Model name: model_name=MEAM_LAMMPS_LeeShimBaskes_2003_Cu__MO_087820130586_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315634429455
cohesive_energy=3.5402784386325172
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
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: 0.013667490436308523
Energy: 0.10380357981021542
Energy: 0.6973222695161155
Energy: 0.014170454893223921
Energy: 0.10380357981084322
Energy: 0.7108713612880017
Energy: 0.014170454893223921
Energy: 0.7108713612849323
Energy: 0.6973222695375655
Energy: 0.014170454893223921
Energy: 0.013667490436308523
Energy: 0.10380357981021542
Energy: 0.014170454893223921
Energy: 0.7108713612837116
Energy: 0.10380357980958761
Energy: 0.710871361286153

minimum gb energy = 0.013667490436308523 eV
minimum distance =  2.48461300601848 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.2641387462216975
Energy: 0.9095427505962724
Energy: 0.9109377086842609
Energy: 0.8151587049909254
Energy: 0.8784524742130366
Energy: 0.8966674122968284
Energy: 0.8783909241015597
Energy: 0.8966674122968284
Energy: 0.9095743847595307
Energy: 0.9096326142451853
Energy: 1.3760348252423706
Energy: 0.909632614244424
Energy: 0.8737869855408122
Energy: 1.0427666116523782
Energy: 0.8779871205425827
Energy: 1.0427666116523782
Energy: 1.1735197307932876
Energy: 0.8566254476090908
Energy: 0.8242626236956216
Energy: 0.8566254476083294
Energy: 0.9187065348681034
Energy: 1.1785311626455721
Energy: 0.8459859658433522
Energy: 1.1785311626448107
Energy: 0.886301838904778
Energy: 0.9465651904927675
Energy: 1.1744282577193867
Energy: 0.9465651904927675
Energy: 0.8797835059323935
Energy: 1.2027905082096817
Energy: 0.8964721197265495
Energy: 1.202790508210443
Energy: 1.0076518836837014
Energy: 0.9905382460670196
Energy: 1.011138166199257
Energy: 0.990538246067781
Energy: 0.8942231864543972
Energy: 1.2410433065121664
Energy: 0.8799100697990736
Energy: 1.241043306512928
Energy: 1.0830237562374065
Energy: 0.9906902583714248
Energy: 1.0096601930923967
Energy: 0.9906902583714248
Energy: 0.8768311920421389
Energy: 1.079099253311198
Energy: 0.899580542334872
Energy: 1.0790992533104369
Energy: 0.8827242576721313
Energy: 0.9467526180317931
Energy: 1.2668921518143774
Energy: 0.9467526180325546
Energy: 0.9186155346391366
Energy: 1.1791147606748789
Energy: 0.8826376207976258
Energy: 1.1791147606748789
Energy: 1.2654371935688369
Energy: 0.8562212894916553
Energy: 0.8210788134650295
Energy: 0.8562212894924166
Energy: 0.8554284522000186
Energy: 1.0422060357524219
Energy: 0.8777917445392294
Energy: 1.0422060357524219
Energy: 0.9100729349317568
Energy: 0.9065499513947207
Energy: 1.4857742690708335
Energy: 0.9065499513939593
Energy: 0.877940840917196
Energy: 0.874994005539026
Energy: 0.9356797176264576
Energy: 0.8749940055382645
Energy: 1.3769031223604449
Energy: 0.9075323628256688
Energy: 0.9090275849156397
Energy: 0.9075323628256688
Energy: 0.9182012985902425
Energy: 1.0427129797733035
Energy: 0.8732769770967835
Energy: 1.0427129797755876
Energy: 0.8212331382384864
Energy: 0.8565713145485886
Energy: 1.174309221051833
Energy: 0.8565713145478273
Energy: 0.8699095762572654
Energy: 1.277231006089845
Energy: 0.9184293149166439
Energy: 1.277231006089845
Energy: 1.173817050191073
Energy: 0.9500984353003393
Energy: 0.882571750557035
Energy: 0.9500984352995779
Energy: 0.8968355711875396
Energy: 1.2027946336102282
Energy: 0.8777393160139192
Energy: 1.2027946336094666
Energy: 1.0090530541857552
Energy: 0.9921425240273264
Energy: 1.008505362012953
Energy: 0.9921425240273264
Energy: 0.881577714681413
Energy: 0.991645105254709
Energy: 0.8962180666819101
Energy: 0.9916451052539476
Energy: 1.0083366674294763
Energy: 0.9925147591936968
Energy: 1.0863588755498368
Energy: 0.9925147591936968
Energy: 0.8972333773319895
Energy: 1.0211260995573226
Energy: 0.8876437449107916
Energy: 1.0211260995573226
Energy: 1.270712431398658
Energy: 0.9469100476903584
Energy: 0.8821794892463235
Energy: 0.946910047689597
Energy: 0.8827736367064857
Energy: 1.0048445011110967
Energy: 0.9184084604591141
Energy: 1.004844501111858
Energy: 0.8206708259891463
Energy: 0.8554969267043602
Energy: 1.2691248029078204
Energy: 0.8554969267043602
Energy: 0.8781136893035993
Energy: 1.0421465788630935
Energy: 0.8552767072728258
Energy: 1.0421465788630935
Energy: 1.4886087135826616
Energy: 0.871767443387383
Energy: 0.910077295243887
Energy: 0.871767443387383

minimum gb energy = 0.8151587049909254 eV
minimum distance =  2.28666652734107 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 1.4330390213946655
Energy: 0.9587091308726812
Energy: 0.9577758469049367
Energy: 0.850819476990992
Energy: 0.9224860313018098
Energy: 0.939463044072749
Energy: 0.9224807717694092
Energy: 0.9394630440736171
Energy: 0.9597279264761835
Energy: 0.959495452782244
Energy: 1.3148620094317647
Energy: 0.959495452781376
Energy: 0.9202644354345673
Energy: 1.0654274519821758
Energy: 0.9230371016011967
Energy: 1.0654274519821758
Energy: 1.3146697046775129
Energy: 0.8996584316805869
Energy: 0.8608847670650092
Energy: 0.8996584316814551
Energy: 0.9702676919213977
Energy: 1.2876385387248916
Energy: 0.8889488473371829
Energy: 1.2876385387240235
Energy: 0.9401348102381619
Energy: 1.0040703005879135
Energy: 1.1006804987788132
Energy: 1.0040703005887817
Energy: 0.9223243451602985
Energy: 1.2189968958115234
Energy: 0.946066569211939
Energy: 1.2189968958106554
Energy: 1.1005944944321921
Energy: 1.047683799173933
Energy: 1.0076450954274239
Energy: 1.0476837991731043
Energy: 0.9470112455034373
Energy: 1.0688021466480553
Energy: 0.9227606970066344
Energy: 1.0688021466428466
Energy: 1.1966556456175748
Energy: 1.003710742424587
Energy: 0.9414501386582874
Energy: 1.003710742424587
Energy: 0.931764074720582
Energy: 1.1789883623681439
Energy: 0.9697772346591201
Energy: 1.1789883622310606
Energy: 0.8617806864213532
Energy: 0.9007511935832503
Energy: 1.196137371281076
Energy: 0.9007511935823822
Energy: 0.9225458390570178
Energy: 1.0654678597080405
Energy: 0.8973924589764191
Energy: 1.0654678596985308
Energy: 1.4347431306843657
Energy: 0.9592375304409272
Energy: 0.9584378761242809
Energy: 0.9592375304409272
Energy: 0.9884931832175846
Energy: 0.9188133127063819
Energy: 0.9225828491157628
Energy: 0.9188133127072501
Energy: 0.9577107339895081
Energy: 0.9589477105017247
Energy: 1.3156091290344336
Energy: 0.958947710504329
Energy: 0.9177696185241188
Energy: 1.0655288900511308
Energy: 0.9692710927521987
Energy: 1.0655288899183883
Energy: 1.3152192485030771
Energy: 0.8998081346958288
Energy: 0.8615580085385597
Energy: 0.8998081346949606
Energy: 0.9702616527667666
Energy: 1.2880263253817708
Energy: 0.8895638189235179
Energy: 1.2880263253817708
Energy: 0.9402897846676578
Energy: 1.0040901903101176
Energy: 1.1006585550195838
Energy: 1.004090190311854
Energy: 0.9223414484069261
Energy: 1.1379870631602118
Energy: 0.9468011139816807
Energy: 1.1379870631576077
Energy: 1.1014338494363352
Energy: 1.0481772601930932
Energy: 1.0120419555532234
Energy: 1.048177260191357
Energy: 0.9472871834068771
Energy: 1.043437519746914
Energy: 0.9357693126567894
Energy: 1.0434375197451775
Energy: 1.194889391644476
Energy: 1.0029893921579602
Energy: 0.9398711400147948
Energy: 1.0029893921579602
Energy: 0.9319858950051819
Energy: 1.0574706039385111
Energy: 0.9691728379360863
Energy: 1.0574706039385111
Energy: 0.8612732614188794
Energy: 0.8619054929065465
Energy: 1.1992215689060226
Energy: 0.861905492902206
Energy: 0.922591980165199
Energy: 0.8621423472978721
Energy: 0.8976077315073587
Energy: 0.8621423472952677
Energy: 1.4388672783503622
Energy: 0.919028071579509
Energy: 0.9576138834734184
Energy: 0.919028071579509

