Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuCo__MO_849011491644_001
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=3.613315641880036
cohesive_energy=3.5402784385667436
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.013701671912862852
Energy: 0.014470803208643654
Energy: 0.8633279462674558
Energy: 0.014470803208643654
Energy: 0.014470803208643654
Energy: 0.7316238171128953
Energy: 0.014470803208643654
Energy: 0.7316238171128953
Energy: 0.8633279462674558
Energy: 0.014470803208643654
Energy: 0.013701671912862852
Energy: 0.014470803208643654
Energy: 0.014470803208643654
Energy: 0.7316238171128953
Energy: 0.014470803208643654
Energy: 0.7316238171122674

minimum gb energy = 0.013701671912862852 eV
minimum distance =  2.47126488356976 Angstroms
sigma value = 1


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

Energy: 0.9547487205841869
Energy: 1.0030403708648086
Energy: 0.9131237293332394
Energy: 1.0030403708655697
Energy: 0.8946282931187496
Energy: 1.1435600789349274
Energy: 0.8981580393746577
Energy: 1.1435600789349274
Energy: 1.0111120488248169
Energy: 0.9949316182588346
Energy: 0.9443213211395531
Energy: 0.9949316182580732
Energy: 0.8906650267087991
Energy: 0.886553544009787
Energy: 0.8652594988783986
Energy: 0.8865535439907523
Energy: 0.9128472077790871
Energy: 1.062255802255845
Energy: 0.9010776738484312
Energy: 1.062255802255845
Energy: 0.8569654987679043
Energy: 1.1809441512797618
Energy: 0.8400568026238165
Energy: 1.1809441512805232
Energy: 0.931695324316661
Energy: 1.083625166275844
Energy: 0.8759516728647257
Energy: 1.0836251662766054
Energy: 0.8196104785525127
Energy: 1.0626301347304326
Energy: 0.8285975912698867
Energy: 1.0626301347304326
Energy: 0.8784200512776283
Energy: 1.112009420723627
Energy: 1.007873200913767
Energy: 1.1120094207251499
Energy: 0.832550591859085
Energy: 0.9958793753187384
Energy: 0.8125459633140314
Energy: 0.9958793753179769
Energy: 1.0182840876087413
Energy: 0.9577524794787118
Energy: 0.8784992994937298
Energy: 0.9577524794688136
Energy: 0.9184898676753878
Energy: 1.0636319016625975
Energy: 0.8427139617643737
Energy: 1.0636319016633589
Energy: 0.8972532799754553
Energy: 1.1182234596986298
Energy: 0.932445196001678
Energy: 1.1182234596986298
Energy: 0.9482019499435126
Energy: 0.9984474760811717
Energy: 0.8582278624906923
Energy: 0.9984474760811717
Energy: 0.9234391730061698
Energy: 1.0621849867635595
Energy: 0.997334689823974
Energy: 1.0621849867635595
Energy: 0.9218387286719812
Energy: 1.1199684412482394
Energy: 0.893527434830429
Energy: 1.1199684412482394
Energy: 0.9448651341364055
Energy: 0.9966762987553799
Energy: 0.8564057295189278
Energy: 0.9966762987561413
Energy: 0.8983566904192346
Energy: 1.1167508865977689
Energy: 0.9327382505270049
Energy: 1.1167508865977689
Energy: 0.8213138547587641
Energy: 1.0056852375905507
Energy: 0.8418235835429226
Energy: 1.0056852375905507
Energy: 1.0151387422969034
Energy: 0.8848793951062441
Energy: 0.879872632952562
Energy: 0.8848793951070055
Energy: 0.8354687616887304
Energy: 0.995480758020609
Energy: 0.8176891418138403
Energy: 0.9954807580198476
Energy: 0.8792764838988664
Energy: 1.1797990328733488
Energy: 1.0043132226366018
Energy: 1.1797990328741101
Energy: 1.025291645802615
Energy: 1.062816800907271
Energy: 0.8823965876765468
Energy: 1.062816800908032
Energy: 0.963668641967226
Energy: 1.0486887096370772
Energy: 0.8761788129103217
Energy: 1.0486887096370772
Energy: 0.8759516881138618
Energy: 1.1750374156192835
Energy: 1.0304040171708242
Energy: 1.175037415620045
Energy: 0.9410098579278309
Energy: 1.0579399820648436
Energy: 0.8614344094974432
Energy: 1.0579399820656052
Energy: 0.8926041853860238
Energy: 1.185344025985318
Energy: 0.8788812051819989
Energy: 1.185344025985318
Energy: 1.0050840295627161
Energy: 0.9938184242103641
Energy: 0.9422246748127177
Energy: 0.9938184242096029
Energy: 0.8936040149497665
Energy: 1.0543543758168117
Energy: 0.8925067537948159
Energy: 1.0543543758168117
Energy: 0.9561436043529699
Energy: 1.0037316171284942
Energy: 0.9201952354925116
Energy: 1.0037316171284942
Energy: 0.8923582316271548
Energy: 1.0862110316695535
Energy: 0.8972075498012583
Energy: 1.0862110316695535
Energy: 0.8684205566518585
Energy: 0.9927399595036736
Energy: 0.9413120039689142
Energy: 0.992739959502912
Energy: 0.9128114577825743
Energy: 1.075718773702376
Energy: 0.8652243122486583
Energy: 1.0757187737016145

minimum gb energy = 0.8125459633140314 eV
minimum distance =  2.3210764527879 Angstroms
sigma value = 1


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

Energy: 1.0153179222711914
Energy: 1.067246792734833
Energy: 0.9622617875183026
Energy: 1.0672467927357012
Energy: 0.9335518998063308
Energy: 1.1970034389420707
Energy: 0.9366888409627594
Energy: 1.1970034389420707
Energy: 1.07118269866437
Energy: 1.0529244609066124
Energy: 1.0106751953534965
Energy: 1.052924460907441
Energy: 0.9039970432678165
Energy: 0.9048671140084462
Energy: 0.8902367698805365
Energy: 0.9048671140093144
Energy: 0.9037935400640187
Energy: 1.1306411782335781
Energy: 1.0491154418619308
Energy: 1.1306411782309738
Energy: 0.9942874780147852
Energy: 1.135841375844752
Energy: 1.0117216305701071
Energy: 1.135841375844752
Energy: 1.0282469950241504
Energy: 1.0905315732227894
Energy: 0.9226449463843263
Energy: 1.0905315732219212
Energy: 0.8473123154600852
Energy: 1.0741693495193694
Energy: 0.877449869164322
Energy: 1.0741693495185014
Energy: 0.9178848764906682
Energy: 0.9323953550129896
Energy: 1.086845283799272
Energy: 0.9323953550138578
Energy: 0.8771913026338908
Energy: 1.1449810166554377
Energy: 0.9050625058139168
Energy: 1.1449810166571737
Energy: 0.9195413653387915
Energy: 1.090240106906617
Energy: 0.9431671344113977
Energy: 1.0902401069074852
Energy: 0.8840737362233286
Energy: 1.0593800544130345
Energy: 0.9830936592114113
Energy: 1.0593800544130345
Energy: 0.9821117555543953
Energy: 1.1287340389132237
Energy: 0.9214413876073971
Energy: 1.1287340389132237
Energy: 0.9819353822009499
Energy: 1.1288624483551957
Energy: 0.9110713360924889
Energy: 1.1288624483560636
Energy: 0.8841432673200456
Energy: 1.0592414734260416
Energy: 0.9815121728295413
Energy: 1.0592414734260416
Energy: 0.9188936344347908
Energy: 1.0899978143348157
Energy: 0.9366407683403356
Energy: 1.0899978143348157
Energy: 0.8771638288301765
Energy: 1.1450080168791033
Energy: 0.8547835512945209
Energy: 1.1450080168791033
Energy: 0.9178688295255403
Energy: 0.9324534660195322
Energy: 0.9524141029930772
Energy: 0.9324534660195322
Energy: 0.847304934406491
Energy: 1.0739914771228123
Energy: 0.8689572359446373
Energy: 1.0739914771245487
Energy: 1.0282047875435474
Energy: 1.0901821339851236
Energy: 0.9207445390913154
Energy: 1.0901821339859916
Energy: 0.9943206361601358
Energy: 1.1355391406528195
Energy: 0.8630567913609226
Energy: 1.1355391406536872
Energy: 0.9041842112787419
Energy: 1.130749720794644
Energy: 0.9226986133833579
Energy: 1.1307497207963804
Energy: 0.9038419658125858
Energy: 0.9051279202911892
Energy: 0.8903348017000965
Energy: 0.9051279202920572
Energy: 1.071351014251251
Energy: 1.0529217232555435
Energy: 1.0110145999947089
Energy: 1.0529217232555435
Energy: 0.9335085464147572
Energy: 1.1970581398998168
Energy: 0.9366179299535129
Energy: 1.1970581398980809
Energy: 1.0153179222703235
Energy: 1.067246792734833
Energy: 0.9742685775920493
Energy: 1.0672467927357012
Energy: 0.9335518998063308
Energy: 1.197003438942939
Energy: 0.9366888409627594
Energy: 1.1970034389412028
Energy: 1.07118269866437
Energy: 1.052924460907441
Energy: 0.9471780964423836
Energy: 1.0529244609083093
Energy: 0.9039970432678165
Energy: 0.9048671140093144
Energy: 0.8980797667066587
Energy: 0.9048671140110507

minimum gb energy = 0.847304934406491 eV
minimum distance =  2.28078970192695 Angstroms
sigma value = 25


