Model name: model_name=MEAM_LAMMPS_MirazDhariwalMeng_2020_CuNTi__MO_122936827583_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315634429455
cohesive_energy=3.5402784386781683
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.74472228912698e-19, 2.4303577578809396e-19, 2.9282982339618e-19, 3.3400576288998e-19, 3.68277923267874e-19, 3.9739267706092194e-19, 4.2244591308677993e-19, 4.4418745001016e-19, 4.631524148268179e-19, 4.79744556048522e-19, 4.942762981189019e-19, 5.0699277406296e-19, 5.180958581365799e-19, 5.27750574533064e-19, 5.36094710442936e-19, 5.432452247604779e-19, 5.4930145243699795e-19, 5.54351513187366e-19, 5.584707093133799e-19, 5.61724730057034e-19, 5.641712537771519e-19, 5.658647544792899e-19, 5.668500931092e-19, 5.67170528436e-19, 5.66829264812958e-19, 5.65726967288766e-19, 5.637354617327039e-19, 5.60702541364542e-19, 5.564503645779059e-19, 5.50761035350572e-19, 5.433798075977339e-19, 5.339974612290299e-19, 5.22242291265372e-19, 5.076624838959719e-19, 4.89703686005466e-19, 4.676817681711359e-19, 4.40753985483498e-19, 4.0785969701084397e-19, 3.6765948308715e-19, 3.18447025597206e-19, 2.58019331669262e-19, 1.83498892068654e-19, 9.107316727711559e-20, -2.4398746870869e-20, -1.7002298440007997e-19, -3.5654037724719e-19, -6.016269391268039e-19, -9.36537931814994e-19, -1.421004102403914e-18, -2.1790243093053598e-18, -3.49252075739124e-18, -6.071015766851819e-18, -1.19204344834551e-17, -2.75082512821362e-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: 0.016739188812447764
Energy: 0.7684076389601243
Energy: 0.35608651902072236
Energy: 1.0683955713882345
Energy: 0.9244236481638729
Energy: 0.2967185847062161
Energy: 0.017153099333019894
Energy: 0.09554309905074045
Energy: 0.7426086114662213
Energy: 0.09369075417035969
Energy: 0.3557416070592399
Energy: 0.6207051404123821
Energy: 0.018223827658265346
Energy: 0.09453441309883177
Energy: 0.017119226667131247
Energy: 0.7432136486473369
Energy: 0.22488773710346643
Energy: 0.35567616399455376
Energy: 0.6194731606560121
Energy: 0.09299652474227717
Energy: 0.09465665063520479
Energy: 0.019192251767238953
Energy: 0.7643210875241222
Energy: 0.3562795199671999
Energy: 0.7641873092167177
Energy: 0.7443040634490834
Energy: 0.09346118169230941
Energy: 0.017764249178090476
Energy: 0.0957350188734423
Energy: 0.7443313618536235
Energy: 0.24454042244949584
Energy: 0.35552997607330766
Energy: 0.6218070483931778
Energy: 0.017685701602138313
Energy: 0.09481225748879812
Energy: 0.01709537887627751
Energy: 0.7433538455553463
Energy: 0.2248347629691641
Energy: 0.7673905294281956
Energy: 0.7476544871405615
Energy: 0.09286697668414902
Energy: 0.09457549494541558

minimum gb energy = 0.016739188812447764 eV
minimum distance =  2.5299492716269 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.0892467549474598
Energy: 1.0374303222562509
Energy: 1.1138913802890082
Energy: 1.14205740260486
Energy: 1.21218043672829
Energy: 1.0848436005643478
Energy: 0.9678628419161858
Energy: 0.9718296662028528
Energy: 1.078050132711617
Energy: 0.9901528449709421
Energy: 1.1052356625917805
Energy: 1.0837162631800041
Energy: 0.992647173755634
Energy: 1.1069274648023568
Energy: 1.0761093298535236
Energy: 1.1003095039409974
Energy: 1.0150963181285415
Energy: 1.1011241674990553
Energy: 1.0999526506599397
Energy: 1.073422800307201
Energy: 1.0952916123844363
Energy: 1.0015369828724614
Energy: 1.09953481299973
Energy: 0.9880162407305433
Energy: 1.0851000253936514
Energy: 1.0352861700335056
Energy: 0.987334994689072
Energy: 1.1250828511853357
Energy: 1.1795522243579601
Energy: 1.0766715565609435
Energy: 1.1024219534316262
Energy: 1.015013798467381
Energy: 1.0643307964799755
Energy: 1.0992131303759918
Energy: 1.0832182496001361
Energy: 1.031657768995213
Energy: 1.0819874942779995
Energy: 1.1143412481978368
Energy: 1.1307376092079258
Energy: 1.1158215298047112
Energy: 1.1179796910378037
Energy: 1.1287500307217813
Energy: 0.9917326244378044
Energy: 1.0820099957846963
Energy: 1.0075925289011591
Energy: 1.0589320035232679
Energy: 1.0387706104759598
Energy: 1.0562742411431425
Energy: 1.0622759378520743
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Energy: 1.0615304906803171
Energy: 0.9766371835337755
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Energy: 1.0468207050179192
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Energy: 1.0379812006026954
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Energy: 1.0494831475939257
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Energy: 1.0706082265725863
Energy: 1.179184713095566
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Energy: 1.0224541142293602
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Energy: 1.0945968916223827
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Energy: 1.1324428904032897
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Energy: 1.0625532154492925
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Energy: 1.0032685671980006
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Energy: 1.0037953912850546
Energy: 1.0090367340706505
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Energy: 1.0753196498064181
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Energy: 1.202170706174688
