691688765
Energy: 1.1221290178584977
Energy: 0.9954329083008766
Energy: 1.0061536847889883
Energy: 1.2008119554720884
Energy: 0.9243726801833688
Energy: 0.9242210737240526
Energy: 1.1650750882564993
Energy: 0.9375208086199461
Energy: 0.9195319265279736
Energy: 1.4166936200482072
Energy: 0.9752923451658341
Energy: 0.8262683078135789
Energy: 1.4166126720263799
Energy: 0.9749695977543109
Energy: 0.8236986702098178

minimum gb energy = 0.8157019634984173 eV
minimum distance =  2.37558624239022 Angstroms
sigma value = 51


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

Energy: 1.292285519053572
Energy: 1.4028636952032747
Energy: 1.393505120710123
Energy: 1.2946993304909808
Energy: 1.538100959003583
Energy: 1.1008995102469468
Energy: 1.2251409991554563
Energy: 0.8979029102348548
Energy: 0.8955422824695867
Energy: 1.2026838810108536
Energy: 0.8952216417155447
Energy: 0.888592914790355
Energy: 1.200443221336859
Energy: 0.8746345911573727
Energy: 0.8745565576585548
Energy: 1.2026342069610094
Energy: 0.8744215960433316
Energy: 0.8098035815837725
Energy: 1.1675764584958106
Energy: 1.0170094959879512
Energy: 1.0171127554587969
Energy: 1.1680190172603875
Energy: 0.9944513768407335
Energy: 1.0428921293865296
Energy: 1.2627034175323837
Energy: 0.9769706638852663
Energy: 0.9770824471444498
Energy: 1.2626972277444315
Energy: 1.0403711345409812
Energy: 0.9308886565679882
Energy: 1.0719781812490652
Energy: 0.9649484796437946
Energy: 0.9590607785649077
Energy: 1.071096273360301
Energy: 0.9943990323239743
Energy: 0.9791881092965221
Energy: 0.9999195269082981
Energy: 0.8825971339964742
Energy: 0.9763050179072038
Energy: 0.9999369525563755
Energy: 1.1488525075221188
Energy: 0.9666008934176457
Energy: 1.1177484789812266
Energy: 1.0677826252845775
Energy: 1.0679762174085852
Energy: 1.1187354307961652
Energy: 1.0673341028247743
Energy: 1.067891906876017
Energy: 0.87434625239696
Energy: 0.8884300820264304
Energy: 0.8531060466618846
Energy: 0.8744440690434971
Energy: 0.9470846397338474
Energy: 0.8098928998065817
Energy: 0.8959165878549397
Energy: 0.7798684000237818
Energy: 0.8526199953258569
Energy: 0.8959309926703363
Energy: 0.8223041610647636
Energy: 0.8953591900436451
Energy: 0.8885343551030643
Energy: 1.2487477138279734
Energy: 1.2486536130769867
Energy: 0.8882368245621248
Energy: 1.2481333379723083
Energy: 1.2485829771151409
Energy: 0.9427657008324337
Energy: 0.8610369223389825
Energy: 0.8528506942556034
Energy: 0.9427291439071085
Energy: 1.1685161001855615
Energy: 0.8894532103050636
Energy: 0.8927923727322002
Energy: 0.8888217475432458
Energy: 0.8423419543706677
Energy: 0.8937071237290564
Energy: 1.1798248678990209
Energy: 0.8900462171935835
Energy: 1.0057305618364405
Energy: 1.0444303483351507
Energy: 1.0439692245254864
Energy: 1.0323164640526568
Energy: 1.071905893230991
Energy: 1.0436438007754694
Energy: 1.1086431694561971
Energy: 0.9082953435715071
Energy: 1.003882101036561
Energy: 1.1102468254188287
Energy: 1.1099119807224405
Energy: 0.951109554514816
Energy: 1.0400771056150484
Energy: 0.9214184534827531
Energy: 0.9262116430854385
Energy: 1.040100950775881
Energy: 0.9544350453314616
Energy: 0.9860802045019919
Energy: 1.2145576495711945
Energy: 0.8896391681042488
Energy: 0.8897325599748301
Energy: 1.0723361539053227
Energy: 0.8936972504353711
Energy: 0.8591788515255725
Energy: 1.3187471638869535
Energy: 0.9214710489253644
Energy: 0.9073729359732284
Energy: 1.3146616986429922
Energy: 0.9426873555886375
Energy: 0.9071048966667669

minimum gb energy = 0.7798684000237818 eV
minimum distance =  2.37905140058966 Angstroms
sigma value = 19


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

Energy: 1.0675578552785803
Energy: 0.8878346359969178
Energy: 0.9623850271029716
Energy: 1.0702373703683221
Energy: 0.8339071941497233
Energy: 0.9647199754882662
Energy: 1.1418161197106447
Energy: 0.8020032385542555
Energy: 0.8019049780740936
Energy: 1.07738304645475
Energy: 0.8018380179884129
Energy: 0.8034459686220344
Energy: 1.1726948572974576
Energy: 0.8383837946845384
Energy: 0.8384284269853642
Energy: 1.1727786009100423
Energy: 0.8384274187378388
Energy: 0.8386454883308091
Energy: 0.9257414924689614
Energy: 0.8394327640405606
Energy: 0.9715429181344403
Energy: 0.9249189541311683
Energy: 0.9428231066729046
Energy: 0.8391329476816235
Energy: 1.1985704188971045
Energy: 0.8016850202402159
Energy: 0.8036456828159004
Energy: 1.1985934063205215
Energy: 0.8382861707813293
Energy: 0.8037423625983607
Energy: 0.9286520364398909
Energy: 0.8334499100261795
Energy: 0.9249202061700956
Energy: 0.9284341130125023
Energy: 0.8332079586238532
Energy: 0.8901913171798564
Energy: 0.972617219384076
Energy: 0.9328674719048536
Energy: 0.9326240930984895
Energy: 0.9734448214466722
Energy: 0.885992129972466
Energy: 0.8344085701424535
Energy: 0.943236290602413
Energy: 0.9639160042860617
Energy: 0.9638287261107777
Energy: 0.942650279525455
Energy: 1.0692925572860488
Energy: 0.9637569946538771
Energy: 0.8384275696072545
Energy: 0.7276427967349178
Energy: 0.728285533846704
Energy: 0.8384855877063966
Energy: 1.1396509823933962
Energy: 0.7584636015603285
Energy: 0.801743489096073
Energy: 1.0062033484338007
Energy: 0.801549292805762
Energy: 0.8018181621455995
Energy: 0.9778539883803385
Energy: 0.801980682924011
Energy: 1.29702895747082
Energy: 0.9237602073985498
Energy: 0.8854725829986004
Energy: 1.297386137441072
Energy: 0.9256010549667054
Energy: 1.3487783217974751
Energy: 1.0785382111860105
Energy: 0.8719155475554028
Energy: 0.8726312438219191
Energy: 0.9798011536330019
Energy: 0.9235001390311024
Energy: 0.8398840889129786
Energy: 0.7792293982831505
Energy: 0.8547778783585468
Energy: 0.8678805399880323
Energy: 0.7790941598064636
Energy: 1.0162245486627972
Energy: 0.8897668488653876
Energy: 1.0161496585724477
Energy: 0.8899861918165303
Energy: 0.8901269197688838
Energy: 0.8394925155205761
Energy: 0.9299228663358814
Energy: 0.889642010192755
Energy: 1.1418338493007678
Energy: 0.9798063995381261
Energy: 0.9795619527525041
Energy: 1.1433028066683069
Energy: 0.9793862660063426
Energy: 0.9180854397396385
Energy: 1.0689139689250955
Energy: 0.839656430666321
Energy: 0.9307966994321366
Energy: 1.069147872199535
Energy: 0.8397151905957357
Energy: 0.9637477025244662
Energy: 1.1983221011325327
Energy: 0.8017361966401824
Energy: 0.801986227748153
Energy: 1.1221147888896452
Energy: 0.8014939815619379
Energy: 0.8018232432711196
Energy: 0.9770545043829926
Energy: 0.838248610189526
Energy: 0.8383064460746781
Energy: 0.9766183759857241
Energy: 0.8383408084958681
Energy: 0.8386515218901132
Energy: 0.9237669982269349
Energy: 0.8385263305925276
Energy: 0.9794626260519338
Energy: 0.9238268449887469
Energy: 1.0793762646313516
Energy: 0.9795055924947363
Energy: 1.0161572387412627
Energy: 0.7790345612806336
Energy: 0.9042563226109632
Energy: 1.0162170872052467
Energy: 0.7789549348909476
Energy: 0.8339778491194878
Energy: 0.9277303436079626
Energy: 0.8398995610252942
Energy: 0.8903632731417859
Energy: 0.9283292153164513
Energy: 0.838797774532853
Energy: 0.8900256141602783
Energy: 0.9730521924424307
Energy: 0.9324404169353488
Energy: 1.0426233956185884
Energy: 0.9730267327487164
Energy: 1.0779445994339258
Energy: 0.9242861290306199
Energy: 0.9426612725865179
Energy: 0.9630807818975431
Energy: 0.9630542725693516
Energy: 0.942754140999491
Energy: 1.0694075261533162
Energy: 0.9627681087005142
Energy: 0.8019714674800948
Energy: 0.9062056426227386
Energy: 0.9054851409322251
Energy: 0.8018849946141821
Energy: 1.1419397108976685
Energy: 0.8042873820348054
Energy: 0.8384299202656043
Energy: 0.8146714150876736
Energy: 0.8383896321710532
Energy: 0.8384655140298561
Energy: 0.8849108905881844
Energy: 0.8384436784223104
Energy: 0.9427016814097653
Energy: 0.9238913635913463
Energy: 0.8860643472732427
Energy: 0.9427458252505505
Energy: 0.9238769587680823
Energy: 0.9712891655938182
Energy: 0.9742995558703101
Energy: 0.8847068816246687
Energy: 0.8338910609033036
Energy: 0.9731751403471836
Energy: 0.9778099437169224
Energy: 0.8016275729221566
Energy: 0.7790140150994086
Energy: 0.9053465662186602
Energy: 0.9043137138732377
Energy: 0.7790523285410311
Energy: 0.9644247633660746
Energy: 0.8340958473700169
Energy: 1.078452638087673
Energy: 0.9055387248026617
Energy: 0.9053477900899999
Energy: 0.9812854036679362
Energy: 0.96446299819211
Energy: 0.8131577013187293
Energy: 1.068748378658295
Energy: 0.9716356767868475
Energy: 0.9311940137409627
Energy: 1.0689370551309063
Energy: 0.9426486357885216
Energy: 0.9637420898267726

minimum gb energy = 0.7276427967349178 eV
minimum distance =  2.32776799653795 Angstroms
sigma value = 27


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

Energy: 0.9041348754203531
Energy: 1.221645874166358
Energy: 1.3085376857986806
Energy: 0.9065328504616563
Energy: 1.5100859926382868
Energy: 1.3087152565558537
Energy: 1.1007009102029566
Energy: 0.8314724971044548
Energy: 0.8314180197291665
Energy: 0.9885681198715195
Energy: 0.8315432819423134
Energy: 0.8312053406109111
Energy: 0.8855174262552601
Energy: 0.7810930741036534
Energy: 0.7812492377445954
Energy: 0.8855111972859983
Energy: 0.7822833099859963
Energy: 0.781263272251208
Energy: 1.1334371467155777
Energy: 1.0007713146242372
Energy: 1.0027263071186079
Energy: 1.256726703811304
Energy: 1.0353721950677988
Energy: 1.0034256043036744
Energy: 0.9867909473463211
Energy: 0.857919584068746
Energy: 0.7486383165516408
Energy: 0.9856180543624297
Energy: 0.9761797294846727
Energy: 0.7452131718582673
Energy: 0.814902446302093
Energy: 0.8665768074762317
Energy: 0.8662941067405253
Energy: 0.8149499181941059
Energy: 0.9064978091605984
Energy: 0.8414240274436664
Energy: 0.8207511448926017
Energy: 0.6896047572568716
Energy: 0.7169141856708523
Energy: 0.8207588997169316
Energy: 0.8157657621636707
Energy: 0.8199669893658499
Energy: 0.8313971716420613
Energy: 1.0888026464224336
Energy: 1.0898781670447566
Energy: 0.831282140986847
Energy: 1.224411740666532
Energy: 1.0509315768080116
Energy: 0.9831158099439877
Energy: 0.9977915389541526
Energy: 0.7327930176946889
Energy: 0.9895184193546781
Energy: 1.2531084095015805
Energy: 0.7559056682950122
Energy: 0.8566913862448196
Energy: 0.8496804631057449
Energy: 0.8203265569832051
Energy: 0.8576214432164609
Energy: 0.8850402625323844
Energy: 0.8065391919488908
Energy: 0.8855046093586338
Energy: 0.8048271299119157
Energy: 0.8060564604842142
Energy: 0.885898776025955
Energy: 0.8208046392298306
Energy: 0.8059261098183614
Energy: 1.0427214025142462
Energy: 0.8314986587767556
Energy: 0.8323926727093223
Energy: 0.9766950172182809
Energy: 0.9057414741113474
Energy: 0.7614406510421703

minimum gb energy = 0.6896047572568716 eV
minimum distance =  2.36076217963847 Angstroms
sigma value = 9


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

Energy: 1.4464832205766245
Energy: 1.4557936912949938
Energy: 1.242390440395679
Energy: 1.4480889027945492
Energy: 1.6369663060593331
Energy: 1.2476830211617262
Energy: 0.901399605289877
Energy: 0.6900432759759566
Energy: 0.6900678704753935
Energy: 0.8186240065942041
Energy: 0.6909816904980606
Energy: 0.7957414144201074
Energy: 0.7037878144606068
Energy: 0.665624009823204
Energy: 0.6659052959751905
Energy: 0.7597807757793553
Energy: 0.6668067618509476
Energy: 0.6659812969533916
Energy: 0.916312171594553
Energy: 0.7214701391031196
Energy: 0.7849558444515014
Energy: 0.9174109314920844
Energy: 0.818102129299317
Energy: 0.795740060545633
Energy: 0.8081411289891769
Energy: 0.7655282321672087
Energy: 0.701921234966615
Energy: 0.9383393200824587
Energy: 0.9682554231562636
Energy: 0.7427514474218258
Energy: 0.7190939063640509
Energy: 0.976927547758506
Energy: 0.8454012708496651
Energy: 0.7188955710286695
Energy: 1.0811746607964394
Energy: 0.697448980984528
Energy: 0.6873347674962097
Energy: 0.6346719785870854
Energy: 0.7044527347078271
Energy: 0.6883988890986389
Energy: 0.9066557588060292
Energy: 0.6882699937284368
Energy: 0.6988326050327359
Energy: 0.8516266421948265
Energy: 0.8763024911724232
Energy: 0.6993107503930851
Energy: 0.9067967233159538
Energy: 0.6994465746026036
Energy: 0.9453450375510231
Energy: 0.7047319357688665
Energy: 0.7976164008401042
Energy: 0.9472887077998577
Energy: 0.8674845508516515
Energy: 0.8237509415470288
Energy: 1.0928211584951177
Energy: 0.7431037969619713
Energy: 0.79134644223106
Energy: 1.094020280181099
Energy: 0.9735922515895313
Energy: 0.8866949143695013
Energy: 0.6660106624373324
Energy: 0.6991600977937346
Energy: 0.6990694594544368
Energy: 0.783218741174174
Energy: 0.6991372267346546
Energy: 0.6989509889261036
Energy: 0.9441151434048751
Energy: 0.7198583930641788
Energy: 0.7196107690880348
Energy: 0.9450953359351866
Energy: 0.7198977192767304
Energy: 0.7755346856510936
Energy: 1.2642067464656586
Energy: 1.3110005014778177
Energy: 1.1113118129292097
Energy: 1.2660526158999466
Energy: 1.3108698790421742
Energy: 1.1127881772227577
Energy: 1.0040392630037134
Energy: 0.7344700875359782
Energy: 0.73403128400833
Energy: 0.9956959996385085
Energy: 0.8663792644724595
Energy: 0.7814998851260588
Energy: 0.7805371142522188
Energy: 0.7174871001187414
Energy: 0.7210247348349413
Energy: 0.7806444079097585
Energy: 0.7359843467892274
Energy: 0.8509884091052912
Energy: 0.6725602718384892
Energy: 0.6842633014174136
Energy: 0.6542421338505447
Energy: 0.6719137140108957
Energy: 0.6932843370294434
Energy: 0.6714135725531748
Energy: 0.6894624310923484
Energy: 0.7665302695729383
Energy: 0.7194811145034885
Energy: 0.689362786124549
Energy: 1.1188197675204552
Energy: 0.6911741115490448
Energy: 0.8109442947447305
Energy: 1.111649016705204
Energy: 0.7914902679709128
Energy: 0.8109049592954349
Energy: 1.2692311345825416
Energy: 0.7851553650471433
Energy: 0.6863390865698783
Energy: 0.6657711084970744
Energy: 0.6757064209661074
Energy: 0.6865819063726744
Energy: 0.7141462598446722
Energy: 0.7055702059449459
Energy: 0.7006057992945686
Energy: 0.695891583022293
Energy: 0.6954050594648664
Energy: 0.7014531079506509
Energy: 0.6850442060882123
Energy: 0.6955284486497073
Energy: 0.703679646165624
Energy: 0.6832508592345437
Energy: 0.6834016305820569
Energy: 0.6997825840855615
Energy: 0.686774704110913
Energy: 0.6938208493618737
Energy: 1.4484313891391423
Energy: 0.6902601934412482
Energy: 0.7330942432186152
Energy: 1.450239074004338
Energy: 0.8085111841098319
Energy: 1.1327030210167384
Energy: 1.1579313040068966
Energy: 0.6895597725153607
Energy: 0.689553640249292
Energy: 1.0228607958148954
Energy: 0.6887743956536394
Energy: 0.7935190527361001
Energy: 0.8045828581750412
Energy: 0.6663015131139887
Energy: 0.6661267614452598
Energy: 0.8048336022642101
Energy: 0.6661146290055192
Energy: 0.6664247656045623
Energy: 0.9079667199645237
Energy: 0.779814022298753
Energy: 0.8509468564036153
Energy: 0.9092751274870579
Energy: 0.7794156894508144
Energy: 0.8510710796111164
Energy: 0.8668375396891141
Energy: 0.6993853021305696
Energy: 0.7471938682712513
Energy: 0.9344089227373793
Energy: 0.8512448360123651
Energy: 0.7662032333158022
Energy: 1.3357980589580296
Energy: 0.9796593822247003
Energy: 0.9767841869867374
Energy: 1.3356593615628407
Energy: 1.0835686682030954
Energy: 1.276435663671245
Energy: 0.7195694259638644
Energy: 0.8830855164333242
Energy: 0.7401264300970964
Energy: 0.7197983528955341
Energy: 0.9599514540071619
Energy: 0.7197485040400022
Energy: 0.6993104037897296
Energy: 0.7614851663674743
Energy: 0.6996686528088135
Energy: 0.6991424027755226
Energy: 0.8769770685513846
Energy: 0.699660105853462
Energy: 1.0653379719342837
Energy: 0.8530711984645177
Energy: 0.8639415012576999
Energy: 0.9723091457216336
Energy: 0.9066011737339569
Energy: 0.8607407485180348
Energy: 0.665837195996866
Energy: 0.7203614822807997
Energy: 0.7921252393619825
Energy: 0.6659792627725445
Energy: 0.9386541627315063
Energy: 0.8770075733842432
Energy: 1.0858469318205943
Energy: 0.8038392326839493
Energy: 0.8038146562793709
Energy: 1.0872087260797565
Energy: 0.803968655196751
Energy: 0.981717352404979
Energy: 0.9706310139682223
Energy: 0.7040555725562815
Energy: 0.7038595420566489
Energy: 0.9440738917862588
Energy: 0.7043478904274094
Energy: 0.7038352169313892
Energy: 1.2702727695697058
Energy: 0.7199461257897315
Energy: 0.7199256758565585
Energy: 1.2717145590423131
Energy: 0.7200278753051289
Energy: 0.9961877132309344
Energy: 0.917445219120505
Energy: 0.7192934435756242
Energy: 0.719389116570991
Energy: 0.9723942999605419
Energy: 0.857174900698275
Energy: 0.8366729495923245
Energy: 0.8180853883351283
Energy: 0.7172887311573088
Energy: 0.8064821655320181
Energy: 0.8180935251142121
Energy: 0.7324926790198956
Energy: 0.7991501231060392
Energy: 0.665880633348018
Energy: 0.7215132051937783
Energy: 0.6982913021461924
Energy: 0.6671544914181072
Energy: 0.7615563908188446
Energy: 0.6661989663383616
Energy: 0.6899310534353335
Energy: 0.7284038818776546
Energy: 0.80059814412941
Energy: 0.6900722524355735
Energy: 0.6936635771336578
Energy: 0.6916371323704728
Energy: 1.6510516854868404
Energy: 1.1108529984986477
Energy: 1.1131702314224126
Energy: 1.6511730420216495
Energy: 1.2658450929926894
Energy: 1.4040043459859752
Energy: 0.6873350244470219
Energy: 0.7163884567438676
Energy: 0.7181535651558969
Energy: 0.7916468892694739
Energy: 0.7198109858187498
Energy: 0.7061974907708172
Energy: 0.6851933172907297
Energy: 0.6813641039445241
Energy: 0.6604277055474115
Energy: 0.6846756857465267
Energy: 0.7034093979800702
Energy: 0.6792230916411024
Energy: 0.7022582157610722
Energy: 0.6791691234111086
Energy: 0.6797142550436952
Energy: 0.7020457774174856
Energy: 0.6847515345622803
Energy: 0.6797824477387807
Energy: 1.157702444706365
Energy: 0.6896800191342563
Energy: 0.6899126675814173
Energy: 1.1605310985673687
Energy: 0.6889979833596492
Energy: 0.7733488637033656