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

Energy: 0.9551592049535439
Energy: 1.1182228801196892
Energy: 1.0933595961984317
Energy: 1.1182228801196892
Energy: 0.9922304002909156
Energy: 1.148483813789462
Energy: 1.0110965431619285
Energy: 1.148483813789462
Energy: 0.9454079991383233
Energy: 1.1773067361292286
Energy: 0.931274820279981
Energy: 1.1773067361292286
Energy: 0.9242141428737428
Energy: 0.9585620950745294
Energy: 0.9349974908403644
Energy: 0.9585620950745294
Energy: 0.935535407595785
Energy: 1.1634218726255199
Energy: 1.0721269887600011
Energy: 1.163421872626529
Energy: 1.0407192281241708
Energy: 1.181554715568879
Energy: 1.085319707308003
Energy: 1.181554715568879
Energy: 0.9799499284898737
Energy: 1.1994262933116746
Energy: 0.9793936678923676
Energy: 1.1994262933116746
Energy: 1.1376303593121442
Energy: 1.1234282498958394
Energy: 0.899381341616309
Energy: 1.1234282498958394
Energy: 0.979706178104692
Energy: 1.1115843596415853
Energy: 0.9786245114194944
Energy: 1.1115843596415853
Energy: 0.9331357894913214
Energy: 1.1821777196763679
Energy: 0.9152071337598147
Energy: 1.1821777196763679
Energy: 0.9698344135041094
Energy: 1.1167887972796207
Energy: 0.9904472958771748
Energy: 1.1167887972796207
Energy: 0.9570547915507804
Energy: 1.1537319115709435
Energy: 1.1038446943067313
Energy: 1.1537319115709435
Energy: 0.931391406227672
Energy: 1.0515415335146205
Energy: 0.9281681335163547
Energy: 1.0515415335146205
Energy: 0.9806085292679758
Energy: 1.0211460468470175
Energy: 0.979499943262508
Energy: 1.0211460468470175
Energy: 0.9714694477776836
Energy: 1.1651835045520993
Energy: 0.8983987095702363
Energy: 1.1651835045520993
Energy: 1.0352584856921365
Energy: 0.9758845938834205
Energy: 0.9676463844759371
Energy: 0.9758845938834205
Energy: 0.8853613399168139
Energy: 1.1831581900675587
Energy: 0.8832051689305724
Energy: 1.1831581900675587
Energy: 0.9352022620554389
Energy: 1.1733820737547673
Energy: 0.970715284278987
Energy: 1.1733820737547673
Energy: 0.9240185977368108
Energy: 0.9584921881909926
Energy: 0.9359643047412948
Energy: 0.95849218818191
Energy: 0.9794234858447802
Energy: 1.178736119428865
Energy: 0.9567163499459749
Energy: 1.178736119428865
Energy: 0.9598948531095227
Energy: 1.0892712279170165
Energy: 0.9564100029594944
Energy: 1.0892712279170165
Energy: 0.9571926197718532
Energy: 1.1283624539667936
Energy: 1.0416016789303157
Energy: 1.1283624539667936
Energy: 0.9906131995069477
Energy: 1.1145734610828368
Energy: 1.010911385929374
Energy: 1.1145734610828368
Energy: 1.1541513084005797
Energy: 1.1814996714317487
Energy: 0.9333306929884281
Energy: 1.1814996714317487
Energy: 1.165347496290926
Energy: 0.9585498993352854
Energy: 0.9623275847905456
Energy: 0.9585498993786795

minimum gb energy = 0.8832051689305724 eV
minimum distance =  2.28558819246943 Angstroms
sigma value = 9


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

Energy: 1.0010879347022437
Energy: 1.1890366647682225
Energy: 1.2313674635700547
Energy: 1.1890366647682225
Energy: 1.0239468580905537
Energy: 1.1067828298104692
Energy: 1.0733253299596555
Energy: 1.1067828299320044
Energy: 0.9916594803934728
Energy: 1.0507502302216325
Energy: 0.9889966210006833
Energy: 1.0507502302216325
Energy: 1.21728553451433
Energy: 1.0245245137846128
Energy: 0.9796381437715762
Energy: 1.0245245137858165
Energy: 1.132741075988477
Energy: 1.1077127421010948
Energy: 1.1693307812503855
Energy: 1.1077127421010948
Energy: 0.9140147517386301
Energy: 1.0510286053801623
Energy: 1.2681212566029247
Energy: 1.0510286053801623
Energy: 1.1312763110542705
Energy: 0.9789594502770105
Energy: 1.0148216178156984
Energy: 0.9789594502770105
Energy: 1.0686577259165078
Energy: 1.0604103064335675
Energy: 0.938338369802228
Energy: 1.0604103064335675
Energy: 1.0795097202003863
Energy: 1.1067874731372862
Energy: 1.03410509674506
Energy: 1.1067874758219196
Energy: 1.0013950876563447
Energy: 1.0488700757354084
Energy: 1.0133867768919742
Energy: 1.0488700757366123
Energy: 0.972242715040341
Energy: 1.1143071450536235
Energy: 0.9965587496630106
Energy: 1.1143071450536235
Energy: 1.078915075197967
Energy: 1.2268484588884239
Energy: 0.9806803221505157
Energy: 1.2268484588884239
Energy: 0.9124758353210709
Energy: 1.2621833233982045
Energy: 0.9979006488274998
Energy: 1.2621833233982045
Energy: 1.045619188364174
Energy: 1.0365627148261887
Energy: 1.1156954945361302
Energy: 1.0365627148249845
Energy: 0.9124863990752392
Energy: 1.2622106386031369
Energy: 1.0690028368893585
Energy: 1.2622106386031369
Energy: 1.078839870049826
Energy: 1.2283294747288251
Energy: 0.9804246353339975
Energy: 1.2283294747300293
Energy: 0.9723891317907253
Energy: 1.1143910413997746
Energy: 0.9891990033050724
Energy: 1.1143910413997746
Energy: 1.0008597196384004
Energy: 1.0487685673483138
Energy: 1.0131096673518707
Energy: 1.0487685673483138
Energy: 1.0793975613860496
Energy: 1.106822990989216
Energy: 1.0619491701643933
Energy: 1.1068229901035587
Energy: 1.0686302461436683
Energy: 1.0604539667060735
Energy: 0.9382187804602272
Energy: 1.0604539667072772
Energy: 1.131133492896963
Energy: 0.9770931309492408
Energy: 1.007819679521025
Energy: 0.9770931309504446

minimum gb energy = 0.9124758353210709 eV
minimum distance =  2.38010392641624 Angstroms
sigma value = 25


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

Energy: 0.9651262420246801
Energy: 1.1597817582153878
Energy: 1.1803110846005278
Energy: 1.1597817582153878
Energy: 0.9466954649521679
Energy: 1.1731598040262352
Energy: 0.9322376850783977
Energy: 1.1731598040262352
Energy: 1.0638756452909324
Energy: 1.2957666234593543
Energy: 0.9351228742843787
Energy: 1.2957666234593543
Energy: 1.3940760736848679
Energy: 1.1861739277533403
Energy: 1.1334894927335635
Energy: 1.1861739277533403
Energy: 1.1332985606699044
Energy: 1.0627641643473933
Energy: 1.015286147960092
Energy: 1.0627641643459043
Energy: 0.9323242983034206
Energy: 1.2350787061716548
Energy: 1.3590693586639013
Energy: 1.2350787061716548
Energy: 1.1474435281918292
Energy: 1.147056788023323
Energy: 1.0631355946653416
Energy: 1.147056788023323
Energy: 1.2535820143591483
Energy: 1.207354386013565
Energy: 1.0176998529020564
Energy: 1.207354386013565
Energy: 0.9327961550662522
Energy: 1.0615024881750252
Energy: 1.0014560973371007
Energy: 1.0615024881750252
Energy: 1.2084747027409617
Energy: 1.2601815852725289
Energy: 1.062775394146753
Energy: 1.26018158527104
Energy: 1.0127298306206702
Energy: 1.2635254026008482
Energy: 1.3209985291491129
Energy: 1.2635254025993594
Energy: 1.0625927651277172
Energy: 1.0231483157751122
Energy: 1.1580600553700748
Energy: 1.0231483157736234
Energy: 1.1271290574787216
Energy: 1.2353121752644192
Energy: 0.9317222824808545
Energy: 1.2353121752644192
Energy: 1.0635245551025234
Energy: 1.1311836604973067
Energy: 1.0939308778560115
Energy: 1.1311836604958179
Energy: 1.016461045956032
Energy: 1.1316638095246607
Energy: 1.2542921857837424
Energy: 1.131663809521683
Energy: 1.0007544756155569
Energy: 1.2814120944063572
Energy: 0.9356970576028666
Energy: 1.281412094407846
Energy: 1.0632557068908188
Energy: 1.0267862125320353
Energy: 1.206794500040449
Energy: 1.0267862125320353

minimum gb energy = 0.9317222824808545 eV
minimum distance =  2.36426580370913 Angstroms
sigma value = 17


