Model name: model_name=MEAM_LAMMPS_SharifiWick_2025_FeMnNiTiCuCrCoAl__MO_675947402254_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521398782730103
cohesive_energy=4.450349886665774
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.3604067260405e-19, 3.17722841758638e-19, 3.7818898792579794e-19, 4.26710907286488e-19, 4.6721072824074e-19, 5.0179691523889795e-19, 5.317624248246e-19, 5.57962819320402e-19, 5.8100532367059e-19, 6.013369451560499e-19, 6.19295743046556e-19, 6.351508830166199e-19, 6.491154545585639e-19, 6.613656971021279e-19, 6.720442043677379e-19, 6.81274343956212e-19, 6.8916025734876e-19, 6.957916664368859e-19, 7.01245475699022e-19, 7.05588976553796e-19, 7.088830517132999e-19, 7.11180573006456e-19, 7.1252800355565e-19, 7.1296860213e-19, 7.12491153493068e-19, 7.109370421580879e-19, 7.08093178632738e-19, 7.037016124789439e-19, 6.974531236063439e-19, 6.889663939760459e-19, 6.777719858342879e-19, 6.632931155928299e-19, 6.44808803766372e-19, 6.214170249099719e-19, 5.919818357901239e-19, 5.550500621997899e-19, 5.08758372713628e-19, 4.50682674084396e-19, 3.77642645693604e-19, 2.8540213252095597e-19, 1.68249374866242e-19, 1.8356458131064798e-20, -1.7518679969146198e-19, -4.27914141938622e-19, -7.628315433333479e-19, -1.2158469865968479e-18, -1.8453870470412e-18, -2.7505848017185198e-18, -4.1072919536233794e-18, -6.243329863838519e-18, -9.802581278035859e-18, -1.61233443385956e-17, -2.8153447812648e-17, -5.2737085867080595e-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: 0.018089513871319733
Energy: 0.1359979485439686
Energy: 0.8634675236632031
Energy: 0.018489457754950485
Energy: 0.1359979485439686
Energy: 1.7189353811812937
Energy: 0.018489457754950485
Energy: 1.718935381782109
Energy: 0.8634675236470453
Energy: 0.018489457755611487
Energy: 0.018089513871319733
Energy: 0.1359979485433076
Energy: 0.018489457754950485
Energy: 1.7189353810637082
Energy: 0.1359979485439686
Energy: 1.7189353810921315

minimum gb energy = 0.018089513871319733 eV
minimum distance =  2.42061466118662 Angstroms
sigma value = 1


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

Energy: 1.5725699101300334
Energy: 1.0814527477069067
Energy: 1.0831109038680842
Energy: 1.0013279211893462
Energy: 1.0399923448046282
Energy: 1.1067811398327292
Energy: 1.038754059319783
Energy: 1.1067811398327292
Energy: 1.0824246667757196
Energy: 1.0818748047560864
Energy: 1.7068089544153453
Energy: 1.0818748047560864
Energy: 1.0369284801170946
Energy: 1.0401255423602505
Energy: 1.0392167414442819
Energy: 1.0401255423442173
Energy: 1.4656906819242592
Energy: 1.026959858357821
Energy: 1.0297526004656148
Energy: 1.0269598583186126
Energy: 1.1060344129164081
Energy: 1.1755708662728244
Energy: 1.0394552858343877
Energy: 1.1755708662728244
Energy: 1.1200136612219893
Energy: 1.1410782878497638
Energy: 1.4690002964076427
Energy: 1.1410782878505654
Energy: 1.089484497081088
Energy: 1.108543668855124
Energy: 1.1195988499550331
Energy: 1.1085436688566543
Energy: 1.2660338515146148
Energy: 1.2156586675471062
Energy: 1.1584404478997492
Energy: 1.2156586675471062
Energy: 1.1157306270122695
Energy: 1.2126427379460871
Energy: 1.092485315969004
Energy: 1.2126427379468887
Energy: 1.0891649733773932
Energy: 1.214626193919886
Energy: 1.266741832311278
Energy: 1.2146261939190843
Energy: 1.0851740142351975
Energy: 1.214341870207353
Energy: 1.1254245676285588
Energy: 1.2143418702057494
Energy: 1.1165508669170154
Energy: 1.1407087767424557
Energy: 1.0748264210286216
Energy: 1.140708776741654
Energy: 1.1040995721862876
Energy: 1.1418481420655513
Energy: 1.0939189232229771
Energy: 1.1418481420647497
Energy: 1.0730281704898892
Energy: 1.0293134943394824
Energy: 1.0259013960526981
Energy: 1.0293134943410858
Energy: 1.0594768437868087
Energy: 1.0261763565610933
Energy: 1.0396751812938367
Energy: 1.0261763565594901
Energy: 1.082242767824027
Energy: 1.0819933595736448
Energy: 0.9966752759676943
Energy: 1.0819933595720415
Energy: 1.039592726206799
Energy: 1.0297070523698466
Energy: 1.0805249500134155
Energy: 1.029707052380268
Energy: 1.03924356277963
Energy: 1.0824017513074717
Energy: 1.0854199317064968
Energy: 1.0824017513082733
Energy: 1.1006498754091936
Energy: 1.026289260723287
Energy: 1.0367372857831771
Energy: 1.0262892606968326
Energy: 1.0275468469028186
Energy: 1.0267933260050652
Energy: 1.4625636153907458
Energy: 1.0267933260042637
Energy: 1.0398227498545163
Energy: 1.0281935075195565
Energy: 1.106272048131831
Energy: 1.0281935075163502
Energy: 1.0841096460609543
Energy: 1.1543089028526508
Energy: 1.08011374131469
Energy: 1.1543089028526508
Energy: 1.1203221870946343
Energy: 1.1454858315088923
Energy: 1.0859919653091301
Energy: 1.1454858315088923
Energy: 1.093182633111166
Energy: 1.2168154739246473
Energy: 1.2737639309554685
Energy: 1.2168154739238455
Energy: 1.0948650786514118
Energy: 1.2118620981119832
Energy: 1.1178240303463762
Energy: 1.2118620981127848
Energy: 1.2696364005804233
Energy: 1.214843955145348
Energy: 1.0899265522123636
Energy: 1.214843955145348
Energy: 1.1195987526028761
Energy: 1.213371817259718
Energy: 1.085666227751266
Energy: 1.213371817259718
Energy: 1.075825364237812
Energy: 1.1410076664639601
Energy: 1.116185265176538
Energy: 1.141007666464762
Energy: 1.094572162651768
Energy: 1.142918195995734
Energy: 1.1035959678657306
Energy: 1.1429181959933288
Energy: 1.025044972836455
Energy: 1.0305229196347154
Energy: 1.0735137444242902
Energy: 1.0305229196347154
Energy: 1.0393419153237842
Energy: 1.026241514087018
Energy: 1.0599753789413482
Energy: 1.0262415140926295
Energy: 0.9965075752075163
Energy: 1.0318711665426321
Energy: 1.0832517046835783
Energy: 1.031871166545037