minimum gb energy = 0.850819476990992 eV
minimum distance =  2.29017548667216 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 1.3583458407659184
Energy: 1.012447581926859
Energy: 1.0126431099084063
Energy: 0.8884524451195249
Energy: 0.972510090214769
Energy: 0.9844875928862514
Energy: 0.9724096274120497
Energy: 0.9844875928862514
Energy: 1.012180685723429
Energy: 1.0128009174922195
Energy: 1.230285536880945
Energy: 1.0128009174922195
Energy: 0.9657908970276385
Energy: 1.0868483883104512
Energy: 0.9727941231773604
Energy: 1.086848388309442
Energy: 1.2322824862659456
Energy: 0.9052270037141423
Energy: 0.9048364295035166
Energy: 0.9052270037151515
Energy: 1.027197042000955
Energy: 1.3028099540564821
Energy: 0.9361389068515926
Energy: 1.3028099540564821
Energy: 1.0156458938391544
Energy: 1.0705944196728272
Energy: 1.014693633082757
Energy: 1.070594419671818
Energy: 0.9724342563623906
Energy: 1.3360271641048702
Energy: 1.0034900578446164
Energy: 1.3360271641048702
Energy: 1.0154720279006577
Energy: 1.0688602549582755
Energy: 1.1072147710538478
Energy: 1.0688602549582755
Energy: 1.0274659756056839
Energy: 1.1687165415003664
Energy: 0.9903474688707427
Energy: 1.1687165415003664
Energy: 1.3627862074240118
Energy: 0.9469710739153895
Energy: 0.9036150039145158
Energy: 0.9469710739153895
Energy: 0.9444743796114903
Energy: 1.0869202370722926
Energy: 0.9724076937106884
Energy: 1.0869202370722926
Energy: 1.011922972683367
Energy: 1.012209590379294
Energy: 1.3605256301501278
Energy: 1.012209590379294
Energy: 0.9726200020328529
Energy: 0.9661107733803492
Energy: 1.047246522892519
Energy: 0.9661107733803492
Energy: 1.2310662051930592
Energy: 1.0124809436098259
Energy: 1.0137008441381528
Energy: 1.0124809436098259
Energy: 1.0727446132455014
Energy: 0.9853900863486955
Energy: 0.9656206484040555
Energy: 0.9853900863486955
Energy: 0.9050634213890344
Energy: 0.9049222322026299
Energy: 1.2327626643794416
Energy: 0.9049222322046481
Energy: 0.9359157612573737
Energy: 1.3032817266968986
Energy: 1.0275972946451153
Energy: 1.3032817266958894
Energy: 1.0147711369350725
Energy: 1.1121456426485434
Energy: 1.0165066259194804
Energy: 1.1121456426485434
Energy: 1.0045608542265672
Energy: 1.070957511969227
Energy: 0.9739737076543228
Energy: 1.070957511969227
Energy: 1.1027759226224192
Energy: 1.0679178265270568
Energy: 1.0146294602284638
Energy: 1.067917826528066
Energy: 0.9874836832151951
Energy: 1.0831632241525995
Energy: 1.0265796473420465
Energy: 1.0831632241515903
Energy: 0.9049780379886592
Energy: 0.9477012150299051
Energy: 1.3613455191515127
Energy: 0.9477012150288959
Energy: 0.9725445701687111
Energy: 0.949045338069009
Energy: 0.9440362911443264
Energy: 0.949045338069009
Energy: 1.3587812734266593
Energy: 0.964985539487393
Energy: 1.0124650326587834
Energy: 0.964985539487393

minimum gb energy = 0.8884524451195249 eV
minimum distance =  2.29346200211849 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 1.2474170625593424
Energy: 1.0695978053787927
Energy: 1.0700861640906885
Energy: 0.9221145046669169
Energy: 1.024413313664167
Energy: 1.0253974070352492
Energy: 1.024735883986384
Energy: 1.0253974070364533
Energy: 1.0700913630262328
Energy: 1.0695909628508962
Energy: 1.4687870526384506
Energy: 1.0695909628508962
Energy: 1.0122759805680548
Energy: 1.105071557612625
Energy: 1.0248487204547014
Energy: 1.1050715576138292
Energy: 1.1187136392448211
Energy: 0.9533986739960084
Energy: 0.9531997470858101
Energy: 0.9533986740994856
Energy: 1.0921629104650048
Energy: 1.294386325591426
Energy: 0.9844782428285119
Energy: 1.294386325591426
Energy: 0.9902133364885235
Energy: 1.1750706024847988
Energy: 1.1210816808725905
Energy: 1.1750706024847988
Energy: 1.0527270049913695
Energy: 1.291122454419412
Energy: 1.0914818014232326
Energy: 1.291122454419412
Energy: 0.9516782576074896
Energy: 0.9532168041426203
Energy: 1.2509699514666133
Energy: 0.9532168041426203
Energy: 1.0245325826310823
Energy: 1.1046389699435495
Energy: 0.9904532708674475
Energy: 1.1046389699447532
Energy: 1.2502457001341345
Energy: 1.0695165607712782
Energy: 1.0766233780622296
Energy: 1.069516560772482
Energy: 1.1112645427774728
Energy: 1.0126190847589267
Energy: 1.024796828750273
Energy: 1.0126190847589267
Energy: 1.070721761877997
Energy: 1.069769756799331
Energy: 1.4699461929744548
Energy: 1.069769756799331
Energy: 1.012678968576672
Energy: 1.0248716584830864
Energy: 1.1487370572434787
Energy: 1.0248716584830864
Energy: 1.1188407764271482
Energy: 0.9534636322629516
Energy: 0.9526640655935552
Energy: 0.9534636322629516
Energy: 1.0916405349667984
Energy: 0.9980942766790899
Energy: 0.9520587805448749
Energy: 0.9980942766790899
Energy: 0.9900958413004433
Energy: 1.1763835500360371
Energy: 1.120507347410065
Energy: 1.1763835500372408
Energy: 0.9901503373822004
Energy: 1.1404273808080982
Energy: 1.091147475746095
Energy: 1.1404273808080982
Energy: 0.9509932012623878
Energy: 0.9528702528367845
Energy: 1.25149864560485
Energy: 0.9528702528415999
Energy: 1.0246599948224293
Energy: 0.9997736676753074
Energy: 0.9902371833760175
Energy: 0.9997736676753074
Energy: 1.2475555186904077
Energy: 1.012186659208972
Energy: 1.0700276808622675
Energy: 1.0121866592077684

minimum gb energy = 0.9221145046669169 eV
minimum distance =  2.29592923878401 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.0871566533666484
Energy: 1.128100067228266
Energy: 1.1382034659634086
Energy: 0.9435696617324538
Energy: 1.0736305751041613
Energy: 1.0167735015458481
Energy: 1.0735950922137882
Energy: 1.0167735015458481
Energy: 1.1282563417554312
Energy: 1.1283650451914287
Energy: 1.336497492339626
Energy: 1.1283650451899396
Energy: 1.060970314004043
Energy: 1.0177259532817458
Energy: 1.0736409262520916
Energy: 1.0177259532817458
Energy: 1.0092135001617106
Energy: 1.1324643354078574
Energy: 1.013661075680861
Energy: 1.1324643354078574
Energy: 1.1884346260343026
Energy: 1.0534360479745708
Energy: 0.9621759436150332
Energy: 1.0534360479745708
Energy: 1.0896592184767626
Energy: 1.1060119404401108
Energy: 1.011457561321251
Energy: 1.1060119404401108
Energy: 1.0749371732475532
Energy: 1.0916206132334325
Energy: 1.0735936533583061
Energy: 1.0916206132334325
Energy: 1.137650022708964
Energy: 1.179291729327336
Energy: 1.5932800354740955
Energy: 1.179291729328825
Energy: 1.07358278940181
Energy: 1.0178860189607044
Energy: 1.1841767375258623
Energy: 1.0178860189607044
Energy: 1.3376568543335643
Energy: 1.128341671469745
Energy: 1.129924909238401
Energy: 1.128341671469745
Energy: 1.1876059280238982
Energy: 1.0180285547564685
Energy: 1.1298106656925813
Energy: 1.0180285547564685
Energy: 1.0801375615818565
Energy: 1.1075432714449083
Energy: 1.0096687810539657
Energy: 1.1075432701755323
Energy: 1.0134683474262407
Energy: 1.1059334427472363
Energy: 1.189849489985429
Energy: 1.1059334427472363
Energy: 1.0103289177109014
Energy: 1.091042678520987
Energy: 1.15164916758713
Energy: 1.091042678520987
Energy: 1.0736242155506877
Energy: 1.0917934689844615
Energy: 1.0908513968177878
Energy: 1.0917934689844615
Energy: 1.185126853308267
Energy: 1.179637069172835
Energy: 1.137985674662022
Energy: 1.179637069172835