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

Energy: 1.0438355766253942
Energy: 1.3077167490582928
Energy: 1.3534450805846636
Energy: 1.3077167490574495
Energy: 1.1254974746454427
Energy: 1.0841078299722584
Energy: 0.9521289449871063
Energy: 1.084107829973102
Energy: 1.2529708757315838
Energy: 1.2499155731949436
Energy: 0.9542754725462247
Energy: 1.2499155731949436
Energy: 1.0433829170362903
Energy: 1.2573497261452833
Energy: 1.1366732980991043
Energy: 1.2573497261452833
Energy: 1.1838847885211918
Energy: 1.1101206624392737
Energy: 1.1907136535075822
Energy: 1.1101206624392737
Energy: 0.9650816559431733
Energy: 1.058965718538766
Energy: 1.406829536283244
Energy: 1.0589657181266385
Energy: 1.0612511995627345
Energy: 1.0655176193328697
Energy: 1.0606486988959793
Energy: 1.0655176193328697
Energy: 1.2579663844613607
Energy: 1.0592589865320325
Energy: 0.9651026298359872
Energy: 1.0592589878956975
Energy: 1.0415969779790377
Energy: 1.2371947493831263
Energy: 1.2156347019064528
Energy: 1.2371947493831263
Energy: 1.2970888169796928
Energy: 1.1737838163624932
Energy: 1.046644237998586
Energy: 1.1737838163624932
Energy: 0.9542274174200442
Energy: 1.1022070512902515
Energy: 1.402330786273856
Energy: 1.1022070512877222
Energy: 1.071956598509048
Energy: 1.065052132773126
Energy: 1.0580758445900804
Energy: 1.065052132773126
Energy: 1.3728022200565875
Energy: 1.0440117571629
Energy: 1.0494811157779587
Energy: 1.0440117571679592
Energy: 0.9562759202376824
Energy: 1.1627301582568423
Energy: 1.1660725109370151
Energy: 1.1627301582551561
Energy: 1.1125084642530578
Energy: 1.0656228310441231
Energy: 1.0816953988577547
Energy: 1.0656228310441231
Energy: 1.1635778559154843
Energy: 1.2295103735744246
Energy: 1.1642323411946336
Energy: 1.2295103735761108
Energy: 1.0596693787375042
Energy: 1.150675807069523
Energy: 1.2559479167474583
Energy: 1.150675807069523
Energy: 1.3703572854017523
Energy: 1.2887273384666185
Energy: 0.9649494301960782
Energy: 1.2887273384657754
Energy: 0.9988015133154057
Energy: 1.1809632677617583
Energy: 1.0280122876732949
Energy: 1.1809632677626014
Energy: 1.0720993853222656
Energy: 1.0584094688341315
Energy: 1.0698232504409273
Energy: 1.0584094687734218
Energy: 1.0583545104192085
Energy: 1.0941595225119818
Energy: 1.1620164987048744
Energy: 1.0941595225111387
Energy: 1.0345093929186129
Energy: 1.1093206843279033
Energy: 1.2955894254228466
Energy: 1.1093206843295895
Energy: 1.1724036858736686
Energy: 1.2343888491992676
Energy: 0.951707617403688
Energy: 1.2343888492001105
Energy: 1.0557971995415827
Energy: 1.1827840682047377
Energy: 1.2163867351075095
Energy: 1.1827840682055808
Energy: 1.0442965695765447
Energy: 1.3233353657048361
Energy: 1.2181843092103235
Energy: 1.3233353657048361
Energy: 1.2832190526371499
Energy: 1.1022474817448786
Energy: 0.9531355810553468
Energy: 1.1022474817440353
Energy: 1.0163908292524195
Energy: 1.256156697432529
Energy: 1.3139039774346595
Energy: 1.256156697432529
Energy: 1.1629876854001047
Energy: 1.0584483286228954
Energy: 1.1631579128642482
Energy: 1.0584483287088624
Energy: 1.2555356944535356
Energy: 1.1947975722803965
Energy: 1.06072898003543
Energy: 1.1947975722812396
Energy: 0.964563473989781
Energy: 1.1834658715768194
Energy: 1.2223198558335933
Energy: 1.1834658715742898

minimum gb energy = 0.951707617403688 eV
minimum distance =  2.27236109897628 Angstroms
sigma value = 53


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

Energy: 0.898607559274833
Energy: 0.8984634226713182
Energy: 1.4185408502675567
Energy: 0.8984634226732593
Energy: 1.1825702057071517
Energy: 1.2020172003740535
Energy: 1.0484252749924534
Energy: 1.2020172003740535
Energy: 0.917493319666332
Energy: 0.91844688058791
Energy: 1.1652820289272328
Energy: 0.9184468805860128
Energy: 0.917459990821399
Energy: 1.1647575599967805
Energy: 1.0586484971018983
Energy: 1.1647575599967805
Energy: 1.1824973776468417
Energy: 1.2019629649819152
Energy: 0.9310198468834958
Energy: 1.2019629649799741
Energy: 0.898607559274833
Energy: 0.8984634226713182
Energy: 1.373255961673956
Energy: 0.8984634226713182
Energy: 1.1825702057052103
Energy: 1.2020172003721123
Energy: 1.1507252163123975
Energy: 1.2020172003740535
Energy: 0.917493319666332
Energy: 0.91844688058791
Energy: 1.1652820289272328
Energy: 0.91844688058791
Energy: 0.917459990821399
Energy: 1.1647575599987217
Energy: 1.0726358327673629
Energy: 1.1647575599967805
Energy: 1.1824973776468417
Energy: 1.2019629649799741
Energy: 1.0501169092525602
Energy: 1.2019629649799741
Energy: 0.898607559274833
Energy: 0.8984634226713182
Energy: 1.4538149904617963
Energy: 0.8984634226713182
Energy: 1.1825702057052103
Energy: 1.2020172003721123
Energy: 1.1507252163143387
Energy: 1.2020172003740535
Energy: 0.917493319666332
Energy: 0.91844688058791
Energy: 1.1652820289272328
Energy: 0.91844688058791

minimum gb energy = 0.8984634226713182 eV
minimum distance =  2.34353922197738 Angstroms
sigma value = 9


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

Energy: 0.9906822835711766
Energy: 1.33515752924887
Energy: 1.388602694646433
Energy: 1.3351575292495883
Energy: 1.3220221456761703
Energy: 1.1031519300762969
Energy: 1.0707742216713507
Energy: 1.1031519300770152
Energy: 1.2074510792282647
Energy: 1.1979747846822444
Energy: 1.0123338064445786
Energy: 1.1979747846836812
Energy: 1.4273874420431047
Energy: 1.2798806285143751
Energy: 1.0953355649096332
Energy: 1.2798806285136568
Energy: 1.3576160193871525
Energy: 1.0378543378991758
Energy: 1.074665810828279
Energy: 1.0378543378984575
Energy: 0.9794892901504033
Energy: 0.9793794499551342
Energy: 1.4737855990391897
Energy: 0.9793794499536973
Energy: 1.4849449738712655
Energy: 1.3927310707189964
Energy: 1.056737473095364
Energy: 1.3927310707189964
Energy: 1.2084768384151732
Energy: 1.316363293309999
Energy: 1.256381914901102
Energy: 1.316363293309999
Energy: 1.2142742853396944
Energy: 1.3599739764130852
Energy: 0.9877808669729273
Energy: 1.3599739764130852
Energy: 1.0602126771532439
Energy: 1.082040105333219
Energy: 1.0440668650468259
Energy: 1.082040105333219
Energy: 1.1157541291008701
Energy: 1.3555915014416207
Energy: 1.4416567247969645
Energy: 1.3555915014401838
Energy: 1.3173911966225087
Energy: 1.3290836341066066
Energy: 1.0180178906837662
Energy: 1.3290836341073249
Energy: 1.0735066004243192
Energy: 1.0863064842261114
Energy: 1.3495667192175318
Energy: 1.0863064842404804
Energy: 1.4267917767860743
Energy: 1.3287813322369089
Energy: 0.9933696415619057
Energy: 1.3287813322369089
Energy: 1.05917512139075
Energy: 1.2293145341032312
Energy: 1.233071195770817
Energy: 1.229314534102513
Energy: 1.0411335926301308
Energy: 1.2881680295677251
Energy: 1.248612535031673
Energy: 1.2881680295670066
Energy: 1.180158224116079
Energy: 1.2305682325916631
Energy: 1.059322834236301
Energy: 1.2305682325916631
Energy: 1.1038888651370018
Energy: 1.0345591548915398
Energy: 1.4738558950196574
Energy: 1.0345591548929767
Energy: 1.4698525373376814
Energy: 1.1719140385605828
Energy: 0.9822379759331175
Energy: 1.1719140385605828
Energy: 1.0178180352610562
Energy: 1.110863455647273
Energy: 1.2244379217989059
Energy: 1.110863455647273
Energy: 1.2593459360126469
Energy: 1.243770217181133
Energy: 1.2576973447596658
Energy: 1.24377021718257
Energy: 1.1393927510279567
Energy: 1.1569341328110314
Energy: 1.0559961763325345
Energy: 1.1569341328110314
Energy: 0.9871146333757936
Energy: 1.1715431654719939
Energy: 1.1428929136067008
Energy: 1.1715431654719939
Energy: 1.4375212422062857
Energy: 1.3358274976383262
Energy: 1.1133727295817395
Energy: 1.3358274976390445
Energy: 1.0563024801297654
Energy: 1.2952203276658623
Energy: 1.4029964877288332
Energy: 1.2952203276651437
Energy: 1.1897971251271102
Energy: 1.0696986644752744
Energy: 1.1106975838295856
Energy: 1.0696986644781483
Energy: 1.1331549832759118
Energy: 1.2303346936246329
Energy: 1.272397700176141
Energy: 1.2303346936253514
Energy: 0.9971057742784118
Energy: 1.2637773127769907
Energy: 1.2767433715751466
Energy: 1.2637773127777092
Energy: 1.1292098917190119
Energy: 0.9796027955819597
Energy: 1.1093200160969565
Energy: 0.9796027955819597
Energy: 1.0228543458156674
Energy: 1.3977287667675795
Energy: 1.4091542669056143
Energy: 1.397728766766861
Energy: 1.3588451385566243
Energy: 1.3525481831479162
Energy: 1.1125319797673647
Energy: 1.3525481831479162
Energy: 0.9929057945798082
Energy: 1.0361373180050812
Energy: 1.1421902320723407
Energy: 1.036137318004363
Energy: 0.9801824138904127
Energy: 1.1560081799240551
Energy: 1.1892672699319635
Energy: 1.156008179922618
Energy: 1.2615723616345516
Energy: 1.3666961210259005
Energy: 1.2556151212795719
Energy: 1.3666961210259005
Energy: 1.0503849530360814
Energy: 1.2148578540301278
Energy: 1.488985261628879
Energy: 1.2148578540301278

minimum gb energy = 0.9793794499536973 eV
minimum distance =  2.30396753835489 Angstroms
sigma value = 73