minimum gb energy = 0.9965075752075163 eV
minimum distance =  2.24156699216001 Angstroms
sigma value = 1


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

Energy: 1.7814932058527018
Energy: 1.1443095136492727
Energy: 1.1467208711979895
Energy: 1.0521946173313537
Energy: 1.097481864242194
Energy: 1.1659925882018898
Energy: 1.0973069727164353
Energy: 1.1659925882010174
Energy: 1.1459164622244522
Energy: 1.1445838901831358
Energy: 1.6389697204493938
Energy: 1.1445838901840497
Energy: 1.0935631724137767
Energy: 1.0844064649654443
Energy: 1.0973484801599367
Energy: 1.0844064649818552
Energy: 1.6401523609404831
Energy: 1.0834513084630852
Energy: 1.0893806459678952
Energy: 1.0834513084630852
Energy: 1.1705936663219971
Energy: 1.1684277611968845
Energy: 1.0980092204678205
Energy: 1.1684277611968845
Energy: 1.150352432257467
Energy: 1.2152251985443996
Energy: 1.3875980512706614
Energy: 1.2152251985443996
Energy: 1.1496307361608582
Energy: 1.2261744816392948
Energy: 1.1883310112820096
Energy: 1.2261744816411229
Energy: 1.38846418657352
Energy: 1.2889034772895382
Energy: 1.2730842830660158
Energy: 1.2889034772858825
Energy: 1.189425167781989
Energy: 1.2894355097918448
Energy: 1.1479776873905188
Energy: 1.2894355097918448
Energy: 1.1370875712223099
Energy: 1.2162238646249488
Energy: 1.1971741928799327
Energy: 1.2162238646222068
Energy: 1.1609270157460134
Energy: 1.2164958262841528
Energy: 1.169425008654841
Energy: 1.2164958262823247
Energy: 1.083923200896426
Energy: 1.0845750672356378
Energy: 1.1353864835527303
Energy: 1.084575067234724
Energy: 1.0969509281915595
Energy: 1.0838238908932618
Energy: 1.1183435887633504
Energy: 1.0838238909188544
Energy: 1.0460929699511141
Energy: 1.1450332412397632
Energy: 1.1452162029454291
Energy: 1.1450332412406774
Energy: 1.14444911326779
Energy: 1.0897112901852208
Energy: 1.097438679367484
Energy: 1.089711290189791
Energy: 1.144381764411745
Energy: 1.1447990741475924
Energy: 1.0951890446421764
Energy: 1.1447990741475924
Energy: 1.093505272382669
Energy: 1.0829303599311544
Energy: 1.1663779826598286
Energy: 1.0829303599329827
Energy: 1.0970184621863557
Energy: 1.0835369812926645
Energy: 1.0839546918749625
Energy: 1.0835369812926645
Energy: 1.1701953334921693
Energy: 1.0865686589252705
Energy: 1.0975081215387095
Energy: 1.0865686589252705
Energy: 1.146913357655272
Energy: 1.2183284320149574
Energy: 1.3845168671738468
Energy: 1.218328432011301
Energy: 1.148321276193036
Energy: 1.2189071389613189
Energy: 1.1883563483697592
Energy: 1.2189071389613189
Energy: 1.386805653123066
Energy: 1.2901214601914845
Energy: 1.1500752210619964
Energy: 1.2901214601905706
Energy: 1.1887752231030069
Energy: 1.2878699984292437
Energy: 1.1488279059840278
Energy: 1.2878699984301576
Energy: 1.1391824337514231
Energy: 1.2156987075681929
Energy: 1.1961500673512913
Energy: 1.215698707570021
Energy: 1.1610854568210172
Energy: 1.2152107156714878
Energy: 1.1685877846197956
Energy: 1.2152107156742298
Energy: 1.082401014183365
Energy: 1.084598574304775
Energy: 1.13527232918897
Energy: 1.0845985743029471
Energy: 1.097202621179337
Energy: 1.0844172263308611
Energy: 1.0471332164180043
Energy: 1.0844172263317753
Energy: 1.0463460015109263
Energy: 1.0944832864831813
Energy: 1.1462553156646302
Energy: 1.0944832864822671

minimum gb energy = 1.0460929699511141 eV
minimum distance =  2.25315189326605 Angstroms
sigma value = 25