minimum gb energy = 0.6346719785870854 eV
minimum distance =  2.35198352812138 Angstroms
sigma value = 57


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

Energy: 0.296689535207813
Energy: 0.30704058369463627
Energy: 0.3064333449432957
Energy: 0.2992800589281825
Energy: 0.317758558623649
Energy: 0.29739331412755954
Energy: 0.2975683306766337
Energy: 0.3374391578301011
Energy: 0.3141648319443185
Energy: 0.33518315728397446
Energy: 0.33644852403547143
Energy: 0.314364473302854
Energy: 0.3776334214852736
Energy: 0.33852146726227
Energy: 0.3387495397632452
Energy: 0.37717141080309663
Energy: 0.3388718185642004
Energy: 0.3381134422137412
Energy: 0.3773988311630411
Energy: 0.33874978901363784
Energy: 0.33883880385219256
Energy: 0.37722180539546474
Energy: 0.3779075379174311
Energy: 0.33829971615348114
Energy: 0.3737195046241688
Energy: 0.2980098360494605
Energy: 0.3271324791470294
Energy: 0.3742564435297089
Energy: 0.2976803623086202
Energy: 0.3484718746853877
Energy: 0.33895976903689906
Energy: 0.2976374517577102
Energy: 0.29769892587009206
Energy: 0.33885822038579166
Energy: 0.2974886587184899
Energy: 0.32678437651087405
Energy: 0.3339191374488623
Energy: 0.31363551640512805
Energy: 0.3496635686942591
Energy: 0.33452584190360846
Energy: 0.33789081562566525
Energy: 0.3500775264986129
Energy: 0.9719923139859256
Energy: 1.0001483707568186
Energy: 0.9998201318220019
Energy: 0.9713952066579139
Energy: 1.1942672034481892
Energy: 0.9692500481048054
Energy: 0.3732338071087204
Energy: 0.38341366662030507
Energy: 0.33792575384816714
Energy: 0.37404391232496975
Energy: 0.3769712698957446
Energy: 0.33797864989666354
Energy: 0.29736832719421424
Energy: 0.3772363315998027
Energy: 0.3293020227063364
Energy: 0.29746920386017783
Energy: 0.3768097607924521
Energy: 0.32812563393293837
Energy: 0.29740893339416574
Energy: 0.3384816721419677
Energy: 0.31460928797789106
Energy: 0.29758578705755445
Energy: 0.3385167022071307
Energy: 0.3271736311108418
Energy: 0.37532239593969946
Energy: 0.3375353012721351
Energy: 0.3526328138263952
Energy: 0.37612437816952576
Energy: 0.33696745029846076
Energy: 0.3526640796758071
Energy: 1.1957430544254601
Energy: 0.99695374010955
Energy: 0.9962519356975864
Energy: 1.195887705331553
Energy: 0.9706560399826524
Energy: 0.9977046476560798
Energy: 0.3742758968867471
Energy: 0.3374643599228947
Energy: 0.3524270833957027
Energy: 0.374759563468267
Energy: 0.3366242517444371
Energy: 0.35247718882844625
Energy: 0.3773225065134389
Energy: 0.29739493141863405
Energy: 0.2974165801612465
Energy: 0.37760829807785845
Energy: 0.29745143257587964
Energy: 0.2979064595784752
Energy: 0.3366754715144622
Energy: 0.3365526575437846
Energy: 0.31434925284025794
Energy: 0.3368993428791814
Energy: 0.2976976195696609
Energy: 0.3142311443239838
Energy: 0.33871234279615914
Energy: 0.33817303613530547
Energy: 0.338005494817076
Energy: 0.3385756414318814
Energy: 0.3367747063009776
Energy: 0.33795276482047626
Energy: 0.37867905161440263
Energy: 0.3842131544110803
Energy: 0.33857636376307515
Energy: 0.37686310555253066
Energy: 0.3799716744677333
Energy: 0.3386690101015852
Energy: 0.2974734609850689
Energy: 0.3381339668011035
Energy: 0.34880957120011663
Energy: 0.2976288689310139
Energy: 0.37450326221274727
Energy: 0.3500155082273324

minimum gb energy = 0.296689535207813 eV
minimum distance =  2.42547074595988 Angstroms
sigma value = 11


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

Energy: 1.2034502443744943
Energy: 1.3947114809690875
Energy: 1.196432770653029
Energy: 1.2056636000748318
Energy: 1.5683098800832995
Energy: 1.2785249311632538
Energy: 0.7556062194963735
Energy: 0.5320169883944686
Energy: 0.5686364848713376
Energy: 0.5705560353184692
Energy: 0.535757527122487
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Energy: 0.5397896638869616
Energy: 0.5601686882306119
Energy: 0.5535556100388742
Energy: 0.5403946083693786
Energy: 0.5652126516127324
Energy: 0.5567180300832555
Energy: 0.5393461109101751
Energy: 0.5874023559547035
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Energy: 0.5368439399015729
Energy: 0.5505937821104034
Energy: 0.5317022828102203
Energy: 0.7189769141144189
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Energy: 0.5316196048645526
Energy: 1.0202481765379265
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Energy: 0.8577155336205637
Energy: 1.1786990200444927
Energy: 1.1709634215714055
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Energy: 0.6240673578456932
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Energy: 0.6663921567312852
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Energy: 0.7205986887026221
Energy: 0.686487940127739
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Energy: 0.7482129563346791
Energy: 0.9055775260703626
Energy: 0.9628850245240174
Energy: 0.9527418361535755
Energy: 1.0790922488570909
Energy: 0.9701879330450056
Energy: 1.1233131197491497
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Energy: 0.7189735785864285
Energy: 0.6920951479493259
Energy: 1.0395148407933463
Energy: 0.9492457183102644
Energy: 0.8987988217299443
Energy: 0.9050977286361737
Energy: 1.0708755395076928
Energy: 1.0124298793491733
Energy: 0.9073204813403117
Energy: 1.1461272232592254
Energy: 1.0561744048266393
Energy: 1.0582463272841287
Energy: 0.7501059506509251
Energy: 0.7471363260879685
Energy: 0.909611684772187
Energy: 0.7325712218294174
Energy: 0.7094522561265456
Energy: 0.9948981147712127
Energy: 0.7329261234321307
Energy: 0.7451835102446649
Energy: 0.7127151766028587
Energy: 0.7365536208932928
Energy: 0.722181374707853
Energy: 0.7543066814924205
Energy: 0.8564782721131211
Energy: 0.9510501002270126
Energy: 0.7559360784588449
Energy: 0.853004077249686
Energy: 0.9498257780852555
Energy: 0.9902681041617832
Energy: 0.6868369743180633
Energy: 0.6580785531333319
Energy: 0.7777120795489963
Energy: 0.9851129581051136
Energy: 0.760638476430683
Energy: 1.2544116155649825
Energy: 1.0836739480954625
Energy: 1.0616571710933704
Energy: 1.2955254227388022
Energy: 1.0810789587040803
Energy: 1.2484019066330732
Energy: 0.6150623304822033
Energy: 0.6553600299493662
Energy: 0.6549768580721145
Energy: 0.615640344821486
Energy: 0.7963121490905436
Energy: 0.626235978468715
Energy: 0.6328482240585159
Energy: 0.7091640209710719
Energy: 0.6295739313415957
Energy: 0.6342948379946964
Energy: 0.6989930519612065
Energy: 0.629394033451497
Energy: 0.6278670926089339
Energy: 0.5516459492487215
Energy: 0.5502751684029183
Energy: 0.6288347683377457
Energy: 0.5368478304354433
Energy: 0.723660059091296
Energy: 1.2990579335688477
Energy: 0.5319826085292021
Energy: 0.6029523018334483
Energy: 1.1508579237678924
Energy: 0.7581453866708673
Energy: 0.5501222802654891

minimum gb energy = 0.5203535523822533 eV
minimum distance =  2.38448390076017 Angstroms
sigma value = 41


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

Energy: 1.1670909787190382
Energy: 1.2790079162619357
Energy: 1.2798582746636809
Energy: 1.1688462964036481
Energy: 1.5037748700639386
Energy: 1.0365042596999718
Energy: 0.907170357210493
Energy: 0.588835179374018
Energy: 0.6291278195643881
Energy: 0.6269590192932989
Energy: 0.5887740721803068
Energy: 0.6290887822906166
Energy: 0.5982805934078715
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Energy: 0.6314639156695021
Energy: 0.6907925886185565
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Energy: 0.594660923816199
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Energy: 0.7859551491442828
Energy: 0.5931201309943119
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Energy: 1.0207107501745936
Energy: 1.1689988528358404
Energy: 1.1588271608127991
Energy: 1.0219888261122216
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Energy: 1.158909370162906
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Energy: 0.6830243621665798
Energy: 0.5948886631721367
Energy: 0.7220443495755506
Energy: 0.6773857582341112
Energy: 0.7030064642550351
Energy: 0.7599094228398608
Energy: 0.7600582253340926
Energy: 0.7027949170003106
Energy: 0.7597478510734368
Energy: 0.693370846366402
Energy: 0.8986774948211667
Energy: 0.6843211499834441
Energy: 0.7016466745836507
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Energy: 0.9303045745872172
Energy: 0.992398201483768
Energy: 0.992225895283233
Energy: 0.8589061675582054
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Energy: 0.5622287793146478
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Energy: 0.6858823847003378
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Energy: 0.6318895260071533
Energy: 0.8775219822648908
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Energy: 1.1686640857121877
Energy: 0.956690463861099
Energy: 0.9806591264103486
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Energy: 0.5888505047455425
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Energy: 0.6179144947127622
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Energy: 0.691729110082769
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Energy: 0.6437988530982313
Energy: 0.6397436230508335
Energy: 0.6297147453379581
Energy: 0.617693670755523
Energy: 0.6188346120618686
Energy: 0.5914127741951543
Energy: 0.7330704130510832
Energy: 0.6904925070391251
Energy: 0.5915942213852228
Energy: 0.6270707015824113
Energy: 0.6781311796956928
Energy: 1.5052739740286623
Energy: 1.1593254372490371
Energy: 1.1754162893809303
Energy: 1.5043948952449977
Energy: 1.1595533394231616
Energy: 1.0947750319663985
Energy: 0.8983537703730393
Energy: 0.7550088870379607
Energy: 0.7549273319806877
Energy: 0.5921666557384874
Energy: 0.8597118148350661
Energy: 0.6779998426366783
Energy: 0.7024264145740067
Energy: 0.7413241914819901
Energy: 0.8697876360143412
Energy: 0.7024175463156519
Energy: 0.7409431849706967
Energy: 0.6773567002219764
Energy: 0.8990338877437382
Energy: 0.6856087074234748
Energy: 0.7017058115257825
Energy: 0.5948788890734369
Energy: 0.685831528913207
Energy: 0.6183590692328869
Energy: 0.8595830462122628
Energy: 0.7142625130653808
Energy: 0.6155945666637416
Energy: 0.8587006916579206
Energy: 0.7140633987782501
Energy: 0.6163295706012063
Energy: 0.9301927582283993
Energy: 0.9924730371400546
Energy: 0.9925067590835398
Energy: 0.9299850346136777
Energy: 0.81704296049497
Energy: 0.6160529233420426
Energy: 1.1854123439270392
Energy: 0.6578295745374053
Energy: 0.6953789089933312
Energy: 1.1660811188903701
Energy: 0.5638934319220406
Energy: 0.6863346850967055
Energy: 1.084349727100603
Energy: 1.0360722462718572
Energy: 1.033754263898991
Energy: 1.0838015927553362
Energy: 1.0655655677232987
Energy: 0.9830174277449228
Energy: 0.6842722159822182
Energy: 0.7197811221878754
Energy: 0.7608844593557751
Energy: 0.6843750396862353
Energy: 0.712787823599548
Energy: 0.6983411241174616
Energy: 0.7592873897353065
Energy: 0.8544083424906657
Energy: 0.7457272403760083
Energy: 0.7599704180105309
Energy: 0.8682153178509903
Energy: 0.7603544480026708
Energy: 0.8573291341066519
Energy: 0.6173056229425383
Energy: 0.6437533359201194
Energy: 0.8572779866220664
Energy: 0.5948365567598678
Energy: 0.6374725103866171
Energy: 1.1669665818205412
Energy: 0.5901161868849802
Energy: 0.5607289516070129
Energy: 1.0608019016509334
Energy: 0.896148445259815
Energy: 0.5576943339703833

minimum gb energy = 0.5576943339703833 eV
minimum distance =  2.39350811937645 Angstroms
sigma value = 33


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

Energy: 0.8107661906344226
Energy: 1.106689515921445
Energy: 1.1063643045881855
Energy: 0.8127161590349665
Energy: 1.417679212229886
Energy: 1.1053032062356576
Energy: 1.045401994318357
Energy: 0.6529757198946089
Energy: 0.6876897670176012
Energy: 0.6772353766953328
Energy: 0.6549020345125615
Energy: 0.633147476012104
Energy: 0.7094404953141346
Energy: 0.6930078302441998
Energy: 0.6929419718423009
Energy: 0.7105124561665008
Energy: 0.692294966312499
Energy: 0.6941784978901926
Energy: 0.7090623076932155
Energy: 0.712784528791726
Energy: 0.6424124748785903
Energy: 0.7100345116165862
Energy: 0.6678149476593925
Energy: 0.6925201336759752
Energy: 0.7082122403512094
Energy: 0.9491049618495478
Energy: 0.6939882629586978
Energy: 0.7050573495322324
Energy: 1.0369904214027255
Energy: 0.6841228444370164
Energy: 0.7646801258158635
Energy: 0.9475461185630442
Energy: 0.935835665027136
Energy: 0.7647981005578354
Energy: 1.1324618993625775
Energy: 0.9357149470795387
Energy: 0.9531377587754445
Energy: 0.7103183603831553
Energy: 0.7546701877888812
Energy: 0.666692924386248
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Energy: 0.7995382195361802
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Energy: 0.6666358668338234
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Energy: 0.7580086625326313
Energy: 0.8420139760678462
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Energy: 1.4679488070501836
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Energy: 0.9137547395243497
Energy: 1.1029297548640533
Energy: 1.1012059228225464
Energy: 0.9137794740302762
Energy: 1.1027605051158103

minimum gb energy = 0.6110505822293512 eV
minimum distance =  2.3974117164153 Angstroms
sigma value = 67


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

Energy: 0.9853513830080985
Energy: 0.6783218403576738
Energy: 0.6756431541515696
Energy: 0.9875270038084584
Energy: 0.7297336413248201
Energy: 0.6754685787980775
Energy: 0.9820873007205557
Energy: 0.7592695186160937
Energy: 0.7036348503637688
Energy: 0.9004514221400218
Energy: 0.7592803848361845
Energy: 0.7036544177198994
Energy: 0.8108003774185417
Energy: 0.6609844698239337
Energy: 0.6921110410826294
Energy: 0.8109459887122034
Energy: 0.6608430030037142
Energy: 0.6942282197031175
Energy: 0.7440602663716754
Energy: 0.6920080755081819
Energy: 0.6907235702083107
Energy: 0.7442694855205139
Energy: 0.6871465346930212
Energy: 0.6868853175510358
Energy: 0.7246135932610993
Energy: 0.6882689164804346
Energy: 0.6882449344463715
Energy: 0.7248894308441338
Energy: 0.6792420195187248
Energy: 0.7256078337854701
Energy: 0.7257567577460123
Energy: 0.8275350188977442
Energy: 0.7258713392406243
Energy: 0.7257716347419886
Energy: 0.8294196048508188
Energy: 0.7258230555189139
Energy: 0.8185937912866154
Energy: 0.721035016012078
Energy: 0.6791998731591056
Energy: 0.8158263250972422
Energy: 0.7262748308401579
Energy: 0.6784259930654152

minimum gb energy = 0.6608430030037142 eV
minimum distance =  2.42503490674259 Angstroms
sigma value = 3