Energy: 1.1129051190222716
Energy: 1.0414061518390059
Energy: 1.1119921887665178
Energy: 0.9814749513116224
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Energy: 1.0134294297745905
Energy: 1.0936970549310883
Energy: 1.138892830310311
Energy: 1.0524312521101982
Energy: 1.0994092930603487
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Energy: 1.035230148392687
Energy: 1.0144393512477174
Energy: 1.0911915269047965
Energy: 1.0831640572494843
Energy: 1.0193336662044075
Energy: 1.046567845846025
Energy: 1.1396315274629814
Energy: 1.0671729938934365
Energy: 1.0831393525372524
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Energy: 1.0985589310516009
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Energy: 1.0857901804384598
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Energy: 1.0682586891888428
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Energy: 1.048070912983142
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Energy: 1.011902908697233
Energy: 1.051738877971788
Energy: 1.0672847878599008
Energy: 1.0605961382309435
Energy: 1.0736946304631538
Energy: 1.1641293282513492
Energy: 1.0793764380740543
Energy: 1.0621674432389376
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Energy: 1.0609712643149471
Energy: 1.0246475175086378
Energy: 1.075272602723104
Energy: 1.0817444348532335
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Energy: 1.074124126204058
Energy: 0.974509837924471
Energy: 1.058115814140402
Energy: 1.0772539482362926
Energy: 0.9920495833237193
Energy: 1.115583729894194
Energy: 1.1791136556418789
Energy: 1.004608770062297
Energy: 1.0457642338991902
Energy: 1.0952789982906797
Energy: 1.0702264340509025
Energy: 1.0790356624256763
Energy: 1.0330298341062125
Energy: 0.9884524576400162
Energy: 1.102749855373334
Energy: 0.9842984705325102
Energy: 1.0775445121074387
Energy: 1.0569041790198934
Energy: 0.9947061782025902
Energy: 1.0626270312188173
Energy: 1.238958050389435
Energy: 1.0673254838693522
Energy: 1.1318707819443963
Energy: 1.07645461102574
Energy: 1.028456626055843
Energy: 1.0077146806147095
Energy: 1.0662816898770084
Energy: 1.0025713641210223
Energy: 1.0548127314913693
Energy: 1.0127241668747011
Energy: 1.1247785884856414
Energy: 0.9887557010843273
Energy: 1.0228446853181519
Energy: 1.1037486631775915
Energy: 1.089607158739326
Energy: 1.0330931980052993
Energy: 1.0730273394053669
Energy: 1.072728515760252
Energy: 1.097481741907976
Energy: 1.1001023491499073
Energy: 1.1391130028845362

minimum gb energy = 0.9678628419161858 eV
minimum distance =  2.27926287204406 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.0919967365860048
Energy: 1.2016943787486776
Energy: 1.0743471050440196
Energy: 1.2389713329380396
Energy: 1.3720915733819607
Energy: 1.060844267243704
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Energy: 0.9978130802628997
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Energy: 1.0879908733533676
Energy: 1.051712014868327
Energy: 1.0224241111300347
Energy: 0.9854152121577276
Energy: 0.9858404051218902
Energy: 1.0470149515769998
Energy: 1.0080092262438436
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Energy: 1.0653030735589142
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Energy: 0.993445912890773
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Energy: 1.0178745862836862
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Energy: 1.0306721658696558
Energy: 1.0104223915231187
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Energy: 1.0482369220540289
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Energy: 0.9823469023714412
Energy: 1.1612068299143594
Energy: 1.0322113189890105
Energy: 0.9972261154329212
Energy: 1.0015391884673939
Energy: 1.0106238120759357
Energy: 0.9778250584592039
Energy: 1.001240397188198
Energy: 1.0784284840233205
Energy: 1.1367303116346728
Energy: 1.0767426566609755
Energy: 1.0108335731546372
Energy: 1.029435546269389
Energy: 0.993905036062058
Energy: 1.1039813919852155
Energy: 1.1630096982222164
Energy: 1.030566303278053
Energy: 1.0321103215069956
Energy: 1.1146979644704145
Energy: 1.0102900943506687
Energy: 1.0238581691538955
Energy: 1.0920371948837424
Energy: 1.0114497007011969
Energy: 1.0467930310589495
Energy: 1.0529047889148193
Energy: 1.008045428923943
Energy: 1.1768975454546813
Energy: 1.0470785594510281
Energy: 0.987625316424434
Energy: 0.9904078365154368
Energy: 0.9951479973848651
Energy: 0.9841128956787248
Energy: 1.0746257315404124
Energy: 1.1268632563118062
Energy: 1.1785546744624913
Energy: 1.0012191007997615
Energy: 1.0036454507134311
Energy: 0.9706932771265592
Energy: 1.023489877356315
Energy: 1.0758786485384144
Energy: 1.0809664192380306
Energy: 1.0033311174421784
Energy: 1.0186283911200449
Energy: 1.0094399611096652
Energy: 0.9876465176240923
Energy: 0.978632720350949
Energy: 1.0072269705931216
Energy: 0.9907735910792222
Energy: 1.0633860271078608
Energy: 1.0058863658459807
Energy: 0.9794400755767741
Energy: 1.0041969553419094
Energy: 1.050241480092364
Energy: 0.9880015119693549
Energy: 1.0288957503157616
Energy: 1.0402368554743648
Energy: 1.045477513916029
Energy: 1.05436069248425
Energy: 1.0204397893133494
Energy: 1.059670991732306
Energy: 1.0381083302276974