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

Energy: 1.698376752852683
Energy: 1.2135177884339599
Energy: 1.213303025656889
Energy: 1.1063197868664318
Energy: 1.1613689983658695
Energy: 1.2287951765252785
Energy: 1.1625643086249753
Energy: 1.228795176524216
Energy: 1.2127876783641527
Energy: 1.214272756651685
Energy: 1.5488168513574814
Energy: 1.2142727566506228
Energy: 1.1554233115485983
Energy: 1.2975368446937905
Energy: 1.1621501555647797
Energy: 1.297536844692728
Energy: 1.5484624787009615
Energy: 1.1484145047980112
Energy: 1.1470727988419118
Energy: 1.148414504801199
Energy: 1.2446424480780283
Energy: 1.2339102030461442
Energy: 1.1625994662769576
Energy: 1.2339102030472067
Energy: 1.2233731503578211
Energy: 1.3095681072066887
Energy: 1.2969401368179028
Energy: 1.3095681072056262
Energy: 1.2121041261250498
Energy: 1.3105450195561479
Energy: 1.2677110037658097
Energy: 1.3105450195614607
Energy: 1.2972369243430442
Energy: 1.3055631609523075
Energy: 1.2072620110178995
Energy: 1.3055631609459326
Energy: 1.2439017907685785
Energy: 1.3059562001400387
Energy: 1.1614666911550373
Energy: 1.3059562001400387
Energy: 1.0983307351421048
Energy: 1.147417189557806
Energy: 1.1454602405634036
Energy: 1.1474171895567435
Energy: 1.0984536207085212
Energy: 1.1470285966687808
Energy: 1.1615418249659233
Energy: 1.147028596675156
Energy: 1.212326352277875
Energy: 1.2138090735887466
Energy: 1.0983009970274416
Energy: 1.2138090735887466
Energy: 1.1610529333286066
Energy: 1.1561724312723387
Energy: 1.2095986324598227
Energy: 1.156172431274464
Energy: 1.1574030201441952
Energy: 1.2148462626124994
Energy: 1.214853840457374
Energy: 1.2148462626124994
Energy: 1.2398640777077312
Energy: 1.1467864088240072
Energy: 1.1551399410823855
Energy: 1.1467864088250699
Energy: 1.146380158043243
Energy: 1.1593841534872136
Energy: 1.158427199715463
Energy: 1.1593841534872136
Energy: 1.162275423391291
Energy: 1.1465216558525984
Energy: 1.2433378005851596
Energy: 1.1465216558525984
Energy: 1.2943135429738466
Energy: 1.310746298193661
Energy: 1.2216304715580237
Energy: 1.3107462981925986
Energy: 1.2684708152662894
Energy: 1.3096508902510746
Energy: 1.2146644136501568
Energy: 1.3096508902489497
Energy: 1.2082168887929903
Energy: 1.3060223506555035
Energy: 1.2965852891136282
Energy: 1.3060223506576287
Energy: 1.2076493715927403
Energy: 1.3055102046174052
Energy: 1.2428682435535938
Energy: 1.3055102046163425
Energy: 1.1468356842535226
Energy: 1.1476838878153894
Energy: 1.0998202889127264
Energy: 1.1476838878164517
Energy: 1.1618357624856255
Energy: 1.147436929415763
Energy: 1.0984303209756865
Energy: 1.1474369294168254
Energy: 1.097505827200438
Energy: 1.1554196546224818
Energy: 1.2133651182858478
Energy: 1.1554196573328612

minimum gb energy = 1.097505827200438 eV
minimum distance =  2.25653764789262 Angstroms
sigma value = 9


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

Energy: 1.5750195657408967
Energy: 1.2891147229126831
Energy: 1.289251920871391
Energy: 1.1590762709571651
Energy: 1.2302330842067244
Energy: 1.2902383849296297
Energy: 1.229283079775694
Energy: 1.2902383849296297
Energy: 1.2886640300335657
Energy: 1.2889124212117347
Energy: 1.8236388975594944
Energy: 1.2889124212117347
Energy: 1.2168228793040952
Energy: 1.290196327364613
Energy: 1.229652311601192
Energy: 1.2901963273658807
Energy: 1.4267488532967794
Energy: 1.2176982203022555
Energy: 1.2198320318709601
Energy: 1.217698220303523
Energy: 1.3238149970789808
Energy: 1.219297680755593
Energy: 1.2297442668592284
Energy: 1.219297680755593
Energy: 1.2852101314014248
Energy: 1.3820376754383412
Energy: 1.2269117679601562
Energy: 1.3820376754396089
Energy: 1.2297051089398714
Energy: 1.3873570336433008
Energy: 1.3232745678212
Energy: 1.3873570336433008
Energy: 1.2159527141344613
Energy: 1.2179402038324052
Energy: 1.1477573135970642
Energy: 1.2179402038324052
Energy: 1.229404252243391
Energy: 1.2183345699410166
Energy: 1.1462049392450921
Energy: 1.2183345699410166
Energy: 1.1439992331330653
Energy: 1.288874115288802
Energy: 1.28770687707967
Energy: 1.288874115288802
Energy: 1.2823107787549253
Energy: 1.2185584274478671
Energy: 1.2294295236475015
Energy: 1.2185584274465995
Energy: 1.290323238974481
Energy: 1.289460420047542
Energy: 1.2106935964155017
Energy: 1.2894604200462743
Energy: 1.21681619746608
Energy: 1.2889486938566188
Energy: 1.2107242167838
Energy: 1.2889486938553516
Energy: 1.258096804684403
Energy: 1.2182883714060975
Energy: 1.229148626773961
Energy: 1.21828837140483
Energy: 1.2169696598462016
Energy: 1.2179807550217328
Energy: 1.2302760518318294
Energy: 1.2179807550217328
Energy: 1.3015350467794853
Energy: 1.3832775253084202
Energy: 1.2264120396684053
Energy: 1.3832775253084202
Energy: 1.2809173064935233
Energy: 1.3827089969809092
Energy: 1.3233995633623838
Energy: 1.3827089969821769
Energy: 1.2139139492713158
Energy: 1.2176560122764468
Energy: 1.1473466278273958
Energy: 1.2176560122751794
Energy: 1.229410752976517
Energy: 1.2183902063302394
Energy: 1.1464460759619641
Energy: 1.2183902063315069
Energy: 1.1444843215234584
Energy: 1.217310108769622
Energy: 1.2895169253357712
Energy: 1.2173101087683544