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

Energy: 1.2894312227648943
Energy: 1.0901014783424663
Energy: 1.0877318199127954
Energy: 1.2522298245182675
Energy: 1.0571710562968974
Energy: 1.1224915491847822
Energy: 1.0932016904454016
Energy: 0.9296211036241357
Energy: 0.8888111392126602
Energy: 0.945875399090268
Energy: 0.9251261893117996
Energy: 0.8605085505826799
Energy: 0.9935985621875141
Energy: 0.9241728182950297
Energy: 0.8598464774558261
Energy: 0.9867755913872104
Energy: 1.0991947552656405
Energy: 0.8875194926489848
Energy: 0.8367819366523287
Energy: 0.8373941437683515
Energy: 0.8777482879356555
Energy: 0.8422694159601698
Energy: 1.0480405071922407
Energy: 0.86260251302674
Energy: 0.8251449626804075
Energy: 0.8810850783627262
Energy: 0.8833009803795119
Energy: 0.8282849062769156
Energy: 0.9887497278964298
Energy: 0.8777051313959632
Energy: 0.9102659974106153
Energy: 0.9853888980941741
Energy: 0.8931388160635763
Energy: 0.9178789990694995
Energy: 0.9232098073161882
Energy: 0.880535051538847
Energy: 0.9816355865767041
Energy: 0.9338866990783822
Energy: 0.9413952244763278
Energy: 0.9728666878083525
Energy: 0.9274984960991904
Energy: 0.8396160545635778
Energy: 1.2083379578066167
Energy: 1.1671321028167567
Energy: 1.0199366598255668
Energy: 1.2099180919247972
Energy: 1.1048042552526762
Energy: 1.0235988426135152
Energy: 0.9551719358934834
Energy: 0.866893866741602
Energy: 0.9377345122109733
Energy: 0.8579885971868747
Energy: 0.9615519851553871
Energy: 0.867167692263395
Energy: 1.1882361018222316
Energy: 0.8689296578138022
Energy: 0.8745669564374395
Energy: 1.2031332085075193
Energy: 1.2462009329303125
Energy: 1.1160311466521329
Energy: 0.9619072269872474
Energy: 0.8812352490321439
Energy: 0.8883481918609341
Energy: 0.9367027912849006
Energy: 0.8295685710076046
Energy: 0.8768865296295604
Energy: 0.9330959915258541
Energy: 0.8916941528523913
Energy: 0.8831555017333553
Energy: 0.896362162748092
Energy: 0.8571915848623285
Energy: 0.8857707030676227
Energy: 0.9958507057134147
Energy: 0.8227564376584304
Energy: 0.8933059900019854
Energy: 0.9797156195922886
Energy: 0.8274328653698395
Energy: 0.8777325472051108
Energy: 0.9460492579828895
Energy: 0.8263834130609575
Energy: 0.8202256304970948
Energy: 0.9481342508716979
Energy: 0.820974489005336
Energy: 0.8370069487406835
Energy: 1.0662691932901416
Energy: 0.8915002029660378
Energy: 0.9412075027016586
Energy: 1.0677301254645504
Energy: 0.9076596821298131
Energy: 0.8789822980714544
Energy: 1.0259984763825278
Energy: 0.8644261430681931
Energy: 0.8565747042984597
Energy: 1.01866932784916
Energy: 0.9063504299565094
Energy: 0.8936276354434303
Energy: 1.1022101463831613
Energy: 0.9966742574248644
Energy: 0.9878181421363633
Energy: 1.0996900817069282
Energy: 1.365722202241836
Energy: 1.1049252752094374
Energy: 1.0168799176106844
Energy: 0.8573497381196439
Energy: 0.8889379596629287
Energy: 1.0220629361632811
Energy: 0.9844962780131089
Energy: 0.9152045254825456
Energy: 1.2506962605854615
Energy: 0.9396671367828711
Energy: 0.895674349443098
Energy: 1.201539377516117
Energy: 0.9485962587035237
Energy: 0.8743547977900429
Energy: 1.1297263551638157
Energy: 0.8902179203612279
Energy: 0.8876472549589766
Energy: 1.0180291909538395
Energy: 0.8997149874848698
Energy: 0.8587007660772584
Energy: 0.920794272478416
Energy: 0.8318438075500652
Energy: 0.8475012532690293
Energy: 0.9723331088290846
Energy: 0.8281892232911399
Energy: 0.8850285892997454
Energy: 0.9605917220150053
Energy: 0.9598909727852651
Energy: 0.8973168649416134
Energy: 0.9583380905831433
Energy: 0.963645788406094
Energy: 0.8982199905231218
Energy: 0.8311733652839588
Energy: 0.8926760692437321
Energy: 0.8674800108946965
Energy: 0.832508876051936
Energy: 0.8473024598664703
Energy: 0.858890149281357
Energy: 1.0281617530372942
Energy: 0.8834627131586448
Energy: 0.8632996802322
Energy: 1.0286537772341748
Energy: 1.1702273274506063
Energy: 1.02477682473356
Energy: 0.9665136453274061
Energy: 1.0029641057029428
Energy: 0.8752486854664401
Energy: 0.9603550990574542
Energy: 0.8596900913629445
Energy: 0.871674033619008
Energy: 1.2555508115086376
Energy: 1.0585622496727347
Energy: 0.9987322400135561
Energy: 1.1672827158357002
Energy: 1.0643736111571964
Energy: 0.997898033673468
Energy: 0.9673622356955383
Energy: 1.0163155916906326
Energy: 1.0002491251787062
Energy: 0.9655111627414698
Energy: 1.030286596208296
Energy: 0.9562777781935801
Energy: 0.965814238357947
Energy: 0.9342327781342501
Energy: 0.880895949072406
Energy: 0.9594517829645164
Energy: 1.023498112859614
Energy: 0.8782935200432374
Energy: 0.8998664273337248
Energy: 0.8681844539113575
Energy: 0.845426997080561
Energy: 0.9007413957427154
Energy: 1.094728811136231
Energy: 0.9167313863157912
Energy: 0.8195883007327012
Energy: 0.8495307392820041
Energy: 0.8228379189545799
Energy: 0.8336657003542005
Energy: 0.9190162154770386
Energy: 0.8328161824563977
Energy: 0.9047881937051714
Energy: 1.0028850806329535
Energy: 0.8758888678384454
Energy: 0.9029034801432636
Energy: 1.0440273072301613
Energy: 0.8875638897484989
Energy: 0.907165165713266
Energy: 0.9690841302376264
Energy: 0.9275088187457676
Energy: 0.906223285473849
Energy: 0.9013881303893172
Energy: 0.8864049892287781
Energy: 1.2080645392204048
Energy: 0.9530795011195428
Energy: 0.941208738628648
Energy: 1.1834928530613291
Energy: 0.9665090168247995
Energy: 0.9159627359738081
Energy: 0.9009451391068144
Energy: 0.9868037939385689
Energy: 0.9574192375727889
Energy: 1.2509857736077532
Energy: 1.0539061455775989
Energy: 0.9487626182870067
Energy: 0.8937856341529359
Energy: 0.9272885727370429
Energy: 0.901738934027492
Energy: 0.9103974483535431
Energy: 0.9190445747105452
Energy: 0.8967783575351644
Energy: 1.137684411499652
Energy: 0.8649722443781493
Energy: 0.8604218628734688
Energy: 1.1265948376869823
Energy: 1.2462817965467026
Energy: 1.1160004597762132
Energy: 0.9209048116226707
Energy: 0.8757968531123534
Energy: 0.8968064223073009
Energy: 0.914782208308687
Energy: 0.8762611292158129
Energy: 0.8870021800626449
Energy: 0.9997419900793827
Energy: 0.8260653429495399
Energy: 0.9292383831586041
Energy: 1.0007078126147007
Energy: 0.9057742381532033
Energy: 0.9208373901520316
Energy: 0.9484395142686781
Energy: 0.8144936370666764
Energy: 0.8133242648501238
Energy: 0.929478021063319
Energy: 0.8177419460356784
Energy: 0.8409078034222168
Energy: 1.06414411220304
Energy: 0.8740703324869104
Energy: 0.8911634772715636
Energy: 1.0661114874589548
Energy: 0.8796502102066338
Energy: 0.8834277979249052
Energy: 1.0256394781699438
Energy: 0.9429854808538615
Energy: 0.8670462800091461
Energy: 1.0182053252659764
Energy: 0.9009764987294397
Energy: 0.8677398870615587
Energy: 1.0257288780436828
Energy: 0.896689029397751
Energy: 0.9130833663946718
Energy: 1.0194457692072012
Energy: 1.0742346805525829
Energy: 1.026365097866698
Energy: 1.105373894760924
Energy: 0.9223600349913292
Energy: 0.9146380758525063
Energy: 1.120333722244999
Energy: 1.1900278416400345
Energy: 1.0349314192051964
Energy: 0.9480487378801844
Energy: 0.9070126152903327
Energy: 0.8747974081570178
Energy: 0.957053249377099
Energy: 1.01753621337254
Energy: 0.8574756803717813
Energy: 1.1342192057579867
Energy: 1.0101106942285758
Energy: 0.9077784291403166
Energy: 1.1358395836198076
Energy: 0.9957500073139245
Energy: 0.876595965858963
Energy: 0.8470391656670058
Energy: 0.8327768625612493
Energy: 0.8413813921525948
Energy: 0.8445601582837078
Energy: 0.8270649540999028
Energy: 0.8141253540211922
Energy: 0.9611538548913783
Energy: 0.9457270513486712
Energy: 0.8988849979832385
Energy: 0.970307673633278
Energy: 0.9486094219049199
Energy: 0.8995511445416857
Energy: 0.829584127914338
Energy: 0.8934432180473202
Energy: 0.8920676447732825
Energy: 0.8318007431659583
Energy: 0.8617825839569799
Energy: 0.8977515174302048
Energy: 0.9096713092684502
Energy: 0.8499087446261478
Energy: 0.8984310062984978
Energy: 0.912967754861675
Energy: 1.1336270761564151
Energy: 0.9186182297916651
Energy: 1.0704750862941763
Energy: 0.9314478595124069
Energy: 0.849667473355
Energy: 1.0938551372508762
Energy: 0.9272015740227662
Energy: 0.9276933503767226
Energy: 1.0928715512071803
Energy: 0.8765902143630977
Energy: 0.7790637724032435
Energy: 0.9325790415224388
Energy: 0.9514155114874474
Energy: 0.8564822419283532

minimum gb energy = 0.7790637724032435 eV
minimum distance =  2.35620578567324 Angstroms
sigma value = 81


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

Energy: 1.32809590737768
Energy: 0.9171148917838755
Energy: 0.8688624826723068
Energy: 1.2788891091651537
Energy: 0.9606037312733611
Energy: 0.9155069599081465
Energy: 0.7537680169534553
Energy: 0.8187570805011589
Energy: 0.8130243920241572
Energy: 0.8046895893171742
Energy: 0.8185296438882335
Energy: 0.8100354234936168
Energy: 0.965974668570575
Energy: 0.8476104214322797
Energy: 0.8412368016751032
Energy: 0.9437388125426589
Energy: 0.9249402849173377
Energy: 0.9121839836826797
Energy: 0.8172576943871929
Energy: 0.8408023439578656
Energy: 0.8798641759871372
Energy: 0.8202143404257423
Energy: 0.7535003351128388
Energy: 0.813962038221075
Energy: 0.8254015608808919
Energy: 0.854737932639277
Energy: 0.8598478338698314
Energy: 0.8284270210585052
Energy: 0.8298607186583158
Energy: 0.8563801852967128
Energy: 0.9455481126052215
Energy: 0.9014499536020775
Energy: 0.8944863594416318
Energy: 0.9410559732367761
Energy: 0.8965882683510005
Energy: 0.8903931572088707
Energy: 1.0051328524816059
Energy: 0.8111670735366312
Energy: 0.7931218966489961
Energy: 1.0022744002634163
Energy: 0.8114143450402743
Energy: 0.8621119919110114
Energy: 1.1270308821934598
Energy: 1.013066218688619
Energy: 0.9655276188441823
Energy: 1.127816790493543
Energy: 0.9982581190066593
Energy: 0.8486590823588589
Energy: 1.0334286700364015
Energy: 0.8281380782232307
Energy: 0.8785461557917428
Energy: 1.028225203227252
Energy: 0.8191210628291187
Energy: 0.8973375713378469
Energy: 0.9372430854943963
Energy: 0.8537407882400638
Energy: 0.849302660904742
Energy: 0.9035139547719884
Energy: 1.0914481359943584
Energy: 0.831397466983092
Energy: 0.8608228051957956
Energy: 0.8098263749779744
Energy: 0.8098668719704499
Energy: 0.8552126372161054
Energy: 0.7092074088196179
Energy: 0.8483164889417818
Energy: 0.7546834781469209
Energy: 0.9121794725560592
Energy: 0.9076020028236021
Energy: 0.7555199710759762
Energy: 0.9400265701010584
Energy: 0.9093842336314464
Energy: 0.9253892514683246
Energy: 0.861091384577173
Energy: 0.9199345057685951
Energy: 0.92699785456119
Energy: 0.8609848837439616
Energy: 0.8448345501304599
Energy: 0.794748121980845
Energy: 0.8287015001784066
Energy: 0.8586622035049788
Energy: 0.8050122826913245
Energy: 0.8297068340745444
Energy: 0.8514480613726124
Energy: 1.1499133900207477
Energy: 0.9488164681688375
Energy: 0.8922846141158628
Energy: 1.146516883612742
Energy: 0.944592610055111
Energy: 0.8983959822231198
Energy: 0.7946945347846366
Energy: 0.8675800656356043
Energy: 0.8646285589768988
Energy: 0.7956244000268439
Energy: 0.9839645099236928
Energy: 0.8680103286073753
Energy: 1.027675890533273
Energy: 0.8009390330680473
Energy: 0.7995621611124634
Energy: 1.0238412824920338
Energy: 1.1285785106288435
Energy: 0.7906543610598198
Energy: 0.8960716617305476
Energy: 0.9020773168769443
Energy: 0.8890654365810161
Energy: 0.9139116061109824
Energy: 0.9100753211148774
Energy: 0.9090187860799928
Energy: 0.7087145871665118
Energy: 0.9204020015198963
Energy: 0.8050637861828109
Energy: 0.8038225346530354
Energy: 0.8790604284196623
Energy: 0.8307196245664732
Energy: 0.9600002203070644
Energy: 0.8738947840584459
Energy: 0.8098607298882647
Energy: 0.7999379058431962
Energy: 0.8814084104550378
Energy: 0.8139985857143328
Energy: 0.8961626570629572
Energy: 0.8654649282811678
Energy: 0.8552652221062462
Energy: 0.9113552577822971
Energy: 0.8353162057778891
Energy: 0.8930033607609111
Energy: 0.9586053780888193
Energy: 0.8469172285724371
Energy: 0.8466531967906301
Energy: 0.959942584868387
Energy: 0.9248203388979518
Energy: 0.8913845240897942
Energy: 0.8482450482494818
Energy: 0.8736154319240769
Energy: 0.8552356878885747
Energy: 0.8413807702667668
Energy: 0.8026831066341062
Energy: 0.8498668692828264
Energy: 0.8908026458355263
Energy: 0.9229648521301642
Energy: 0.8935662810972949
Energy: 0.8882148542655004
Energy: 1.1626717981084926
Energy: 0.8940448203174625
Energy: 0.9734679945933087
Energy: 0.8533630941649482
Energy: 0.8614630930794223
Energy: 0.9839310711539565
Energy: 0.7966791097113434
Energy: 0.850917368955989
Energy: 1.1281026335351727
Energy: 1.0001261811404123
Energy: 0.9995443609118977
Energy: 1.129086981907299
Energy: 1.0390593945562085
Energy: 0.9058016376342032
Energy: 1.137972124898265
Energy: 0.8415322815101248
Energy: 0.8255733876348803
Energy: 1.0549913737525978
Energy: 0.8574084695829287
Energy: 0.9186144792089601
Energy: 1.0008044454605518
Energy: 0.8128919767628379
Energy: 0.8961517790201803
Energy: 0.995179354406993
Energy: 0.7090707424529763
Energy: 0.8490402417692421
Energy: 0.8609725406456381
Energy: 0.8535620181594671
Energy: 0.8536140391952779
Energy: 0.8323558552902979
Energy: 1.0933897539772433
Energy: 0.8493309798862816
Energy: 0.8942937501509457
Energy: 0.8816074722388343
Energy: 0.8395432383608846
Energy: 0.8891741079769738
Energy: 0.8249690335666054
Energy: 0.9036954319627009
Energy: 0.9279430880665049
Energy: 0.9356744575739446
Energy: 0.9249407396428415
Energy: 0.9291276797439935
Energy: 0.969466255009049
Energy: 0.8472798123738258
Energy: 0.8091689147946092
Energy: 0.8514275577658384
Energy: 0.8080484030379115
Energy: 0.8214191656537913
Energy: 0.8521968703684955
Energy: 0.8510217401684063
Energy: 0.8595018392126544
Energy: 0.8590578369258043
Energy: 0.8605243707738229
Energy: 0.8936982564715602
Energy: 0.8274873129385056
Energy: 0.8526204939585128
Energy: 0.7900557744967477
Energy: 0.8561468097746917
Energy: 0.8999036533395882
Energy: 0.7926126087539982
Energy: 1.0043435107084677
Energy: 0.8936004551766121
Energy: 0.821293823680796
Energy: 0.8405264933078193
Energy: 0.8788402342757287
Energy: 0.8234898580547804
Energy: 0.7798897443732365
Energy: 0.8125473432492099
Energy: 1.051157529379027
Energy: 0.886215482708559
Energy: 0.7920950078988966
Energy: 1.0238158599402105
Energy: 1.1258596173669067
Energy: 1.0124485307353726
Energy: 0.957429441895195
Energy: 0.8160970229830343
Energy: 0.8220282656847668
Energy: 0.7758782349731208
Energy: 0.960689108936892
Energy: 0.8077847995630617
Energy: 1.328896308365143
Energy: 0.8848663942322298
Energy: 0.8754215975909081
Energy: 1.2798746885965253
Energy: 0.8846313042539876
Energy: 0.9225789869937147

minimum gb energy = 0.7087145871665118 eV
minimum distance =  2.38202405127516 Angstroms
sigma value = 43