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

Energy: 1.053267360633689
Energy: 1.074169339605688
Energy: 1.4846998473891047
Energy: 1.074169339668356
Energy: 1.323180191864436
Energy: 1.0772994660909792
Energy: 1.0532790805630832
Energy: 1.0772994660898394
Energy: 1.0997016667394888
Energy: 1.0572359905576951
Energy: 1.0046844245396047
Energy: 1.0572359905576951
Energy: 1.2522439279979674
Energy: 1.143920442652219
Energy: 1.0918318511871699
Energy: 1.1439204426510792
Energy: 1.1320895578467334
Energy: 1.1247285339733804
Energy: 0.9907822584572774
Energy: 1.1247285339733804
Energy: 1.1557231522737454
Energy: 1.0083918538984404
Energy: 1.4093615358056868
Energy: 1.0083918538984404
Energy: 1.4941985869910772
Energy: 1.268417419704568
Energy: 1.102097360735141
Energy: 1.268417419704568
Energy: 1.0849772410909564
Energy: 1.2022167738527199
Energy: 1.3372725316297136
Energy: 1.2022167738527199
Energy: 1.420088490126141
Energy: 0.9803193109073611
Energy: 0.979977719508411
Energy: 0.980319310908501
Energy: 1.0584528934494082
Energy: 1.1658601749335125
Energy: 0.9812128633255172
Energy: 1.1658601749346524
Energy: 1.0794361861472237
Energy: 1.056972717758019
Energy: 1.3780842333655487
Energy: 1.056972717758019
Energy: 1.2811133128345538
Energy: 1.1709881282146009
Energy: 1.0701056809766352
Energy: 1.1709881282100416
Energy: 1.1173264363882
Energy: 1.1885442899585326
Energy: 1.5882871836394707
Energy: 1.1885442899585326
Energy: 1.3794209155750485
Energy: 1.1708739057532465
Energy: 1.1408298264624712
Energy: 1.1708739057521067
Energy: 0.9909532450880607
Energy: 1.2622773786180403
Energy: 1.3847691664785111
Energy: 1.2622773786169004
Energy: 1.333657372513031
Energy: 1.1107975992815418
Energy: 1.0525285023851965
Energy: 1.1107975992815418
Energy: 1.052141121935866
Energy: 1.1167208238426125
Energy: 1.099797720646152
Energy: 1.1167208238426125
Energy: 1.0514859457825472
Energy: 1.0735314564424732
Energy: 1.1051927074452899
Energy: 1.0735314564424732
Energy: 1.0411583987295827
Energy: 0.9798091127316468
Energy: 1.1433640083193013
Energy: 0.9798091127305069
Energy: 1.060816948812393
Energy: 1.375921944796323
Energy: 1.4553398624144849
Energy: 1.375921944796323
Energy: 1.3829725177958472
Energy: 1.1422070777026807
Energy: 1.1548800433386128
Energy: 1.1422070777026807
Energy: 1.1254216884845185
Energy: 1.1130861693212988
Energy: 1.416941976740969
Energy: 1.1130861693212988

minimum gb energy = 0.9798091127305069 eV
minimum distance =  2.30342973083344 Angstroms
sigma value = 7


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

Energy: 1.0005337409392763
Energy: 0.9997720873752923
Energy: 1.4929345804871097
Energy: 0.9997720873728745
Energy: 1.4817850662494418
Energy: 1.1206343746353813
Energy: 1.1125306372057815
Energy: 1.1206343746345753
Energy: 1.1075148493720974
Energy: 1.1645280616893758
Energy: 1.0658855720754725
Energy: 1.164528061687764
Energy: 1.1372185399702524
Energy: 1.0691360162306751
Energy: 1.1191646381919131
Energy: 1.069136016229906
Energy: 1.0626945674612414
Energy: 1.101401504795518
Energy: 1.0124214506743947
Energy: 1.1014015047939059
Energy: 1.1163184202015244
Energy: 1.1054937179446456
Energy: 1.368830441912114
Energy: 1.1054937179430337
Energy: 1.3966116382822653
Energy: 1.369802034214162
Energy: 1.1401968025410787
Energy: 1.369802034214162
Energy: 1.115966708830015
Energy: 1.0015769544952116
Energy: 1.5124130720968725
Energy: 1.0015769544968236
Energy: 1.3943437127940013
Energy: 1.0609929989025033
Energy: 1.1164341382253666
Energy: 1.0609929989016973
Energy: 1.0667848032911136
Energy: 1.1803579710660794
Energy: 1.288568609767232
Energy: 1.1803579710660794
Energy: 1.1382148446266063
Energy: 1.1644961174374246
Energy: 1.1599668824545606
Energy: 1.1644961174374246
Energy: 1.002014475089654
Energy: 1.1013928063083143
Energy: 1.1171997446494781
Energy: 1.1013928063067022
Energy: 1.0109142899823962
Energy: 1.0008424805417229
Energy: 1.2589055933529423
Energy: 1.000842480542529
Energy: 1.13875588883617
Energy: 0.9964457478343968
Energy: 1.2196203608788247
Energy: 0.9964457478360088
Energy: 1.0649851143606046
Energy: 1.313800269067115
Energy: 1.4091105834811353
Energy: 1.3138002690695332
Energy: 1.4704108298566378
Energy: 0.9955916159826927
Energy: 1.1430353889942284
Energy: 0.9955916159802746
Energy: 1.0733731611085326
Energy: 1.101645580538787
Energy: 1.2631913086206048
Energy: 1.101645580539593
Energy: 1.0255300579681945
Energy: 1.0695326533854705
Energy: 1.1168229630516109
Energy: 1.0695326533862766
Energy: 1.074061894651737
Energy: 1.103581820794489
Energy: 1.0365071579911556
Energy: 1.103581820796907
Energy: 1.0758176906845611
Energy: 1.0877142509421267
Energy: 1.1236427459849678
Energy: 1.0877142509429327
Energy: 1.135490754868867
Energy: 1.2076936973943972
Energy: 1.1165660184422652
Energy: 1.2076936973960095
Energy: 1.1061960422016526
Energy: 1.2616809802790179
Energy: 1.3307693545171262
Energy: 1.2616809802782118
Energy: 1.4387417192049725
Energy: 1.1161982808960955
Energy: 1.1606393261442025
Energy: 1.1161982808944835
Energy: 1.0048973660388156
Energy: 1.001209200980446
Energy: 1.5308097230960764
Energy: 1.0012092009772218
Energy: 1.2064494676494721
Energy: 1.130310208505117
Energy: 1.0556720251781415
Energy: 1.1303102085059231
Energy: 1.171557556774054
Energy: 1.162008635272828
Energy: 1.1384035043380523
Energy: 1.162008635272828
Energy: 1.0615687530670228
Energy: 1.126986155025427
Energy: 1.092134944943901
Energy: 1.126986155023815
Energy: 1.2360396763871133
Energy: 1.1016086540548993
Energy: 1.1190082891128672
Energy: 1.1016086540548993
Energy: 1.093379430401822
Energy: 1.1044959722539673
Energy: 1.313138492505904
Energy: 1.1044959722523553
Energy: 1.304694687737734
Energy: 1.283304529319863
Energy: 1.1481307875582107
Energy: 1.2833045293190568
Energy: 1.093323334580314
Energy: 1.1042307319688294
Energy: 1.356148840820371
Energy: 1.1042307319704414

minimum gb energy = 0.9955916159802746 eV
minimum distance =  2.29789581460279 Angstroms
sigma value = 29


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

Energy: 0.9428615516499135
Energy: 0.9423457415926024
Energy: 1.2957820078547302
Energy: 0.9423457415926024
Energy: 1.4061220636382838
Energy: 1.1741725995425432
Energy: 0.9407417992919064
Energy: 1.1741725995431045
Energy: 1.0231708640178385
Energy: 1.1270031911203584
Energy: 1.1602122552031835
Energy: 1.127003191120078
Energy: 0.9410296312964586
Energy: 0.9131097601651162
Energy: 1.1734668223380507
Energy: 0.9131097601651162
Energy: 0.9434759382021132
Energy: 0.9131182979942153
Energy: 1.1615653165907165
Energy: 0.9131182995454213
Energy: 1.1715278282160746
Energy: 0.9932011008378613
Energy: 1.1714980781844484
Energy: 0.9932011008376117
Energy: 0.9126444350671679
Energy: 0.9132245616244936
Energy: 0.9434576273679202
Energy: 0.9132245616244936
Energy: 1.174875047032552
Energy: 0.9170792219949339
Energy: 0.9407976986191052
Energy: 0.9170792219946532
Energy: 1.1600492387240138
Energy: 1.1270104063473976
Energy: 1.1106628256396034
Energy: 1.1270104063473976

minimum gb energy = 0.9126444350671679 eV
minimum distance =  2.33824435964535 Angstroms
sigma value = 5


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

Energy: 0.9383818919582998
Energy: 0.944574522726413
Energy: 1.358785716081306
Energy: 0.9445745227271742
Energy: 1.1360194467106066
Energy: 1.411019785925159
Energy: 0.9552223708372858
Energy: 1.411019785925159
Energy: 0.9241938952454218
Energy: 0.9415863187386105
Energy: 1.172235840052433
Energy: 0.9415863187386105
Energy: 0.9939905998000194
Energy: 0.992124909472537
Energy: 0.9265178212630176
Energy: 0.9921249094717756
Energy: 0.9368072562007081
Energy: 0.9971540552378269
Energy: 1.1421977786677886
Energy: 0.9971540552385884
Energy: 1.0931101426199497
Energy: 1.0658443529501456
Energy: 0.924347235340587
Energy: 1.0658443529501456
Energy: 0.9209147209263164
Energy: 0.9954706413182377
Energy: 0.918515797008927
Energy: 0.9954706413174763
Energy: 0.9209157992655242
Energy: 0.9464445825112047
Energy: 0.9375578262106997
Energy: 0.9464445825028295
Energy: 0.9236337269074153
Energy: 0.9966396666112661
Energy: 0.9675998214344016
Energy: 0.9966396666120275
Energy: 0.9233538793801267
Energy: 0.9959267848738875
Energy: 0.9238955902957852
Energy: 0.9959267848746489
Energy: 0.9659951452034927
Energy: 1.172757410885496
Energy: 0.9259579215788266
Energy: 1.1727574105019298
Energy: 0.9573245592466325
Energy: 0.9346140217194264
Energy: 0.9447354297003085
Energy: 0.9346140217186649
Energy: 1.068982042427005
Energy: 0.9464286540409304
Energy: 0.9479744313336415
Energy: 0.9464286540416917
Energy: 0.9354300814928223
Energy: 1.2448518855646409
Energy: 1.2500446462174142
Energy: 1.2448518855646409
Energy: 1.4912371976925562
Energy: 1.2638470461704399
Energy: 0.9253904493022115
Energy: 1.2638470461704399
Energy: 0.9251143640873798
Energy: 0.9418932918865883
Energy: 1.2140776586225728
Energy: 0.9418932918873497
Energy: 1.1356187003897975
Energy: 0.9347735412127967
Energy: 0.9368308605745754
Energy: 0.9347735412120353
Energy: 0.9279896410460031
Energy: 0.9454080470005792
Energy: 1.350535220962699
Energy: 0.9454080469800563
Energy: 0.9223831507698638
Energy: 0.9959045870973222
Energy: 0.9254910930894595
Energy: 0.9959045870973222
Energy: 0.9347122150036329
Energy: 1.131077737058172
Energy: 0.9328271615505709
Energy: 1.1310777363929962
Energy: 0.9423344427062524
Energy: 0.991148489662489
Energy: 0.928686439420572
Energy: 0.991148489662489
Energy: 0.9600919372607637
Energy: 0.9955351801685072
Energy: 0.9235022423494337
Energy: 0.9955351801685072
Energy: 0.9284388386720399
Energy: 1.1714508885336803
Energy: 0.9685355061824691
Energy: 1.1714508885336803
Energy: 0.9447636787965316
Energy: 0.9494171133927731
Energy: 0.9572206307634474
Energy: 0.9494171133920118
Energy: 0.9513915516187995
Energy: 0.9406876250071002
Energy: 0.9563090474926816
Energy: 0.9406876250071002
Energy: 0.964518338083302
Energy: 0.9463417599004842
Energy: 0.9387287435853122
Energy: 0.9463417598951546
Energy: 0.9283821015100929
Energy: 0.9183299983116304
Energy: 1.0736145142149416
Energy: 0.918329998310869
Energy: 1.226171580618595
Energy: 1.1771964755695363
Energy: 0.9250105829395445
Energy: 1.1771964755657294
Energy: 0.9312678051928805
Energy: 1.1687239938176401
Energy: 1.2586032326559848
Energy: 1.1687239938145946
Energy: 1.3131404115187622
Energy: 1.0406954379830942
Energy: 0.9276296321453643
Energy: 1.0406954379838556
Energy: 0.9226362489750569
Energy: 0.9313191746779301
Energy: 1.2996394601977599
Energy: 0.9313191746771685
Energy: 1.135380137948259
Energy: 1.0024608358791134
Energy: 0.9316416775362446
Energy: 1.0024608358791134
Energy: 0.9266430101047751
Energy: 1.1912098689674524
Energy: 1.0117533696674526
Energy: 1.1912098689666908