minimum gb energy = 0.9435696617324538 eV
minimum distance =  2.29547466738029 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 1.5222191534701737
Energy: 1.2797013705512872
Energy: 1.2775224963438552
Energy: 1.1769358163779295
Energy: 1.052826871329354
Energy: 1.0166532748492758
Energy: 1.2153872439529978
Energy: 1.016653274503722
Energy: 1.0579166707527987
Energy: 1.0635707270084056
Energy: 1.3801933156213775
Energy: 1.0635707270092487
Energy: 1.0146836473750864
Energy: 1.0834507413503522
Energy: 1.2158638576114202
Energy: 1.0834507413503522
Energy: 1.1399730284223446
Energy: 1.2489704124987566
Energy: 1.0374630921247066
Energy: 1.2489704124987566
Energy: 1.2160356517553885
Energy: 1.142629206042685
Energy: 1.099591698281135
Energy: 1.142629206042685
Energy: 1.2405142581722746
Energy: 1.0652799528393635
Energy: 1.0650456729882545
Energy: 1.0652799528402066
Energy: 1.268120232943876
Energy: 1.0647003755904851
Energy: 1.0627380442498204
Energy: 1.0647003755904851
Energy: 1.2794445306614344
Energy: 1.2789502948149265
Energy: 1.3818657081279473
Energy: 1.27895029481577
Energy: 1.2052810342508566
Energy: 1.1367324509141854
Energy: 1.2138668447836893
Energy: 1.136732450913342
Energy: 1.1385156840819355
Energy: 1.1661984522305715
Energy: 1.0540882248322514
Energy: 1.1661984522263555
Energy: 1.270158763179173
Energy: 1.1341344382593732
Energy: 0.9967146203373148
Energy: 1.1341344382475687
Energy: 1.076165193325
Energy: 1.1338389808566116
Energy: 0.9957259846631222
Energy: 1.1338389808566116
Energy: 1.2377360128574333
Energy: 1.0406319597214604
Energy: 1.0535938232843478
Energy: 1.0406319597248332
Energy: 1.2739241711886609
Energy: 1.267280533202195
Energy: 1.313857994473154
Energy: 1.2672805332013521
Energy: 1.2803796841760775
Energy: 1.2241845014676525
Energy: 1.5508030899537848
Energy: 1.2241845014676525
Energy: 1.4387055621448597
Energy: 1.0648097096909672
Energy: 1.064413947309667
Energy: 1.0648097096892808
Energy: 1.3685874410250018
Energy: 1.0645165450279963
Energy: 1.0574591442578154
Energy: 1.0645165450279963
Energy: 1.213886456732681
Energy: 1.1219846402721014
Energy: 1.139292003181074
Energy: 1.1219846402308238
Energy: 1.0370571087278835
Energy: 1.3218008715713117
Energy: 1.1266873564409488
Energy: 1.3218008715721545
Energy: 1.0153439032903402
Energy: 1.0172935470917246
Energy: 1.2689758837287726
Energy: 1.0172935470908815
Energy: 1.0634119325979188
Energy: 1.0708991512332044
Energy: 1.2357827737308702
Energy: 1.0708991512332044
Energy: 1.215376927294963
Energy: 1.150042645271729
Energy: 1.2315888877189316
Energy: 1.1500426452708858
Energy: 1.3811381546707258
Energy: 1.2792265259183355
Energy: 1.2802814222925027
Energy: 1.2792265259183355
Energy: 0.9970409883539337
Energy: 1.1499759282462865
Energy: 1.174107745788189
Energy: 1.1499759282471296
Energy: 0.9957275948830954
Energy: 0.9969381816498407
Energy: 1.1403054806797157
Energy: 0.9969381816489976
Energy: 1.033015667128794
Energy: 0.995930027961636
Energy: 1.2698003065901036
Energy: 0.995930027961636
Energy: 0.9954093806008002
Energy: 0.9969017593884723
Energy: 1.238291765802432
Energy: 0.9969017594221997
Energy: 1.0556622303749708
Energy: 1.0143170386665135
Energy: 1.172837449846374
Energy: 1.0143170386656701
Energy: 1.5232699890871104
Energy: 1.2801722697787337
Energy: 1.2751514250721108
Energy: 1.2801722697787337

minimum gb energy = 0.9954093806008002 eV
minimum distance =  2.28639994281124 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 1.3594578940416997
Energy: 1.1723658543430562
Energy: 1.1730033104986473
Energy: 0.9167257922344064
Energy: 1.0984100561525758
Energy: 1.1436716074604556
Energy: 1.1189373274775312
Energy: 1.143671607404206
Energy: 1.1681401676183019
Energy: 1.4373511123292642
Energy: 1.1269648792596352
Energy: 1.4373511123312053
Energy: 1.0992150833461882
Energy: 1.1439030985746452
Energy: 1.118985913125292
Energy: 1.1439030964635846
Energy: 1.1324836538336591
Energy: 0.9729725542690302
Energy: 0.8966144862947178
Energy: 0.9729725542690302
Energy: 1.096574420330324
Energy: 1.4589642812188517
Energy: 0.8968151613200052
Energy: 1.4589642812188517
Energy: 1.364079670547522
Energy: 1.195293246701366
Energy: 1.1711226957294525
Energy: 1.195293246701366
Energy: 1.2908832499147438
Energy: 1.3844563500507394
Energy: 1.2145801187367198
Energy: 1.3844563500507394
Energy: 1.1690233973191733
Energy: 1.4374561851295302
Energy: 1.1287687307353043
Energy: 1.4374561851295302
Energy: 1.0970054772258633
Energy: 1.1444106449481455
Energy: 1.1187936948980965
Energy: 1.1444106449481455
Energy: 1.131505239810202
Energy: 1.183436760641311
Energy: 0.8968758859289204
Energy: 1.183436760641311
Energy: 1.1177851329871893
Energy: 1.1833689126355942
Energy: 0.8992672258017501
Energy: 1.1833689126375355
Energy: 1.2908279257001571
Energy: 1.1436008472872725
Energy: 1.193573746655321
Energy: 1.143600847281449

minimum gb energy = 0.8966144862947178 eV
minimum distance =  2.2716959972514 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 1.3169410688555565
Energy: 1.380366989812613
Energy: 1.380928921185438
Energy: 1.2859427102462728
Energy: 1.1486508205001313
Energy: 1.253279889661463
Energy: 1.4100555488571493
Energy: 1.2532798896621813
Energy: 1.0086350318249102
Energy: 1.011415852915485
Energy: 1.2268038826057501
Energy: 1.0114158529162038
Energy: 1.0119693052310135
Energy: 1.0399479394920061
Energy: 1.4027164794079805
Energy: 1.0399479394927247
Energy: 1.0103773212150813
Energy: 1.0084911281393505
Energy: 1.3759068638344296
Energy: 1.0084911281400688
Energy: 1.1132844599014322
Energy: 1.2523137440602754
Energy: 1.3749943504390998
Energy: 1.252313744059557
Energy: 1.4948276718682363
Energy: 1.339143721190914
Energy: 1.3816947511628366
Energy: 1.3391437211901958
Energy: 1.4942934535581043
Energy: 1.3041375627161078
Energy: 1.3477957691682267
Energy: 1.3041375627161078
Energy: 1.097257396729468
Energy: 1.3495844412538147
Energy: 1.056578329437753
Energy: 1.3495844412538147
Energy: 0.9767787006495825
Energy: 1.0580618471491217
Energy: 1.288190150048073
Energy: 1.0580618642300512
Energy: 1.136930512848045
Energy: 1.1385970436452268
Energy: 1.3577002010500987
Energy: 1.1385970436459454
Energy: 1.1646391548154669
Energy: 1.2198405547696582
Energy: 1.3215927378803962
Energy: 1.2198405547703768
Energy: 1.4955373448271128
Energy: 1.132883710608691
Energy: 1.2893942332645587
Energy: 1.132883710608691
Energy: 1.480079982881412
Energy: 1.1380456054655872
Energy: 1.1621691292641372
Energy: 1.1380456054648687
Energy: 1.2873365202024973
Energy: 1.151568192038624
Energy: 1.0604613645184755
Energy: 1.1515681920379057
Energy: 1.135679908642459
Energy: 1.3353819233550084
Energy: 1.0939408819704717
Energy: 1.3353819233564455
Energy: 1.2990992976737594
Energy: 1.2933843151676423
Energy: 1.1936588555407168
Energy: 1.2933843151410596
Energy: 1.3797285061374747
Energy: 1.3794942712123093
Energy: 1.3177148136497105
Energy: 1.3794942712108722
Energy: 1.3675842375116405
Energy: 1.3054546530657505
Energy: 1.219844695059177
Energy: 1.3054546530650317
Energy: 1.2263488042082016
Energy: 1.0111758642699502
Energy: 1.008591936548977
Energy: 1.0111758642742612
Energy: 1.4028884924184948
Energy: 1.0088123838057657
Energy: 1.0117940819850744
Energy: 1.0088123838036103
Energy: 1.3775845532014566
Energy: 1.008362003374843
Energy: 1.0082820408692876
Energy: 1.0083620033755618
Energy: 1.3761935735218565
Energy: 1.2514275496352254
Energy: 1.0666290177033466
Energy: 1.2514275496352254
Energy: 1.3781393306160448
Energy: 1.3182847124641308
Energy: 1.4974848279109565
Energy: 1.3182847124641308
Energy: 1.3492232893531966
Energy: 1.3038787364373623
Energy: 1.5009396047409613
Energy: 1.303878736436644
Energy: 1.0585634963627408
Energy: 1.3522605635189324
Energy: 1.1060058754079842
Energy: 1.3522605635210876
Energy: 1.2869781069085817
Energy: 1.1229685164131942
Energy: 0.9766854028762348
Energy: 1.122968516411757
Energy: 1.47406272758737
Energy: 1.1327014352792728
Energy: 1.1377591886219935
Energy: 1.1327014352799913
Energy: 1.3191778449613956
Energy: 1.2299285278544414
Energy: 1.164557298273363
Energy: 1.229928527853723
Energy: 1.2683264287565352
Energy: 1.1320365766894167
Energy: 1.4119557791313262
Energy: 1.132036576688698
Energy: 1.1623470558863778
Energy: 1.1390144909316922
Energy: 1.2290047738865144
Energy: 1.139014490930255
Energy: 1.1062744333847778
Energy: 1.1250472581075015
Energy: 1.2873493385558348
Energy: 1.1250472581060644
Energy: 1.0619988874647859
Energy: 1.1710974701687014
Energy: 1.1384119598094846
Energy: 1.1710974701679826
Energy: 1.1878032695772454
Energy: 1.341776760279964
Energy: 1.2170302024960533
Energy: 1.341776760278527
Energy: 1.3198233638753252
Energy: 1.3800363164900644
Energy: 1.3794386797068792
Energy: 1.3800363164893459