Energy: 1.009826025380486
Energy: 1.0026467761871192
Energy: 1.0255186188437297
Energy: 1.1413094169077451
Energy: 1.1711248820459899
Energy: 1.0632744993199925
Energy: 1.0444739686919402
Energy: 1.0147425167588273
Energy: 0.9769505477796506
Energy: 0.9864326159871091
Energy: 1.076433224241734
Energy: 1.0043152940841262
Energy: 1.0566093195202209
Energy: 1.0078362381087844
Energy: 1.0107710523712337
Energy: 0.9773697437261822
Energy: 1.00073202456199
Energy: 1.074061372064688
Energy: 1.0566867884674058
Energy: 1.0293027075431296
Energy: 0.9878183770238784
Energy: 1.0221951485160574
Energy: 0.9843640604270566
Energy: 1.005947549086587
Energy: 1.1099979241878337
Energy: 0.9785740614931341
Energy: 1.0473652895812755
Energy: 1.066423591948656
Energy: 0.9920683457615067
Energy: 1.044664783547822
Energy: 1.026518130796237
Energy: 1.0163626353499682
Energy: 0.9849724514178377
Energy: 1.0443282839952772
Energy: 0.9954676885001343
Energy: 0.9843924386354598
Energy: 1.050827479491605
Energy: 1.0063660164765926
Energy: 1.015841785388594
Energy: 1.0043823672920786
Energy: 1.0152067978290413
Energy: 1.039766115183547
Energy: 1.1309699223620957
Energy: 1.1894760357572696
Energy: 1.0235862475211754
Energy: 1.0201687628403908

minimum gb energy = 0.9706259089681074 eV
minimum distance =  2.30352780788928 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.1438557869216461
Energy: 1.0265408982221922
Energy: 1.1530347493621642
Energy: 0.9966264641106359
Energy: 1.0400377134817353
Energy: 1.0121073111319414
Energy: 1.0162489893017135
Energy: 1.0778374203268368
Energy: 0.9984352685716118
Energy: 1.0621256232011826
Energy: 1.109831488076066
Energy: 1.0328721765805693
Energy: 1.0221310972151831
Energy: 1.088190038499801
Energy: 1.0121009339615996
Energy: 1.0468554909489387
Energy: 1.1203882363144997
Energy: 1.0138573139526221
Energy: 1.047333163471908
Energy: 1.0184447596413486
Energy: 1.0588484663077535
Energy: 1.0587398575173776
Energy: 1.125563502268954
Energy: 1.0573232283412977
Energy: 1.1408865361634712
Energy: 1.0984398715518346
Energy: 1.061279124996227
Energy: 1.0986855590049707
Energy: 1.0757427946742137
Energy: 1.0672685521989898
Energy: 1.047266776416379
Energy: 1.0771921007313232
Energy: 1.0913497094716915
Energy: 1.081160795866835
Energy: 1.0535110899110247
Energy: 1.0805502114254033
Energy: 1.0531261701358248
Energy: 1.0568109590535517
Energy: 1.1257353334593083
Energy: 1.0743450872559928
Energy: 1.0886801692982524
Energy: 1.0866491239448115
Energy: 1.0578614271242814
Energy: 1.0156980037198133
Energy: 1.0710002294167127
Energy: 1.071718082076958
Energy: 1.0835236474983163
Energy: 1.0736868595190492
Energy: 1.004934940963639
Energy: 1.05917858620918
Energy: 1.1519206065492797
Energy: 1.0501692423574163
Energy: 1.0609309702417906
Energy: 1.07035725964272
Energy: 1.0551906513570786
Energy: 1.0605293299098946
Energy: 1.0459669595987133
Energy: 1.094359128367596
Energy: 1.1119910538723436
Energy: 1.0180617079231007
Energy: 1.0922812516628277
Energy: 1.0136028691979146
Energy: 1.032403616895382
Energy: 1.0356455160603553
Energy: 1.1134140654782803
Energy: 1.0869657646920285
Energy: 1.1014936216977957
Energy: 1.0684239050736866
Energy: 1.0211379670618927
Energy: 1.0914716719527349
Energy: 1.0396676255283923
Energy: 1.080296637638565
Energy: 1.0999075471683728
Energy: 1.0806022142400253
Energy: 1.0475020514710571
Energy: 1.0336501473616626
Energy: 1.0187860175185526
Energy: 1.0339475568581191
Energy: 1.1322397109384466
Energy: 1.046662925034085
Energy: 1.1105857378474535
Energy: 1.0822581041138364
Energy: 1.0432250464095734
Energy: 1.041467272657899
Energy: 1.017198637285999
Energy: 1.0394342200938231
Energy: 1.049615445221498
Energy: 1.0293396965257722
Energy: 1.1508638034115055
Energy: 1.0641898906333866
Energy: 1.014816603467586
Energy: 1.0446609600600134
Energy: 1.1186329719806893
Energy: 1.0469241348475287
Energy: 1.0326992339045211
Energy: 1.0608846490793877
Energy: 1.0184572602495545
Energy: 1.1404910745939558
Energy: 1.059398794643419
Energy: 1.0516982892138738
Energy: 1.0498195564704296
Energy: 0.9881251070075546
Energy: 1.1292521890797804
Energy: 1.0727817680319838
Energy: 1.0170224496852271
Energy: 1.0060055832665777
Energy: 1.0971406521510463
Energy: 0.9967672625777073
Energy: 1.0047708411012872
Energy: 1.1080272362182946
Energy: 1.0242048076221026
Energy: 1.0340114447537958
Energy: 1.1206389099221612
Energy: 1.155400870857188
Energy: 1.127224257583848
Energy: 1.068885275650476
Energy: 1.0418952881124848
Energy: 1.0635287372109552
Energy: 1.096282841258423
Energy: 1.0084023880782138
Energy: 1.13046309460531
Energy: 1.127138062759276
Energy: 1.0843512834332762
Energy: 1.100950511613661
Energy: 1.0237909630326265
Energy: 1.1137877148255753
Energy: 1.0713085296372082
Energy: 0.9932569800574489
Energy: 1.176691508139266
Energy: 1.0432205825190812
Energy: 1.2142098948819873
Energy: 1.0289276105246896
Energy: 1.0068999520109
Energy: 1.078303379482521
Energy: 1.1946179903480372
Energy: 1.0379687629564536
Energy: 1.107717416662631
Energy: 1.0458332730633262
Energy: 1.0619526553545546
Energy: 1.1533064807508164
Energy: 1.0351229856891473
Energy: 1.0322749844280843
Energy: 1.042472494778438