minimum gb energy = 1.1439992331330653 eV
minimum distance =  2.30422770213519 Angstroms
sigma value = 25


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

Energy: 1.4005081316622263
Energy: 1.3698879859312678
Energy: 1.368602492554146
Energy: 1.199348045462962
Energy: 1.225323979839451
Energy: 1.2939353494837762
Energy: 1.2241411535554845
Energy: 1.2939353494837762
Energy: 1.3682528298262793
Energy: 1.3696759444498572
Energy: 1.3112991998784378
Energy: 1.3696759444498572
Energy: 1.1913763159729764
Energy: 1.2944812836642743
Energy: 1.2246035955369463
Energy: 1.2944812836642743
Energy: 1.2926671615989769
Energy: 1.3887822275157218
Energy: 1.2256628013422444
Energy: 1.3887822275141541
Energy: 1.1907409596281409
Energy: 1.2230695276719972
Energy: 1.2203983779255836
Energy: 1.2230696302925836
Energy: 1.4109580807059514
Energy: 1.3081912113976821
Energy: 1.2990308516420588
Energy: 1.3081912113444214
Energy: 1.1843298879019357
Energy: 1.3792878435775517
Energy: 1.226769928510744
Energy: 1.3792878435806868
Energy: 1.3672963059819911
Energy: 1.3683728072679677
Energy: 1.1881842707749704
Energy: 1.3683728072695354
Energy: 1.2257425297693372
Energy: 1.1928733801556077
Energy: 1.1839395746316066
Energy: 1.19287338015404
Energy: 1.3085495273697076
Energy: 1.3703564020631318
Energy: 1.3715731353752902
Energy: 1.3703564020631318
Energy: 1.1876726617792701
Energy: 1.295878182488815
Energy: 1.191580115273455
Energy: 1.295878182488815
Energy: 1.222125139023491
Energy: 1.3909838247060147
Energy: 1.2934776594226867
Energy: 1.3909838247075463
Energy: 1.225252765445858
Energy: 1.3073993333156577
Energy: 1.1923439282781492
Energy: 1.307399333317225
Energy: 1.2976393175837209
Energy: 1.3075918131660558
Energy: 1.1841216187615102
Energy: 1.3075918131644881
Energy: 1.2221181981288456
Energy: 1.3801049575121003
Energy: 1.1840992203001894
Energy: 1.3801049575121003
Energy: 1.1845607988521663
Energy: 1.1921360090208046
Energy: 1.3703198076504517
Energy: 1.1921360090208046

minimum gb energy = 1.1839395746316066 eV
minimum distance =  2.31760388806825 Angstroms
sigma value = 17


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

Energy: 1.9027975185268038
Energy: 1.526509101622332
Energy: 1.5254356724702196
Energy: 1.4239586181827002
Energy: 1.2756438405413772
Energy: 1.3120116534382629
Energy: 1.4411953042587813
Energy: 1.3120116534382629
Energy: 1.3186650921660676
Energy: 1.319486148680233
Energy: 1.7410714492502966
Energy: 1.319486148680233
Energy: 1.3105369326974574
Energy: 1.3130772689802477
Energy: 1.3071125373165526
Energy: 1.3130772689820234
Energy: 1.4628793766512809
Energy: 1.4131929803590642
Energy: 1.3483490647841283
Energy: 1.4131929803590642
Energy: 1.3107117602710572
Energy: 1.4169316390413034
Energy: 1.3088183291894229
Energy: 1.4169316390413034
Energy: 1.574491440103302
Energy: 1.3176748745487135
Energy: 1.3174317585822117
Energy: 1.3176748745487135
Energy: 1.6617190559414878
Energy: 1.3108610067731394
Energy: 1.2826442605221369
Energy: 1.310861006772252
Energy: 1.527835944065048
Energy: 1.528401691593513
Energy: 1.458940853480492
Energy: 1.5284016915917373
Energy: 1.5326431014541848
Energy: 1.3969194552671331
Energy: 1.4402007219928843
Energy: 1.3969194552697966
Energy: 1.4610471870109012
Energy: 1.2791690966873968
Energy: 1.2388123860339344
Energy: 1.2791690973573888
Energy: 1.4045252747487653
Energy: 1.2779307070602446
Energy: 1.2848915685335685
Energy: 1.2779307068579517
Energy: 1.4014662278091385
Energy: 1.2781724806217887
Energy: 1.276365068948617
Energy: 1.2781724806217887
Energy: 1.4167243900202668
Energy: 1.3117945991448203
Energy: 1.2387836249648405
Energy: 1.311794599146596
Energy: 1.5306673718949007
Energy: 1.4143227607495596
Energy: 1.6593273244041993
Energy: 1.4143227607495596
Energy: 1.5293581041030917
Energy: 1.5446980909335093
Energy: 1.660814561784365
Energy: 1.5446980909335093
Energy: 1.539131121030652
Energy: 1.3177581124769966
Energy: 1.3191846868259693
Energy: 1.3177581124761089
Energy: 1.541371268324094
Energy: 1.3178056175180852
Energy: 1.315850734272522
Energy: 1.3178056175180852
Energy: 1.3104898337858006
Energy: 1.4532978737465239
Energy: 1.3200366411434263
Energy: 1.4532978737465239
Energy: 1.335944185274254
Energy: 1.4164621558043446
Energy: 1.3132205551946041
Energy: 1.4164621558061203
Energy: 1.3194628732446083
Energy: 1.3106547462274936
Energy: 1.5336111860521153
Energy: 1.3106547462283813
Energy: 1.3186543476327708
Energy: 1.3185121759256475
Energy: 1.5757791191536794
Energy: 1.318512175923872
Energy: 1.4398532965327255
Energy: 1.3941302958225386
Energy: 1.441469972736346
Energy: 1.3941302958243142
Energy: 1.635191848816688
Energy: 1.5289834058856742
Energy: 1.5242368840995366
Energy: 1.5289834058856742
Energy: 1.2843501574145688
Energy: 1.2792228907690377
Energy: 1.5353276143543282
Energy: 1.2792228907699257
Energy: 1.2824019656005043
Energy: 1.2780072369957987
Energy: 1.4606688430660286
Energy: 1.278007236968318
Energy: 1.2371486213537555
Energy: 1.2848820022289498
Energy: 1.4020449072901262
Energy: 1.2848820020940475
Energy: 1.287966436428437
Energy: 1.2777343488548334
Energy: 1.5814155596642936
Energy: 1.277734348853058
Energy: 1.277439324540885
Energy: 1.398332718808113
Energy: 1.4010127089337423
Energy: 1.398332718809001
Energy: 1.659454745631882
Energy: 1.5264224780987157
Energy: 1.5240583325656114
Energy: 1.5264224780996036