minimum gb energy = 0.9766854028762348 eV
minimum distance =  2.28330185700709 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 1.381547957972927
Energy: 1.295134699965137
Energy: 1.2954398347724734
Energy: 1.205506948587666
Energy: 1.3569391687697183
Energy: 1.3392425347337384
Energy: 1.4555089082139365
Energy: 1.3392425347348784
Energy: 1.0433931348533612
Energy: 1.2474427872464255
Energy: 1.1820379664060585
Energy: 1.2474427872464255
Energy: 1.073626652543634
Energy: 1.0817145150344754
Energy: 1.4205729999506351
Energy: 1.0817145150344754
Energy: 1.0703531553285786
Energy: 1.0513397168163126
Energy: 1.423492591936477
Energy: 1.0513397168151726
Energy: 1.14263929727275
Energy: 1.2552165000232771
Energy: 1.415507455085565
Energy: 1.2552165000232771
Energy: 1.6637444681477649
Energy: 1.4798870566155085
Energy: 1.3505149515906745
Energy: 1.4798870566155085
Energy: 1.5996251745840389
Energy: 1.2418313191449144
Energy: 1.3082047724110535
Energy: 1.2418313191449144
Energy: 1.1754947161373144
Energy: 1.297719481211226
Energy: 1.2044054944097233
Energy: 1.297719481210086
Energy: 1.0462044832520945
Energy: 1.2164422450472065
Energy: 1.284264185879746
Energy: 1.2164422450472065
Energy: 1.1873505285140054
Energy: 1.073083113213742
Energy: 1.2849253531102718
Energy: 1.073083113212602
Energy: 1.1434125983257404
Energy: 1.0748858307007603
Energy: 1.249597926519522
Energy: 1.0748858307007603
Energy: 1.2273698136414402
Energy: 1.1742384485199053
Energy: 1.1650124309269194
Energy: 1.1742384485199053
Energy: 1.1819057388585323
Energy: 1.230122294659507
Energy: 1.1157724290099376
Energy: 1.230122294659507
Energy: 1.2831563546808387
Energy: 1.2032953959052326
Energy: 1.0756414339480325
Energy: 1.2032953959052326
Energy: 1.3896005171881496
Energy: 1.314446468937688
Energy: 1.1115900390883202
Energy: 1.314446468937688
Energy: 1.3703097265090691
Energy: 1.213633110293294
Energy: 1.1580811382723193
Energy: 1.2136331102944338
Energy: 1.3165615454048534
Energy: 1.3536892708700927
Energy: 1.660147101659356
Energy: 1.3536892708712327
Energy: 1.2245813135865982
Energy: 1.2109098838094823
Energy: 1.4744533132956663
Energy: 1.2109098838106223
Energy: 1.1286990763956741
Energy: 1.2213799619095462
Energy: 1.1638844504328445
Energy: 1.2213799619095462
Energy: 1.1723364430645964
Energy: 1.213760166981109
Energy: 1.0469081242854164
Energy: 1.213760166981109
Energy: 1.38272179046096
Energy: 1.2457004541674326
Energy: 1.2790333338030933
Energy: 1.2457004541674326

minimum gb energy = 1.0433931348533612 eV
minimum distance =  2.27561701464203 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 1.6744903035788423
Energy: 1.3423225102107395
Energy: 1.379070833329291
Energy: 1.2657538172642013
Energy: 1.1199764069282274
Energy: 1.1956644986411484
Energy: 1.3762891473717405
Energy: 1.1956644986500145
Energy: 1.0298710750206526
Energy: 1.2028078071723889
Energy: 1.142852842535914
Energy: 1.2028078071740007
Energy: 1.0552676332149242
Energy: 1.094974746009524
Energy: 1.3633816668744483
Energy: 1.094974746008718
Energy: 1.1269396717997322
Energy: 1.1142777345270476
Energy: 1.286717521703415
Energy: 1.1142777345270476
Energy: 1.1413022894126847
Energy: 1.2013443462778601
Energy: 1.2868867025122679
Energy: 1.2013443462746358
Energy: 1.4850775273739527
Energy: 1.2916703453991987
Energy: 1.1669810729898316
Energy: 1.2916703453975866
Energy: 1.4138686491966723
Energy: 1.103895942281832
Energy: 1.16283162779426
Energy: 1.10389594228425
Energy: 1.350253658524483
Energy: 1.033288853274861
Energy: 1.0325502970984828
Energy: 1.0332888532772424
Energy: 1.2870390185274434
Energy: 1.2455203951925506
Energy: 1.0374678505242922
Energy: 1.2455203951917446
Energy: 1.3796794269204422
Energy: 1.3122919628734653
Energy: 1.2155667317890415
Energy: 1.3122919628734653
Energy: 1.3892862884724835
Energy: 1.3050784515100446
Energy: 1.480448672000761
Energy: 1.3050784515092386
Energy: 1.2117220113019014
Energy: 1.21984225170405
Energy: 1.1939785594968249
Energy: 1.219842251703244
Energy: 1.161090849676569
Energy: 1.1692645213393302
Energy: 1.0502695523203156
Energy: 1.1692645213385242
Energy: 1.21454521867928
Energy: 1.1430347857453234
Energy: 1.0941264915294495
Energy: 1.1430347857453234
Energy: 1.5791606075260964
Energy: 1.1664727827852148
Energy: 1.2725949615326395
Energy: 1.1664727827868269
Energy: 1.495521011848659
Energy: 1.1422453634840437
Energy: 1.428294124559535
Energy: 1.14224536348485
Energy: 1.1085058679983428
Energy: 1.394591539372018
Energy: 1.1413988550053442
Energy: 1.3945915393736301
Energy: 1.0840864521635036
Energy: 1.0852307373329313
Energy: 1.3534740541145454
Energy: 1.0852307339789526
Energy: 1.140013955884986
Energy: 1.1194235914022106
Energy: 1.4083012049870998
Energy: 1.119423591415107
Energy: 1.182071239283623
Energy: 1.4689902117889753
Energy: 1.2899364724515587
Energy: 1.4689902117905873
Energy: 1.4635677792217967
Energy: 1.3149362539019251
Energy: 1.3715663611253057
Energy: 1.3149362539027312
Energy: 1.462717893029636
Energy: 1.1206065118469577
Energy: 1.1452374637401763
Energy: 1.1206065118477635
Energy: 1.3498295267881104
Energy: 1.0798205051637275
Energy: 1.045603767112512
Energy: 1.0798205051621155
Energy: 1.2881656614266046
Energy: 1.3680826510353772
Energy: 1.0314044080195102
Energy: 1.3680826510345714
Energy: 1.312821956465199
Energy: 1.1958568030982861
Energy: 1.1145441852214002
Energy: 1.1958568030982861
Energy: 1.3748720381414916
Energy: 1.3457244668568091
Energy: 1.4771841437544357
Energy: 1.345724466855197
Energy: 1.1897588148639673
Energy: 1.189235739617382
Energy: 1.2338590652854358
Energy: 1.1892357396198003
Energy: 1.1013229008748273
Energy: 1.191032206827973
Energy: 1.1375768435429296
Energy: 1.191032206827973
Energy: 1.1428048845924492
Energy: 1.1664292169760349
Energy: 1.0509778897195763
Energy: 1.1664292169768407
Energy: 1.6198960745079132
Energy: 1.2791661952546902
Energy: 1.3322064541775644
Energy: 1.2791661952587208

minimum gb energy = 1.0298710750206526 eV
minimum distance =  2.24557735925016 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 0.9049500942994653
Energy: 1.2386811988600335
Energy: 1.173350519285833
Energy: 0.9065329185799775
Energy: 1.1276794554649414
Energy: 1.016579677379986
Energy: 1.132166071058366
Energy: 1.0165796773802669
Energy: 1.3359823230606604
Energy: 1.2406202452382746
Energy: 1.091018053130275
Energy: 1.240620245237994
Energy: 1.0990029323549615
Energy: 0.9247768443930171
Energy: 1.131794517616508
Energy: 0.9247768443935473
Energy: 1.0999266601815383
Energy: 1.0982704763008024
Energy: 0.9089746252772822
Energy: 1.0982704763013638
Energy: 1.1316884045788387
Energy: 1.1781507433091165
Energy: 0.9089136230345619
Energy: 1.1781507433091165
Energy: 0.9117432337773909
Energy: 0.9901632017682932
Energy: 1.33681811608871
Energy: 0.99016320176664
Energy: 1.1315904168034978
Energy: 0.925990641845235
Energy: 0.9385793894842235
Energy: 0.9259906418416789
Energy: 0.9089351863934748
Energy: 0.928571235728852
Energy: 1.0946796740505633
Energy: 0.9285712357283218

minimum gb energy = 0.9049500942994653 eV
minimum distance =  2.32207357487365 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 1.2224649799278595
Energy: 1.2072073515390416
Energy: 1.2493144318575353
Energy: 0.9272326865181095
Energy: 1.3034664797969597
Energy: 0.936013869770002
Energy: 1.101591173078526
Energy: 0.9360138697722861
Energy: 1.1035996569189654
Energy: 1.0045253213852154
Energy: 1.088748404016302
Energy: 1.004525321384454
Energy: 0.9462428317308813
Energy: 0.9338914706135935
Energy: 1.2669092638180797
Energy: 0.9338914706143547
Energy: 1.122321328375049
Energy: 0.9736196476224078
Energy: 1.4023505082365488
Energy: 0.9736196476224078
Energy: 0.9768818587330443
Energy: 0.9792761461017206
Energy: 1.349996715346291
Energy: 0.9792761461024821
Energy: 0.9333321498545158
Energy: 0.934401802355971
Energy: 1.2737468670675614
Energy: 0.934401802355971
Energy: 0.9809286536884728
Energy: 0.9364625175109957
Energy: 1.2279090403306574
Energy: 0.9364625175117572
Energy: 1.2743408931726765
Energy: 0.9822060010406798
Energy: 1.2804448233202077
Energy: 0.9822060010406798
Energy: 1.082662520693758
Energy: 0.9240834704674286
Energy: 1.1429646168844065
Energy: 0.9240834704681898
Energy: 1.2588726960199912
Energy: 0.9233300624439299
Energy: 0.9242395805980428
Energy: 0.9233300624431685
Energy: 1.2437530494797684
Energy: 0.9631682104423586
Energy: 0.9682640381964853
Energy: 0.96316821044312
Energy: 1.2630374506466404
Energy: 1.1870402274658356
Energy: 1.108648149456257
Energy: 1.187040227466597
Energy: 1.2532582639282333
Energy: 1.1852128083677604
Energy: 1.0979518056873128
Energy: 1.1852128083685218
Energy: 0.9395551120496402
Energy: 0.9354831644360794
Energy: 1.1008041568499032
Energy: 0.9354831644337952
Energy: 0.9380878345563843
Energy: 0.9348355381100321
Energy: 1.3007710663794954
Energy: 0.9348355381100321
Energy: 1.2425015984941707
Energy: 1.2065148509398742
Energy: 1.599963279322302
Energy: 1.2065148509398742
Energy: 1.1386221361731879
Energy: 0.9369197674341329
Energy: 1.3046911411612578
Energy: 0.9369197674348942
Energy: 1.086888367602472
Energy: 1.0066003783033088
Energy: 1.1393610024808254
Energy: 1.0066003783025474
Energy: 1.1025205274616268
Energy: 0.9341241816473493
Energy: 0.94374494012594
Energy: 0.9341241816458264
Energy: 1.350201925146349
Energy: 0.978975915695437
Energy: 1.1220208892798829
Energy: 0.9789759156961982
Energy: 1.4253041214522812
Energy: 0.9957898547142094
Energy: 1.1108725831655544
Energy: 0.9957898547156976
Energy: 1.2754422572543616
Energy: 0.934602857937592
Energy: 0.9346667186596436
Energy: 0.934602857937592
Energy: 1.2466545579689365
Energy: 0.9353213478187973
Energy: 0.9398167378932094
Energy: 0.9353213478127061
Energy: 1.2460398428180872
Energy: 0.9819460607045734
Energy: 1.2750966205892493
Energy: 0.9819460607045734
Energy: 1.145066953191821
Energy: 0.925052533861088
Energy: 1.082497535043302
Energy: 0.9250525338595652
Energy: 0.9253336514492418
Energy: 0.9603074477176424
Energy: 1.258554357216393
Energy: 0.9603074477184037
Energy: 0.9650127312528429
Energy: 0.9621234608759403
Energy: 1.2165498477170167
Energy: 0.9621234608759403
Energy: 1.1086272951501743
Energy: 0.9232762676881342
Energy: 1.2258293115595333
Energy: 0.9232762676812816
Energy: 1.098867810788049
Energy: 1.185510495979487
Energy: 1.2186216553115914
Energy: 1.1855104959802485
Energy: 1.097445986444115
Energy: 0.9364831578381457
Energy: 0.9363146051896027
Energy: 0.936483157838907
Energy: 1.2616002959406951
Energy: 0.9352882208533605
Energy: 0.9357722989145167
Energy: 0.935288220852599
Energy: 1.6022991822891848
Energy: 0.9343365345221214
Energy: 1.100537794701582
Energy: 0.9343365345221214