Energy: 1.0350915953054258
Energy: 1.0968885501713794
Energy: 1.0572262726128498
Energy: 1.0270744250324009
Energy: 1.0130452014716573
Energy: 1.1142615827097713
Energy: 1.066029381459511
Energy: 1.1128119595032162
Energy: 1.103189306194765
Energy: 1.0592868554725932
Energy: 1.1066526019223455
Energy: 1.067801217457442
Energy: 1.1731187049100311
Energy: 1.0554350609055791
Energy: 1.0403425572762277
Energy: 1.0889026309783112
Energy: 1.0943103551456748
Energy: 1.0673209610253769
Energy: 1.124697421320973
Energy: 1.0979054949930158
Energy: 1.0729042496230952
Energy: 1.100293004851574
Energy: 1.0930041691159063
Energy: 1.0796066350818456
Energy: 1.1493339563473228
Energy: 1.0514918587661708
Energy: 1.0338366065652909
Energy: 1.0511486752506272
Energy: 1.0540269251662204
Energy: 1.110314379011124
Energy: 1.083676241727204
Energy: 1.0520985287149625
Energy: 1.0313905754904067
Energy: 1.1594533187877247
Energy: 1.0369968619395384
Energy: 1.075762959409506
Energy: 1.0728142352075265
Energy: 1.0867875836570753
Energy: 1.1014750689408384
Energy: 1.069486923624605
Energy: 1.004619510792022
Energy: 1.048036672470093
Energy: 1.0193857236004547
Energy: 1.096823670129775
Energy: 1.019934307394465
Energy: 1.0533788483476205
Energy: 1.0583962863671983
Energy: 1.107073550991873
Energy: 1.06070697870954
Energy: 1.0359663753572508
Energy: 1.0649008813123737
Energy: 1.026467925638172
Energy: 1.0923568154553434
Energy: 1.0611645119347983
Energy: 1.0723430108635852
Energy: 1.0956864789842684
Energy: 1.1180889355950123
Energy: 1.0924230567995858
Energy: 1.0323991353197244
Energy: 1.0648931342164423
Energy: 1.016677707367925
Energy: 1.1025857664647305
Energy: 1.0509105843042077
Energy: 1.1000894775074772
Energy: 1.1122546560491746
Energy: 1.045457173008009
Energy: 1.076410366112543
Energy: 1.0417193737170147
Energy: 1.0620123229677614
Energy: 1.0876816149440516
Energy: 1.0002069415935653
Energy: 1.1029483456450035
Energy: 1.075697656811609
Energy: 1.0430715547572085
Energy: 1.0617856576424205
Energy: 1.108749992504468
Energy: 1.0406314712883447
Energy: 1.0363985950300458
Energy: 1.0359935470194697
Energy: 1.0333093436059027
Energy: 1.1748676125701876
Energy: 1.0299433497011863
Energy: 0.9957866493485997
Energy: 1.0620737582323054
Energy: 1.0305969345107922
Energy: 1.0994260380684644
Energy: 1.1231311069153114
Energy: 0.9890992331433965
Energy: 1.0572451920205568
Energy: 1.0484913241543954
Energy: 1.0606074570792496
Energy: 1.093765725105217
Energy: 1.1047814195164865
Energy: 1.0271722138813908
Energy: 1.0521006651670328
Energy: 1.051213666944627
Energy: 1.0932143144125082
Energy: 1.0643042382144223
Energy: 1.0992783721516226
Energy: 1.0287939583749501
Energy: 1.066781462673217
Energy: 1.0978933195413785
Energy: 1.0212929393066101
Energy: 1.0891809928979002
Energy: 1.1514465511528875
Energy: 1.0945001637582432
Energy: 1.0470122937343065
Energy: 1.022802724836257
Energy: 1.126117976831107

minimum gb energy = 0.9881251070075546 eV
minimum distance =  2.26638097681813 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 0.9648462589728514
Energy: 1.2689571510991415
Energy: 1.369013210456198
Energy: 1.2213682516837774
Energy: 1.113958071875422
Energy: 1.139296164829503
Energy: 0.9425040214518088
Energy: 1.0434054038204437
Energy: 1.0590420014173232
Energy: 1.1374919591765102
Energy: 1.1211086279824842
Energy: 1.050731491110946
Energy: 1.0430435102614888
Energy: 1.0180301174418265
Energy: 1.0482133036898735
Energy: 1.0338841811496695
Energy: 1.0331348115436647
Energy: 1.1705528242642458
Energy: 1.0821319005545476
Energy: 1.0421325325532038
Energy: 1.0422724678354804
Energy: 1.0424901301857206
Energy: 1.0370942129008378
Energy: 1.1327188430986073
Energy: 1.058859944089139
Energy: 1.1346269112692284
Energy: 1.0346251698346052
Energy: 1.1234675523986952
Energy: 1.0450280115227673
Energy: 1.0460008880956848
Energy: 1.143919598164233
Energy: 1.033658695561249
Energy: 1.1380747118874688
Energy: 1.0410673338669258
Energy: 1.0439782057622549
Energy: 0.9409432667795714
Energy: 1.0469698103022929
Energy: 1.0320888743427086
Energy: 1.0572880913229656
Energy: 1.0539558465914807
Energy: 1.0428100469800539
Energy: 1.0455331165659285
Energy: 1.0374047000987332
Energy: 1.0540124033226004
Energy: 1.0312316585076151
Energy: 1.0905913928762418
Energy: 0.9454273152699328
Energy: 0.9466258953645871
Energy: 1.0155423576377562
Energy: 0.9435247427411987
Energy: 1.0633850112927925
Energy: 1.2806889110492132
Energy: 1.0516555499809632
Energy: 1.1603114389750782
Energy: 1.0322113164449098
Energy: 1.0451445437938702
Energy: 0.9438001334001387
Energy: 1.060385094606302
Energy: 1.30570716010541
Energy: 1.0571071734434154
Energy: 1.0447828095963294
Energy: 1.033323792657984
Energy: 1.0453555287444891
Energy: 1.0375591132754127
Energy: 1.0536519808050275
Energy: 1.0326373648496763
Energy: 1.129678061807891
Energy: 1.0515853010104532
Energy: 1.0414117947909656
Energy: 1.0420567066159045
Energy: 1.0367247463381812
Energy: 1.0381991458400066
Energy: 1.028308023178961
Energy: 1.0458090005270317
Energy: 1.06209046510696
Energy: 1.0486255935543092
Energy: 1.1242324027077637
Energy: 1.0496562705961925
Energy: 1.0464170500421521
Energy: 1.0363392556424338
Energy: 1.0424808151029084