minimum gb energy = 1.2371486213537555 eV
minimum distance =  2.25329873593399 Angstroms
sigma value = 53


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

Energy: 1.725932803114274
Energy: 1.4265770360732346
Energy: 1.4252912516943719
Energy: 1.1842221317977815
Energy: 1.42887925307409
Energy: 1.2600142511191623
Energy: 1.4244852969252093
Energy: 1.2600142511171184
Energy: 1.4235601630940622
Energy: 1.4252902311874593
Energy: 1.4368702903706903
Energy: 1.4252902311874593
Energy: 1.4316303547937714
Energy: 1.2617144459096428
Energy: 1.4345215829742055
Energy: 1.2617144459096428
Energy: 1.4459491414378374
Energy: 1.259613472720069
Energy: 1.1621288657984365
Energy: 1.259613472720069
Energy: 1.4340707672895103
Energy: 1.262023271602382
Energy: 1.1630766095854383
Energy: 1.262023271602382
Energy: 1.6827518604263412
Energy: 1.4341129748311792
Energy: 1.4216899539289778
Energy: 1.4341129748311792
Energy: 1.6804299604967772
Energy: 1.2631872440885352
Energy: 1.4474835278046638
Energy: 1.2631872440885352
Energy: 1.4228712975616833
Energy: 1.4276709530737155
Energy: 1.4377357585956303
Energy: 1.4276709530737155
Energy: 1.430110298459518
Energy: 1.2655853323511483
Energy: 1.4305377744968695
Energy: 1.2655853323531925
Energy: 1.4499115535913158
Energy: 1.265046444639706
Energy: 1.1635604764869854
Energy: 1.265046444639706
Energy: 1.4306980721599796
Energy: 1.2650515180278814
Energy: 1.1612473244683184
Energy: 1.2650515180258377
Energy: 1.6811278840876471
Energy: 1.2647622168253134
Energy: 1.446621197523917
Energy: 1.2647622168253134

minimum gb energy = 1.1612473244683184 eV
minimum distance =  2.3092075667215 Angstroms
sigma value = 9