minimum gb energy = 0.9232762676812816 eV
minimum distance =  2.2904679754831 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 1.294927691538556
Energy: 1.2051222649976518
Energy: 1.206440888665111
Energy: 0.8948001327268296
Energy: 1.305099482664826
Energy: 0.8976366504306852
Energy: 1.115163932336675
Energy: 0.8976366504359491
Energy: 1.115579833480499
Energy: 1.1463226303998615
Energy: 1.1126996079856588
Energy: 1.1463226304009144
Energy: 0.9082591051102205
Energy: 0.8952891693721975
Energy: 1.3167123081331396
Energy: 0.8952891693721975
Energy: 0.9772601607503716
Energy: 0.9539266588179027
Energy: 1.4062405497442378
Energy: 0.9539266588189556
Energy: 0.9537891163362424
Energy: 0.9060237444975832
Energy: 1.4071379585324324
Energy: 0.9060237444975832
Energy: 0.8933532493907507
Energy: 0.8950008791182982
Energy: 1.2616646396260438
Energy: 0.8950008791172693
Energy: 0.8985183141516742
Energy: 0.899371257129088
Energy: 1.301465724314706
Energy: 0.899371257129088
Energy: 1.296856042263139
Energy: 0.9616011011963153
Energy: 1.3062112014058544
Energy: 0.9616011011952627
Energy: 1.1008528107441367
Energy: 0.9004877819856174
Energy: 1.0616055482538957
Energy: 0.9004877819866701
Energy: 1.2609481898113055
Energy: 0.9008313118150527
Energy: 0.8939677036268108
Energy: 0.9008313118140002
Energy: 1.304235271500302
Energy: 0.8976453809114613
Energy: 0.9552538403201121
Energy: 0.8976453809104086
Energy: 1.2992862103735343
Energy: 0.8961666576719797
Energy: 0.975731211333078
Energy: 0.8961666576719797
Energy: 1.272572616205643
Energy: 0.8954722608343304
Energy: 1.1122902762488633
Energy: 0.8954722608343304
Energy: 0.9107485108419024
Energy: 1.144867688864338
Energy: 1.1146495370614986
Energy: 1.1448676888632852
Energy: 0.9074674638473589
Energy: 0.8966846181740398
Energy: 1.305055425749919
Energy: 0.8966846181740398
Energy: 0.9762487876351387
Energy: 0.9771149244227626
Energy: 1.559636044287418
Energy: 0.9771149244217099
Energy: 0.9586743010656524
Energy: 0.898592447864696
Energy: 1.4059908505978718
Energy: 0.8985924478636432
Energy: 0.9516758296106602
Energy: 0.8976011317171575
Energy: 1.3072380457216417
Energy: 0.8976011317171575
Energy: 1.0633727518473972
Energy: 0.898000040545674
Energy: 1.300274879994089
Energy: 0.8980000405488322
Energy: 1.1107143532438564
Energy: 0.963133715037552
Energy: 1.2947658744985258
Energy: 0.9631337150364992
Energy: 1.1238289667751005
Energy: 0.9000714084147132
Energy: 0.8980446953990459
Energy: 0.9000714084136605
Energy: 1.2637972855828703
Energy: 0.8953159234743558
Energy: 0.8952398160012841
Energy: 0.8953159234733031
Energy: 1.2996777011610474
Energy: 0.8967836040860047
Energy: 0.8948409475886034
Energy: 0.8967836040860047

minimum gb energy = 0.8933532493907507 eV
minimum distance =  2.30327103243873 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 1.3775804690160116
Energy: 0.9304240976931406
Energy: 1.213679401611283
Energy: 0.8840977064434276
Energy: 1.4274039898111326
Energy: 0.8868764457940398
Energy: 1.0318828895580499
Energy: 0.8868764457972932
Energy: 1.1578270111966573
Energy: 0.8851455501780131
Energy: 1.0329842891921515
Energy: 0.8851455501819172
Energy: 1.1312789112502264
Energy: 0.8763497686858881
Energy: 1.117995854670688
Energy: 0.8763497686904429
Energy: 1.0281273999105285
Energy: 0.8761680371431456
Energy: 1.2727500890730683
Energy: 0.8761680371431456
Energy: 0.8982243527077937
Energy: 0.8950695176455794
Energy: 1.4213800976180384
Energy: 0.89506951764623
Energy: 0.8767346037241347
Energy: 0.8756283326102163
Energy: 1.2846486656432643
Energy: 0.8756283326102163
Energy: 0.8807398865394891
Energy: 0.878053560878127
Energy: 1.3810391659057357
Energy: 0.8780535608794283
Energy: 1.2496463331030703
Energy: 0.8784490927555884
Energy: 1.289675631685338
Energy: 0.8784490927555884
Energy: 1.0098712629751692
Energy: 0.8890947462902067
Energy: 1.036559258391976
Energy: 0.889094746289556
Energy: 1.3251999348400902
Energy: 0.9393769711510734
Energy: 0.8915356809182899
Energy: 0.9393769711686417
Energy: 1.431714404923107
Energy: 0.9066947724838601
Energy: 1.067580841334626
Energy: 0.9066947724825587
Energy: 1.5508668131992487
Energy: 0.9260716391517386
Energy: 0.9494735942447297
Energy: 0.9260716391536906
Energy: 1.346088805061011
Energy: 0.8853846178028949
Energy: 0.887160819920958
Energy: 0.8853846178028949
Energy: 1.1658039478293032
Energy: 0.8877683058079147
Energy: 0.8901151538690549
Energy: 0.887768305809216
Energy: 1.355226839103976
Energy: 0.9265783357279986
Energy: 1.2919772126559435
Energy: 0.9265783357286493
Energy: 0.8881403052592722
Energy: 0.8901310669180994
Energy: 1.2542120375293804
Energy: 0.8901310669180994
Energy: 0.8886223705563038
Energy: 0.8863926042097227
Energy: 1.3223339038087087
Energy: 0.8863926042077707
Energy: 0.894754684232241
Energy: 0.8879129879145403
Energy: 1.4769357388393032
Energy: 0.8879129879151911
Energy: 0.9606807545565551
Energy: 0.9372303883163335
Energy: 1.3781863939275416
Energy: 0.9372303883189362
Energy: 1.030071109794453
Energy: 0.886924745634731
Energy: 1.4293573941966091
Energy: 0.886924745634731
Energy: 1.028526376853094
Energy: 1.1275294795813366
Energy: 1.1559635111660869
Energy: 1.1275294795819872
Energy: 1.1764395411127353
Energy: 0.875631126663198
Energy: 1.1550876905534073
Energy: 0.875631126663198
Energy: 1.2713963469993017
Energy: 0.8766469476172731
Energy: 1.0284845143085266
Energy: 0.8766469476172731
Energy: 1.4176879037757304
Energy: 0.8795960223166167
Energy: 0.8950046014888052
Energy: 0.879596022315966
Energy: 1.2870331033578342
Energy: 0.8771970143476632
Energy: 0.8791625637049868
Energy: 0.8771970143463618
Energy: 1.3796133929085308
Energy: 0.8783828291493668
Energy: 0.8837557539914632
Energy: 0.8783828291330997
Energy: 1.2856755908957143
Energy: 0.8771986321204025
Energy: 1.2492461373694543
Energy: 0.8771986321184504
Energy: 1.033125646483216
Energy: 1.1266018607198314
Energy: 1.0120941134069337
Energy: 1.1266018607230848
Energy: 0.8928659256382482
Energy: 0.8847800256205407
Energy: 1.327891914365182
Energy: 0.8847800256192394
Energy: 1.0667362160720955
Energy: 0.924977859811149
Energy: 1.5086003266975934
Energy: 0.9249778598091969
Energy: 0.95164751206975
Energy: 0.9255383860550348
Energy: 1.4811666602105067
Energy: 0.9255383860537926
Energy: 0.8851406916923915
Energy: 0.8852334284558458
Energy: 1.3217936123285319
Energy: 0.8852334284564966
Energy: 0.8934767930831853
Energy: 0.8872188764405126
Energy: 1.1318866152165608
Energy: 0.8872188764418139
Energy: 1.292363475876682
Energy: 0.9254455876826676
Energy: 1.3531197042835148
Energy: 0.9254455876820169
Energy: 1.253639488483701
Energy: 0.8892241252070705
Energy: 0.8867788160255099
Energy: 0.8892241252070705
Energy: 1.3212640258864319
Energy: 0.8852534782535707
Energy: 0.8858037227533664
Energy: 0.88525347825292
Energy: 1.4792431766264251
Energy: 0.8888464052899899
Energy: 0.9329716165345915
Energy: 0.8888464052899899