Energy: 1.1643947474656045
Energy: 1.0429369953580638
Energy: 1.047288393724943
Energy: 0.9437852754425802
Energy: 1.047060728898337
Energy: 1.1443663784092473
Energy: 1.0375014385358947
Energy: 1.1681567311050662
Energy: 1.1345003658888473
Energy: 1.044187753672389
Energy: 1.036213172135417
Energy: 1.0337295538631408
Energy: 1.031365675772563
Energy: 1.275826637214104
Energy: 0.9432860319413245
Energy: 0.9426749892017378
Energy: 1.0157576928175516
Energy: 0.940864501063508
Energy: 1.0531073449675283
Energy: 1.0324746937196667
Energy: 1.1500790652286395
Energy: 0.9436825801507902
Energy: 0.9424972356007153
Energy: 1.01610735313087
Energy: 0.941531457743083
Energy: 1.0847329181902126
Energy: 1.278753616610819
Energy: 1.0345289551625725
Energy: 1.1236118088990552
Energy: 1.1372561902108482
Energy: 0.9419642252762439
Energy: 1.0484313595486074
Energy: 1.0657632035171283
Energy: 1.1365742275966797
Energy: 1.1197148528842156
Energy: 1.0452445701093769
Energy: 1.0431874627287525
Energy: 1.0178891427704444
Energy: 1.0428988568424449
Energy: 1.0333532311982747
Energy: 1.0326106342245331
Energy: 1.1701758754789886
Energy: 1.0826363783327226
Energy: 1.0423120176447276
Energy: 1.0421251008439303
Energy: 1.0422019023966296
Energy: 1.0863331359881894
Energy: 1.133322356475645
Energy: 1.058994371895234
Energy: 1.1343845009344584
Energy: 1.136103531912253
Energy: 1.2157157651224593
Energy: 1.0445416551961304
Energy: 1.0457350769600118
Energy: 1.1442064487975916
Energy: 1.033567937053244
Energy: 1.095854798480723
Energy: 1.040839603667196
Energy: 1.0438093952391192
Energy: 0.9409079867386955
Energy: 1.0458481751509006
Energy: 1.0320472316307767
Energy: 1.056629606483592
Energy: 1.0521496759662659
Energy: 0.9422226855066762
Energy: 1.0420082772135388
Energy: 1.0373474244665142
Energy: 1.058465188943425
Energy: 1.0310770392260158
Energy: 1.088996957073965
Energy: 0.9444454633347139
Energy: 0.9471563463265803
Energy: 1.0154595308159597
Energy: 0.9432908104655013
Energy: 1.063077737593922
Energy: 1.2783021211261947
Energy: 1.0527924138913465
Energy: 1.1596733159386023
Energy: 1.0381646126927915
Energy: 1.045557783333364
Energy: 0.9407432447093858
Energy: 1.0606026022208228
Energy: 1.3052457408933054
Energy: 1.0574709761505787
Energy: 1.0459742398903111
Energy: 1.0327920843147576
Energy: 1.019771881132624
Energy: 1.0375191782440891
Energy: 1.0057688951643067
Energy: 1.0330552371887325
Energy: 1.130233492204151
Energy: 1.0522135803154418
Energy: 1.0409472856649291
Energy: 1.0420593694827176
Energy: 1.0365286528376778
Energy: 1.0395830266828694
Energy: 1.0286592485773198
Energy: 1.036898207112966
Energy: 1.059145652467637
Energy: 1.0320809944510756
Energy: 1.1243081596751958
Energy: 1.0495752757209982
Energy: 1.0463802360086096
Energy: 1.0361175429604608
Energy: 1.042011845657625
Energy: 1.1410875405686507
Energy: 1.0425562244808222
Energy: 1.0473431262350976
Energy: 0.941752031455055
Energy: 1.046952379923415
Energy: 1.1437248890083862
Energy: 1.0370629884449474
Energy: 1.1687851251941899
Energy: 1.133805581876041
Energy: 1.0439987037117247
Energy: 1.0363316640053686
Energy: 1.0340490722437776
Energy: 1.0315082601077283
Energy: 1.2762160194075407
Energy: 0.9432008508853291
Energy: 0.9426231618531298
Energy: 1.0155514070664173
Energy: 0.9408925890554463
Energy: 1.054267545851292
Energy: 1.0324841563418257
Energy: 1.0586757729810539
Energy: 0.9436838137576499
Energy: 0.9424409492914775
Energy: 1.0161622522442764

minimum gb energy = 0.9407432447093858 eV
minimum distance =  2.33686500689602 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.2177553276758484
Energy: 1.4368789730846552
Energy: 0.9973544268740584
Energy: 1.0444227979038327
Energy: 0.9218683404494599
Energy: 0.9215327159520396
Energy: 1.1323124322609042
Energy: 1.1406987003597644
Energy: 1.067776973212372
Energy: 1.0408939488406561
Energy: 1.1467111547274733
Energy: 0.9918205891423891
Energy: 1.0160824360593057
Energy: 1.0622755188918698
Energy: 0.99772594646573
Energy: 1.0206755682330189
Energy: 1.0254248963932617
Energy: 1.18857142028362
Energy: 1.0092771324367962
Energy: 1.0091354256725904
Energy: 1.199086941650434
Energy: 1.0230503872024543
Energy: 1.0513640293343027
Energy: 1.0390324198779066
Energy: 1.0442744810449525
Energy: 1.039810266612785
Energy: 1.069545434771665
Energy: 1.0177906616557348
Energy: 0.9917275674716803
Energy: 0.9232616462199477
Energy: 1.0592384553990644
Energy: 1.0389719421581565
Energy: 0.9496452335106816
Energy: 1.0010193564379626
Energy: 1.026426813490215
Energy: 0.9524487291454992
Energy: 0.9346283992160244
Energy: 1.04743249430449
Energy: 1.023995419673403
Energy: 0.991709517085991
Energy: 0.9703383404035276
Energy: 1.01871629225037
Energy: 0.9697759001543479
Energy: 1.061016361441242
Energy: 1.0704073480197531
Energy: 1.018762285516916
Energy: 0.960178729820045
Energy: 0.956149465950925
Energy: 1.0088356201908606
Energy: 1.0033917777389045
Energy: 0.9505127803312222
Energy: 1.025642158087993
Energy: 1.1538239815073505
Energy: 0.9918829714843438
Energy: 0.9904801341971937
Energy: 1.0199694583965015
Energy: 1.0690488945658743
Energy: 0.9927402468557897
Energy: 1.1806646679333557
Energy: 1.062532925268092
Energy: 1.0516504774705402