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

Energy: 1.3630081202311026
Energy: 1.0458831566309932
Energy: 0.9613373540605819
Energy: 1.3648838868680826
Energy: 0.9911374343987935
Energy: 0.8564290192320005
Energy: 0.8321067280816434
Energy: 0.8244463874409059
Energy: 0.8670101150685787
Energy: 0.9167167073681391
Energy: 0.8244269738676024
Energy: 0.8872396134532717
Energy: 0.937153031128271
Energy: 0.8139822475197511
Energy: 0.8137801331979888
Energy: 0.937043650035558
Energy: 0.8559614193127237
Energy: 0.8773781414241341
Energy: 0.8064132602334495
Energy: 0.7800421638212819
Energy: 0.7873175678611071
Energy: 0.8061951474166622
Energy: 0.9347672653160716
Energy: 0.7906320480190967
Energy: 0.7713042664574551
Energy: 0.8259782760653303
Energy: 0.8378087060933813
Energy: 0.7627278340781328
Energy: 0.8028101309215535
Energy: 0.8377026919309469
Energy: 0.9296978833288145
Energy: 0.8020369786007573
Energy: 0.8377791024694672
Energy: 0.9297556170110334
Energy: 0.7672814402497568
Energy: 0.8377110170106785
Energy: 0.7517628363276284
Energy: 0.8154622728214853
Energy: 0.8154306780243835
Energy: 0.7521461331736595
Energy: 0.8155100192298858
Energy: 0.8105696232807876
Energy: 1.148707184875541
Energy: 0.8326849513318885
Energy: 0.8918538878933487
Energy: 1.1494310812618929
Energy: 0.8283051070599454
Energy: 0.8388856768681994
Energy: 0.8253425544103884
Energy: 0.812071974303194
Energy: 0.8129098789797607
Energy: 0.8240607702886109
Energy: 1.0697084704106206
Energy: 0.8137248702797054
Energy: 1.121887592420888
Energy: 0.9608623366123658
Energy: 0.9038345685933663
Energy: 1.1332489314857304
Energy: 0.9923910726902376
Energy: 0.9038155666077023
Energy: 1.005799236840784
Energy: 0.9672292217575613
Energy: 0.9052889147861812
Energy: 1.0057916704780967
Energy: 0.809549861238342
Energy: 0.9351272276518136
Energy: 1.0096683132642024
Energy: 0.8609182485878528
Energy: 0.8382074372069004
Energy: 0.7413228032003252
Energy: 1.0539585393837723
Energy: 0.8630903872074647
Energy: 1.1610596849121557
Energy: 0.9000569391726524
Energy: 0.8617022583238086
Energy: 0.8382913225675345
Energy: 0.8998770825145687
Energy: 0.8617764876153585
Energy: 0.9538362371045195
Energy: 0.8292848635296283
Energy: 0.8404263881096483
Energy: 0.7607782726066996
Energy: 0.8459997371818283
Energy: 0.846099521089993
Energy: 0.8934485693019314
Energy: 0.8966047892167918
Energy: 0.8538732806698867
Energy: 0.8936738007741818
Energy: 0.9998436660026532
Energy: 0.8535097801824204
Energy: 0.7917607210616858
Energy: 0.8487131065107277
Energy: 0.8074487826649587
Energy: 0.7921543969712456
Energy: 0.8147604122878506
Energy: 0.7591672137836414
Energy: 0.7706196566027513
Energy: 0.8483462963776118
Energy: 0.8490549541341568
Energy: 0.770908261264151
Energy: 0.9976268496782583
Energy: 0.8488495905925197
Energy: 0.8954253110771404
Energy: 0.8732591625485496
Energy: 0.7963654843364334
Energy: 0.9949055012527395
Energy: 0.9089966279135356
Energy: 0.8430330519251615
Energy: 1.1298526050547184
Energy: 1.0076548712113313
Energy: 0.8489016130601297
Energy: 1.0014454655415066
Energy: 1.007554340011678
Energy: 0.8045960076651418
Energy: 0.9660167310633986
Energy: 1.0295172344942296
Energy: 0.9092127836430066
Energy: 0.8679105946906963
Energy: 1.0561796071378702
Energy: 0.8746814513263758
Energy: 1.0165067682204079
Energy: 0.9294107916777036
Energy: 0.8471247356696759
Energy: 1.0176372383017973
Energy: 0.9066632344320851
Energy: 0.8188176013906004
Energy: 1.0066147899994509
Energy: 0.8633576512846793
Energy: 0.8632551124217303
Energy: 1.0067051645028013
Energy: 1.2182703155214991
Energy: 0.8635818762533648
Energy: 0.9076376138903535
Energy: 0.7745238740970946
Energy: 0.8455236156793298
Energy: 0.9080553686838503
Energy: 0.8856149554370419
Energy: 0.8461424966011303
Energy: 1.0828156155819015
Energy: 0.9927626627817223
Energy: 0.8701084676604224
Energy: 1.060923027835296
Energy: 0.9791886884312668
Energy: 0.7900430216684504
Energy: 0.9175546047935375
Energy: 0.7719607599493379
Energy: 0.7695281861333397
Energy: 0.9177397809161635
Energy: 0.772346796895493
Energy: 0.795713848355216
Energy: 0.9259423170198925
Energy: 0.7510778882353888
Energy: 0.8177952300140029
Energy: 0.8542129940898651
Energy: 0.7513779864945898
Energy: 0.8397011312994634
Energy: 0.8381847829504189
Energy: 0.8369134658261452
Energy: 0.8503375037195731
Energy: 0.8382223277786441
Energy: 0.9419988233588564
Energy: 0.846555396732001
Energy: 0.8617757815894366
Energy: 0.8336393992946086
Energy: 0.7991411021014703
Energy: 0.8623338219366146
Energy: 0.8237935744268338
Energy: 0.8027038469421376
Energy: 1.009285973295661
Energy: 0.8394457218212571
Energy: 0.8402243999784875
Energy: 1.0058686533497891
Energy: 1.1486955629099824
Energy: 0.8388386465644667
Energy: 1.0264542166192228
Energy: 0.8242118916893598
Energy: 0.8475528291171959
Energy: 1.0266387449914882
Energy: 0.7614251145964538
Energy: 0.8122153015181377
Energy: 1.3544418324363823
Energy: 1.1119176856044182
Energy: 0.9436083956909316
Energy: 1.3548786731004372
Energy: 1.1130084079037017
Energy: 0.9437028870354001

minimum gb energy = 0.7413228032003252 eV
minimum distance =  2.33087566125235 Angstroms
sigma value = 57


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

Energy: 1.1127647952172783
Energy: 0.8763225845593773
Energy: 0.876327473073933
Energy: 1.1145056866178884
Energy: 1.1693444250128686
Energy: 0.8767488043937016
Energy: 0.7277170799639376
Energy: 0.7925585427987285
Energy: 0.830846105643961
Energy: 0.792149002576604
Energy: 0.7925431502497565
Energy: 0.8297043298234501
Energy: 0.9763645170912006
Energy: 0.8388033964805313
Energy: 0.7305739683778409
Energy: 0.9766916260616284
Energy: 0.839240152876385
Energy: 0.7707163001706951
Energy: 0.7946122653658423
Energy: 0.8240851147094166
Energy: 0.7921549446867115
Energy: 0.7920073959602124
Energy: 0.8139956682458817
Energy: 0.7915763059512481
Energy: 0.84994355562589
Energy: 0.8097553457034576
Energy: 0.8085410027986456
Energy: 0.8502822303249469
Energy: 0.8066884021814046
Energy: 0.7838266837525956
Energy: 0.9382124708118039
Energy: 0.8333892623519952
Energy: 0.806418309647401
Energy: 0.989527769898253
Energy: 0.7789091408079667
Energy: 0.8061718366455531
Energy: 0.8427138785715016
Energy: 0.7899286734232991
Energy: 0.7899655112861935
Energy: 0.8411970614441936
Energy: 0.7929794037547648
Energy: 0.7899552193339158
Energy: 1.0256155976509593
Energy: 0.7897369102513547
Energy: 0.8985259949045363
Energy: 1.026695364257393
Energy: 0.9075694114546475
Energy: 0.8293344406983523
Energy: 0.8412628034620833
Energy: 0.8302472502450016
Energy: 0.8297713892359633
Energy: 0.841157198021778
Energy: 0.9178642525312372
Energy: 0.8301041659690382
Energy: 1.1315910289918922
Energy: 0.8281716818443857
Energy: 0.8280594850841915
Energy: 1.131526822403347
Energy: 1.143977951988015
Energy: 0.7973089408875704
Energy: 0.9179012234461552
Energy: 0.7861265937611935
Energy: 0.8325172087958603
Energy: 0.9181268529775564
Energy: 0.7720802566780834
Energy: 0.8306370136568358
Energy: 0.7290147704274098
Energy: 0.9175451929741882
Energy: 0.8320384983804064
Energy: 0.7304410172944913
Energy: 0.9175109335102821
Energy: 0.843330889778466
Energy: 0.7317445159546044
Energy: 0.7880655985508942
Energy: 0.8439233582377468
Energy: 0.729046550539531
Energy: 0.7926652636135755
Energy: 0.8442318035402335
Energy: 0.9174614757277186
Energy: 0.7917191189891208
Energy: 0.8234111186035594
Energy: 0.9174230050595279
Energy: 0.7928203875579087
Energy: 0.8299141458597559
Energy: 0.9188005815770133
Energy: 0.8025921698071107
Energy: 0.8287179385100202
Energy: 0.9186987712171437
Energy: 1.0571665047956593
Energy: 0.8280265286790339
Energy: 0.7644767030416465
Energy: 0.7797421165010596
Energy: 0.7797092577373015
Energy: 0.7654848776777052
Energy: 0.8381445806740847
Energy: 0.7893735330737411
Energy: 0.839609895473809
Energy: 0.8247260824726697
Energy: 0.8246052580627597
Energy: 0.7673059412570844
Energy: 0.9994029474905373
Energy: 0.8239019051752261
Energy: 0.8404655859244139
Energy: 0.7858339591007097
Energy: 0.8484796868292029
Energy: 0.8433546555812402
Energy: 0.7652559977214577
Energy: 0.82418636701313
Energy: 0.8427264140337515
Energy: 0.7869918094770352
Energy: 0.8513515103967876
Energy: 0.8428377341616463
Energy: 0.7870053431723267
Energy: 0.828451892187686
Energy: 0.8427100892576488
Energy: 0.9652839911904001
Energy: 0.8462992110964859
Energy: 0.772336776163206
Energy: 1.0122780808041318
Energy: 0.8466339579198349
Energy: 0.7712795752387231
Energy: 0.8323419368824541
Energy: 0.83251201350709
Energy: 0.771557361232356
Energy: 0.7930662028550547
Energy: 0.838132528097536
Energy: 1.1959834487385008
Energy: 0.8278593278840956
Energy: 0.856874441452295
Energy: 1.1963453977328917
Energy: 1.2362337850443914
Energy: 0.8568806996779226
Energy: 0.9172990833779333
Energy: 0.7917610639168917
Energy: 0.8322633459507746
Energy: 0.917311522499932
Energy: 0.9177339573821289
Energy: 0.8307093517083075
Energy: 0.7321415114567156
Energy: 0.9601431306298353
Energy: 0.8440362071318044
Energy: 0.8113012375953673
Energy: 0.9174877114160477
Energy: 0.8442892481202067

minimum gb energy = 0.7277170799639376 eV
minimum distance =  2.40101380365895 Angstroms
sigma value = 17


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

Energy: 1.2055370951585007
Energy: 0.8838331649034413
Energy: 0.8841849272794832
Energy: 1.2075815903053093
Energy: 1.0607864921080203
Energy: 0.744507343080494
Energy: 0.7428507427338603
Energy: 0.7983622714149562
Energy: 0.8222714993742268
Energy: 0.8978684498645043
Energy: 0.8082641280341227
Energy: 0.7629729694068588
Energy: 0.9831440387053677
Energy: 0.8031354997562382
Energy: 0.7609742966972622
Energy: 0.9844323884493101
Energy: 0.8033518693446722
Energy: 0.7152952709207987
Energy: 0.8136068162571928
Energy: 0.8030267910706843
Energy: 0.7589708744922985
Energy: 0.8136594585291183
Energy: 0.681421063916409
Energy: 0.8135505846781751
Energy: 0.8146920138504327
Energy: 0.7521071395784811
Energy: 0.7520028080955106
Energy: 0.8139869469349854
Energy: 0.8330261817337781
Energy: 0.7395906973565696
Energy: 1.025658316632051
Energy: 0.6955951432406823
Energy: 0.7553061413351201
Energy: 1.0354852265084789
Energy: 0.6953363160844592
Energy: 0.6736352806379298
Energy: 0.7578190442915925
Energy: 0.6919365052537306
Energy: 0.69195200382582
Energy: 0.7583135004060665
Energy: 0.6956543386639086
Energy: 0.7085418942449577
Energy: 0.9801789204847223
Energy: 0.7175969682248267
Energy: 0.7795298778266492
Energy: 0.981791542110228
Energy: 0.8437989807093216
Energy: 0.7799392347349253
Energy: 0.6943161461392436
Energy: 0.7195186922004942
Energy: 0.7660501495312816
Energy: 0.6956754517436313
Energy: 0.7476289641314944
Energy: 0.6920898191179717
Energy: 0.6949618029817096
Energy: 0.7196784015197004
Energy: 0.7195790555279896
Energy: 0.6949336102239472
Energy: 0.7195089930779709
Energy: 0.7197847115473789
Energy: 0.9282381141027932
Energy: 0.7396167630965006
Energy: 0.7523847089324922
Energy: 0.9253351008952325
Energy: 0.8670143099605133
Energy: 0.7527533575476351
Energy: 0.8496235801452879
Energy: 0.7816233840513421
Energy: 0.7815695236889124
Energy: 0.8441942885493567
Energy: 0.7826845066473641
Energy: 0.7815909758975087
Energy: 0.8548749741933283
Energy: 0.9034695017978801
Energy: 0.8052152891963572
Energy: 0.7655554778144866
Energy: 0.9714560533088347
Energy: 0.807291084991327
Energy: 0.8367623158210692
Energy: 0.8107452464003029
Energy: 0.8119519255498462
Energy: 0.8363641840009884
Energy: 0.8982669850107395
Energy: 0.8399190562869171
Energy: 1.061824861341382
Energy: 0.8949973253329507
Energy: 0.7829196251531572
Energy: 1.0620791455835215
Energy: 0.7829551377269698
Energy: 0.7844552694918921
Energy: 1.02176482459059
Energy: 0.8071746545052192
Energy: 0.7791749630699424
Energy: 1.023133166471476
Energy: 0.8078925574070019
Energy: 0.8050397182442954
Energy: 0.9690758701925325
Energy: 0.8848927915159249
Energy: 0.8508982785194121
Energy: 0.9261532725146601
Energy: 0.8857517038701177
Energy: 0.8509795233288882

minimum gb energy = 0.6736352806379298 eV
minimum distance =  2.38033776454017 Angstroms
sigma value = 17