minimum gb energy = 0.8756283326102163 eV
minimum distance =  2.29692675753812 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 1.4478403651384344
Energy: 0.8097826571859085
Energy: 0.8112726952145386
Energy: 0.8400956383230905
Energy: 1.0900390015558625
Energy: 1.1566792883617685
Energy: 1.0801691183921984
Energy: 1.1566792883617685
Energy: 0.8008915194326928
Energy: 0.8928810990225804
Energy: 1.0872602658991808
Energy: 0.8928810990208779
Energy: 0.8016646867066402
Energy: 1.0840394717095352
Energy: 1.0894853570304182
Energy: 1.0840394717095352
Energy: 0.8657459777376244
Energy: 0.8082245170671198
Energy: 1.120844052285405
Energy: 0.8082245170671198
Energy: 0.8102292752598512
Energy: 0.8118091027391151
Energy: 1.1235882037157257
Energy: 0.8118091027391151
Energy: 0.8060165009072543
Energy: 0.8065264404821876
Energy: 1.0895253779060037
Energy: 0.8065264404821876
Energy: 0.8101914201216444
Energy: 0.8107575270404942
Energy: 1.4507750256328251
Energy: 0.8107575270421968
Energy: 1.0786274600339971
Energy: 1.1583006747469118
Energy: 1.3481002429943525
Energy: 1.1583006747469118
Energy: 1.1338535748407297
Energy: 0.8946322871791973
Energy: 1.0898726531841667
Energy: 0.8946322871791973
Energy: 1.0893511062658756
Energy: 0.8965876979581778
Energy: 0.799420407450925
Energy: 0.8965876979581778
Energy: 1.1244227109226983
Energy: 1.0859195925412568
Energy: 0.8688291795972471
Energy: 1.0859195925412568
Energy: 1.1240018059087202
Energy: 0.8092113177181924
Energy: 0.8098327873182447
Energy: 0.8092113177181924
Energy: 1.352598839207766
Energy: 0.8064739304785804
Energy: 0.8049735751278022
Energy: 0.8064739304785804
Energy: 1.3458585658612712
Energy: 0.8087839350571756
Energy: 0.8093684834557903
Energy: 0.8087839350571756

minimum gb energy = 0.799420407450925 eV
minimum distance =  2.31748533916911 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 1.2816956612365527
Energy: 0.7763194550358826
Energy: 1.1324741738241795
Energy: 0.7863876592068918
Energy: 1.2313612731450327
Energy: 0.7755505626486362
Energy: 0.9258869097625827
Energy: 0.7755505626493499
Energy: 1.2830594563558297
Energy: 0.7716784931695652
Energy: 0.9199367167856758
Energy: 0.7716784931767011
Energy: 1.0121732067782294
Energy: 0.833593890864788
Energy: 1.1037632683035976
Energy: 0.8335938908626472
Energy: 1.1828452078588445
Energy: 0.8313876736557789
Energy: 1.1805859932578064
Energy: 0.8313876736564925
Energy: 0.9237858882019901
Energy: 1.051510548150588
Energy: 1.1746337084976075
Energy: 1.051510548152729
Energy: 0.9228189218561919
Energy: 0.7739371876623886
Energy: 1.421059112002387
Energy: 0.7739371876623886
Energy: 0.9340684617987457
Energy: 0.9270201836106835
Energy: 1.4426893705767825
Energy: 0.9270201836099701
Energy: 0.7824644704624557
Energy: 0.7751025649530077
Energy: 1.4145257580787678
Energy: 0.7751025649544349
Energy: 0.7746989101868852
Energy: 0.7729749356307015
Energy: 1.4135291392720084
Energy: 0.7729749356264201
Energy: 0.7724844624035253
Energy: 0.7788100636582099
Energy: 1.2822113399211135
Energy: 0.7788100636603507
Energy: 1.1745000146123319
Energy: 1.085897330280448
Energy: 1.4140348924122066
Energy: 1.0858973302783723
Energy: 1.177634229033485
Energy: 1.0495888294887235
Energy: 1.1692189313215384
Energy: 1.0495888294830147
Energy: 1.2398385690631661
Energy: 0.771787882276948
Energy: 1.0133622516488736
Energy: 0.7717878822719529
Energy: 1.3823300023985523
Energy: 0.7744767522837364
Energy: 1.1519380071166478
Energy: 0.7744767522830226
Energy: 1.3805168861106891
Energy: 0.7750590801401649
Energy: 0.7823849800452176
Energy: 0.7750590801423056
Energy: 1.318126992845161
Energy: 0.7734933048049274
Energy: 0.775074487563016
Energy: 0.7734933048049274
Energy: 1.2833057358891713
Energy: 0.7972949952945652
Energy: 0.7926311540881145
Energy: 0.7972949952938516
Energy: 1.434656046161629
Energy: 0.7745831164315498
Energy: 0.943121271095028
Energy: 0.774583116432977
Energy: 1.360064776632615
Energy: 0.7711604437669222
Energy: 0.8940136639584304
Energy: 0.7711604437369516
Energy: 1.0102492343588412
Energy: 0.7775634660720881
Energy: 0.937577396772514
Energy: 0.777563466070661
Energy: 1.2681505411580964
Energy: 1.0993686501235882
Energy: 1.1730011085988368
Energy: 1.0993686501243016
Energy: 0.9258168459228496
Energy: 1.050985171027254
Energy: 1.1807022879102507
Energy: 1.0509851710243996
Energy: 0.7742133409867732
Energy: 0.7716185365205089
Energy: 1.4170001765271287
Energy: 0.7716185365226497
Energy: 0.928215126792049
Energy: 0.7946553548651473
Energy: 1.3828289847252708
Energy: 0.7946553548694288
Energy: 0.7886217462255815
Energy: 0.7938352735693017
Energy: 1.3793615663614225
Energy: 0.793835273567161
Energy: 0.772418278010206
Energy: 0.7725752901787709
Energy: 1.4104604585284528
Energy: 0.7725752901801981
Energy: 0.7722698963097593
Energy: 0.7763045013673204
Energy: 1.284574435166972
Energy: 0.7763045013708884
Energy: 1.1686671385214047
Energy: 1.0861767745008282
Energy: 1.434730519594593
Energy: 1.0861767745015418
Energy: 0.8928693781066797
Energy: 1.0496976628757182
Energy: 1.1713399812513197
Energy: 1.049697662874291
Energy: 1.2331231845056463
Energy: 0.8304554415942629
Energy: 1.011300525596138
Energy: 0.8304554415935492
Energy: 1.3796020838007281
Energy: 0.7749302576045662
Energy: 1.172516097475375
Energy: 0.774930257603139
Energy: 1.3824592609558202
Energy: 0.7744121159882784
Energy: 0.7724495829746201
Energy: 0.7744121159889921
Energy: 1.4114708643266822
Energy: 0.7718866744357571
Energy: 0.7726286405785734
Energy: 0.7718866744364707
Energy: 1.4762957678520514
Energy: 0.7735364152589104
Energy: 0.8066808013130741
Energy: 0.773536415259624

minimum gb energy = 0.7711604437369516 eV
minimum distance =  2.30662478828943 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 1.2515201704173762
Energy: 0.7357905160397353
Energy: 0.7359892295992548
Energy: 0.7641716301970164
Energy: 1.5202148779568665
Energy: 0.7227139460374318
Energy: 0.9552352805953523
Energy: 0.7227139460374318
Energy: 1.239783818405271
Energy: 1.0234467838572625
Energy: 0.9589740981037347
Energy: 1.0234467838560346
Energy: 1.2577709438856015
Energy: 0.8138795037997951
Energy: 1.1273931324993154
Energy: 0.8138795037985674
Energy: 1.1772855516680938
Energy: 0.8133791754570091
Energy: 1.0129486718203355
Energy: 0.8133791754570091
Energy: 0.9364667239415385
Energy: 0.9334093603366951
Energy: 1.3185231388797298
Energy: 0.9334093603366951
Energy: 0.8105052434360827
Energy: 0.9320528558060391
Energy: 1.3700814183975805
Energy: 0.9320528558060391
Energy: 0.9789129042123917
Energy: 0.7163784679751746
Energy: 1.5287439393836735
Energy: 0.7163784679751746
Energy: 0.8107285073777036
Energy: 0.7174246619729114
Energy: 1.3756534285359892
Energy: 0.7174246619716836
Energy: 0.8169568202751281
Energy: 0.7010612274963138
Energy: 1.4424929849110946
Energy: 0.7010612274963138
Energy: 0.8889988139128746
Energy: 0.890101257806991
Energy: 1.1154493246958255
Energy: 0.8901012578082187
Energy: 1.0435365160916024
Energy: 0.7009565992429682
Energy: 1.4426618542233336
Energy: 0.7009565992429682
Energy: 1.0518534795850463
Energy: 1.0176619238295443
Energy: 1.239392345865619
Energy: 1.0176619238307718
Energy: 1.2234197757802951
Energy: 0.8076745095332569
Energy: 1.2581953875880212
Energy: 0.8076745095320292
Energy: 1.0129486718203355
Energy: 0.9635151847675465
Energy: 1.2269740212256128
Energy: 0.9635151847663187
Energy: 1.3039822632614715
Energy: 0.9679355097681117
Energy: 0.9498243869094369
Energy: 0.9679355097681117
Energy: 1.3043382470262888
Energy: 0.7224528318794762
Energy: 0.80566160806742
Energy: 0.7224528318794762
Energy: 1.5287439393836735
Energy: 0.7235495645783687
Energy: 0.8981715919466586
Energy: 0.7235495645783687
Energy: 1.3756534285359892
Energy: 0.7258189684911347
Energy: 0.7235794651496377
Energy: 0.7258189684911347
Energy: 1.5201318250708153
Energy: 0.7237877221764131
Energy: 0.7233025644077318
Energy: 0.7237877221764131