Energy: 0.9774876892809539
Energy: 1.0535199911275277
Energy: 1.0233143730714618
Energy: 1.1257132204028968
Energy: 1.0630805919785504
Energy: 1.0461133233742068
Energy: 0.9971905058716614
Energy: 1.0038933473593703
Energy: 0.9915704020737375
Energy: 1.0682074030190771
Energy: 1.0658204451684352
Energy: 1.042417528079375
Energy: 1.0206739078370226
Energy: 0.9541396012482114
Energy: 0.9522178455545081
Energy: 1.136951188657163
Energy: 1.141796995855342
Energy: 0.9617950905220046
Energy: 1.1958922169655763
Energy: 1.470047607394914
Energy: 0.9522439879898712
Energy: 0.9521981287175209
Energy: 1.2078510088395606
Energy: 0.9518927137465112
Energy: 1.1262834673330868
Energy: 0.9759697347439863
Energy: 1.0830356706487867
Energy: 0.9749449880986224
Energy: 1.0673254581762504
Energy: 0.95273297823384
Energy: 1.1316757205328334
Energy: 1.0641734771373799
Energy: 1.0266257079464582
Energy: 1.002610616254818
Energy: 1.0907606965756622
Energy: 1.1235419017188386
Energy: 1.0083750890118537
Energy: 1.0002007896492078
Energy: 0.943340356544958
Energy: 1.0618926111927016
Energy: 1.1845736949332686
Energy: 1.1072821638144217
Energy: 1.0248533281026644
Energy: 1.1876953086262911
Energy: 1.1079821443990743
Energy: 1.082053424549398
Energy: 1.0392831974191485
Energy: 1.0500541271274282
Energy: 0.9673398969927713
Energy: 1.100995763255042
Energy: 1.0259432030642601
Energy: 0.9924054557954985
Energy: 0.99449382614712
Energy: 1.0334506685996325
Energy: 0.9746214094723031
Energy: 0.8744536444100215
Energy: 1.003676977696048
Energy: 1.0251861655012011
Energy: 0.9530197706761453
Energy: 0.9235527361486301
Energy: 1.07825297117507
Energy: 1.0541316366890696
Energy: 1.0759824850821718
Energy: 0.979524505823554
Energy: 0.9951908922881783
Energy: 0.9525447672564821
Energy: 0.9931366714494656
Energy: 1.043615831119589
Energy: 1.0796535753445489
Energy: 0.9547407127063018
Energy: 0.9533429470075898
Energy: 0.9883315710068459
Energy: 0.9850551979761121
Energy: 0.9613646425292198
Energy: 1.0162010665305194
Energy: 1.063722008453512
Energy: 0.9965236655553067
Energy: 0.9700539137858618
Energy: 1.0033695456574185
Energy: 1.0031106761456334
Energy: 0.9247734803272489
Energy: 1.1595569685880505
Energy: 1.1613198210047424
Energy: 1.0222664714328946
Energy: 1.022660087231674
Energy: 1.0487906549836996
Energy: 1.010677345858396
Energy: 1.0267761112902742
Energy: 1.0631565582634097
Energy: 1.0390660735493533
Energy: 0.9422696049757455
Energy: 1.0033834496885554
Energy: 1.0117737067729318
Energy: 0.9915327208995502
Energy: 1.0230562086373556
Energy: 1.183321009075172
Energy: 1.033648642817238
Energy: 0.8960685512697351
Energy: 1.2551599819286012
Energy: 1.0084535720728858
Energy: 1.005173363076874
Energy: 0.9245685407663066
Energy: 0.9975034830489491
Energy: 1.0519796445044318
Energy: 0.9522117769789814
Energy: 0.9522673339541334
Energy: 1.1654953046353496
Energy: 1.1317067799916034
Energy: 1.063780692981603
Energy: 1.0547928726810731
Energy: 1.0975500397760962
Energy: 1.1132230311719822
Energy: 1.1236565496715618
Energy: 0.9700271186843995

minimum gb energy = 0.8744536444100215 eV
minimum distance =  2.30117127028947 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.1787439896192526
Energy: 1.1706858571498915
Energy: 1.223879588356465
Energy: 1.254148219231628
Energy: 1.171618119056733
Energy: 1.1553581622377358
Energy: 1.2309266355171888
Energy: 1.0055650285338027
Energy: 0.9776412967281637
Energy: 1.0981724560390194
Energy: 1.0319747009028353
Energy: 1.0486562558587391
Energy: 0.9733126869042956
Energy: 1.1692506004148797
Energy: 1.2067774281845733
Energy: 1.1235075061970705
Energy: 1.158289166275709
Energy: 1.1128076297268346
Energy: 1.1860364379592414
Energy: 1.0164493252005093
Energy: 1.1499492330057446
Energy: 1.112680474612661
Energy: 1.0167123876579243
Energy: 1.1640477900497073
Energy: 1.1933874254502643
Energy: 1.1774325602134217
Energy: 1.1564469132910977
Energy: 1.2572343689007306
Energy: 0.9551981399886034
Energy: 1.1416600793202814
Energy: 1.0626634946558027
Energy: 1.0258050588434446
Energy: 1.0235538746963109
Energy: 1.13281991175076
Energy: 1.196955302572029
Energy: 1.0547856678032885
Energy: 1.0754895692154076
Energy: 1.077435484842162
Energy: 1.1331899403512844
Energy: 1.123429929506978
Energy: 1.1171104682533122
Energy: 1.0421462365989456
Energy: 1.0853112604001904
Energy: 1.0304107466456018
Energy: 1.0757350731715178
Energy: 1.0506537463879577
Energy: 0.9666417451730827
Energy: 1.0529591969457406
Energy: 1.087274565442165
Energy: 1.0329737943921855
Energy: 1.0289196787263035
Energy: 1.0077736104509818
Energy: 0.9636168747054067
Energy: 1.041016196738703
Energy: 1.0406381067917667
Energy: 1.0220561411268034
Energy: 1.0067860465057836
Energy: 1.0838519663038337
Energy: 1.0965310894687104
Energy: 1.0315284568573049
Energy: 1.1533815415227338
Energy: 1.1408373852710052
Energy: 0.9907041299972914
Energy: 1.1860791493374203
Energy: 1.086866118007436
Energy: 0.978527733217139
Energy: 0.9767496397626231
Energy: 0.9971514787085123
Energy: 1.099768676385953
Energy: 0.9992018986461324
Energy: 1.0657362992934658
Energy: 0.9936016790995189
Energy: 1.0220071749527206
Energy: 1.0425476288727247
Energy: 1.019288703760856