minimum gb energy = 0.918329998310869 eV
minimum distance =  2.26396346097038 Angstroms
sigma value = 1


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

Energy: 1.006648238588588
Energy: 1.0802032266058763
Energy: 1.2854874243166876
Energy: 1.0802032266048238
Energy: 0.9233050230058366
Energy: 0.8778015724417608
Energy: 0.8972865042421359
Energy: 0.8778015724407081
Energy: 0.8899387544959352
Energy: 0.9064972460479804
Energy: 1.0778305066324578
Energy: 0.9064972460469277
Energy: 0.9044919185093159
Energy: 0.9738422097973299
Energy: 0.8978089321683258
Energy: 0.9738422097962772
Energy: 0.8963080526079047
Energy: 0.9038853931954226
Energy: 1.1571206879179965
Energy: 0.9038853931954226
Energy: 0.8954102885484245
Energy: 1.1019984987048297
Energy: 0.897661484606559
Energy: 1.1019984987058826
Energy: 0.8899816869601647
Energy: 1.00115490711123
Energy: 0.9026950648300682
Energy: 1.00115490711123
Energy: 0.890269638786918
Energy: 0.9090049869730445
Energy: 0.9375444046451619
Energy: 0.9090049869730445
Energy: 0.906258838132965
Energy: 0.91257704320966
Energy: 0.9532123308087466
Energy: 0.9125770432107129
Energy: 0.9062935046704166
Energy: 1.1306885588850182
Energy: 0.9260698672135197
Energy: 1.130688558886071
Energy: 0.8898894719140028
Energy: 1.0711430906170203
Energy: 0.9156049276536801
Energy: 1.0711430906159676
Energy: 0.8901192541561057
Energy: 1.1033974074344524
Energy: 1.05634122311893
Energy: 1.1033974074344524
Energy: 0.8954903909095447
Energy: 1.2002979339453133
Energy: 0.8995022330029219
Energy: 1.2002979339453133
Energy: 0.8961665518313873
Energy: 0.9097273112631952
Energy: 1.2132866465869558
Energy: 0.9097273112621425
Energy: 0.9583899030828033
Energy: 0.9706316890817098
Energy: 0.899567914544273
Energy: 0.9706316890827625
Energy: 0.8896958351487928
Energy: 0.9069046169849844
Energy: 1.1819388886203632
Energy: 0.9069046169849844
Energy: 1.0633634199309754
Energy: 1.3258187590003225
Energy: 0.8940287783728329
Energy: 1.3258187593075803
Energy: 1.006648238588588
Energy: 1.0802032266048238
Energy: 1.2856037910177893
Energy: 1.0802032266048238
Energy: 0.9233050230089948
Energy: 0.8778015724417608
Energy: 0.8972865042421359
Energy: 0.8778015724407081
Energy: 0.8899387544959352
Energy: 0.9064972460469277
Energy: 1.0778305066314053
Energy: 0.9064972460469277
Energy: 0.9044919185103686
Energy: 0.9738422097973299
Energy: 0.8978089321683258
Energy: 0.9738422097962772
Energy: 0.8963080526079047
Energy: 0.9038853931954226
Energy: 1.1571206879464204
Energy: 0.9038853931954226
Energy: 0.8954102885484245
Energy: 1.1019984987058826
Energy: 0.8976614846076117
Energy: 1.1019984987058826
Energy: 0.8899816869601647
Energy: 1.00115490711123
Energy: 0.9026950648300682
Energy: 1.00115490711123

minimum gb energy = 0.8778015724407081 eV
minimum distance =  2.30848547816255 Angstroms
sigma value = 17


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

Energy: 0.901609687928315
Energy: 0.9021431545097572
Energy: 1.2288122593970352
Energy: 0.9021431545104079
Energy: 1.0836149505163988
Energy: 0.8937077732353023
Energy: 0.8841221384414509
Energy: 0.8937077732366037
Energy: 0.8815684122205424
Energy: 0.8950637172220507
Energy: 1.110654835727832
Energy: 0.8950637172200987
Energy: 1.0107214912673244
Energy: 1.0782643659775302
Energy: 0.8799556376758336
Energy: 1.0782643659775302
Energy: 0.8838628163540646
Energy: 0.8993076325259931
Energy: 1.192825651594562
Energy: 0.8993076325636734
Energy: 0.9445502469214188
Energy: 1.2443674616592306
Energy: 0.8883902302740092
Energy: 1.2443674616618332
Energy: 0.8995267883268405
Energy: 1.0931394230320264
Energy: 0.8926467272077515
Energy: 1.0931394230300742
Energy: 0.8874899673571461
Energy: 1.1111662945920995
Energy: 0.8808925877960707
Energy: 1.1111662945920995
Energy: 0.9025047154665187
Energy: 1.1284058616065022
Energy: 0.9301766833967863
Energy: 1.1284058616071528
Energy: 0.9059794499635578
Energy: 1.1122386458156812
Energy: 0.8906138025165363
Energy: 1.1122386458150304
Energy: 0.8862974751940678
Energy: 1.0974212327568642
Energy: 0.8883656375951635
Energy: 1.0974212327568642
Energy: 0.8874722715841272
Energy: 0.9423640951887059
Energy: 0.8747417325952995
Energy: 0.9423640951887059
Energy: 0.8902397352164743
Energy: 1.1054643283734051
Energy: 0.8827636722441833
Energy: 1.1054643283747065
Energy: 0.8992853137774575
Energy: 1.105250451747059
Energy: 0.9012342769196288
Energy: 1.105250451747059
Energy: 0.896297251748745
Energy: 1.1155232695377464
Energy: 0.9089998294542585
Energy: 1.1155232695364452
Energy: 0.8870749035653926
Energy: 0.8960601137375601
Energy: 1.1893241346393735
Energy: 0.8960601137382108
Energy: 0.8838483217913178
Energy: 1.0816881138375187
Energy: 0.8832770242242918
Energy: 1.0816881138368681
Energy: 0.8766527456334046
Energy: 0.9868725581198976
Energy: 1.0822941522635077
Energy: 0.9868725581205483
Energy: 1.4301136156196452
Energy: 1.3180288188395908
Energy: 0.8839234756979281
Energy: 1.3180288188382894
Energy: 0.8854481930258985
Energy: 0.8927175324093375
Energy: 1.0945141922293518
Energy: 0.8927175324099881
Energy: 1.3663234414143266
Energy: 0.8887705540969891
Energy: 0.8981897582238415
Energy: 0.8887705540963384
Energy: 0.898686315671691
Energy: 0.9894570715315368
Energy: 1.2411314669303337
Energy: 0.9894570715321875
Energy: 0.9897943720127529
Energy: 1.0866958336949133
Energy: 0.8864579916591072
Energy: 1.0866958336949133
Energy: 0.8839656414637506
Energy: 0.8872004124548967
Energy: 1.134679165350354
Energy: 0.8872004124561981
Energy: 0.9483264228029507
Energy: 0.9871204010698569
Energy: 0.8783031162253232
Energy: 0.9871204010731103
Energy: 0.8847479482818196
Energy: 0.9592551672185138
Energy: 0.8833549316369345
Energy: 0.9592551672178631
Energy: 1.0754142769786454
Energy: 1.1097920736749547
Energy: 0.8879680122085288
Energy: 1.1097920736723519
Energy: 0.912265734603007
Energy: 1.1156775782321156
Energy: 0.896597959217761
Energy: 1.1156775782308141
Energy: 0.9154999693230383
Energy: 1.1051819160607426
Energy: 0.9020328128762454
Energy: 1.1051819160594414
Energy: 0.8845530009929874
Energy: 1.1060134138384428
Energy: 0.9049500175498433
Energy: 1.1060134138364905
Energy: 0.8747908057122534
Energy: 0.9568694643588931
Energy: 0.8763851324765497
Energy: 0.9568694643588931
Energy: 0.8862422935079711
Energy: 1.0968092916662977
Energy: 0.8838609156211283
Energy: 1.0968092916662977
Energy: 0.8881043099561126
Energy: 1.1132027245891143
Energy: 1.0819249652021028
Energy: 1.1132027245897649
Energy: 0.9324889744573351
Energy: 1.1276650097035463
Energy: 0.8909754255679131
Energy: 1.1276650097035463
Energy: 0.8795739382115833
Energy: 0.9025253064729301
Energy: 0.9072640729701763
Energy: 0.9025253064033072
Energy: 0.8928620079524907
Energy: 1.09375488359949
Energy: 0.9008450592653979
Energy: 1.0937548835988393
Energy: 0.8864590455253459
Energy: 1.288709729545129
Energy: 0.9445288482896881
Energy: 1.2887097295470809
Energy: 1.1905555910397012
Energy: 1.100618864606541
Energy: 0.884976921960711
Energy: 1.1006188645668493

minimum gb energy = 0.8747417325952995 eV
minimum distance =  2.289526882065 Angstroms
sigma value = 89