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

Energy: 1.6687693156767858
Energy: 1.6066929774850047
Energy: 1.606302890453111
Energy: 1.4686467719272704
Energy: 1.2768968766457698
Energy: 1.2772292157146057
Energy: 1.6065883525707838
Energy: 1.277229215713093
Energy: 1.284589073726903
Energy: 1.2785081967949767
Energy: 1.5653455976660806
Energy: 1.278508196796421
Energy: 1.2788641682386468
Energy: 1.278836567126261
Energy: 1.7006785903182997
Energy: 1.2788365671270172
Energy: 1.2782556020835936
Energy: 1.2759978049447562
Energy: 1.684969317771564
Energy: 1.2759978049455127
Energy: 1.2742794346637811
Energy: 1.2758846052683366
Energy: 1.683825193340844
Energy: 1.2758846052645545
Energy: 1.7001646720730912
Energy: 1.5807315703350202
Energy: 1.58930859820854
Energy: 1.580731570335777
Energy: 1.6950514464216448
Energy: 1.5920071157804108
Energy: 1.578628672102263
Energy: 1.592007115767551
Energy: 1.374457772223527
Energy: 1.4368554677727534
Energy: 1.3597407912415995
Energy: 1.4368554677719971
Energy: 1.2637932642338159
Energy: 1.363633635256803
Energy: 1.5789777326300698
Energy: 1.363633635256803
Energy: 1.3715676517908397
Energy: 1.3721544730550745
Energy: 1.6904735993880562
Energy: 1.3721544730550745
Energy: 1.371822276499286
Energy: 1.3905463561774847
Energy: 1.6743205081656105
Energy: 1.3905463561812668
Energy: 1.6961645639836993
Energy: 1.3716464668183082
Energy: 1.3775444086026465
Energy: 1.3716464668183082
Energy: 1.6978796585264777
Energy: 1.3726556088109008
Energy: 1.3770385293804603
Energy: 1.3726556088124138
Energy: 1.5799964129571638
Energy: 1.3684666143225208
Energy: 1.3702284811826253
Energy: 1.3684666143240336
Energy: 1.4555010486658757
Energy: 1.429206106726969
Energy: 1.3709767048734038
Energy: 1.429206106726969
Energy: 1.582123354306843
Energy: 1.4291729891651728
Energy: 1.3759258063267927
Energy: 1.4291729891644163
Energy: 1.6056249437280508
Energy: 1.5824300011689068
Energy: 1.669131006756891
Energy: 1.582430001169663
Energy: 1.6029659616482543
Energy: 1.2780266358953196
Energy: 1.3646503470871345
Energy: 1.2780266358938068
Energy: 1.5630144831801263
Energy: 1.2791852830798047
Energy: 1.2788229774694813
Energy: 1.2791852830775354
Energy: 1.7009380730714887
Energy: 1.2781570501094075
Energy: 1.2775567225261348
Energy: 1.278157050110164
Energy: 1.684073668246894
Energy: 1.2760832318692519
Energy: 1.2760655151619638
Energy: 1.2760832317324025
Energy: 1.684514834310002
Energy: 1.2757038353971675
Energy: 1.2742677638933337
Energy: 1.2757038353835515
Energy: 1.5904316328156352
Energy: 1.5782964954890681
Energy: 1.6953331840716506
Energy: 1.5782964954913374
Energy: 1.5778866374428788
Energy: 1.5808052571772842
Energy: 1.698248460363539
Energy: 1.580805257178797
Energy: 1.3617081282113799
Energy: 1.4499391412403164
Energy: 1.3725275444037712
Energy: 1.4499391412206488
Energy: 1.578065489372183
Energy: 1.3698755257952804
Energy: 1.2639391868307155
Energy: 1.3698755258270516
Energy: 1.46791150868462
Energy: 1.373290573489655
Energy: 1.3723249649429912
Energy: 1.3732905734911678
Energy: 1.671961010395165
Energy: 1.3788061372161449
Energy: 1.378392419624149
Energy: 1.3788061372169012
Energy: 1.37937048515104
Energy: 1.373616416068507
Energy: 1.6896375972644218
Energy: 1.3736164160662376
Energy: 1.3749887905863947
Energy: 1.3736912691006946
Energy: 1.5654036183280644
Energy: 1.373691269101451
Energy: 1.3787908488704312
Energy: 1.3846373271172743
Energy: 1.5815976807024772
Energy: 1.384637327116518
Energy: 1.3698479531205312
Energy: 1.4351135180951065
Energy: 1.457967776557363
Energy: 1.435113518095863
Energy: 1.374134491654554
Energy: 1.4306065012268752
Energy: 1.4621789897199833
Energy: 1.430606501225362
Energy: 1.6705717682114276
Energy: 1.5814296629998965
Energy: 1.6038931979160536
Energy: 1.5814296630029225

minimum gb energy = 1.2637932642338159 eV
minimum distance =  2.22685806536687 Angstroms
sigma value = 73


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

Energy: 1.7739615442724224
Energy: 1.5475981872652496
Energy: 1.5488249021717366
Energy: 1.3926978314369733
Energy: 1.3117748472967086
Energy: 1.3036811402517696
Energy: 1.4741793162347643
Energy: 1.3036811402517696
Energy: 1.3053906635801984
Energy: 1.30356824282876
Energy: 1.5077251441696584
Energy: 1.30356824282876
Energy: 1.3032217068258505
Energy: 1.3052969878871459
Energy: 1.6672412952441138
Energy: 1.3052969878871459
Energy: 1.3104957542053115
Energy: 1.3098208327061667
Energy: 1.6577153861440368
Energy: 1.3098208327073666
Energy: 1.3913723848494504
Energy: 1.5599214719038124
Energy: 1.6562866795242703
Energy: 1.559921471902612
Energy: 1.4692777286450518
Energy: 1.533219165670611
Energy: 1.5701317629813334
Energy: 1.5332191656646104
Energy: 1.471702354667684
Energy: 1.5374466483438558
Energy: 1.5443613103565428
Energy: 1.5374466483438558
Energy: 1.3911849169048665
Energy: 1.4641634130196153
Energy: 1.5209731373159188
Energy: 1.464163413029217
Energy: 1.350066564506847
Energy: 1.4594850905196093
Energy: 1.5328598606258537
Energy: 1.4594850905184091
Energy: 1.3925119250295257
Energy: 1.298524505979131
Energy: 1.5478278943391088
Energy: 1.298524505979131
Energy: 1.3557856305296472
Energy: 1.3028555186743778
Energy: 1.5861702028836042
Energy: 1.302855518675578
Energy: 1.5297821839596906
Energy: 1.4047894286718705
Energy: 1.3575434700289897
Energy: 1.4047894286718705
Energy: 1.5175781459320041
Energy: 1.3761796151883108
Energy: 1.3771265332431892
Energy: 1.3761796151883108
Energy: 1.5646923591269954
Energy: 1.359360229737614
Energy: 1.3595924606987915
Energy: 1.359360229737614
Energy: 1.6620309013770296
Energy: 1.358769669476637
Energy: 1.3577821854184993
Energy: 1.358769669476637
Energy: 1.6559661153537402
Energy: 1.6139392587514179
Energy: 1.376253646002645
Energy: 1.6139392587502177
Energy: 1.4789505878906837
Energy: 1.5292428048402174
Energy: 1.4695261638199384
Energy: 1.5292428048402174
Energy: 1.493203383378801
Energy: 1.4892114595941595
Energy: 1.471218357655445
Energy: 1.4892114595941595
Energy: 1.4455294064523865
Energy: 1.3985285100211726
Energy: 1.4763852153470531
Energy: 1.3985285100223728
Energy: 1.4946774706739894
Energy: 1.4147034137805568
Energy: 1.3547410451609583
Energy: 1.4147034137793566
Energy: 1.6509299007021427
Energy: 1.4961695028943025
Energy: 1.4946942818516538
Energy: 1.4961695028943025