Energy: 1.039872648054327
Energy: 1.0889336196201322
Energy: 1.01922391579956
Energy: 0.9969863791481413
Energy: 1.1406530824969825
Energy: 1.096489197130073
Energy: 1.1416446247425518
Energy: 1.1858835421721046
Energy: 1.0702296026306515
Energy: 1.1778524412103202
Energy: 1.0045741902454224
Energy: 1.0495832646291394
Energy: 1.216740119681532
Energy: 1.014891565966244
Energy: 1.0037837398944554
Energy: 1.0685726186629558
Energy: 1.1374906567375942
Energy: 1.0872282060065779
Energy: 1.1879870585277503
Energy: 0.9881747926155724
Energy: 1.0641580416714453
Energy: 1.0837710796378435
Energy: 1.0844156628694743
Energy: 1.0354279841826142
Energy: 1.100966181281728
Energy: 1.0796823894826344
Energy: 0.9738409951888959
Energy: 1.1221178981488031
Energy: 1.068457064293376
Energy: 0.9698298429965868
Energy: 0.9518497644923593
Energy: 1.079111108319453
Energy: 1.1221182674044694
Energy: 1.102547349579209
Energy: 0.994774517022725
Energy: 1.1106878632649508
Energy: 1.1448626927850178
Energy: 1.1042824162220601
Energy: 1.0861308310133468
Energy: 1.078498564180975
Energy: 1.0605393446450397
Energy: 1.2101393856759681
Energy: 1.2067619547887174
Energy: 1.0370630061909425
Energy: 1.078647472749863
Energy: 1.1472647308141761
Energy: 1.1632003176931494
Energy: 1.2442545752730254
Energy: 1.1086325938172235
Energy: 1.134907548845806
Energy: 1.2292945868171523
Energy: 1.0538639097338505
Energy: 0.961944070836715
Energy: 0.9804368955262552
Energy: 1.0253442983018402
Energy: 1.0449775957307499
Energy: 0.9764548119227563
Energy: 1.1143508784330494
Energy: 1.1323388068564266
Energy: 1.0514812984780812
Energy: 1.15367207558849
Energy: 1.24409980769497
Energy: 1.1809703162948035
Energy: 1.158932421670911
Energy: 0.9631012111887929
Energy: 1.002900854690937
Energy: 1.1056190647896778
Energy: 1.1680186903345169
Energy: 1.2800561474060923
Energy: 1.1455404527301034
Energy: 0.9495806866836785
Energy: 1.1958817542910063
Energy: 1.098617249180964
Energy: 1.0498342211752774
Energy: 1.1217413228521504
Energy: 0.9755289684253532
Energy: 1.03033699882322
Energy: 0.9507586649510126
Energy: 1.125068245296642
Energy: 1.1770544538244492
Energy: 1.1944855756307036
Energy: 1.0298466408362796
Energy: 1.2510504061970016
Energy: 1.1721964875995226
Energy: 1.156196766722818
Energy: 0.9970493057833723
Energy: 1.012630292396676
Energy: 0.9778541643294668
Energy: 1.0422335432383265
Energy: 1.0231930213991431
Energy: 1.0734929846571146
Energy: 1.026344271448767
Energy: 1.1687963431308688
Energy: 1.0812638743343521
Energy: 1.1214000036708867
Energy: 1.1623198248620945
Energy: 1.136962616733908
Energy: 1.0216665820010256
Energy: 1.0163703560667308
Energy: 1.0825056954015946
Energy: 1.1120769216926096
Energy: 1.0158581595777512
Energy: 1.1640545792920072
Energy: 1.1931491169678008
Energy: 1.1777548347097972
Energy: 1.1563555057566188
Energy: 1.0808674414315742
Energy: 0.9710659047906438
Energy: 1.1477602628817087
Energy: 1.1285535539541287
Energy: 1.060545509965862
Energy: 1.006889012138915
Energy: 1.089007379635486
Energy: 1.0752446998415899
Energy: 1.0550074144179453
Energy: 1.0728732193922734
Energy: 1.0771845576906065
Energy: 0.98600996288426
Energy: 1.1239237677958385
Energy: 1.1167729507371487
Energy: 1.0927453864822663
Energy: 1.0412214946519938
Energy: 1.0640243645214558
Energy: 1.1364020991168242
Energy: 1.1351853889680399
Energy: 0.9663714118677733
Energy: 1.0752802186148276
Energy: 1.1207270729222616
Energy: 1.027102456521471
Energy: 1.0273521775175607
Energy: 1.0497137215971353
Energy: 0.9808233773627791
Energy: 1.0638996827749008
Energy: 1.0236926150261052
Energy: 1.022638737733839
Energy: 0.9854899787361754
Energy: 1.1484062413042104
Energy: 1.096553197004295
Energy: 1.0319982464237045
Energy: 1.1536979794595552
Energy: 1.1403171640854695
Energy: 1.0688577020252512
Energy: 1.0477962049330574
Energy: 1.091348013438437
Energy: 0.9699479915700571
Energy: 0.9953436058244597
Energy: 1.0224958249210172
Energy: 1.0692299450464897
Energy: 0.9986273072867063
Energy: 1.061905512931982
Energy: 0.9935981151803386
Energy: 0.975522938835922
Energy: 1.041618033689377
Energy: 1.037320958241773
Energy: 1.0803455757862412
Energy: 0.9964737217969976
Energy: 0.9863278702750756
Energy: 0.9961384651988566
Energy: 1.1400209970784525
Energy: 1.0190648206747597
Energy: 1.1920370009972354
Energy: 1.1866850195263798
Energy: 1.069099810266763
Energy: 1.0394933531780357
Energy: 1.0043800639088096
Energy: 1.0511750212337923
Energy: 1.0402226691854652
Energy: 1.0084823794138709
Energy: 1.0654233620119982
Energy: 1.069045376567396
Energy: 1.135851119769933
Energy: 1.110932295877913
Energy: 1.1540011094669211
Energy: 1.1343648509482438
Energy: 0.9744734521690586
Energy: 1.1754825381706562
Energy: 1.0755246137239665
Energy: 1.0369449003482967
Energy: 1.0944100267055556
Energy: 1.0692273032869046
Energy: 0.9731177489738336
Energy: 1.050913100233344
Energy: 1.0860834811680442
Energy: 0.9701317306734512
Energy: 0.9538955747000155
Energy: 1.0806643081038227
Energy: 1.1333814477862405
Energy: 1.0536620878746992
Energy: 0.995307138064603
Energy: 1.0600620335442974
Energy: 1.1151693134167238
Energy: 1.0953394452154788
Energy: 1.1312818290679352
Energy: 1.1642926343430549
Energy: 1.0585730010176095