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

Energy: 1.2505726156565837
Energy: 0.8502489200382888
Energy: 0.7193879029444296
Energy: 1.252740755534002
Energy: 0.9842392918208138
Energy: 0.7819881111557623
Energy: 0.9848709020889127
Energy: 0.8412041431362861
Energy: 0.7974966926522831
Energy: 0.957740160137476
Energy: 0.8910481643124396
Energy: 0.8159201175002258
Energy: 0.9176958230645027
Energy: 0.7111839501351586
Energy: 0.7572102559616612
Energy: 0.9186480675146133
Energy: 0.7979450035333885
Energy: 0.72660026020384
Energy: 0.7876642424194646
Energy: 0.7577618258719876
Energy: 0.7262168870672344
Energy: 0.7873100216590055
Energy: 0.6385253374965362
Energy: 0.6931721548109738
Energy: 0.783631638503297
Energy: 0.6971551261926344
Energy: 0.7271937649669264
Energy: 0.7838845266319844
Energy: 0.891423236399433
Energy: 0.7191223150723093
Energy: 1.0951854755025632
Energy: 0.664984297992796
Energy: 0.6755400070940634
Energy: 1.0980840540038848
Energy: 0.6647417757410709
Energy: 0.7111219455752688
Energy: 0.676789669113786
Energy: 0.7059054592305458
Energy: 0.6633582966284246
Energy: 0.6766919177396142
Energy: 0.6660338158439185
Energy: 0.6738361362371663
Energy: 0.901907912007514
Energy: 0.6525607979265567
Energy: 0.686864357323639
Energy: 0.7689752437962377
Energy: 0.6484129809057246
Energy: 0.7083740318342647
Energy: 0.6247509550504269
Energy: 0.7077583020768196
Energy: 0.686342754483177
Energy: 0.6259055396408146
Energy: 0.7811438872555287
Energy: 0.6246734760861725
Energy: 0.6297517239877058
Energy: 0.6870158666505463
Energy: 0.6894141464084695
Energy: 0.626197146626034
Energy: 0.6810892334913687
Energy: 0.7082786246278676
Energy: 0.8198777331141569
Energy: 0.6267980667309004
Energy: 0.7250803907660177
Energy: 0.7966128989740167
Energy: 0.6265706745782371
Energy: 0.6579973806715884
Energy: 0.8171596536333495
Energy: 0.6247602259067041
Energy: 0.6246820241951514
Energy: 0.8183806006433226
Energy: 0.6285417468388259
Energy: 0.686129999247825
Energy: 0.7227744505139614
Energy: 0.6578721450502252
Energy: 0.6851282083076663
Energy: 0.6811560969807595
Energy: 0.8983150010468914
Energy: 0.6858486931216556
Energy: 0.6642164323572305
Energy: 0.6752521609848928
Energy: 0.665776293972187
Energy: 0.663959465613146
Energy: 0.6797653601529428
Energy: 0.6639813106671058
Energy: 0.6646923094262659
Energy: 0.7246168226418742
Energy: 0.7604104171254819
Energy: 0.6648634737319836
Energy: 0.9345133619458736
Energy: 0.7357474005223704
Energy: 0.8777599692960337
Energy: 0.8246648879109189
Energy: 0.7075102483146628
Energy: 0.7917263849287394
Energy: 0.8245237120349318
Energy: 0.7283653087684923
Energy: 0.6761297990414098
Energy: 0.7583747524229196
Energy: 0.7582307839493204
Energy: 0.6769024457053742
Energy: 0.7582969749551264
Energy: 0.6970041754832682
Energy: 0.6765440885553071
Energy: 0.823636998179681
Energy: 0.7905538119606373
Energy: 0.6771625477961686
Energy: 0.9235916977871368
Energy: 0.7051114672282316
Energy: 0.9137170907539803
Energy: 0.7586022267187744
Energy: 0.7062034100557449
Energy: 0.9138313979211059
Energy: 0.8147561742013271
Energy: 0.7989861178118792
Energy: 1.0488910069344715
Energy: 0.7859960664528589
Energy: 0.755412368194504
Energy: 1.048908522980362
Energy: 0.9502874373580524
Energy: 0.8421099829550759
Energy: 0.9577193658362462
Energy: 0.8901698704678385
Energy: 0.7731924816264153
Energy: 0.9589332505199527
Energy: 0.9572783151731453
Energy: 0.7741532844044674
Energy: 0.8605819666531282
Energy: 0.8370205938606049
Energy: 0.8211363854146505
Energy: 0.825072506260937
Energy: 0.9146902681143176
Energy: 0.726942027928213
Energy: 0.7423482155698846
Energy: 0.7871079547785033
Energy: 0.7743956932475345
Energy: 0.7421819544386354
Energy: 0.8074318426542015
Energy: 0.8207378982534135
Energy: 0.9338122150603075
Energy: 0.8696113661929925
Energy: 0.7909370291557092
Energy: 0.9326595010819502
Energy: 0.6342812011357373
Energy: 0.7910606960006665
Energy: 0.7574647897498263
Energy: 0.7111694646976164
Energy: 0.757335355630309
Energy: 0.7577260560244049
Energy: 0.7115929788416071
Energy: 0.7266954331944049
Energy: 0.7827747467616893
Energy: 0.6968532751314875
Energy: 0.6959103467064475
Energy: 0.7838642676463141
Energy: 0.809104934571363
Energy: 0.7821557905778784
Energy: 1.0970757280198322
Energy: 0.717865319701659
Energy: 0.7352184925462736
Energy: 0.7117313161403416
Energy: 0.8618242952472324
Energy: 0.711093408439538
Energy: 0.9000812889348568
Energy: 0.6635783545324266
Energy: 0.6638830578484536
Energy: 0.7869517538635304
Energy: 0.6654127622485744
Energy: 0.6639974542950736
Energy: 0.8866613767572646
Energy: 0.7163044746473133
Energy: 0.7144265340866377
Energy: 0.8875606168066557
Energy: 0.705707298384988
Energy: 0.6789398372803861
Energy: 0.6271404028172061
Energy: 0.7023576045435225
Energy: 0.7077083878108872
Energy: 0.6271905003859515
Energy: 0.7022959952664826
Energy: 0.7413349413139351
Energy: 0.6302046141171027
Energy: 0.6851898836814809
Energy: 0.6974223926453936
Energy: 0.6312602115678273
Energy: 0.7326930089481306
Energy: 0.647207195009339
Energy: 0.9458914207277609
Energy: 0.7097601835256517
Energy: 0.6557173754431481
Energy: 0.9457944956291133
Energy: 0.6264151302927592
Energy: 0.6551102984050594
Energy: 0.7808036429665836
Energy: 0.6291843966619003
Energy: 0.6246220444477224
Energy: 0.7814693455306331
Energy: 0.6251012160960272
Energy: 0.6244390027915285
Energy: 1.0392970723752626
Energy: 0.6501054924701181
Energy: 0.6825005621312786
Energy: 1.041375738395858
Energy: 0.6272378397584667
Energy: 0.7400125588124512
Energy: 0.6698303862098401
Energy: 0.6754540032581359
Energy: 0.674787711532932
Energy: 0.6703008928617011
Energy: 0.6775134733936519
Energy: 0.6756937306814589
Energy: 0.671218945255043
Energy: 0.7071424247009588
Energy: 0.7352313999032183
Energy: 0.6638239761951532
Energy: 0.7068443922908847
Energy: 0.6644643778908732
Energy: 0.8878400006865501
Energy: 0.7209818578396989
Energy: 0.7203843791342729
Energy: 0.889198926049474
Energy: 0.7167570111861382
Energy: 0.7257185074969498
Energy: 0.6784141308458959
Energy: 0.7578197901098165
Energy: 0.7833068497462727
Energy: 0.6709088372371345
Energy: 0.759386283131726
Energy: 0.7573683850312631
Energy: 1.1743009480324669
Energy: 0.859656445425688
Energy: 0.7582669439565605
Energy: 0.9459938317292877
Energy: 0.9224008882291024
Energy: 0.7879148832154204
Energy: 0.9151587965043141
Energy: 0.7803593840731281
Energy: 0.7743574319214697
Energy: 0.9163835754119893
Energy: 0.8434998117349713
Energy: 0.8127887762173376
Energy: 0.8541057283329875
Energy: 0.7351484389798535
Energy: 0.8085642354748496
Energy: 0.8494942620792229
Energy: 0.7351535129906775
Energy: 0.7584895918389846
Energy: 0.9555639566880704
Energy: 0.6740704003401036
Energy: 0.7904360581564214
Energy: 0.9567628947266469
Energy: 0.7771870046502857
Energy: 0.7740374621769945
Energy: 0.7419921704959413
Energy: 0.8514027992217129
Energy: 0.7729920678545016
Energy: 0.7424606181084727
Energy: 0.8711776214468284
Energy: 0.820630862138375

minimum gb energy = 0.6244390027915285 eV
minimum distance =  2.36399586636791 Angstroms
sigma value = 57


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

Energy: 1.1278840986303538
Energy: 0.8056060585804827
Energy: 0.6909250988349622
Energy: 1.1293288374746817
Energy: 0.9171898103084658
Energy: 0.7393571879217989
Energy: 0.9166753446471668
Energy: 0.7692777526941332
Energy: 0.7579671209910229
Energy: 0.9104369428128679
Energy: 0.8632144019192893
Energy: 0.7759362821115624
Energy: 0.85862764740136
Energy: 0.6697023528248578
Energy: 0.682087274931302
Energy: 0.8601062787663956
Energy: 0.7432545680547807
Energy: 0.6939258259794274
Energy: 0.7530183534417109
Energy: 0.6715284294970587
Energy: 0.694093278283485
Energy: 0.7519025793287388
Energy: 0.735793113509565
Energy: 0.6688560259791558
Energy: 0.7364820572360173
Energy: 0.6689220794892049
Energy: 0.6931594168060975
Energy: 0.7377649869044636
Energy: 0.8397481744463093
Energy: 0.6949316192752558
Energy: 1.0210201782727144
Energy: 0.6392015642613054
Energy: 0.6425730317342426
Energy: 1.0234742978023688
Energy: 0.6390821396122809
Energy: 0.6704036644927641
Energy: 0.8112106162666071
Energy: 0.6791177398272995
Energy: 0.6843739077371759
Energy: 0.8125923291721786
Energy: 0.6775371722883888
Energy: 0.6385225123628434
Energy: 0.822464581124065
Energy: 0.6492421120658889
Energy: 0.6594396464293709
Energy: 0.7807511076369203
Energy: 0.6485027272293279
Energy: 0.6686340938939749
Energy: 0.595172583940001
Energy: 0.7570578771510629
Energy: 0.5932625926274904
Energy: 0.5961266292370353
Energy: 0.7962363708734614
Energy: 0.5929515225738724
Energy: 0.5972743606385553
Energy: 0.6866332024771659
Energy: 0.6628547307500493
Energy: 0.5975418825377712
Energy: 0.6663765332965504
Energy: 0.6655314532011798
Energy: 0.9383416105882235
Energy: 0.5737457644687229
Energy: 0.6814217329841745
Energy: 0.8001676076511781
Energy: 0.5850928679292355
Energy: 0.6688798916633949
Energy: 0.7888843322722526
Energy: 0.5783569745774396
Energy: 0.5719298095778156
Energy: 0.7728995193794331
Energy: 0.5759265686422205
Energy: 0.6641684549620943
Energy: 0.5753591836061313
Energy: 0.6644373293528124
Energy: 0.6454782106143481
Energy: 0.5767132632799741
Energy: 0.6411251349615381
Energy: 0.7334189829156617
Energy: 0.5726574868469072
Energy: 0.6522869217691196
Energy: 0.6391276941593208
Energy: 0.5735565245474423
Energy: 0.7754266454640336
Energy: 0.5718754187832302
Energy: 0.5732032197340529
Energy: 0.6476634564076941
Energy: 0.6596238855553334
Energy: 0.5734205491485315
Energy: 0.6246410974814068
Energy: 0.6474662928060353
Energy: 0.8075418997838475
Energy: 0.5950119299572709
Energy: 0.6466524835334477
Energy: 0.7026529912524079
Energy: 0.6051520922909921
Energy: 0.6222183466056236
Energy: 0.7166139174742503
Energy: 0.601752700606176
Energy: 0.5927981523996043
Energy: 0.7160958515783091
Energy: 0.5987451527574061
Energy: 0.6461016356056161
Energy: 0.6585392005338613
Energy: 0.6133758992257268
Energy: 0.6417480245964645
Energy: 0.6585417075778256
Energy: 0.8289228894125262
Energy: 0.6448831211582507
Energy: 0.6393627495590438
Energy: 0.6292975064142028
Energy: 0.6390996011527702
Energy: 0.6406533591228417
Energy: 0.7536350358420825
Energy: 0.6391518902524496
Energy: 0.8128855610771398
Energy: 0.6972226880584321
Energy: 0.7034780424680932
Energy: 0.8144717269990321
Energy: 0.6598866769158662
Energy: 0.7113603783399718
Energy: 0.8639584539670531
Energy: 0.7885616066155061
Energy: 0.7089319885466804
Energy: 0.7495415453354419
Energy: 0.7874151221510423
Energy: 0.6856513064125159
Energy: 0.6768209882475883
Energy: 0.7264015059727817
Energy: 0.6392890773169684
Energy: 0.676781463027378
Energy: 0.735316501520994
Energy: 0.666074367745558
Energy: 0.6962337031598694
Energy: 0.7834012136115284
Energy: 0.7265138058398909
Energy: 0.6941870478119082
Energy: 0.8640992809623741
Energy: 0.7511743082523358
Energy: 0.8615387986223605
Energy: 0.6599548147009472
Energy: 0.6700611385586326
Energy: 0.8632303889808967
Energy: 0.8569134653681634
Energy: 0.757620064444969
Energy: 0.8595427873917181
Energy: 0.6941915420774658
Energy: 0.694555705946281
Energy: 0.8601487319096273
Energy: 0.6944472132347849
Energy: 0.750949111053092
Energy: 0.8965916439910262
Energy: 0.8460488832787533
Energy: 0.7272782000203459
Energy: 0.8973733050562319
Energy: 0.8988241122129963
Energy: 0.7264162374801865
Energy: 1.130022150714784
Energy: 0.7920903651144693
Energy: 0.6941481632590152
Energy: 0.9164151127106321
Energy: 0.8609508350266456
Energy: 0.7181593992131399

minimum gb energy = 0.5718754187832302 eV
minimum distance =  2.37456840486403 Angstroms
sigma value = 43


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

Energy: 1.0489656399272944
Energy: 0.7044833023106807
Energy: 0.6157779730866153
Energy: 1.0506063001806727
Energy: 0.7718509223752157
Energy: 0.6146248746172568
Energy: 0.7600137190439675
Energy: 0.6384562874197172
Energy: 0.6382351448981632
Energy: 0.7576470969419403
Energy: 0.7383684499186552
Energy: 0.5650153530051494
Energy: 0.7330029326042009
Energy: 0.5683334601157704
Energy: 0.5759339853737407
Energy: 0.7344566998205774
Energy: 0.6245583202723818
Energy: 0.5580666583947386
Energy: 0.650106555594987
Energy: 0.5737203298540804
Energy: 0.5583072997775901
Energy: 0.6500601916319106
Energy: 0.6220776176152869
Energy: 0.5899963154476593
Energy: 0.6380899464842297
Energy: 0.582329069480376
Energy: 0.5680689443862829
Energy: 0.6380333526186025
Energy: 0.7048552781391894
Energy: 0.5563077682436031
Energy: 0.9722938950480603
Energy: 0.5641377960242276
Energy: 0.5564843162068774
Energy: 0.974169570250701
Energy: 0.5639369445718745
Energy: 0.5335825429387461
Energy: 0.7003319133336934
Energy: 0.5918456985686497
Energy: 0.5918582299325318
Energy: 0.701673971346578
Energy: 0.5965604278337814
Energy: 0.603356117289012
Energy: 0.6738840082613043
Energy: 0.5653175400702527
Energy: 0.5490984249583072
Energy: 0.6750648686975503
Energy: 0.5401541382312623
Energy: 0.5491543402616491
Energy: 0.5265617544771568
Energy: 0.5488513146350619
Energy: 0.5244101668191926
Energy: 0.5280438392530051
Energy: 0.6657206195068092
Energy: 0.5243964299762146
Energy: 0.5856475621289342
Energy: 0.5435473167325974
Energy: 0.5365972520838763
Energy: 0.5244853127526348
Energy: 0.5625541446479768
Energy: 0.5335364102829904
Energy: 0.7607799216388424
Energy: 0.49943104004423
Energy: 0.5803977698432291
Energy: 0.571367467222673
Energy: 0.49937115739841775
Energy: 0.5374631222658547
Energy: 0.6707922814717435
Energy: 0.5001298538146154
Energy: 0.49962714715804313
Energy: 0.662822845691246
Energy: 0.5020944319491186
Energy: 0.5774054631673488
Energy: 0.6486464418474133
Energy: 0.536919814496031
Energy: 0.560989402834113
Energy: 0.6500037440670188
Energy: 0.5537465760296162
Energy: 0.560687871821945
Energy: 0.48513716503299614
Energy: 0.6800510708863728
Energy: 0.485174029816026
Energy: 0.48652425283537887
Energy: 0.6535834765544172
Energy: 0.4853677145662362
Energy: 0.487428392853817
Energy: 0.5522809956792459
Energy: 0.5335642398929314
Energy: 0.4875838191659638
Energy: 0.5526167064341342
Energy: 0.5450521023191174
Energy: 0.5430931626786913
Energy: 0.479434888335348
Energy: 0.4793396382537781
Energy: 0.5437855742670044
Energy: 0.4793290242675581
Energy: 0.5540745315541006
Energy: 0.6651707263167532
Energy: 0.48026511942456085
Energy: 0.4802264435400653
Energy: 0.6624212598254356
Energy: 0.480225488376856
Energy: 0.5612208989130284
Energy: 0.6395258192102771
Energy: 0.5877095879905034
Energy: 0.5853251665305507
Energy: 0.5645012351515236
Energy: 0.6925308654038921
Energy: 0.5005314096064164
Energy: 0.4783812562977809
Energy: 0.5952420203348594
Energy: 0.4784659098340035
Energy: 0.47915688358684005
Energy: 0.6543384650152207
Energy: 0.47847938243209903
Energy: 0.6414415791897538
Energy: 0.5842940554883682
Energy: 0.589068094075738
Energy: 0.6430097168751944
Energy: 0.536419597715635
Energy: 0.5503775333275814
Energy: 0.6548579179168967
Energy: 0.4879287870365784
Energy: 0.4877444310091024
Energy: 0.6686824307529476
Energy: 0.4878975754541985
Energy: 0.5535508005817122
Energy: 0.5417466418361544
Energy: 0.4855086851121644
Energy: 0.4855489221105006
Energy: 0.5423134240902935
Energy: 0.4854033943861878
Energy: 0.5577177805973896
Energy: 0.5843241984678136
Energy: 0.5372464386559914
Energy: 0.5334577479859938
Energy: 0.5017757469957954
Energy: 0.6422728638210232
Energy: 0.5320612515531092
Energy: 0.4997738501745873
Energy: 0.664579618405293
Energy: 0.4994056167429343
Energy: 0.5012870895803373
Energy: 0.659660039433904
Energy: 0.4996165206326445
Energy: 0.6579235785075478
Energy: 0.5390224669370984
Energy: 0.5438031707560985
Energy: 0.6594372508410297
Energy: 0.5563378033727132
Energy: 0.5434856028380759
Energy: 0.6736162827587957
Energy: 0.5244397461792325
Energy: 0.5245847848182744
Energy: 0.6752300006481872
Energy: 0.5245817775489062
Energy: 0.5295597848046991
Energy: 0.7936087295894394
Energy: 0.5238615205049192
Energy: 0.5637427759923924
Energy: 0.5675742826883431
Energy: 0.5238486770919446
Energy: 0.5443659136243342
Energy: 0.5532785818299616
Energy: 0.5607262108985711
Energy: 0.562231289517945
Energy: 0.5665814358153628
Energy: 0.6441308389623326
Energy: 0.5544344663898607
Energy: 0.5676218525545761
Energy: 0.561141742031602
Energy: 0.5651533751007227
Energy: 0.5686377678686153
Energy: 0.6784607106663573
Energy: 0.5653150473221498
Energy: 0.6967394695519034
Energy: 0.5822322840037549
Energy: 0.5614985212383787
Energy: 0.6980994778538349
Energy: 0.5537711996933458
Energy: 0.5612612589982173
Energy: 0.7115914986045772
Energy: 0.6760055692411722
Energy: 0.6761261740945421
Energy: 0.7110688979615775
Energy: 0.6809506911607373
Energy: 0.6885574632230673
Energy: 1.0113708958821193
Energy: 0.6330482287959852
Energy: 0.5747693344997113
Energy: 1.0130906783986826
Energy: 0.6329647203362361
Energy: 0.5495951769568002
Energy: 0.6541709967564511
Energy: 0.6331150609622571
Energy: 0.6234827827911522
Energy: 0.6548125375026865
Energy: 0.7315828894677964
Energy: 0.6250326010210333
Energy: 0.7350729759236533
Energy: 0.5939372581307316
Energy: 0.5659609762652976
Energy: 0.6437290495189054
Energy: 0.6503568519959617
Energy: 0.6340757832455852
Energy: 0.7331424410076026
Energy: 0.5817887771685706
Energy: 0.5847659252205595
Energy: 0.7345287634636269
Energy: 0.6355117874282558
Energy: 0.5903172119781488
Energy: 0.7600137561625565
Energy: 0.6232419004701188
Energy: 0.6235859551689138
Energy: 0.7591013944655993
Energy: 0.759503638312087
Energy: 0.6249079762157024

minimum gb energy = 0.4783812562977809 eV
minimum distance =  2.35394193960124 Angstroms
sigma value = 81


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

Energy: 0.035430962683683065
Energy: 0.06727061894798093
Energy: 0.03616402993033592
Energy: 0.0375050212543036
Energy: 0.0668953863681579
Energy: 0.035863704815831135
Energy: 0.06839880609499494
Energy: 0.03605888629357485
Energy: 0.03604898650044899
Energy: 0.03617168578600432
Energy: 0.03706461328563363
Energy: 0.0362633372709318
Energy: 0.4343514121533
Energy: 0.03581895210746291
Energy: 0.03621001942006063
Energy: 0.4281931133334593
Energy: 0.035928414313857
Energy: 0.06753800852810772
Energy: 0.038504793878026
Energy: 0.03595372051435881
Energy: 0.035999860850483144
Energy: 0.0368581161383497
Energy: 0.035881157834168835
Energy: 0.06807142695341672
Energy: 0.06764635538267415
Energy: 0.06690823012623187
Energy: 0.06699889951015119
Energy: 0.06856524805892276
Energy: 0.4313268454391887
Energy: 0.06699614165716819
Energy: 0.03646502770560171
Energy: 0.08794952158760476
Energy: 0.036190553347019844
Energy: 0.037663471143820584
Energy: 0.03628629991287413
Energy: 0.03592485116739058
Energy: 0.03607372890624824
Energy: 0.036030058783453396
Energy: 0.03613390105660195
Energy: 0.03626880806525205
Energy: 0.037003032534227834
Energy: 0.0361359034200678
Energy: 0.06707267767250871
Energy: 0.03594684059821018
Energy: 0.03599276357057886
Energy: 0.0669937938404745
Energy: 0.03575948388393773
Energy: 0.06764193509840327
Energy: 0.03663181151741586
Energy: 0.03601557896171692
Energy: 0.06964319030128148
Energy: 0.038050919660130175
Energy: 0.03590020087521493
Energy: 0.06923126386254691
Energy: 0.03614022884787018
Energy: 0.0668026802833698
Energy: 0.06683291478630285
Energy: 0.036029919640504275
Energy: 0.4311321787927289
Energy: 0.06710552934014229

minimum gb energy = 0.035430962683683065 eV
minimum distance =  2.53081289765965 Angstroms
sigma value = 3