minimum gb energy = 1.298524505979131 eV
minimum distance =  2.25471117990102 Angstroms
sigma value = 7


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

Energy: 2.060350331263111
Energy: 1.5362244923044284
Energy: 1.5355879932587873
Energy: 1.3053293229449796
Energy: 1.3355876588784101
Energy: 1.4512640173125555
Energy: 1.5969163906967476
Energy: 1.4512640173049176
Energy: 1.308763004244139
Energy: 1.310057647136052
Energy: 1.4103222424082988
Energy: 1.3100576471436902
Energy: 1.3088589198315939
Energy: 1.3061441018638562
Energy: 1.6219027060305988
Energy: 1.3061441018638562
Energy: 1.3332827442135073
Energy: 1.3353088544787701
Energy: 1.5300211011453542
Energy: 1.3353088544779215
Energy: 1.3041279871606364
Energy: 1.3346707757406187
Energy: 1.527391706334164
Energy: 1.3346707757423157
Energy: 1.5945824748565327
Energy: 1.3339757094146227
Energy: 1.302299132534702
Energy: 1.3339757094129252
Energy: 1.5913919215271173
Energy: 1.3336159385117972
Energy: 1.3340860856604535
Energy: 1.3336159385075539
Energy: 1.5611986582640949
Energy: 1.3032711233827177
Energy: 1.305700667655329
Energy: 1.3032711233827177
Energy: 1.5228607931250073
Energy: 1.48979108047766
Energy: 1.332071179466389
Energy: 1.4897910804768113
Energy: 1.4466296923217592
Energy: 1.4592331848526132
Energy: 1.473358590513241
Energy: 1.4592331848610998
Energy: 1.486667349670485
Energy: 1.4487614577711283
Energy: 1.5942434641503922
Energy: 1.4487614577719772
Energy: 1.4460675499499411
Energy: 1.419536013048586
Energy: 1.4911610495740155
Energy: 1.4195360130910186
Energy: 1.4163916427718697
Energy: 1.3781099923663171
Energy: 1.302473019757341
Energy: 1.3781099923671658
Energy: 1.4949380464418922
Energy: 1.4202623811192328
Energy: 1.3308967900850128
Energy: 1.4202621103132287
Energy: 1.6254335820243195
Energy: 1.4219044172494846
Energy: 1.4240956857627085
Energy: 1.4219044168618047
Energy: 1.6381319056640722
Energy: 1.4583014925450664
Energy: 1.4235644042860174
Energy: 1.4583014934170953
Energy: 1.3353056527173808
Energy: 1.4891342092269018
Energy: 1.4079010568909254
Energy: 1.489134209225204
Energy: 1.3031004818407632
Energy: 1.3079242625799863
Energy: 1.597231356773975
Energy: 1.307924262583381
Energy: 1.33370089785595
Energy: 1.3350943092231855
Energy: 1.6250052376861037
Energy: 1.3350943092214882
Energy: 1.3025476632206074
Energy: 1.3341868191318247
Energy: 1.5228651454157094
Energy: 1.334186819132596
Energy: 1.5910282325401728
Energy: 1.335874958649709
Energy: 1.3041523157936001
Energy: 1.3358749586505576
Energy: 1.591507558392171
Energy: 1.334401313232119
Energy: 1.3357363493652177
Energy: 1.3344013132304215
Energy: 1.6057440564684475
Energy: 1.3067710086226703
Energy: 1.3060408547666136
Energy: 1.3067710086226703
Energy: 1.524227607132991
Energy: 1.308919651188076
Energy: 1.3086075746373464
Energy: 1.3089196511914705
Energy: 1.5306540642187114
Energy: 1.450049222941716
Energy: 1.3343694951489398
Energy: 1.4500492228890995
Energy: 1.4813471019452062
Energy: 1.4796795213937135
Energy: 1.7862945179288119
Energy: 1.479679521395411
Energy: 1.4559856346985454
Energy: 1.4552516764823193
Energy: 1.4829809757494175
Energy: 1.455251676480622
Energy: 1.413668729074532
Energy: 1.3797547918352706
Energy: 1.4207943134980598
Energy: 1.3797547918361195
Energy: 1.4859105182049255
Energy: 1.4194594566793894
Energy: 1.3013548165464124
Energy: 1.419459456673449
Energy: 1.6260712685843866
Energy: 1.4546068041979554
Energy: 1.4553221322326202
Energy: 1.4546068041614635

minimum gb energy = 1.3013548165464124 eV
minimum distance =  2.22578866653191 Angstroms
sigma value = 29