minimum gb energy = 0.7009565992429682 eV
minimum distance =  2.29970513408013 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 1.4417222051362082
Energy: 0.6468956510526821
Energy: 0.6463847934945309
Energy: 0.675592827357208
Energy: 1.3885906067831053
Energy: 0.6391142299254821
Energy: 0.8265994109083881
Energy: 0.6391142299235648
Energy: 1.3112148448323833
Energy: 0.6395716766668131
Energy: 0.8247546532395719
Energy: 0.6395716766562676
Energy: 1.0378352553378383
Energy: 0.63904504631765
Energy: 1.1311600318835562
Energy: 0.63904504631765
Energy: 1.2714169158738235
Energy: 0.9298828865769874
Energy: 1.131996617261981
Energy: 0.9298828865769874
Energy: 1.065032881546253
Energy: 1.118311283721759
Energy: 1.129768494469557
Energy: 1.118311283721759
Energy: 1.0762875515111754
Energy: 0.9163544953425242
Energy: 1.2115171250917485
Energy: 0.9163544953281442
Energy: 1.101457942819125
Energy: 0.8064718567361809
Energy: 1.2361886193300287
Energy: 0.8064718567361809
Energy: 0.8076557097327424
Energy: 0.8059537937882427
Energy: 1.3791644550938185
Energy: 0.8059537937882427
Energy: 0.8085124955505963
Energy: 0.8060159908833762
Energy: 1.2468585849334917
Energy: 0.806015990884335
Energy: 0.7098042630472106
Energy: 0.6406858231898649
Energy: 1.2325070195037342
Energy: 0.6406858231994516
Energy: 0.7146241040924531
Energy: 0.6381978653837805
Energy: 1.2467432452310607
Energy: 0.6381978653837805
Energy: 0.7256613711624121
Energy: 0.6295037099023751
Energy: 1.4985471393238607
Energy: 0.6295037099014166
Energy: 0.9143725493762968
Energy: 0.6373938367872501
Energy: 1.3345481146671936
Energy: 0.6373938367882088
Energy: 0.9057506935176572
Energy: 0.6278786008451411
Energy: 1.3238298130301966
Energy: 0.6278786008451411
Energy: 0.900797611942848
Energy: 0.6366896650065161
Energy: 1.3148597222935798
Energy: 0.6366896650055573
Energy: 1.1205765066701685
Energy: 0.8053634494165489
Energy: 1.3190513530048604
Energy: 0.8053634494165489
Energy: 0.8614141515036681
Energy: 1.0800989619726673
Energy: 1.3166517652041365
Energy: 1.0800989619726673
Energy: 1.1155721412251753
Energy: 1.0498899656400236
Energy: 1.0747716047876792
Energy: 1.049889965639065
Energy: 1.3863131566888698
Energy: 0.8515474734175887
Energy: 1.0655041085011188
Energy: 0.8515474734175887
Energy: 1.2342428107419592
Energy: 0.6386316042420422
Energy: 0.8258871460127967
Energy: 0.6386315970302513
Energy: 1.389088317665254
Energy: 0.6389635420036632
Energy: 0.7079959434034698
Energy: 0.6389635018856871
Energy: 1.4378086279156197
Energy: 0.6400518621544654
Energy: 0.831422311421506
Energy: 0.6400518621400854
Energy: 1.235599101714904
Energy: 0.6453707782685236
Energy: 0.6385426084660116
Energy: 0.6453707782675648
Energy: 1.5164715984554575
Energy: 0.6385322323329224
Energy: 0.6401115463007805
Energy: 0.6385322323329224
Energy: 1.3129875657543801
Energy: 0.6485882188132861
Energy: 0.6383389955414763
Energy: 0.6485882188142447

minimum gb energy = 0.6278786008451411 eV
minimum distance =  2.30166872031827 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 1.4691299089155365
Energy: 0.5796530514441466
Energy: 0.5805918038479044
Energy: 0.6041148555635273
Energy: 1.4328334211145595
Energy: 0.5728903084068981
Energy: 0.7303703681172087
Energy: 0.5728903084068981
Energy: 1.3124276190847644
Energy: 0.5744366750150139
Energy: 0.7015617033560217
Energy: 0.5744366750032247
Energy: 1.133165987296634
Energy: 0.5748135769937146
Energy: 1.0088563393433552
Energy: 0.5748135769929287
Energy: 1.3185360413531062
Energy: 0.824143099777864
Energy: 0.9908863907936208
Energy: 0.824143099777864
Energy: 1.0963451573432872
Energy: 0.8289290112979795
Energy: 0.989713553914351
Energy: 0.8289290112971935
Energy: 1.101404022869365
Energy: 1.0251915772086915
Energy: 1.209059377761456
Energy: 1.0251915772079054
Energy: 1.1074915295557182
Energy: 1.0272305932223877
Energy: 0.9773058765149212
Energy: 1.0272305932216017
Energy: 0.8255384655976872
Energy: 1.0178763018565586
Energy: 1.2048442784171884
Energy: 1.0178763018573445
Energy: 0.8762496093726511
Energy: 0.8240232999417489
Energy: 1.419679041246976
Energy: 0.824023299940177
Energy: 0.7006830280090692
Energy: 0.5735467329684119
Energy: 1.3012884429697211
Energy: 0.5735467328977116
Energy: 0.697051373380892
Energy: 0.5738570443066628
Energy: 1.420668169558113
Energy: 0.5738570443082349
Energy: 0.7425523551470083
Energy: 0.5747992608479404
Energy: 1.4215255464385492
Energy: 0.5747992608691256
Energy: 0.5726841741294627
Energy: 0.5791141550756435
Energy: 1.3012177699499803
Energy: 0.5791141550764294
Energy: 0.5742752037560824
Energy: 0.5731673971174351
Energy: 1.3197894009697875
Energy: 0.5731673971119334
Energy: 0.57204897664496
Energy: 0.5763639107539278
Energy: 1.31466531939042
Energy: 0.5763639107547137
Energy: 0.7525818891552275
Energy: 0.5761381707002502
Energy: 1.319135818003207
Energy: 0.5761381706994642
Energy: 0.6962959264211942
Energy: 0.5724113796658505
Energy: 1.3173595040803339
Energy: 0.5724113796642787
Energy: 0.7340926043145818
Energy: 0.5780128365183077
Energy: 1.1256580051655736
Energy: 0.5780128365183077
Energy: 1.001828568522154
Energy: 0.8267051964156585
Energy: 1.1246708380623787
Energy: 0.8267051964156585
Energy: 0.976671510276564
Energy: 0.8306890529724116
Energy: 1.2091540827224467
Energy: 0.8306890530054217
Energy: 0.9930877382360945
Energy: 0.8298342781427773
Energy: 1.1177786836182626
Energy: 0.8298342781427773
Energy: 1.2052510831272556
Energy: 1.0641100386101272
Energy: 1.0958996456186718
Energy: 1.0641100386093414
Energy: 0.9774156926231787
Energy: 0.8305929552151227
Energy: 0.994054662638778
Energy: 0.8305929552151227
Energy: 1.2109680642553304
Energy: 1.0220742155479776
Energy: 0.8191842622255945
Energy: 1.0220742155471916
Energy: 1.206394217898462
Energy: 0.5731648448787555
Energy: 0.9906481499339772
Energy: 0.573164844872468
Energy: 1.209044910592472
Energy: 0.5767856208713587
Energy: 0.7437551140859108
Energy: 0.5767856208721446
Energy: 1.4248885456937086
Energy: 0.5736779922627535
Energy: 0.695214927314121
Energy: 0.5736779922635038
Energy: 1.222838534775195
Energy: 0.5789535514961396
Energy: 0.7521669621297336
Energy: 0.5789535514969254
Energy: 1.2199480361615749
Energy: 0.5769927368644083
Energy: 0.5719105053447239
Energy: 0.5769927368644083
Energy: 1.4214294621284431
Energy: 0.572416191776143
Energy: 0.5735966629848569
Energy: 0.5724161917753569
Energy: 1.3983523713577801
Energy: 0.5785886191086692
Energy: 0.5721436485382334
Energy: 0.5785886191078834