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

Energy: 1.0965587574438262
Energy: 0.6248085814418082
Energy: 0.6627817415930983
Energy: 1.0969708433411665
Energy: 0.5976254919168531
Energy: 0.6033550454057987
Energy: 0.6504556992781503
Energy: 0.6312713544827304
Energy: 0.6310244569048223
Energy: 0.655553002997166
Energy: 0.6545405246206215
Energy: 0.6434845880871762
Energy: 0.6590654221004387
Energy: 0.6041029884882785
Energy: 0.6036859830322276
Energy: 0.6596707387805231
Energy: 0.60377817806046
Energy: 0.6248816700293596
Energy: 0.6258334982895936
Energy: 0.6030706978569054
Energy: 0.602870804446049
Energy: 0.6259533987587012
Energy: 0.5475918255260603
Energy: 0.6410058356056455
Energy: 0.5354743043390171
Energy: 0.6310669819521204
Energy: 0.6467275743752651
Energy: 0.5344050996309806
Energy: 0.6546072542298065
Energy: 0.6449271233435194
Energy: 1.0401930830963744
Energy: 0.6152881900019719
Energy: 0.6581514438776125
Energy: 0.6210368695349852
Energy: 0.6156074376497174
Energy: 0.5807586288465554
Energy: 0.6300226072923842
Energy: 0.619178668904588
Energy: 0.6130285614533737
Energy: 0.6293035776447898
Energy: 0.6065881655461144
Energy: 0.6521721584372332
Energy: 0.6287428025481784
Energy: 0.5848679393720848
Energy: 0.5845769542374861
Energy: 0.6244981011214178
Energy: 0.5558695926017861
Energy: 0.5737990367773513
Energy: 0.6501200904810759
Energy: 0.5842487961841298
Energy: 0.6190311573843605
Energy: 0.6511792055163966
Energy: 0.5152740507075297
Energy: 0.6192348328208659
Energy: 0.6038406207087931
Energy: 0.5410248444526546
Energy: 0.558719713330352
Energy: 0.6038905923498411
Energy: 0.5406318930803868
Energy: 0.5396047282789037
Energy: 0.6153741990619037
Energy: 0.594203032304756
Energy: 0.5880643144386263
Energy: 0.5619336304321695
Energy: 0.6051682823602069
Energy: 0.5620877223506159
Energy: 0.505182837703133
Energy: 0.6019927677544141
Energy: 0.6046656316961068
Energy: 0.5057394408637783
Energy: 0.5939870726594738
Energy: 0.5031915870163701
Energy: 0.5465275718757564
Energy: 0.5485745020794646
Energy: 0.5663790328731525
Energy: 0.5461280089494146
Energy: 0.5484236205464813
Energy: 0.5370415817255026
Energy: 0.7007848459016968
Energy: 0.5517503062259072
Energy: 0.5712618144483297
Energy: 0.6282910779284138
Energy: 0.49740082010099473
Energy: 0.5697383809884344
Energy: 0.5978359836594879
Energy: 0.5100415164484671
Energy: 0.5100465986557494
Energy: 0.5989578353034583
Energy: 0.5124774463276965
Energy: 0.5096323957612853
Energy: 0.6089976881821102
Energy: 0.5549518221968684
Energy: 0.5515045800025177
Energy: 0.5959301069837692
Energy: 0.607087066030009
Energy: 0.5521410630981735
Energy: 0.4853749881738535
Energy: 0.5579116596365993
Energy: 0.5631514899880962
Energy: 0.4856110615210239
Energy: 0.5595349458067723
Energy: 0.48541026797393766
Energy: 0.5117664413700499
Energy: 0.5494723337058792
Energy: 0.5557442820402414
Energy: 0.5115420071450619
Energy: 0.5494525672691136
Energy: 0.5936194332058098
Energy: 0.8028092137137882
Energy: 0.6109496114158467
Energy: 0.5496296370979834
Energy: 0.8039398211095543
Energy: 0.6048220241845291
Energy: 0.5564423597331013
Energy: 0.5999278048909286
Energy: 0.49789236283499766
Energy: 0.4870450405009944
Energy: 0.6013597503895874
Energy: 0.5012763163600613
Energy: 0.48535438842380535
Energy: 0.5997249685240782
Energy: 0.5549653873952252
Energy: 0.5540984344594303
Energy: 0.6001011866429
Energy: 0.5647705907240478
Energy: 0.556184807858575
Energy: 0.5126748405714279
Energy: 0.5502590072469603
Energy: 0.5226217811084531
Energy: 0.5136400361472607
Energy: 0.6270708102416386
Energy: 0.5099618192424796
Energy: 0.4837750721258855
Energy: 0.593169788615334
Energy: 0.5955344669900524
Energy: 0.4925705452501968
Energy: 0.7073703727427749
Energy: 0.5969341232659449
Energy: 0.9064979448671556
Energy: 0.5462489194803132
Energy: 0.5246700374292755
Energy: 0.9071273602956662
Energy: 0.5462543980920814
Energy: 0.5343019152107522
Energy: 0.5806200991999722
Energy: 0.5044335578600289
Energy: 0.504958814059893
Energy: 0.5809715827240988
Energy: 0.5050542875548312
Energy: 0.5032485991218443
Energy: 0.6362319894944575
Energy: 0.5759054724309524
Energy: 0.5757890714558233
Energy: 0.6054191985755801
Energy: 0.5513937029574497
Energy: 0.5879221921679306
Energy: 0.5793040778718136
Energy: 0.5759646290447509
Energy: 0.5522577782454606
Energy: 0.5804036681475508
Energy: 0.6307397559982809
Energy: 0.5588453481594663
Energy: 0.5161453341097356
Energy: 0.6510829546242053
Energy: 0.6500366074802407
Energy: 0.5161405844454213
Energy: 0.652176923369101
Energy: 0.6498334662544242
Energy: 0.9908687522157354
Energy: 0.6480919519382073
Energy: 0.5795885411455215
Energy: 0.5664196810976513
Energy: 0.6479423629811619
Energy: 0.5535686803893425
Energy: 0.5645570466606593
Energy: 0.6295312928955705
Energy: 0.5982344440875185
Energy: 0.565035829874373
Energy: 0.6318113071906515
Energy: 0.5973642363639399
Energy: 0.6226671650919463
Energy: 0.5913594461863314
Energy: 0.5912822261249185
Energy: 0.623300406029851
Energy: 0.5594216975364303
Energy: 0.5963961325621184
Energy: 0.6880376019209254
Energy: 0.5910959629676097
Energy: 0.6367447778641231
Energy: 0.6886582629296941
Energy: 0.5146046568697858
Energy: 0.65842018008224
Energy: 0.54855233503863
Energy: 0.6251661338473576
Energy: 0.6250858773264476
Energy: 0.5486231617454204
Energy: 0.6257725716050859
Energy: 0.599162483086747

minimum gb energy = 0.4837750721258855 eV
minimum distance =  2.35577531581585 Angstroms
sigma value = 67


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

Energy: 1.075494639071373
Energy: 0.7401201378638744
Energy: 0.7899223379612648
Energy: 1.0770015953588008
Energy: 0.741780853868224
Energy: 0.7761410923848227
Energy: 0.724176307391808
Energy: 0.7464964955060986
Energy: 0.7398681311362466
Energy: 0.7759214647620138
Energy: 0.7790786112162448
Energy: 0.7607619523101065
Energy: 0.8372580373328864
Energy: 0.7268005612697992
Energy: 0.7558381453022287
Energy: 0.7790716443964225
Energy: 0.7235311329607228
Energy: 0.7552874527907631
Energy: 0.7292846613155917
Energy: 0.758198345038043
Energy: 0.7583143436488623
Energy: 0.7305486217828896
Energy: 0.7001338199802748
Energy: 0.7604928083495922
Energy: 0.6794752418726469
Energy: 0.7458280194312513
Energy: 0.7664773404522197
Energy: 0.679475807509344
Energy: 0.7769797742016475
Energy: 0.771347954459441
Energy: 1.0097453624736785
Energy: 0.7692678938890043
Energy: 0.7736574003134837
Energy: 1.0131603795142992
Energy: 0.7693909413403158
Energy: 0.7425267192285914
Energy: 0.684439891037272
Energy: 0.8012596701211997
Energy: 0.7729531959060673
Energy: 0.682368276347575
Energy: 0.7859189006280763
Energy: 0.720690803895604
Energy: 0.7335292439391231
Energy: 0.7100581120604885
Energy: 0.6628523792129837
Energy: 0.7342256000873082
Energy: 0.6959399173089524
Energy: 0.7211697704075598
Energy: 0.756720014005541
Energy: 0.7766676443092141
Energy: 0.7333428781838335
Energy: 0.7504970403692058
Energy: 0.6363227248373271
Energy: 0.7707503408759111
Energy: 0.744970857223794
Energy: 0.640426047783072
Energy: 0.639079585249624
Energy: 0.7458471822114479
Energy: 0.6528864350379606
Energy: 0.6461954569992
Energy: 0.7522097639130205
Energy: 0.7849995533401288
Energy: 0.7443904555806689
Energy: 0.6960700182201002
Energy: 0.7540140905080182
Energy: 0.7452842452034727
Energy: 0.6222893035105052
Energy: 0.7123217742270979
Energy: 0.7354756300440612
Energy: 0.62260569271407
Energy: 0.7538849692245331
Energy: 0.6158967532130971
Energy: 0.6202287111957135
Energy: 0.7254418898122976
Energy: 0.6747780862202936
Energy: 0.6201701762495656
Energy: 0.7216980319034146
Energy: 0.6161997658695231
Energy: 0.9040700748815985
Energy: 0.7517631499589345
Energy: 0.7229026955081451
Energy: 0.7902853926683716
Energy: 0.7314833214123644
Energy: 0.7223301022450972
Energy: 0.7309671711078317
Energy: 0.6199803987492302
Energy: 0.615491135072478
Energy: 0.7322242551443201
Energy: 0.6173188728400105
Energy: 0.6762883951059161
Energy: 0.7385839816993983
Energy: 0.7220249794112703
Energy: 0.7189657060340487
Energy: 0.7344308735678723
Energy: 0.6766872248308576
Energy: 0.7167992089659642
Energy: 0.6562016181981991
Energy: 0.6931264602995205
Energy: 0.661190891418138
Energy: 0.6570295514414782
Energy: 0.6977288850925867
Energy: 0.6560548658130321
Energy: 0.6374685657237621
Energy: 0.7618461891253752
Energy: 0.7544629525540417
Energy: 0.635701886167977
Energy: 0.7802297415138961
Energy: 0.721789062414008
Energy: 0.9519994691065637
Energy: 0.7922421728232173
Energy: 0.7307661701897894
Energy: 0.9278758711581448
Energy: 0.8069773972163058
Energy: 0.7647441175114278
Energy: 0.6354054655530224
Energy: 0.6849912824166422
Energy: 0.7292967562718071
Energy: 0.636090372831472
Energy: 0.6836522539298642
Energy: 0.7321510909239265
Energy: 0.7521025038627959
Energy: 0.7835294095218268
Energy: 0.7637809868715483
Energy: 0.7534199440482896
Energy: 0.7119526653903259
Energy: 0.7602333815514403
Energy: 0.8378829733512603
Energy: 0.7022262265352711
Energy: 0.7519625949476016
Energy: 0.7785111339933016
Energy: 0.7024819861971457
Energy: 0.7596522136732794
Energy: 0.7245917365201899
Energy: 0.7621595339085872
Energy: 0.7415427488215667
Energy: 0.714618071178705
Energy: 0.7589963915855698
Energy: 0.7617891943453661

minimum gb energy = 0.615491135072478 eV
minimum distance =  2.34293751878397 Angstroms
sigma value = 33


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

Energy: 1.2096254019811838
Energy: 0.9554173601316212
Energy: 1.0162819912177434
Energy: 1.211863278338128
Energy: 0.9147600301702751
Energy: 0.9110062833435598
Energy: 0.7786281385321155
Energy: 0.8113440167173925
Energy: 0.8115155149424369
Energy: 0.8739246117510002
Energy: 0.8764687423033662
Energy: 0.8364391579460561
Energy: 0.9099195970955981
Energy: 0.8549156609690365
Energy: 0.853748603219103
Energy: 0.9108971787151589
Energy: 0.8553543393595086
Energy: 0.8891149616351052
Energy: 0.7671822132906229
Energy: 0.8737447866097804
Energy: 0.8700107117921865
Energy: 0.7685485063080978
Energy: 0.7531032903621734
Energy: 0.8523932121434703
Energy: 0.7477653126564122
Energy: 0.8402548667176789
Energy: 0.8397199914132569
Energy: 0.7375230605101022
Energy: 0.9260359445033862
Energy: 0.8392072715566805
Energy: 1.1203712908550154
Energy: 0.9193131944310488
Energy: 0.867986178629592
Energy: 1.1219241471071102
Energy: 0.920470531933816
Energy: 0.821522661428039
Energy: 0.7486776936126937
Energy: 0.8666267759031998
Energy: 0.8450952833545587
Energy: 0.7485181824913009
Energy: 0.8670501246310808
Energy: 0.7716886793159606
Energy: 0.77071795689136
Energy: 0.830783314651476
Energy: 0.8284947990527218
Energy: 0.7716742831897807
Energy: 0.8264088472957211
Energy: 0.7690805893720646
Energy: 0.8263962133004548
Energy: 0.8657649585126187
Energy: 0.8392979839512362
Energy: 0.8148872940027603
Energy: 0.6959216396826775
Energy: 0.8295585669259447
Energy: 0.807106878779706
Energy: 0.7015794653286604
Energy: 0.697130298963808
Energy: 0.808125030318856
Energy: 0.698244508131808
Energy: 0.7674766725823567
Energy: 0.9688829075780392
Energy: 0.7758833148023991
Energy: 0.8217637875323269
Energy: 0.7984488729997581
Energy: 0.7542379846675713
Energy: 0.8087905768569024
Energy: 0.6988282522660234
Energy: 0.8112747751586027
Energy: 0.8268334888179599
Energy: 0.6988149342551897
Energy: 0.9057881709425416
Energy: 0.6991728612976768
Energy: 0.6966627650301784
Energy: 0.825575782709288
Energy: 0.8560923748644319
Energy: 0.6969261766286817
Energy: 0.8822049505729681
Energy: 0.7134813488845271
Energy: 1.0341026027408726
Energy: 0.8706510897259689
Energy: 0.8539725471384092
Energy: 0.8391422825447064
Energy: 0.8521918280115477
Energy: 0.8144806486269539
Energy: 0.7508135353804297
Energy: 0.7791430220238686
Energy: 0.7759223133483666
Energy: 0.7510992534632905
Energy: 0.749831874170446
Energy: 0.7892728632895226
Energy: 0.7973139335303794
Energy: 0.8664969870144249
Energy: 0.8536198895773689
Energy: 0.8552578752706668
Energy: 0.7134973273292793
Energy: 0.8504360025967854
Energy: 0.9095845157657201
Energy: 0.82970053632696
Energy: 0.8303268921425192
Energy: 0.9086744370644836
Energy: 0.8300740000906031
Energy: 0.8673198393210356
Energy: 0.8740471659818546
Energy: 0.8314070639287028
Energy: 0.8119918267972728
Energy: 0.8741109139825338
Energy: 0.8310287291232167
Energy: 0.8242516196872395
Energy: 1.2107056568252583
Energy: 0.8823470140246276
Energy: 0.8848328173515461
Energy: 1.2119535869570193
Energy: 0.8816418700590308
Energy: 0.8278466724811162
Energy: 0.7786669790175927
Energy: 0.8113947985167326
Energy: 0.8115647911801315
Energy: 0.781600969517742
Energy: 0.8759153017752835
Energy: 0.8119894792784452
Energy: 0.896103283114972
Energy: 0.8545520568947949
Energy: 0.8537483265410181
Energy: 0.8969627537245989
Energy: 0.8339041800612058
Energy: 0.8525690921647814
Energy: 0.8859072936903922
Energy: 0.8542329647593546
Energy: 0.8539969682164233
Energy: 0.8413602793998598
Energy: 0.8552723601398858
Energy: 0.8528406648253518
Energy: 0.7479273008507237
Energy: 0.8115055684708309
Energy: 0.8399460914509166
Energy: 0.7489864993296946
Energy: 0.9251449538780997
Energy: 0.8396017704832441
Energy: 1.1199939596764306
Energy: 0.9181798847523711
Energy: 0.8705355327802323
Energy: 1.120817107855805
Energy: 0.9218364397473859
Energy: 0.8212353554073014
Energy: 0.7486724066771695
Energy: 0.8605102024464579
Energy: 0.8460230560108949
Energy: 0.7487857071811375
Energy: 0.8644914463310145
Energy: 0.8641674815079082
Energy: 0.7690715815031508
Energy: 0.8063814581714551
Energy: 0.8054967377449441
Energy: 0.7701383318887705
Energy: 0.8057761086420212
Energy: 0.8096881930330605
Energy: 0.8447277284269781
Energy: 0.824752599025421
Energy: 0.8274069180732665
Energy: 0.8455457950160268
Energy: 0.6989157354521985
Energy: 0.8252843856197195
Energy: 0.8062518232534719
Energy: 0.6970212522117946
Energy: 0.7145898601980931
Energy: 0.8069119307270307
Energy: 0.6993187296036406
Energy: 0.7669831880962803
Energy: 0.9725808272825108
Energy: 0.7545430618306923
Energy: 0.8093811146477149
Energy: 0.9688649373449263
Energy: 0.7569517305591557
Energy: 0.808664708117397
Energy: 0.6985732829971006
Energy: 0.8124542646988239
Energy: 0.8270730287435358
Energy: 0.698442928642941
Energy: 0.903447151120456
Energy: 0.6986100992237059
Energy: 0.6965223991762385
Energy: 0.8177855269713351
Energy: 0.7136938057071656
Energy: 0.6964714516955256
Energy: 0.8300115641920405
Energy: 0.7139489361048544
Energy: 0.8284366143387444
Energy: 0.8665051495287943
Energy: 0.8268517587989229
Energy: 0.7782571799568259
Energy: 0.8530922608375843
Energy: 0.8148270018884843
Energy: 0.8473657990954656
Energy: 0.7702620211984407
Energy: 0.7672378473606865
Energy: 0.831160307793863
Energy: 0.769129494342648
Energy: 0.790938218478903
Energy: 0.8332721044810495
Energy: 0.713609830356394
Energy: 0.8504174160032609
Energy: 0.8345298370368909
Energy: 0.7134262819668511
Energy: 0.8505225026735325
Energy: 0.9077772204697523
Energy: 0.8353561944660788
Energy: 0.8298764170056154
Energy: 0.9074904217345919
Energy: 0.9245285362440226
Energy: 0.8275792074299697
Energy: 0.8751127545200283
Energy: 0.8298519714610499
Energy: 0.8359384650686495
Energy: 0.8737460094297788
Energy: 0.8296297968151188
Energy: 0.8402034675340646
Energy: 1.2126691136922962
Energy: 0.8823086369163338
Energy: 0.8973098547710463
Energy: 1.0365607130638925
Energy: 0.8815726333465937
Energy: 0.8285286371821416

minimum gb energy = 0.6959216396826775 eV
minimum distance =  2.35989815511984 Angstroms
sigma value = 41