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

Energy: 0.8002626252318714
Energy: 0.8001428391345109
Energy: 0.8609503176681969
Energy: 0.8001428391345109
Energy: 0.8012395487709376
Energy: 0.8225066786100697
Energy: 0.8119869530199271
Energy: 0.8225066786100697
Energy: 0.8102460957437974
Energy: 1.2467730449604268
Energy: 1.4725315299090858
Energy: 1.2467730449604268
Energy: 0.8637851542425363
Energy: 0.8221321844150191
Energy: 0.812125541733858
Energy: 0.8221321844150191
Energy: 0.8096365661407707
Energy: 1.1494519870909494
Energy: 1.1481355416360606
Energy: 1.1494519870909494
Energy: 0.809788693593036
Energy: 0.8008951890074802
Energy: 0.8029105571433157
Energy: 0.8008951890057777
Energy: 0.8104237023339033
Energy: 0.9428888741361238
Energy: 0.8004927040021236
Energy: 0.9428888741361238
Energy: 0.8306778023843445
Energy: 1.2075341977560028
Energy: 0.811987482886161
Energy: 1.2075341977560028
Energy: 0.8110457826413102
Energy: 0.8860165246438244
Energy: 0.803625830308919
Energy: 0.8860165246438244
Energy: 0.8216617859306696
Energy: 1.1492780230069013
Energy: 0.8098716062115456
Energy: 1.1492780230069013
Energy: 0.7999734220086068
Energy: 0.8227379830716094
Energy: 0.8095804130254983
Energy: 0.8227379830716094
Energy: 0.8001343165307285
Energy: 0.9438402994436159
Energy: 0.8121220270111104
Energy: 0.9438402994436159
Energy: 0.8111561300155122
Energy: 1.1508726783320973
Energy: 0.8306062826961187
Energy: 1.1508726783320973
Energy: 0.8111463924398183
Energy: 0.8835872897069834
Energy: 0.8106027417550286
Energy: 0.8835872897069834
Energy: 0.803430802945096
Energy: 1.1508087893817893
Energy: 0.811084707186287
Energy: 1.1508087893817893

minimum gb energy = 0.7999734220086068 eV
minimum distance =  2.29352042574865 Angstroms
sigma value = 13


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

Energy: 0.7989872309528412
Energy: 1.127743419786164
Energy: 1.2292561121781262
Energy: 1.1277434197854506
Energy: 1.2653324206038716
Energy: 1.1558812108033836
Energy: 0.7741547078662729
Energy: 1.1558812108033836
Energy: 0.7784496212366607
Energy: 1.0359478955580228
Energy: 0.9705120207916841
Energy: 1.0359478955587365
Energy: 0.7748066760715069
Energy: 1.0265493703528534
Energy: 0.7720914712720583
Energy: 1.0265493703542805
Energy: 0.785483870787812
Energy: 1.2922243977785668
Energy: 0.8198068358240354
Energy: 1.292224397782135
Energy: 0.7744961435754818
Energy: 0.9089506625756947
Energy: 0.7835535848877851
Energy: 0.9089506625756947
Energy: 0.7826474812818287
Energy: 1.292020879018689
Energy: 1.1157879972960871
Energy: 1.2920208790201162
Energy: 0.7750313056629768
Energy: 1.0459631611224585
Energy: 0.7834997774521969
Energy: 1.0459631611203177
Energy: 0.7826162276336758
Energy: 1.246047270618253
Energy: 0.9846774029759373
Energy: 1.2460472706203938
Energy: 0.9509577789524937
Energy: 1.3157353214120353
Energy: 0.7719842358645423
Energy: 1.315735321412749
Energy: 0.7848488370009168
Energy: 0.8537490458171622
Energy: 0.7734054155629658
Energy: 0.8537490458171622
Energy: 1.0557890626279607
Energy: 1.2582615204914607
Energy: 0.7767321431658317
Energy: 1.2582615206341132
Energy: 0.807382165361755
Energy: 0.7868195948828769
Energy: 0.8118895228410165
Energy: 0.7868195948821632
Energy: 1.048270360411169
Energy: 1.1550958018682878
Energy: 0.7766653554836986
Energy: 1.1550958024817124
Energy: 0.7847149208343182
Energy: 0.9177303720153799
Energy: 0.7879343887110358
Energy: 0.9177303720168071
Energy: 0.773021232681161
Energy: 0.9662494735740484
Energy: 0.7797733163350381
Energy: 0.9662494735754755
Energy: 0.7823519032559862
Energy: 1.1248846302536633
Energy: 0.7792065206195476
Energy: 1.124884630257231
Energy: 0.8045450911094458
Energy: 0.8368641024844901
Energy: 0.7920428209764261
Energy: 0.8368641024844901
Energy: 0.7828797869287795
Energy: 1.0971754934780564
Energy: 0.792384193258581
Energy: 1.097175493477343
Energy: 0.7828829114928537
Energy: 1.0978177665166746
Energy: 0.7921162297488239
Energy: 1.0978177665202427
Energy: 0.8043855784919088
Energy: 0.8373595103454532
Energy: 0.7924044697299039
Energy: 0.8373595103433125
Energy: 0.7827262853670187
Energy: 1.1245558362328958
Energy: 0.7792301806066575
Energy: 1.124555836230755
Energy: 0.773120275767711
Energy: 0.9921096230522649
Energy: 0.7786922357298444
Energy: 0.992109630789811
Energy: 0.7850369556951472
Energy: 0.9169247095761904
Energy: 0.7793172450896605
Energy: 0.916924709573336
Energy: 1.0494035306229224
Energy: 0.9666733882263426
Energy: 0.7780846635701846
Energy: 0.9666733882213476
Energy: 0.8074261303581259
Energy: 0.7870317211989436
Energy: 0.7854963717037097
Energy: 0.7870317212010842
Energy: 1.0555931597077775
Energy: 1.2779171978622248
Energy: 0.7779440548815802
Energy: 1.2779171978629382
Energy: 0.7840889540286391
Energy: 1.0149669092075808
Energy: 0.7700155853950277
Energy: 1.0149669092082942
Energy: 0.951643758504207
Energy: 1.309826409858719
Energy: 0.7719321602080114
Energy: 1.3098264098594325
Energy: 0.782666890070024
Energy: 0.9559999512897757
Energy: 0.9020198339096249
Energy: 0.95599995122698
Energy: 0.7759933962057903
Energy: 1.0458595149354752
Energy: 0.7837431445141276
Energy: 1.0458595149312586
Energy: 0.7860936088958558
Energy: 1.2496740726641016
Energy: 1.1359431179864297
Energy: 1.2496740726626745
Energy: 0.7744840960814697
Energy: 0.9099613143906378
Energy: 0.7835491947903989
Energy: 0.9099613143835018
Energy: 0.7850614315141925
Energy: 1.2861424899776024
Energy: 1.050525862717847
Energy: 1.2861424900645952
Energy: 0.7740552805625401
Energy: 1.1428419457784145
Energy: 0.7720966307753904
Energy: 1.142841945779128

minimum gb energy = 0.7700155853950277 eV
minimum distance =  2.31181677016864 Angstroms
sigma value = 37


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

Energy: 0.8416348246710229
Energy: 0.8417757467958829
Energy: 0.7322522659877031
Energy: 0.8417757467958829
Energy: 1.2815438401611075
Energy: 1.0399051490186717
Energy: 0.7166725664729943
Energy: 1.0399051490186717
Energy: 0.7295679922233116
Energy: 1.1536419466457217
Energy: 1.009488127462967
Energy: 1.1536419466457217
Energy: 0.8070335996135922
Energy: 0.8313021762164298
Energy: 0.7175071065108156
Energy: 0.8313021762176573
Energy: 0.71643232304504
Energy: 1.043064657058669
Energy: 0.7878453120335404
Energy: 1.043064657058669
Energy: 0.7220295546804373
Energy: 1.145274056521731
Energy: 0.808372773314908
Energy: 1.145274056522931
Energy: 0.7243831296292159
Energy: 1.270703565935428
Energy: 1.0478785734879474
Energy: 1.270703565935428
Energy: 0.7057366563290665
Energy: 0.7331612636537126
Energy: 0.7356583827159476
Energy: 0.7331612636524848
Energy: 0.717349575791734
Energy: 1.0479197113567924
Energy: 1.0520981889035423
Energy: 1.0479197113567924
Energy: 1.0147001097553543
Energy: 1.3180140348164964
Energy: 0.8079489899599671
Energy: 1.3180140348164964
Energy: 0.7164936173836546
Energy: 1.1701465320416722
Energy: 0.8064687939917844
Energy: 1.1701465320416722
Energy: 0.9644845199834557
Energy: 1.0276585197826522
Energy: 0.7170368224656575
Energy: 1.0276585197826522
Energy: 0.8113553180624887
Energy: 1.1422344987199917
Energy: 0.7087130064420306
Energy: 1.1422344987199917
Energy: 1.0495482583244615
Energy: 1.2974245763760666
Energy: 0.7054060345486342
Energy: 1.2974245764509282
Energy: 0.8406483575008867
Energy: 0.8601164579289663
Energy: 0.7056868880337194
Energy: 0.8601164579289663
Energy: 0.8410095147052752
Energy: 1.0275831184736426
Energy: 0.7160071231303998
Energy: 1.027583118472415
Energy: 0.8115601229522191
Energy: 0.9535486543218443
Energy: 0.7210613894617549
Energy: 0.9535486543218443
Energy: 0.8061605469842527
Energy: 1.2231405483141828
Energy: 0.716456869887636
Energy: 1.2231405482540532
Energy: 0.716668040046281
Energy: 1.0286432476921767
Energy: 0.7164477472646988
Energy: 1.0286432476921767
Energy: 0.7164290988946972
Energy: 1.1722540506758756
Energy: 0.8060213772959629
Energy: 1.1722540506746477

minimum gb energy = 0.7054060345486342 eV
minimum distance =  2.25880458182475 Angstroms
sigma value = 25