minimum gb energy = 0.5719105053447239 eV
minimum distance =  2.31578314130992 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 1.2697430670127767
Energy: 0.5348212477649996
Energy: 0.5362481958705423
Energy: 0.5542850516516356
Energy: 1.36598957062729
Energy: 0.5284041986468945
Energy: 0.6374646151627561
Energy: 0.5284041986482261
Energy: 1.3594851646199988
Energy: 0.5297548446614427
Energy: 0.6379042780678243
Energy: 0.5297548446647719
Energy: 1.271367615431945
Energy: 0.5314223992788923
Energy: 0.8960485305698368
Energy: 0.5314223992848847
Energy: 1.3656031491179137
Energy: 0.7482900720943613
Energy: 0.8694450469398763
Energy: 0.7482900720936955
Energy: 1.1692286537741683
Energy: 0.7562856844133047
Energy: 0.8858236233428123
Energy: 0.7562856844139705
Energy: 0.999650977893008
Energy: 0.755446086987755
Energy: 1.0822883807490944
Energy: 0.7554460869857575
Energy: 1.1803377633090801
Energy: 0.9741571343538125
Energy: 0.864439610060758
Energy: 0.9741571343524807
Energy: 0.9813904487642137
Energy: 0.9661830809534017
Energy: 1.0756748828665401
Energy: 0.9661830809527358
Energy: 0.9806266284294687
Energy: 0.971993995441688
Energy: 1.264408790572341
Energy: 0.971993995441688
Energy: 0.8762780094954786
Energy: 0.7556569645837728
Energy: 1.1323166681354675
Energy: 0.7556569645930942
Energy: 0.7355768782585355
Energy: 0.9256803463407254
Energy: 1.2642487139281027
Energy: 0.9256803463413912
Energy: 0.8871863085387538
Energy: 0.750011031735161
Energy: 1.2635688316678502
Energy: 0.7500110317344952
Energy: 0.6672967681742116
Energy: 0.5312484218559718
Energy: 1.1328432930420511
Energy: 0.5312484218566376
Energy: 0.6318818028262424
Energy: 0.5303915089821015
Energy: 1.4525320323920654
Energy: 0.5303915089781066
Energy: 0.6783929840370869
Energy: 0.5315668776632826
Energy: 1.266161608801123
Energy: 0.5315668776652801
Energy: 0.5449928809367038
Energy: 0.5337706464273234
Energy: 1.2716098254141428
Energy: 0.5337706464259918
Energy: 0.5270649242967345
Energy: 0.5280263896352658
Energy: 1.4563954315514405
Energy: 0.5280263896352658
Energy: 0.5426640054001601
Energy: 0.5309506989617064
Energy: 1.2103725657472113
Energy: 0.5309506989577116
Energy: 0.6488073661062292
Energy: 0.5321731043902459
Energy: 1.3644777315265473
Energy: 0.5321731043921828
Energy: 0.6295884051922045
Energy: 0.5292051811061101
Energy: 1.3663856988259557
Energy: 0.5292051810868015
Energy: 0.6521404373222633
Energy: 0.5347636448807235
Energy: 1.177122596304673
Energy: 0.5347636448793918
Energy: 0.8970345281506696
Energy: 0.7489131003649424
Energy: 1.168105461347811
Energy: 0.7489131003649424
Energy: 0.8655759386490851
Energy: 0.7509739606630647
Energy: 1.267252016974733
Energy: 0.7509739606623989
Energy: 0.9042269633730797
Energy: 0.753590649621859
Energy: 0.9935531298988551
Energy: 0.7535906496231906
Energy: 1.0756555214550438
Energy: 0.9696114356422582
Energy: 1.2662256157630556
Energy: 0.9696114356422582
Energy: 0.8695810309206727
Energy: 0.9681978034917619
Energy: 1.0775224175211966
Energy: 0.9681978034910961
Energy: 1.088112720034006
Energy: 0.97544841925042
Energy: 0.9939055341982014
Energy: 0.9754484192497542
Energy: 1.078936337457859
Energy: 0.7484149282819645
Energy: 1.0804292275991905
Energy: 0.7484149282812987
Energy: 1.0761150397413561
Energy: 0.7496370178946589
Energy: 0.8652450263371403
Energy: 0.7496370178953247
Energy: 1.2734142160642767
Energy: 0.7477889647146718
Energy: 0.735702931715611
Energy: 0.7477889649489172
Energy: 1.1338985759886435
Energy: 0.5298922812445913
Energy: 0.9065982220157026
Energy: 0.5298922812445913
Energy: 1.264925203661329
Energy: 0.5317497175028548
Energy: 0.6374237057532266
Energy: 0.5317497175035206
Energy: 1.3675804314030269
Energy: 0.5285739705740001
Energy: 0.653996707642989
Energy: 0.5285739705753317
Energy: 1.4152996585591204
Energy: 0.5375929191356745
Energy: 0.6586272938222002
Energy: 0.5375929191296822
Energy: 1.4516722819335584
Energy: 0.529031937179575
Energy: 0.5334190175693722
Energy: 0.529031937179575
Energy: 1.3576264545516201
Energy: 0.5295705314207609
Energy: 0.5326475473864607
Energy: 0.5295705314207609

minimum gb energy = 0.5270649242967345 eV
minimum distance =  2.31443753431524 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 1.3568777624186745
Energy: 0.47612304720175547
Energy: 0.47586254021930685
Energy: 0.5225770711743071
Energy: 1.384188614679819
Energy: 0.4770761300406363
Energy: 0.5721212822196282
Energy: 0.47707613003948135
Energy: 1.210149675287561
Energy: 0.4776371310758553
Energy: 0.5653844756965555
Energy: 0.4776371310747003
Energy: 1.1127957167009381
Energy: 0.4767456561757917
Energy: 0.7992283190823875
Energy: 0.47674565616712977
Energy: 1.3828355660159277
Energy: 0.674114036766335
Energy: 0.796565523605748
Energy: 0.674114036766335
Energy: 1.0397876982887952
Energy: 0.6750350510898927
Energy: 0.8010618989716077
Energy: 0.6750350510898927
Energy: 1.0455164160659833
Energy: 0.4763967751471412
Energy: 0.9592604183480782
Energy: 0.4763967622968084
Energy: 1.2179543153243535
Energy: 0.877487481753563
Energy: 0.7654881702761078
Energy: 0.877487481753563
Energy: 1.0435741905683
Energy: 0.8830054422769525
Energy: 0.9612204873570735
Energy: 0.8830054422763751
Energy: 1.0425571239571996
Energy: 0.8967569080697478
Energy: 1.1277902936289659
Energy: 0.8967569080697478
Energy: 0.9677307723804089
Energy: 0.865117433733874
Energy: 0.9957066280385352
Energy: 0.8651174337332965
Energy: 0.890685719300145
Energy: 0.8782883655487304
Energy: 1.1284700758610116
Energy: 0.8782883655493079
Energy: 0.9590941599334682
Energy: 0.87937077851691
Energy: 1.1262956218238123
Energy: 0.8793707785174876
Energy: 0.7703741779971011
Energy: 0.47675527568258447
Energy: 0.9956538361748788
Energy: 0.4767552756848943
Energy: 0.6534367640711101
Energy: 0.6749815928156492
Energy: 1.2969567233260124
Energy: 0.6749815928156492
Energy: 0.7686886086638702
Energy: 0.6770659618859218
Energy: 1.1261317161700457
Energy: 0.6770659618859218
Energy: 0.5660242153911192
Energy: 0.47838375946013517
Energy: 1.129334174418389
Energy: 0.47838375945955763
Energy: 0.5652964709064466
Energy: 0.47614493957140486
Energy: 1.4628752939322411
Energy: 0.47614493957140486
Energy: 0.6008721683175102
Energy: 0.4754430161763691
Energy: 1.295008280946059
Energy: 0.47544301617001694
Energy: 0.4756369321942358
Energy: 0.4758555956964591
Energy: 1.29890485944372
Energy: 0.4758555956964591
Energy: 0.4765055797767835
Energy: 0.475984889647707
Energy: 1.460842836186825
Energy: 0.47598488964712954
Energy: 0.4758584632799543
Energy: 0.4757252284210496
Energy: 1.2092469032549227
Energy: 0.475725228422782
Energy: 0.5670050253512664
Energy: 0.47906068265188945
Energy: 1.3808691398577058
Energy: 0.479060682651312
Energy: 0.5673480840555374
Energy: 0.4760390583208099
Energy: 1.384646406073466
Energy: 0.4760390583196549
Energy: 0.5673423526779028
Energy: 0.4789345364347475
Energy: 1.111343644307694
Energy: 0.47893453643532496
Energy: 0.791858160933978
Energy: 0.674793651904944
Energy: 1.3782163483405903
Energy: 0.6747936519055214
Energy: 0.796481728928961
Energy: 0.6750853148412
Energy: 1.2106593596809487
Energy: 0.6750853148412
Energy: 0.9593585583305431
Energy: 0.47663621298740394
Energy: 1.1136888641975915
Energy: 0.47663621346590973
Energy: 0.9609173973316533
Energy: 0.87602917870824
Energy: 1.2201180410780228
Energy: 0.8760291787076625
Energy: 0.959029546244978
Energy: 0.8814745553323063
Energy: 1.0415229968523623
Energy: 0.8814745553323063
Energy: 1.1323064382101526
Energy: 0.8819145107131119
Energy: 0.8785520798095079
Energy: 0.8819145107131119
Energy: 1.0121343639329847
Energy: 0.8817908349801138
Energy: 1.1334700227844257
Energy: 0.8817908349806913
Energy: 1.1267643338961963
Energy: 0.882085349396402
Energy: 0.8890752653222993
Energy: 0.882085349396402
Energy: 1.295052065218979
Energy: 0.8763109142650487
Energy: 0.8888441279368346
Energy: 0.8763109142650487
Energy: 0.9934662207521957
Energy: 0.6763025643349713
Energy: 0.8976965759169763
Energy: 0.6763025643343938
Energy: 1.2945902883747509
Energy: 0.6753877195184672
Energy: 0.7691932610654231
Energy: 0.6753877195190446
Energy: 1.2945426192113407
Energy: 0.675179638288727
Energy: 0.7714193315846689
Energy: 0.6751796382898819
Energy: 1.2362014547982028
Energy: 0.47814038107467777
Energy: 0.566022671855922
Energy: 0.4781403808062893
Energy: 1.4594862995320979
Energy: 0.47638799150340794
Energy: 0.5664653299484387
Energy: 0.47638799150340794
Energy: 1.2960742499346232
Energy: 0.479432417443857
Energy: 0.5663750829392639
Energy: 0.47943241744270204
Energy: 1.138309803292541
Energy: 0.4758458572282356
Energy: 0.47585418361513027
Energy: 0.475845857228813
Energy: 1.38289954952556
Energy: 0.4754515264504663
Energy: 0.47606514712400344
Energy: 0.47545152645104377
Energy: 1.212605804701534
Energy: 0.4758930934847904
Energy: 0.47545892764948877
Energy: 0.4758930934842129

minimum gb energy = 0.47544301617001694 eV
minimum distance =  2.30958543894512 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.015463000269776131
Energy: 0.4948324598953941
Energy: 1.1095340198036656
Energy: 0.01621276284202176
Energy: 0.7204081305273174
Energy: 0.11151452948673278
Energy: 0.721607543268535
Energy: 0.11151452948673278
Energy: 0.01607033280165892
Energy: 0.11005208803864736
Energy: 0.7201368457428904
Energy: 0.11005208803909129
Energy: 0.01716752329563953
Energy: 0.1113983035015565
Energy: 0.7224777661243198
Energy: 0.1113983035015565
Energy: 0.7213056394492218
Energy: 0.11192647240555842
Energy: 0.7225081805710859
Energy: 0.11192647240597767
Energy: 0.015969744163343836
Energy: 0.10987156541539739
Energy: 0.7202953050459061
Energy: 0.10987156541539739

minimum gb energy = 0.015463000269776131 eV
minimum distance =  2.52121302260851 Angstroms
sigma value = 1