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

Energy: 1.1209255398389637
Energy: 1.104547488100132
Energy: 1.1080811100979744
Energy: 1.1229725696440267
Energy: 1.3374392433139821
Energy: 1.1111489681854207
Energy: 0.890621568336363
Energy: 0.9510598974870428
Energy: 0.9518899752523506
Energy: 0.9907264429833859
Energy: 0.9759541037630245
Energy: 0.9785837683588889
Energy: 0.9667853720297132
Energy: 0.9880434762682461
Energy: 0.9879022896273031
Energy: 0.9673772454742433
Energy: 0.9654988212380183
Energy: 0.9405533618497735
Energy: 0.9828563985249247
Energy: 0.9653122863723871
Energy: 0.9654661363876498
Energy: 0.9464918413430873
Energy: 0.9152162383445756
Energy: 0.8304930794589178
Energy: 0.841745289604581
Energy: 0.9769747823941509
Energy: 0.9793531605764455
Energy: 0.8416637768822458
Energy: 1.0313976211750195
Energy: 0.9755507421495562
Energy: 1.0400356246800684
Energy: 1.0256584148438193
Energy: 1.0257248058971686
Energy: 1.0410884745942213
Energy: 1.0172604435803199
Energy: 1.0276965354688985
Energy: 0.8413079145974381
Energy: 0.9409051159755862
Energy: 0.9794986535512324
Energy: 0.8405679528846414
Energy: 0.9486880083227055
Energy: 0.8413869794825082
Energy: 0.8218676723373941
Energy: 0.9452558820191053
Energy: 0.8733448050524149
Energy: 0.8229864299401949
Energy: 0.9426584706135832
Energy: 0.8220371159426947
Energy: 0.9475103633176448
Energy: 0.8795915948104452
Energy: 0.9425226976347878
Energy: 0.9436914700773489
Energy: 0.8651768548742406
Energy: 0.942058713259642
Energy: 0.9038417535410405
Energy: 0.8333042441814426
Energy: 0.8587761833559948
Energy: 0.9044309157623297
Energy: 0.8298893169482281
Energy: 0.9174442671969156
Energy: 0.935482476891981
Energy: 0.8571723988240723
Energy: 0.9856512994363185
Energy: 0.9369104211444224
Energy: 0.7884389239150681
Energy: 0.8690542204092971
Energy: 1.019598770210774
Energy: 0.9467443994220748
Energy: 0.951346392364803
Energy: 1.020736540114532
Energy: 1.0426757126569042
Energy: 0.908555986279505
Energy: 0.9780910293134105
Energy: 0.9163120065917052
Energy: 0.9618137433589781
Energy: 0.9790309464467231
Energy: 0.9177790204749606
Energy: 0.9096872396949722
Energy: 1.1253914211956535
Energy: 0.9893095707621168
Energy: 1.100429936675488
Energy: 1.1253340936174643
Energy: 0.9765386783350317
Energy: 1.0961379274406213

minimum gb energy = 0.7884389239150681 eV
minimum distance =  2.32079477468972 Angstroms
sigma value = 11


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

Energy: 1.3849952748203245
Energy: 1.323571228852935
Energy: 1.2238822050310378
Energy: 1.3865160523954712
Energy: 1.2794239488804482
Energy: 1.1432928627204475
Energy: 1.0798522854420671
Energy: 0.9445852199080725
Energy: 0.944805031990212
Energy: 1.1368094804420883
Energy: 0.958871453363389
Energy: 0.993623174427039
Energy: 1.1679159326587047
Energy: 1.1020036959344364
Energy: 1.1021991087954197
Energy: 1.1692053481346982
Energy: 1.0436207518825686
Energy: 1.1034124167791102
Energy: 1.107870485916109
Energy: 1.0490553670669536
Energy: 1.028223640812938
Energy: 1.0775150653816163
Energy: 0.9471588001153456
Energy: 1.0573170099437328
Energy: 0.9655893331513052
Energy: 0.958231141635077
Energy: 0.9891605918262492
Energy: 0.9658134009879302
Energy: 0.9592065330369396
Energy: 0.9960741948303924
Energy: 1.0790121227938352
Energy: 0.9618461123902197
Energy: 1.0187221687668546
Energy: 1.0605875905599556
Energy: 0.9361960656877881
Energy: 1.0164365984743973
Energy: 0.9480168289073959
Energy: 1.0129912094821822
Energy: 1.018602467758908
Energy: 0.9482548161226582
Energy: 1.0351393584780253
Energy: 1.0189637858879985
Energy: 0.9575063385839685
Energy: 1.0191027491775466
Energy: 0.9889633560945593
Energy: 0.9577356979326505
Energy: 0.9661451148529298
Energy: 0.9811957958293577
Energy: 1.0418297346071999
Energy: 1.0846512352318873
Energy: 1.0913722113986621
Energy: 0.9742679943647846
Energy: 1.0734931637062732
Energy: 1.1322460739404154
Energy: 0.9190219009912542
Energy: 1.0942898201184712
Energy: 1.0914175904188113
Energy: 1.02713516336779
Energy: 1.139637976783635
Energy: 1.1320572686141765
Energy: 0.9845482615641338
Energy: 0.9893405376933571
Energy: 1.0107674507815532
Energy: 0.9859238751868978
Energy: 0.9605485183718421
Energy: 0.9691390513354701
Energy: 0.9973491383901015
Energy: 1.207919363732452
Energy: 1.2077972329468283
Energy: 1.0320566844822354
Energy: 1.0960311152763305
Energy: 1.207768839097496
Energy: 0.9379719751021449
Energy: 0.9990783418895345
Energy: 1.008481313167008
Energy: 0.9381300969520033
Energy: 1.1200956874256358
Energy: 1.0032710897412451
Energy: 1.1828507593919277
Energy: 1.106391107179531
Energy: 1.086185597326019
Energy: 1.0931055235632283
Energy: 1.0992432949401247
Energy: 1.0930739297093144
Energy: 0.9258506631192148
Energy: 1.0458216202744592
Energy: 1.059849455591522
Energy: 0.9259490511948285
Energy: 1.0420013478056405
Energy: 1.0581263764654727
Energy: 0.9369140955031993
Energy: 1.0045200147059483
Energy: 1.0128386527134168
Energy: 0.9073873118208436
Energy: 0.9875514398920694
Energy: 0.9769213159282234
Energy: 0.9198433738161025
Energy: 1.0140082535212898
Energy: 1.0230667913471057
Energy: 0.9200910472480959
Energy: 0.9943591019166577
Energy: 1.017469497898379
Energy: 1.119547176398925
Energy: 0.9997517726737426
Energy: 1.0379319812287946
Energy: 1.121333011534972
Energy: 1.001552647990618
Energy: 1.0099290283235454
Energy: 0.9594290520947865
Energy: 1.0046778843368627
Energy: 0.9968074772389035
Energy: 0.9589759369140214
Energy: 1.034680609671273
Energy: 1.0118357687015325
Energy: 1.071539947382643
Energy: 1.1305727946863364
Energy: 1.130546056412652
Energy: 1.0701586800155471
Energy: 1.0852429173835574
Energy: 1.0649694214280698
Energy: 1.0195950284391295
Energy: 1.0898462303707666
Energy: 1.015737430948812
Energy: 1.0109194493004947
Energy: 0.925471300996282
Energy: 0.9930207024201818
Energy: 0.9561659567979414
Energy: 1.0077388881737719
Energy: 0.9908734631375502
Energy: 0.9237392759355506
Energy: 1.020778823143482
Energy: 0.9928965371118633
Energy: 1.3157141818701734
Energy: 1.104828627391683
Energy: 1.102692781085182
Energy: 1.0844333920076783
Energy: 1.1075827534164098
Energy: 1.1027695903869978
Energy: 1.026916236623261
Energy: 0.9536298427778749
Energy: 0.9965970331441013
Energy: 1.0361513103514834
Energy: 0.934182375463407
Energy: 0.9856534004764936
Energy: 1.0120372748457436
Energy: 1.0497195790064369
Energy: 1.0321186759607015
Energy: 1.0131592907068419
Energy: 1.0647004886856666
Energy: 1.0142664860298547
Energy: 1.03777757238813
Energy: 1.0098037498587848
Energy: 1.0172031318073231
Energy: 0.9916959821824773
Energy: 0.911839495822837
Energy: 1.0108309581792632
Energy: 1.0663254719360251
Energy: 0.9111372104916797
Energy: 0.9326455292406458
Energy: 1.0351132424771305
Energy: 0.9079011038090319
Energy: 1.0089171350451234
Energy: 1.0175434955728395
Energy: 0.9947955420893287
Energy: 1.0448246168473763
Energy: 0.985861539498331
Energy: 0.928884197239157
Energy: 1.0492842557764446
Energy: 1.1020506091644928
Energy: 1.0724786990340136
Energy: 1.0627615601774425
Energy: 1.101684492863802
Energy: 1.0951664123754783
Energy: 1.0651353300189204
Energy: 1.1241753932875094
Energy: 0.9267278708324853
Energy: 0.9928287077188572
Energy: 1.1374984801448798
Energy: 0.9258718950313918
Energy: 1.0062222698341712
Energy: 1.387738712616997
Energy: 1.030378446851321
Energy: 1.0632585185444214
Energy: 1.2464217148317174
Energy: 1.1022277674634542
Energy: 1.0630679743834708

minimum gb energy = 0.9073873118208436 eV
minimum distance =  2.30591981792394 Angstroms
sigma value = 57


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

Energy: 1.2473272929883845
Energy: 1.0784654176355475
Energy: 1.0765203149331708
Energy: 1.2498611380862692
Energy: 1.4580862159271233
Energy: 1.0787283265560175
Energy: 0.8969400028516583
Energy: 1.0556745039701114
Energy: 1.0584207626355517
Energy: 1.0323655674362358
Energy: 1.104672275595042
Energy: 1.0342578302105476
Energy: 0.9992207964937107
Energy: 1.0097263204005362
Energy: 1.0114652288244415
Energy: 0.9995768655239474
Energy: 1.088564142519238
Energy: 0.9951764296651742
Energy: 1.000511829167198
Energy: 1.0281202063524042
Energy: 0.9799424647038422
Energy: 1.0011091093775133
Energy: 1.0091084951658051
Energy: 0.9799554515166872
Energy: 0.9221378240738581
Energy: 1.0528047141014316
Energy: 1.0517342969113248
Energy: 0.9225390406761742
Energy: 1.0503731821010163
Energy: 1.0536512585077191
Energy: 1.0945698682647462
Energy: 1.0472267292774935
Energy: 1.0441850195877613
Energy: 1.0124898456291902
Energy: 1.0629442039791674
Energy: 1.0437109208352893
Energy: 0.9882501074941813
Energy: 0.9308895004762445
Energy: 1.0066251426078197
Energy: 0.9894477662342727
Energy: 0.9331761375749296
Energy: 1.0363828884837998
Energy: 1.0317584356146523
Energy: 0.9815769237197377
Energy: 1.0261892634841967
Energy: 1.0330436134140277
Energy: 0.9936844937626946
Energy: 1.0221139249597238
Energy: 1.1071342836891356
Energy: 0.9925537682658276
Energy: 1.075197478875677
Energy: 1.0723808857590578
Energy: 0.9935029864264225
Energy: 1.0722427541688668
Energy: 1.107223020972017
Energy: 0.9923811526733106
Energy: 1.0740372377035752
Energy: 1.0161460421410338
Energy: 1.0006944433156386
Energy: 1.0723404103176584
Energy: 1.032332723799901
Energy: 1.0154712615846622
Energy: 1.0265105645443113
Energy: 1.0333615812066563
Energy: 0.9958934775092467
Energy: 0.9689029031917925
Energy: 0.9946710113878144
Energy: 1.0940662685971358
Energy: 1.0407224257849084
Energy: 0.9956083810539407
Energy: 1.0903779193493355
Energy: 0.992493591108243
Energy: 0.9932855439185384
Energy: 1.0129108209101714
Energy: 1.0121379925990788
Energy: 0.9945332581643405
Energy: 1.106192359148309
Energy: 1.0112590045292795
Energy: 1.093414589026231
Energy: 1.06495445399568
Energy: 1.0598477590825284
Energy: 1.0941321059156144
Energy: 1.007049298758247
Energy: 1.0618230330371392
Energy: 1.0052711137918633
Energy: 1.0015736265171438
Energy: 1.052357488902789
Energy: 1.005701139263807
Energy: 0.9319389138628268
Energy: 1.0545797616931392
Energy: 0.989077141619472
Energy: 0.9317788055252186
Energy: 1.005961428635071
Energy: 0.9893978130119462
Energy: 0.9930304858920145
Energy: 0.9894945388983332
Energy: 0.8967756516013861
Energy: 1.033933150799281
Energy: 1.0331787947052793
Energy: 0.8972158426287425
Energy: 0.9974438256532193
Energy: 1.012551578373714

minimum gb energy = 0.8967756516013861 eV
minimum distance =  2.36229641765924 Angstroms
sigma value = 9


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

Energy: 1.47650647472206
Energy: 1.0213175317308796
Energy: 1.3099554179594655
Energy: 1.3150658868206353
Energy: 1.138443429801793
Energy: 1.313518473497912
Energy: 1.0685645808830009
Energy: 1.0558758309213885
Energy: 1.0491850076488793
Energy: 1.152096499536538
Energy: 1.0682543103877278
Energy: 1.0086569819625633
Energy: 1.1163764284017705
Energy: 1.0525740278103046
Energy: 1.0442461233673779
Energy: 1.1169107222868593
Energy: 1.0876915050470959
Energy: 1.0429411857006685
Energy: 1.0394204445632191
Energy: 1.0328586212436472
Energy: 1.031664972848875
Energy: 1.0415530846118461
Energy: 1.0368693373329136
Energy: 1.0399670565949368
Energy: 1.0270575033942684
Energy: 0.9914013892769683
Energy: 0.9939103602695205
Energy: 1.028468941144446
Energy: 0.9918812246721479
Energy: 0.9975315945877206
Energy: 0.9876062111276154
Energy: 1.0099437945284915
Energy: 0.9902176381763229
Energy: 0.9888781707965555
Energy: 1.047777333006735
Energy: 0.994575579628749
Energy: 1.1499850496648953
Energy: 1.0795927355259978
Energy: 1.2927029280659794
Energy: 1.1510071300800737
Energy: 1.1346794833343805
Energy: 1.292389489282939
Energy: 1.0632099302627378
Energy: 0.9915724769326019
Energy: 0.9912748830596716
Energy: 1.0511938439241015
Energy: 1.0340234816650626
Energy: 0.9916770981144425
Energy: 1.154726737649829
Energy: 1.0267104024363056
Energy: 1.0019251772855957
Energy: 1.0444202488567784
Energy: 1.053352714073094
Energy: 1.0540311472036772
Energy: 1.1518030296205308
Energy: 1.002403184145089
Energy: 1.0017535438190768
Energy: 1.1030052522914184
Energy: 1.0129838365642734
Energy: 1.0089849453368918
Energy: 1.0351342031085244
Energy: 1.0058909815487294
Energy: 1.002571305476523
Energy: 1.012064966728108
Energy: 1.014514555065539
Energy: 0.9804206044018902
Energy: 1.0108510373179822
Energy: 1.007173496257101
Energy: 1.0045761566952545
Energy: 1.0100846011241522
Energy: 0.9931978037996624
Energy: 0.9991989715469766
Energy: 1.1378043577907304
Energy: 1.0479231577806278
Energy: 1.039536644968125
Energy: 1.066704422455595
Energy: 1.0466408735023809
Energy: 1.0662621729989383
Energy: 1.1850243107613423
Energy: 1.0553772788284133
Energy: 1.0487877333911766
Energy: 1.179202006555844
Energy: 1.0775498634268328
Energy: 1.0496124668992342
Energy: 1.0362590201960218
Energy: 1.008939225443323
Energy: 0.9932386351215812
Energy: 1.0368542545410668
Energy: 1.0118639207635045
Energy: 1.0243610253968145
Energy: 1.005119679296308
Energy: 1.2258741617992328
Energy: 1.0582787015344868
Energy: 1.0059758975891542
Energy: 1.1892156936970322
Energy: 0.9988256733721642
Energy: 1.036153026464587
Energy: 1.0220630751875321
Energy: 1.0318162266838569
Energy: 1.0366493472173286
Energy: 1.1464019009900759
Energy: 1.0310769577812016
Energy: 1.068579818649771
Energy: 1.0416908341888445
Energy: 1.0411597931937824
Energy: 1.0699659635195917
Energy: 1.0380019606415118
Energy: 1.0423977272665068
Energy: 1.04898011324636
Energy: 1.0584957465898635
Energy: 1.0544258242661153
Energy: 1.0502193927767565
Energy: 1.0285311794831449
Energy: 1.083316490726749
Energy: 1.0747862293701105
Energy: 1.0471236040424576
Energy: 1.0556703042077085
Energy: 1.0714096028750653
Energy: 1.0479398105536666
Energy: 1.051802564879154
Energy: 1.0352125206934901
Energy: 1.017079685611713
Energy: 1.0202573543239029
Energy: 1.0394950991150738
Energy: 1.01536824740196
Energy: 1.0040944904188938

minimum gb energy = 0.9804206044018902 eV
minimum distance =  2.32570413852351 Angstroms
sigma value = 27