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

Energy: 0.7603050351604626
Energy: 1.157130218268012
Energy: 0.6447273046748356
Energy: 1.1571302182689274
Energy: 1.2288307358171107
Energy: 1.0677140720555867
Energy: 0.6484392109329093
Energy: 1.0677140720594214
Energy: 0.7222490608395864
Energy: 0.7979477840003547
Energy: 0.8826426626675579
Energy: 0.7979478703642742
Energy: 0.864458186399421
Energy: 0.99291781413915
Energy: 0.6505521748910097
Energy: 0.9929178141401086
Energy: 0.656600463319516
Energy: 1.0789914584372355
Energy: 0.6880543580152757
Energy: 1.0789914584381943
Energy: 0.7123942595136628
Energy: 1.0910022305921008
Energy: 0.6570260246865355
Energy: 1.0910022305930596
Energy: 0.6476185366880782
Energy: 0.7912611137870957
Energy: 0.9167158219995245
Energy: 0.7912611137880544
Energy: 0.638679828583235
Energy: 1.0079998128587888
Energy: 0.7234185277238514
Energy: 1.0079998128578302
Energy: 0.647087454859122
Energy: 1.0670906225763221
Energy: 1.0499793715088508
Energy: 1.0670906227650936
Energy: 0.6314737059906018
Energy: 0.9403326513819459
Energy: 0.6801415852644408
Energy: 0.9403326513819459
Energy: 0.6475633612946124
Energy: 0.79043892984196
Energy: 0.9452455523145603
Energy: 0.7904389298448361
Energy: 0.8826410172180849
Energy: 0.9949325046938307
Energy: 0.7234213394186577
Energy: 0.9949325046947893
Energy: 0.651954484256493
Energy: 0.8881439163844507
Energy: 0.8638659700174851
Energy: 0.8881439163786986
Energy: 0.8602322804116854
Energy: 1.058232134735982
Energy: 0.6567491746611855
Energy: 1.0582321579485896
Energy: 0.6592976740551736
Energy: 0.9599625812788718
Energy: 0.7061086354825395
Energy: 0.959962581230938
Energy: 0.9167397814013488
Energy: 1.1632475007095975
Energy: 0.6495414501599096
Energy: 1.1632475007038454
Energy: 0.72731116759346
Energy: 0.8931248590353216
Energy: 0.7123892028017732
Energy: 0.8931248590295696
Energy: 0.8827969528726248
Energy: 0.950263769251423
Energy: 0.6459045677423455
Energy: 0.9502637507419337
Energy: 0.7645509727089068
Energy: 1.1754852256317332
Energy: 0.6311497513861795
Energy: 1.1754852256307744
Energy: 1.0566538833120898
Energy: 1.1514333628854416
Energy: 0.649233642884064
Energy: 1.1514333628844828
Energy: 0.7268882555146108
Energy: 0.998835939680543
Energy: 0.6378298121692393
Energy: 0.9988359396795842
Energy: 0.7235279281518262
Energy: 1.016798150558387
Energy: 0.6530970457524471
Energy: 1.0167981505574282
Energy: 0.6595282118905096
Energy: 0.82663620471874
Energy: 0.860267766734466
Energy: 0.8266362047196987
Energy: 0.7077300985402991
Energy: 1.152299712647373
Energy: 0.6558813282694081
Energy: 1.1522997126464145
Energy: 0.646553910266706
Energy: 1.1787798976734523
Energy: 0.9173142130670203
Energy: 1.1787798976734523
Energy: 0.6361857643290306
Energy: 1.0187572092891284
Energy: 0.7282008917798657
Energy: 1.018757209287211

minimum gb energy = 0.6311497513861795 eV
minimum distance =  2.27798899363782 Angstroms
sigma value = 41


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

Energy: 0.8307210267347358
Energy: 1.0098799796847135
Energy: 0.8911645749398527
Energy: 1.0098799796847135
Energy: 1.1377916720066685
Energy: 0.9661965613808579
Energy: 0.5817497925612543
Energy: 0.9661965613808579
Energy: 0.5986623448901893
Energy: 0.9972858877541073
Energy: 1.1558513406693698
Energy: 0.9972858877548935
Energy: 0.8224034898705138
Energy: 0.8252480859761552
Energy: 0.581756978737972
Energy: 0.8252480859620079
Energy: 0.5778963385615047
Energy: 0.9330225227142714
Energy: 0.6152729100147852
Energy: 0.9330230289388998
Energy: 0.6983641693537038
Energy: 0.9787047892814643
Energy: 0.5817524556143033
Energy: 0.9787047892822502
Energy: 0.5808997282336009
Energy: 0.8270413169463248
Energy: 0.7502222923559485
Energy: 0.8270413169651876
Energy: 0.5712622658571838
Energy: 0.8268398339238322
Energy: 0.5788515242192415
Energy: 0.8268398339246182
Energy: 0.5837875223934192
Energy: 1.074519622864002
Energy: 0.9607802572482559
Energy: 1.0745196228647877
Energy: 0.5725120193474244
Energy: 0.820200960445562
Energy: 0.599110284091993
Energy: 0.820200960445562
Energy: 0.5810944079848722
Energy: 0.9420231092223761
Energy: 0.9809707328068006
Energy: 0.942023109223948
Energy: 0.5731688376931258
Energy: 0.8327060998391855
Energy: 0.8314345483813725
Energy: 0.8327060998376137
Energy: 0.5839163717154395
Energy: 0.9685414640379014
Energy: 0.9807057125012622
Energy: 0.9685414639774187
Energy: 0.7858501630109062
Energy: 1.0967703599507184
Energy: 0.5992144257812791
Energy: 1.0967703599507184
Energy: 0.5808882951427332
Energy: 0.9535986030357914
Energy: 0.8229765659653849
Energy: 0.9535986030310756
Energy: 0.7652566234895469
Energy: 0.8601772642916905
Energy: 0.5787091455873917
Energy: 0.8601772642924763
Energy: 0.583689800033898
Energy: 0.969494822540332
Energy: 0.6976077567801829
Energy: 0.9694948225395459
Energy: 0.7498701407272389
Energy: 1.2756495024134413
Energy: 0.5815843385377414
Energy: 1.2756495024079395
Energy: 0.5810718964089809
Energy: 0.8276792810442414
Energy: 0.57055932680478
Energy: 0.8276792809546782
Energy: 0.7463163296517398
Energy: 0.9182592011089055
Energy: 0.5861830961571016
Energy: 0.9182592011089055
Energy: 0.6014570408187143
Energy: 1.0440117331479648
Energy: 0.5724249577231694
Energy: 1.0440117331479648
Energy: 0.9827791385016841
Energy: 1.097902715821854
Energy: 0.5818729179511893
Energy: 1.097902715821854
Energy: 0.8338662272626282
Energy: 1.017632087619223
Energy: 0.573101101822991
Energy: 1.0176320876200091
Energy: 0.8312734111539825
Energy: 1.0183717261768903
Energy: 0.5857494860556882
Energy: 1.0183717261761043
Energy: 0.6014290476237145
Energy: 1.0926921996986496
Energy: 0.578584197650059
Energy: 1.0926921996986496
Energy: 0.8203583344609018
Energy: 1.0958248062844738
Energy: 0.5819125568871076
Energy: 1.0958248062844738
Energy: 0.5810906944835916
Energy: 0.8707293896210476
Energy: 0.7656599568140366
Energy: 0.8707293896186897
Energy: 0.578771953970086
Energy: 0.9683509732482406
Energy: 0.5862350436691267
Energy: 0.9683509732474546
Energy: 0.583715983162852
Energy: 1.1055944070104866
Energy: 0.7498794455071907
Energy: 1.1055944070104866
Energy: 0.5709565574959734
Energy: 0.9960542684325332
Energy: 0.5844901155538926
Energy: 0.9960542684333191
Energy: 0.5860108603473649
Energy: 1.034640961066662
Energy: 0.746075704424162
Energy: 1.0346409610643044
Energy: 0.5738755695332651
Energy: 1.0429827402444605
Energy: 0.6044929360804491
Energy: 1.0429827402428884

minimum gb energy = 0.57055932680478 eV
minimum distance =  2.27321373367702 Angstroms
sigma value = 15