Energy: 1.2082510518350373
Energy: 1.1365531131739395
Energy: 1.1836606373746277
Energy: 1.0790211491462032
Energy: 1.148339281435303
Energy: 1.1638917685107415
Energy: 1.1879064579651282
Energy: 1.1550860117563988
Energy: 1.0172080503743526
Energy: 1.1453485186229166
Energy: 0.9791117183793315
Energy: 0.9872876130436439
Energy: 1.0492300221086814
Energy: 1.0811652002499892
Energy: 1.0798311427811096
Energy: 0.9967049963276042
Energy: 1.1913798565927682
Energy: 1.1336779697506134
Energy: 1.1086554384850065
Energy: 1.154397075547562
Energy: 1.2411585023979348
Energy: 1.1767496882966326
Energy: 1.1577825327827127
Energy: 1.0293713656852268
Energy: 1.0817952193674873
Energy: 1.0395595061553358
Energy: 1.1704859013194555
Energy: 1.184284347177065
Energy: 1.0307113904139527
Energy: 0.9509715124943685
Energy: 1.1976195641140217
Energy: 1.022093523968857
Energy: 1.1119619645213854
Energy: 1.16952668393595
Energy: 1.1790609257451772
Energy: 1.0292468989118966
Energy: 0.9496950953178246
Energy: 1.2115020867689519
Energy: 1.1786123342344033
Energy: 1.2332143981035697
Energy: 1.0294704604690714
Energy: 1.2478522668641425
Energy: 1.0408969870922613
Energy: 1.1566628162582426
Energy: 1.1700926361986792

minimum gb energy = 0.9495806866836785 eV
minimum distance =  2.2711211561894 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.1009626303724867
Energy: 1.279591317710118
Energy: 0.9659333085979639
Energy: 0.9719826266102722
Energy: 0.9685872915852988
Energy: 0.9664814589424641
Energy: 0.9718323467243564
Energy: 1.0698599528298076
Energy: 1.2037734832271105
Energy: 0.9684297795859373
Energy: 0.9706257358538716
Energy: 0.9702849062421962
Energy: 0.9681628479012016
Energy: 1.1931673556677564
Energy: 1.0710761143465477
Energy: 1.1877656637897158
Energy: 0.9778572765762129
Energy: 0.9722027732354039
Energy: 0.9730006841242669
Energy: 0.977291444151083
Energy: 0.970822089762031
Energy: 1.077092722686357
Energy: 1.1875267154405804
Energy: 0.9741092134970917
Energy: 0.9726618960631147
Energy: 0.9732942324072615
Energy: 0.9739236841181698
Energy: 0.9734473973833602
Energy: 1.0178196934568426
Energy: 1.189181245700826
Energy: 1.0869502253805166
Energy: 1.1927118639240566
Energy: 0.971230315334835
Energy: 1.0861667270033433
Energy: 1.1966115697245532
Energy: 1.0844204022350783
Energy: 1.202254193241462
Energy: 0.9672373396330793
Energy: 0.9804327920283419
Energy: 0.9824361451335232
Energy: 0.9671967690438619
Energy: 0.9764832195351302
Energy: 1.07014525306997
Energy: 1.189461468340571
Energy: 0.9670708445919339
Energy: 0.9728930746186918
Energy: 0.9726040146044291
Energy: 0.9681349257622323
Energy: 1.1946437779195007
Energy: 1.0697525518071649
Energy: 1.1880179663542714
Energy: 0.9664158038808714
Energy: 0.9725360865224795
Energy: 0.9734364297777528
Energy: 0.9683378459820204
Energy: 1.187582192152455
Energy: 0.966346183367179
Energy: 1.1948116870911922
Energy: 0.9678375875681557
Energy: 0.9816818296712742
Energy: 0.9834849553355233
Energy: 0.9677907371359907
Energy: 0.9762380346760372
Energy: 1.1481367592260425
Energy: 1.283693287632667
Energy: 1.0200261686186318
Energy: 1.192163619010768
Energy: 1.1926951050095733
Energy: 1.086515074321533
Energy: 1.2784336770300975
Energy: 0.9667919192270286
Energy: 1.193820667177004
Energy: 0.9677157962166331
Energy: 0.9821364822168442
Energy: 0.9839075619626128
Energy: 0.9675039962908595
Energy: 0.9767256210084395
Energy: 1.0699653658603612
Energy: 1.1929839450774753
Energy: 0.9668267748162427
Energy: 0.9725805185367619
Energy: 0.9727596294030045
Energy: 0.9680788343599748
Energy: 1.187007939508112
Energy: 1.070462184424125
Energy: 1.1908920799390623
Energy: 0.9674890773771166
Energy: 0.9717992042065543
Energy: 0.9705202982528297
Energy: 0.96773205329262
Energy: 1.1899548343521307
Energy: 1.0838833600272022
Energy: 1.1932929083769994
Energy: 0.9669263412996506
Energy: 0.9664340319009738
Energy: 0.9799195244966558
Energy: 0.9901463187331974
Energy: 0.9671636960999037
Energy: 1.0190706749713885
Energy: 1.1957104258844213
Energy: 1.086847850366697
Energy: 0.9699951344530368
Energy: 0.9706754224933755
Energy: 0.9694393082409338
Energy: 1.1926692344615044
Energy: 1.0734703722267531
Energy: 1.1863274931533176
Energy: 0.9751959732229715
Energy: 0.9732087734473011
Energy: 0.9736670069134035
Energy: 0.9747034074050596
Energy: 0.9700149979167023
Energy: 1.072159959945106
Energy: 1.1865569225406274
Energy: 0.9761737336511292
Energy: 0.9731902981770035
Energy: 0.9743725009141059
Energy: 0.975948623286881
Energy: 0.9702691139670961
Energy: 1.1440025033043968
Energy: 1.2023394544016672
Energy: 0.9689506900628118
Energy: 0.9705272974929229
Energy: 0.9722565104563912
Energy: 0.9696650119197732
Energy: 1.1939130568603737
Energy: 1.0842089177348566
Energy: 1.2790014980460531
Energy: 0.9672263676801218
Energy: 0.9731750509403446
Energy: 0.9665438914277059
Energy: 0.9673491442267603
Energy: 0.9708654302546765
Energy: 1.07076848838492
Energy: 1.1957983760481679
Energy: 0.9686075774424889
Energy: 0.9712152886656994
Energy: 0.9702412838111155
Energy: 0.9670372116556583
Energy: 1.1896878830617692

minimum gb energy = 0.9659333085979639 eV
minimum distance =  2.34412867122876 Angstroms
sigma value = 23