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

Energy: 1.042542333601009
Energy: 1.0351244818457217
Energy: 1.0136928716613818
Energy: 1.044039445680144
Energy: 1.4214189562323805
Energy: 1.0145879229411743
Energy: 1.0055719928241884
Energy: 1.109248015734494
Energy: 1.1080541246556117
Energy: 1.1311508624024713
Energy: 1.1096455497533761
Energy: 0.9837942419395634
Energy: 1.0792233854551192
Energy: 0.9644033975028944
Energy: 0.9714638584713859
Energy: 1.0802893877076676
Energy: 0.9467627083212017
Energy: 1.0291406059861783
Energy: 1.0665137351796368
Energy: 0.9641712183260716
Energy: 1.0050927903827265
Energy: 1.0677600371570755
Energy: 1.0132659595805888
Energy: 1.041910092731343
Energy: 0.9837095334370886
Energy: 0.9808659993119535
Energy: 0.9600231113857775
Energy: 0.9846723601822809
Energy: 1.0134318967458318
Energy: 0.9491191731356923
Energy: 0.9843861749665228
Energy: 0.9880091971163993
Energy: 0.9668514613749754
Energy: 0.9853653137774935
Energy: 1.0088821832076968
Energy: 0.9667867505030775
Energy: 1.0014925083163684
Energy: 0.8969171821943576
Energy: 0.8972205308728373
Energy: 1.00195670924899
Energy: 0.900350249608975
Energy: 0.8949362577544763
Energy: 0.9942654756338014
Energy: 0.9814123513915196
Energy: 1.0112832704469095
Energy: 0.9945161424296163
Energy: 0.9573544801637599
Energy: 1.0127866067043325
Energy: 1.0807796612263032
Energy: 0.9622957073933671
Energy: 0.964175969501086
Energy: 0.9723813582920081
Energy: 1.0037642906926232
Energy: 0.9774766020177255
Energy: 1.089794685473996
Energy: 0.9661898702818323
Energy: 0.9661740849281109
Energy: 1.0127095259076617
Energy: 1.001669827802226
Energy: 0.9673689700320888
Energy: 0.9941000238304186
Energy: 0.9816428515629003
Energy: 1.0973301832667839
Energy: 0.9946639313910857
Energy: 0.9905756279415386
Energy: 1.0968624066963937
Energy: 1.0119905407513858
Energy: 1.002471203661892
Energy: 0.9715855174740664
Energy: 1.013143190038637
Energy: 0.9981723374358198
Energy: 0.9747936755532614
Energy: 0.8975984580109592
Energy: 1.015252283995293
Energy: 0.8935656203491229
Energy: 0.8984960776673617
Energy: 1.0289753380083795
Energy: 0.8930720696032782
Energy: 0.8981513886361977
Energy: 1.009226112967918
Energy: 1.0321055321430357
Energy: 0.9088529731295606
Energy: 1.0499358636746963
Energy: 0.962388760359002
Energy: 0.9910105831778993
Energy: 0.9695734843956442
Energy: 0.9807670426461302
Energy: 1.005823189078344
Energy: 0.9712028569324181
Energy: 0.9814933673657545
Energy: 1.032106177589148
Energy: 0.957299486278092
Energy: 0.9571510611285975
Energy: 1.0326880443563613
Energy: 0.9577945631706981
Energy: 0.9643788408778895
Energy: 0.9784872481985133
Energy: 1.0008212672627805
Energy: 1.0066682798488689
Energy: 0.9789179696794543
Energy: 1.0314309569364615
Energy: 1.0057601425401284
Energy: 0.9872789493905585
Energy: 0.9901224924069908
Energy: 0.9521467125897342
Energy: 0.9829145694733337
Energy: 1.0144441776413358
Energy: 0.9486422507010456
Energy: 0.9994134902699934
Energy: 0.9069476813378051
Energy: 0.8939562729138267
Energy: 1.0003922535096923
Energy: 0.8994172136072807
Energy: 0.8934657379922395
Energy: 1.0257828014739747
Energy: 0.9011289511509558
Energy: 0.8961592159382509
Energy: 1.0268029236726295
Energy: 0.8992543410158242
Energy: 0.8960548457532275
Energy: 1.0621747019161025
Energy: 1.0104238100045952
Energy: 0.9820684917806687
Energy: 0.9768813096901955
Energy: 1.0040770206454455
Energy: 0.9500847944559668
Energy: 0.94520645444943
Energy: 1.0830119286602211
Energy: 1.0617221456607333
Energy: 0.9455723493255345
Energy: 1.101337552333574
Energy: 1.0624826975335726
Energy: 1.1186149813570112
Energy: 0.9956143271585073
Energy: 0.9946707914195423
Energy: 1.1200635520476752
Energy: 0.9983312085252446
Energy: 0.9946146580877733
Energy: 1.1020914704953633
Energy: 1.0068588248477714
Energy: 1.0051781748104116
Energy: 1.0896345826471898
Energy: 1.0111672394925058
Energy: 1.0197844592615641
Energy: 1.0427287297879695
Energy: 1.1080292105039315
Energy: 1.0914873495240016
Energy: 1.066470025529174
Energy: 1.1020924348586054
Energy: 0.9818077269102995

minimum gb energy = 0.8930720696032782 eV
minimum distance =  2.33919810336646 Angstroms
sigma value = 19


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

Energy: 1.4164510181648344
Energy: 1.1467696279172488
Energy: 1.4462494186719819
Energy: 1.3144815185156526
Energy: 0.9806034389424757
Energy: 0.9463545609972115
Energy: 1.0416144852239704
Energy: 1.048917339990068
Energy: 1.0428436168099888
Energy: 1.1197189747993692
Energy: 1.038954092207069
Energy: 0.9865060935216029
Energy: 1.0518268827321848
Energy: 1.0421020361927025
Energy: 1.034064224775676
Energy: 1.0480092481174905
Energy: 1.0467984323943407
Energy: 1.025762291172573
Energy: 1.0176793429043725
Energy: 0.985053233800616
Energy: 0.9862584567449111
Energy: 1.0179128046534136
Energy: 0.9913910801710538
Energy: 0.9851526842258054
Energy: 0.9286674447365897
Energy: 1.0313487569670294
Energy: 1.0217857865152877
Energy: 0.9298870991527748
Energy: 1.0283600186789166
Energy: 1.0218725835912403
Energy: 1.0360815217762485
Energy: 1.0005882964466508
Energy: 0.9871237737573624
Energy: 1.036473618747476
Energy: 1.1195245652407524
Energy: 0.9868635608640043
Energy: 1.0085124377371821
Energy: 1.1415871034915037
Energy: 1.189712169214656
Energy: 1.0046101409632304
Energy: 1.1395815720397817
Energy: 1.1414775262491628
Energy: 1.0631417814732014
Energy: 0.9767197613906136
Energy: 0.9857683235641354
Energy: 1.06361934542487
Energy: 1.029845265480789
Energy: 1.008586068506075
Energy: 0.9177647353812646
Energy: 0.9718143340064422
Energy: 0.9402733029905121
Energy: 0.9179511385175938
Energy: 0.9843754361947187
Energy: 0.9567856993907613
Energy: 0.9397143774899146
Energy: 0.968554280316278
Energy: 0.9637840484493786
Energy: 0.9688849165795036
Energy: 1.0266082712969684
Energy: 0.9637449068295899
Energy: 1.1766331982391598
Energy: 1.111376709662617
Energy: 1.097148469694606
Energy: 1.1780577416824307
Energy: 1.1204252130305017
Energy: 1.094420984928677
Energy: 1.0338908086544798
Energy: 0.9763308980907173
Energy: 0.9828676350824985
Energy: 1.033886905092591
Energy: 1.0007643384193154
Energy: 0.9779294825830214
Energy: 1.2870226943512022
Energy: 0.9795587951823782
Energy: 0.9601465505120923
Energy: 1.0421313703668333
Energy: 0.9786396133217502
Energy: 0.9672241470066313
Energy: 0.9967825421124807
Energy: 0.9766435703796549
Energy: 0.9776908982268229
Energy: 1.004462205970182
Energy: 0.9899533766631554
Energy: 0.9821770012200093
Energy: 0.9585919620183152
Energy: 0.9407481706139466
Energy: 0.946380863248572
Energy: 0.9584016101847052
Energy: 0.9023577043951136
Energy: 0.9444985443921878
Energy: 0.9805562275754485
Energy: 0.9522335342917342
Energy: 0.9494263168586428
Energy: 1.0332230836119
Energy: 0.9309369380634058
Energy: 0.9498656878966408
Energy: 1.1576266688174202
Energy: 0.9572748171613921
Energy: 0.95503263167781
Energy: 1.158616177468504
Energy: 0.9570770073158124
Energy: 0.954553305862832
Energy: 0.9712023427276065
Energy: 0.9856866014411327
Energy: 0.9745868932299412
Energy: 0.9718240401076849
Energy: 1.0247538914327872
Energy: 0.9757891636635593
Energy: 1.0068318556223184
Energy: 1.0673000445134508
Energy: 0.9757507849851721
Energy: 1.0084036487850758
Energy: 1.063082397647199
Energy: 0.9749782251824649
Energy: 0.9564216793209803
Energy: 0.9783639701056521
Energy: 0.9838385458476984
Energy: 0.9574737701714219
Energy: 0.9570946913839776
Energy: 0.9737069223054905
Energy: 0.9016120658936316
Energy: 0.9569010404949071
Energy: 0.9409308614748203
Energy: 0.9018774669487095
Energy: 0.958896134588714
Energy: 0.9389927570645843
Energy: 0.9396073120779725
Energy: 0.9605165242655292
Energy: 0.9592432307686901
Energy: 0.939372272792168
Energy: 1.0089496321446876
Energy: 0.9588055626329324
Energy: 0.9812672079238915
Energy: 0.9933327014026946
Energy: 0.9838364540866728
Energy: 0.9818058480647887
Energy: 0.9969618012742067
Energy: 0.9683564415755049
Energy: 1.0241756267385467
Energy: 0.9895359996787625
Energy: 0.9619918485279033
Energy: 1.011774520740314
Energy: 0.929784099773087
Energy: 0.9881823336132197
Energy: 0.9778301314857532
Energy: 1.002535995027319
Energy: 0.9785581447310894
Energy: 0.9629729056430012
Energy: 1.0239132692462318
Energy: 0.9727410568576338
Energy: 1.04351759659671
Energy: 0.9937634931335487
Energy: 0.9685862291611903
Energy: 1.026589645124384
Energy: 0.9910415431933901
Energy: 0.968782695790356
Energy: 0.9922864323513115
Energy: 0.9458896992542859
Energy: 0.9460759160045312
Energy: 0.9913688191793385
Energy: 0.9388589470720918
Energy: 0.9475318488082675
Energy: 0.9905744383760567
Energy: 0.9592267952267419
Energy: 0.973533219056625
Energy: 0.9710679849375156
Energy: 0.9518531065201644
Energy: 0.9721105341167998
Energy: 0.9693998403878487
Energy: 0.9853979959038555
Energy: 1.0155080079506795
Energy: 0.9521784070574332
Energy: 1.0122128812065765
Energy: 0.9648738361852525

minimum gb energy = 0.9016120658936316 eV
minimum distance =  2.34202147340971 Angstroms
sigma value = 101


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

Energy: 1.291806858203752
Energy: 1.4788431266734725
Energy: 1.4996453688474896
Energy: 1.2931065810642481
Energy: 1.67287391862161
Energy: 1.1982404609986128
Energy: 1.02717716825396
Energy: 0.976792515986998
Energy: 0.9742926249064808
Energy: 1.1369712623935893
Energy: 0.9818810435194496
Energy: 0.9388019259240185
Energy: 1.0388368221342374
Energy: 1.0719165570078295
Energy: 0.9233710691294851
Energy: 1.039838768539637
Energy: 1.072887916185338
Energy: 0.9224850331330656
Energy: 0.9800157640852933
Energy: 0.9436092204903775
Energy: 0.9407938462909574
Energy: 0.9810735825632242
Energy: 0.9666474486767292
Energy: 0.9399940841159209
Energy: 0.8840273576594302
Energy: 1.0195651603649487
Energy: 1.0511330749170196
Energy: 0.8857124514216463
Energy: 1.0407462119206041
Energy: 0.9181303387523444
Energy: 1.032703791914207
Energy: 0.9396855524318615
Energy: 0.9390593964597164
Energy: 1.0333395835051635
Energy: 1.0874098951887836
Energy: 0.9422959685348455
Energy: 0.9957670437236515
Energy: 1.3620136167288999
Energy: 0.9467370193221321
Energy: 0.995239223898047
Energy: 1.364349937555096
Energy: 1.207713462439701
Energy: 1.0528776558310289
Energy: 0.9425352142781873
Energy: 0.941262264057729
Energy: 1.053060817821245
Energy: 0.9626225145637625
Energy: 0.9780643016253641
Energy: 0.8728372644527312
Energy: 0.9392269809135028
Energy: 0.9160647360727551
Energy: 0.8740165576849875
Energy: 0.9739049768934841
Energy: 0.914843348846005
Energy: 0.9177760516603971
Energy: 0.9372309481816173
Energy: 0.936365771830228
Energy: 0.9505210218078327
Energy: 0.9944460341366896
Energy: 0.9360796309269918
Energy: 1.3238229710227445
Energy: 1.221548310553828
Energy: 1.1843370779615952
Energy: 1.3241270749080039
Energy: 1.2248306507025057
Energy: 1.1820118479293114
Energy: 0.9897507310993929
Energy: 0.9449671999461134
Energy: 0.941676106384547
Energy: 0.9899164878327997
Energy: 0.9514098861530542
Energy: 0.9408586528585187
Energy: 1.0837633692266928
Energy: 1.021789008000119
Energy: 0.9430508589764312
Energy: 1.0840542145537015
Energy: 1.0357802776771075
Energy: 0.9442041912376807
Energy: 0.894566457615914
Energy: 0.9287354548813748
Energy: 0.9291441765126989
Energy: 0.9197764731682678
Energy: 0.97040465830615
Energy: 0.9419656210535771
Energy: 0.9738345290217384
Energy: 0.8885328609518661
Energy: 0.9129178595601711
Energy: 0.974921251162956
Energy: 0.8874552452577608
Energy: 0.9140885432458756
Energy: 0.9719011333429914
Energy: 0.9326869826754998
Energy: 0.9354719035693193
Energy: 0.9719480418135777
Energy: 0.8716112772647105
Energy: 0.9355037956316916
Energy: 1.29031306631589
Energy: 1.0110841239581085
Energy: 0.9325957392997031
Energy: 1.2841260157583971
Energy: 0.9917512254493894
Energy: 1.189705267742375
Energy: 0.9773917908361353
Energy: 0.9896850245420122
Energy: 0.9660114013150066
Energy: 0.9782577932892763
Energy: 1.0080497650653388
Energy: 0.9415154302189847
Energy: 1.0364587444533837
Energy: 1.0960745131360976
Energy: 1.083702758954695
Energy: 1.0414323948486213
Energy: 1.097315646152057
Energy: 0.930559704115436
Energy: 1.1108639556925586
Energy: 0.9413035570513684
Energy: 0.9307783480855042
Energy: 1.099532950691872
Energy: 1.0957086008335308
Energy: 0.9456241293402606
Energy: 0.8873342506960823
Energy: 0.9523779667363674
Energy: 1.0641805854453643
Energy: 0.8889569126035054
Energy: 0.9935976661874901
Energy: 0.9194992577326591
Energy: 0.9747876938728407
Energy: 0.9418298229591169
Energy: 0.9403410178433651
Energy: 0.9421690240288921
Energy: 1.0251760371884993
Energy: 0.9432377466173868
Energy: 0.955172367061034
Energy: 1.1001520275352237
Energy: 0.9371320048602241
Energy: 0.9558494133627071
Energy: 1.1012465560047953
Energy: 0.9410931881345141
Energy: 1.0232260825044672
Energy: 0.9535905666280914
Energy: 0.9536349101452954
Energy: 1.0100425030896085
Energy: 0.9316691175085957
Energy: 0.9680521977968586
Energy: 0.8704052106463319
Energy: 0.9378760829857564
Energy: 0.9304579032900695
Energy: 0.8707697518440825
Energy: 0.9743611308158836
Energy: 0.9293855587415585
Energy: 0.9189625065490965
Energy: 0.9449557276338231
Energy: 0.9332356804870503
Energy: 0.8733044772664413
Energy: 1.0230842026292775
Energy: 0.9324798990666792
Energy: 1.13526344326937
Energy: 1.2176286038702115
Energy: 0.9278413295678221
Energy: 1.0731388384106901
Energy: 1.226520588328061
Energy: 0.9286454365042496
Energy: 1.0260509574764787
Energy: 0.9056551472399379
Energy: 0.9364118030972354
Energy: 1.0166747394833686
Energy: 0.8890101422836368
Energy: 0.9420434559634951
Energy: 0.8948358505635081
Energy: 0.9764821502652841
Energy: 0.9291265261255414
Energy: 1.059918735478949
Energy: 0.9757466885144309
Energy: 0.9287898816229399
Energy: 1.0831605854401847
Energy: 0.9707340216536313
Energy: 0.9307541943171503
Energy: 1.0838219391356343
Energy: 0.970465265246498
Energy: 0.9279905686385396
Energy: 0.9798468588743457
Energy: 0.9036584260446612
Energy: 0.9406012737293407
Energy: 0.9808271142213151
Energy: 0.8868341070332166
Energy: 0.9408047209208709
Energy: 0.9732852530783549
Energy: 0.9137908991424574
Energy: 0.9293621985480635
Energy: 0.9458965217695054
Energy: 0.8716771282102087
Energy: 0.9349012667513256
Energy: 1.2809697520460626
Energy: 0.984975537961999
Energy: 0.9180490609715598
Energy: 1.225771468580731
Energy: 0.9840161006222456
Energy: 0.9171486215920377

minimum gb energy = 0.8704052106463319 eV
minimum distance =  2.32184870619456 Angstroms
sigma value = 33


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

Energy: 0.015462999950685707
Energy: 0.01617287194547895
Energy: 0.016070198427066487
Energy: 0.017167501458584616
Energy: 0.721304515963058
Energy: 0.015969615318696992
Energy: 0.01621275368095948
Energy: 0.11151448769247531
Energy: 0.11005206350680434
Energy: 0.11139828124058575
Energy: 0.11192643388978189
Energy: 0.109871543063533
Energy: 1.1095339954339996
Energy: 0.7216081942653082
Energy: 0.7201367844992291
Energy: 0.7224776229902867
Energy: 0.7225096976468792
Energy: 0.7202952814766813
Energy: 0.4948324317680887
Energy: 0.11151448769333847
Energy: 0.11005206350680434
Energy: 0.11139828124014182
Energy: 0.11192643388978189
Energy: 0.10987154306308905

minimum gb energy = 0.015462999950685707 eV
minimum distance =  2.52121293084795 Angstroms
sigma value = 1