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

Energy: 0.7540689237996543
Energy: 0.979433483977237
Energy: 0.8307741537781053
Energy: 0.979433483977237
Energy: 1.1154871046250265
Energy: 0.9612298536655083
Energy: 0.5444360652687504
Energy: 0.96122985366684
Energy: 0.5616031623367007
Energy: 0.7443752169710893
Energy: 1.091988415305738
Energy: 0.7443752169717551
Energy: 1.085534287934764
Energy: 0.967838770894989
Energy: 0.5445395109719642
Energy: 0.967838770894989
Energy: 0.5420032443282031
Energy: 1.046125757456056
Energy: 0.5618041777447725
Energy: 1.0461257574573877
Energy: 0.7384562193662684
Energy: 0.867473059932733
Energy: 0.544387116997881
Energy: 0.8674730599333988
Energy: 0.5437938219661632
Energy: 0.7485152652777538
Energy: 0.6819354475662802
Energy: 0.748515265277088
Energy: 0.6313556912585516
Energy: 0.8439394536384733
Energy: 0.5443714641901982
Energy: 0.8439394594105356
Energy: 0.5454578410696843
Energy: 0.9877766280606741
Energy: 0.8160001948616439
Energy: 0.9877766280600083
Energy: 0.5257560822892947
Energy: 1.0335266586888916
Energy: 0.5426772699575798
Energy: 1.0335266586895573
Energy: 0.5442164272663458
Energy: 0.8636113388312232
Energy: 0.9268812696309047
Energy: 0.8636113388305574
Energy: 0.5269605431695474
Energy: 0.8913680676281011
Energy: 0.5622610750063693
Energy: 0.8913680676294328
Energy: 0.5457525708524268
Energy: 0.9894048005846602
Energy: 0.9923515255993719
Energy: 0.989404800585326
Energy: 0.5286540083405887
Energy: 0.9795085055833246
Energy: 0.7543430717786411
Energy: 0.9795085055839903
Energy: 0.5439808371786892
Energy: 0.8676799850848522
Energy: 1.0132600662067728
Energy: 0.8676799851001659
Energy: 0.7107760742849137
Energy: 0.7406270953958314
Energy: 0.5621557259452957
Energy: 0.7406270953659303
Energy: 0.5459492238949345
Energy: 0.9890205723378278
Energy: 0.8917074286386506
Energy: 0.9890205723384936
Energy: 0.6944988255229003
Energy: 1.0449395718694026
Energy: 0.5423933784741887
Energy: 1.0449395718694026
Energy: 0.5438141413866148
Energy: 0.9439791298146255
Energy: 0.7338894455988215
Energy: 0.9439791297939852
Energy: 0.679919835009221
Energy: 0.8684243873468042
Energy: 0.5445768212765704
Energy: 0.8684243873468042
Energy: 0.5456695216167494
Energy: 0.9990037872510112
Energy: 0.685138624617204
Energy: 0.999003787251677
Energy: 0.6786968815348741
Energy: 0.9843302098365134
Energy: 0.5480731964818852
Energy: 0.9843302098358475
Energy: 0.5440355888901708
Energy: 0.9434517799915728
Energy: 0.5262752920745953
Energy: 0.9434517799929045
Energy: 0.9226285198596154
Energy: 0.8636820393922827
Energy: 0.5442507842320861
Energy: 0.8636820393929485
Energy: 0.5633559562415172
Energy: 0.9588545524759514
Energy: 0.5267145259510546
Energy: 0.9588545524766172
Energy: 0.8963088483294117
Energy: 0.9862259310986463
Energy: 0.5474741849375614
Energy: 0.986225931099978
Energy: 0.7560003075609493
Energy: 0.9774247827066594
Energy: 0.527414996025709
Energy: 0.9774247827066594
Energy: 1.0126964177095983
Energy: 0.8675504203493679
Energy: 0.5442082492688444
Energy: 0.8675504203487022
Energy: 0.563586719387735
Energy: 1.0588242284018055
Energy: 0.5316768259217685
Energy: 1.0588242284018055
Energy: 0.7420363038399692
Energy: 0.9864720501740264
Energy: 0.5477604216571497
Energy: 0.9864720501733606
Energy: 0.5439223848988799
Energy: 1.041817672109271
Energy: 0.7073372641564201
Energy: 1.0418176721099368
Energy: 0.7340566441174875
Energy: 0.8676223362906402
Energy: 0.5444188813928476
Energy: 0.8676223362946351
Energy: 0.5455084025550855
Energy: 1.1795066246596193
Energy: 0.6800671183366558
Energy: 1.179506624654293
Energy: 0.5300037053664874
Energy: 0.8830831717711944
Energy: 0.5477135567215858
Energy: 0.8830831717705286
Energy: 0.5403454085553824
Energy: 0.9834269991196863
Energy: 0.678378447291625
Energy: 0.9834269991196863
Energy: 0.5259277278050176
Energy: 0.94055917300268
Energy: 0.5460372763679084
Energy: 0.9405591730040116
Energy: 0.5455922184972201
Energy: 1.0005832114257889
Energy: 0.9191706131545363
Energy: 1.0005832114264548

minimum gb energy = 0.5257560822892947 eV
minimum distance =  2.30917166173193 Angstroms
sigma value = 85


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

Energy: 0.7646100258073986
Energy: 0.9629232500164331
Energy: 0.7249258453275583
Energy: 0.9629232500158557
Energy: 1.133130525000061
Energy: 0.7589831971240061
Energy: 0.496513266314547
Energy: 0.7589831971240061
Energy: 0.7356334332984882
Energy: 0.8523332339881592
Energy: 0.6422257516978155
Energy: 0.8523332339881592
Energy: 1.1080384426234116
Energy: 0.8125354856209527
Energy: 0.496563863080167
Energy: 0.8125354856215301
Energy: 0.5672878503628237
Energy: 0.7412457324063605
Energy: 0.5329244648103774
Energy: 0.7412457324115577
Energy: 0.8338838680125965
Energy: 0.6968367024797779
Energy: 0.4966105248700948
Energy: 0.6968367025299909
Energy: 0.5403130789269255
Energy: 0.693829789756213
Energy: 0.6511692368828406
Energy: 0.6938297897504383
Energy: 0.7138865304780179
Energy: 0.9329619619533189
Energy: 0.5032054691268695
Energy: 0.9329619619550513
Energy: 0.5024336713093751
Energy: 0.6694364361543408
Energy: 0.7400662335607808
Energy: 0.6694364361543408
Energy: 0.605473098616084
Energy: 0.6874397599493323
Energy: 0.5406765346982875
Energy: 0.6874397599481773
Energy: 0.49764357415986943
Energy: 0.7537500709349414
Energy: 0.8729773760243844
Energy: 0.7537500709372512
Energy: 0.5186115428728879
Energy: 0.9488859157091152
Energy: 0.5677464546668455
Energy: 0.9488859157091152
Energy: 0.4959586502160393
Energy: 0.6687154294595992
Energy: 0.9567908328684231
Energy: 0.6687154294601766
Energy: 0.47485732413255494
Energy: 0.7586418487838822
Energy: 0.7362408273988091
Energy: 0.7586416272317181
Energy: 0.4973746253217214
Energy: 0.8121185898233294
Energy: 1.0915056344152438
Energy: 0.8121185898267943
Energy: 0.47228570414654203
Energy: 0.9321257413005388
Energy: 0.7074277881668369
Energy: 0.9321257413011163
Energy: 0.49612827132163484
Energy: 0.6688272159237191
Energy: 0.9829560121259764
Energy: 0.6688272158377297
Energy: 0.6206280360515669
Energy: 0.7587893078738613
Energy: 0.7361400365663285
Energy: 0.7587893286491989
Energy: 0.4974324966619083
Energy: 0.884357477980413
Energy: 0.9366054496304136
Energy: 0.8843574779786805
Energy: 0.6077992152864803
Energy: 0.9809700938896857
Energy: 0.5677716668278725
Energy: 0.9809700938896857
Energy: 0.4969175367414454
Energy: 0.6347430150358974
Energy: 0.8889416659115976
Energy: 0.6347430150353199
Energy: 0.6512256599186378
Energy: 0.6994887156861905
Energy: 0.5407003204898844
Energy: 0.6994887156873455
Energy: 0.5034352398416944
Energy: 0.8465112680768222
Energy: 0.7132820020915956
Energy: 0.846511268229797
Energy: 0.6542296980633227
Energy: 0.9463142762273934
Energy: 0.5030675254319807
Energy: 0.9463142762285484
Energy: 0.5421453435009087
Energy: 0.6395936734256733
Energy: 0.6064487021604701
Energy: 0.6395936734250959
Energy: 0.8755607146762786
Energy: 0.8000189751891279
Energy: 0.49721328896049444
Energy: 0.8000189751891279
Energy: 0.5692988170091585
Energy: 0.9000615620548118
Energy: 0.5157318335680026
Energy: 0.9000615620559667
Energy: 0.8773105722245523
Energy: 0.9473533817609211
Energy: 0.4964442745214724
Energy: 0.9473533817603437
Energy: 0.7376288045701533
Energy: 0.8254619592701183
Energy: 0.5203388569321238
Energy: 0.8254619592314546
Energy: 1.031126888419588
Energy: 0.8039595902237482
Energy: 0.49835086640027576
Energy: 0.803959515997458
Energy: 0.7665731567212086
Energy: 0.9394885995573617
Energy: 0.47193333822577666
Energy: 0.9394885995573617
Energy: 0.9534686641078413
Energy: 0.9414353944159245
Energy: 0.49637762212692643
Energy: 0.941435394415347
Energy: 0.7377226047945696
Energy: 0.7578581637759628
Energy: 0.4765939085191665
Energy: 0.757858163777118
Energy: 0.9363469703428529
Energy: 0.8739546288818373
Energy: 0.4984792029885341
Energy: 0.8739546288812599
Energy: 0.5690545048457033
Energy: 0.9641504353658751
Energy: 0.6079156528602615
Energy: 0.9641504353658751
Energy: 0.725391632779663
Energy: 0.9034077669347245
Energy: 0.4984510444104557
Energy: 0.9034077669433862
Energy: 0.5421996574269159
Energy: 0.6989983410674111
Energy: 0.6514677412177958
Energy: 0.6989983410685662
Energy: 0.7143192823029276
Energy: 0.838100146035582
Energy: 0.5049082845927555
Energy: 0.8381001460361595
Energy: 0.5037084705593979
Energy: 0.993646723774133
Energy: 0.6537253602782116
Energy: 0.881939229162076
Energy: 0.5231465656196318
Energy: 0.9250893137190777
Energy: 0.544049326525636
Energy: 0.9250893137219651
Energy: 0.4960918225930706
Energy: 0.7542210005344991
Energy: 0.8735884864469596
Energy: 0.7542210005431611
Energy: 0.516346623856602
Energy: 0.8885541001370493
Energy: 0.571268458759728
Energy: 0.8885541001370493
Energy: 0.49727180545862965
Energy: 0.9060080498461536
Energy: 0.8771107613359141
Energy: 0.906008049845576

minimum gb energy = 0.47193333822577666 eV
minimum distance =  2.30642602815959 Angstroms
sigma value = 113


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

Energy: 0.015501494157562154
Energy: 0.016168257088768963
Energy: 0.8071191396808153
Energy: 0.0161682570883497
Energy: 0.8064078429440277
Energy: 1.4242790241395997
Energy: 0.25543643623007595
Energy: 1.4242790241391559
Energy: 0.015501494157562154
Energy: 0.016168257088768963
Energy: 0.807098921260049
Energy: 0.0161682570883497
Energy: 0.8064078429440277
Energy: 1.4242790241395997
Energy: 0.25543643623007595
Energy: 1.4242790241391559
Energy: 0.015501494158006076
Energy: 0.016168257088768963
Energy: 0.8071696628042789
Energy: 0.0161682570883497
Energy: 0.8064078429435837
Energy: 1.4242790241391559
Energy: 0.25543643623007595
Energy: 1.4242790241391559

minimum gb energy = 0.015501494157562154 eV
minimum distance =  2.51169336215928 Angstroms
sigma value = 1