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

Energy: 1.1939014846947198
Energy: 1.324411601009076
Energy: 1.2416475813898704
Energy: 1.1967940064003417
Energy: 1.2252005649063358
Energy: 1.3410482927792442
Energy: 1.235018088354428
Energy: 1.3410482927789484
Energy: 1.2229847768322608
Energy: 1.3116134441359977
Energy: 1.198679022939919
Energy: 1.3116134441359977
Energy: 1.2018826894779968
Energy: 1.2271054446886092
Energy: 1.2290307751885907
Energy: 1.2271054446799379
Energy: 1.2234931525503008
Energy: 1.2305840886226387
Energy: 1.2019036839056774
Energy: 1.2305840886310142
Energy: 1.2386351277290801
Energy: 1.320033931883271
Energy: 1.2021172371481468
Energy: 1.3200339318838623
Energy: 1.1975065179631208
Energy: 1.3164755511908754
Energy: 1.2261824222873081
Energy: 1.31647555119058
Energy: 1.2344745246856232
Energy: 1.231721419004184
Energy: 1.2020950323219202
Energy: 1.231721419002443
Energy: 1.2019512206089447
Energy: 1.229673030943915
Energy: 1.2351933564446003
Energy: 1.2296730309430284

minimum gb energy = 1.1939014846947198 eV
minimum distance =  2.28269920364507 Angstroms
sigma value = 5


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

Energy: 1.6092399471244812
Energy: 1.2100455491355024
Energy: 1.4630082751947497
Energy: 1.190154835597879
Energy: 1.365815683780945
Energy: 1.2055562943467328
Energy: 1.422606139583987
Energy: 1.2055562943451297
Energy: 1.426353804912241
Energy: 1.2954511008870953
Energy: 1.421317221308221
Energy: 1.2954511008870953
Energy: 1.2186790613714558
Energy: 1.2030287835190399
Energy: 1.456336339137439
Energy: 1.2030287835182383
Energy: 1.4604972982804705
Energy: 1.2438954900449484
Energy: 1.4239958754977815
Energy: 1.2438954900465518
Energy: 1.2438868366685811
Energy: 1.2433451055708769
Energy: 1.4282430974146847
Energy: 1.2433451055708769
Energy: 1.2034847163506115
Energy: 1.2030716183531356
Energy: 1.454734857815124
Energy: 1.2030716183531356
Energy: 1.2146524912009855
Energy: 1.2070460035875357
Energy: 1.61864578921593
Energy: 1.207046003586734
Energy: 1.3105745862530906
Energy: 1.2633435609111368
Energy: 1.6101655533893835
Energy: 1.2633435609127401
Energy: 1.411263049658314
Energy: 1.1893338960164184
Energy: 1.1936050197244639
Energy: 1.1893338960164184
Energy: 1.3087521768117987
Energy: 1.1875320155206484
Energy: 1.1903819060713412
Energy: 1.1875320155230533
Energy: 1.6234595659366884
Energy: 1.1866016180502037
Energy: 1.186983104242197
Energy: 1.1866016180502037
Energy: 1.6224572941272128
Energy: 1.1876593098765855
Energy: 1.4266609710570775
Energy: 1.187659309875784
Energy: 1.2641133079373041
Energy: 1.2558993192286934
Energy: 1.4267254699251835
Energy: 1.2558993192294952
Energy: 1.2043707891538817
Energy: 1.2036346993993585
Energy: 1.4288789281681347
Energy: 1.2036346993977554
Energy: 1.2087750112625453
Energy: 1.2057480261194633
Energy: 1.4161023624717288
Energy: 1.2057480261210667
Energy: 1.2062137265470818
Energy: 1.2027251188898413
Energy: 1.215550892910682
Energy: 1.2027251188898413
Energy: 1.4560420082438617
Energy: 1.2075813362230814
Energy: 1.2175126760948036
Energy: 1.2075813362254861
Energy: 1.418368490836117
Energy: 1.2966414846804453
Energy: 1.4272935176812078
Energy: 1.2966414846820484
Energy: 1.4554822089740302
Energy: 1.2026000053104764
Energy: 1.2155809143348792
Energy: 1.2026000053104764
Energy: 1.427525711067885
Energy: 1.2443347599003511
Energy: 1.4617946973843359
Energy: 1.2443347599019545
Energy: 1.4242649470343236
Energy: 1.2434830557132253
Energy: 1.2021014321207248
Energy: 1.2434830557116219
Energy: 1.4569978650137374
Energy: 1.203694094708368
Energy: 1.2039453173720664
Energy: 1.2036940947067647
Energy: 1.6330651209839218
Energy: 1.205585763303506
Energy: 1.2100612400792097
Energy: 1.2055857633043077
Energy: 1.611676538508262
Energy: 1.261802792227388
Energy: 1.3076747207709205
Energy: 1.261802792227388
Energy: 1.1972145291386362
Energy: 1.1915256216299739
Energy: 1.4105223980429877
Energy: 1.1915256216275687
Energy: 1.190362136014608
Energy: 1.187883220303534
Energy: 1.3105069428668044
Energy: 1.1878832203027323
Energy: 1.185528754718511
Energy: 1.1909286640874497
Energy: 1.2676992379946161
Energy: 1.1909286640874497
Energy: 1.2126278764927814
Energy: 1.1883883377637354
Energy: 1.6145043365847211
Energy: 1.1883883377637354
Energy: 1.425527444955394
Energy: 1.255447064165545
Energy: 1.306472976365274
Energy: 1.255447064165545
Energy: 1.426606716543492
Energy: 1.204427121908824
Energy: 1.2054834483526016
Energy: 1.2044271219096259
Energy: 1.413551263091619
Energy: 1.206516708553447
Energy: 1.2051183159149215
Energy: 1.2065167085550503
Energy: 1.2164259421837633
Energy: 1.2035198764963528
Energy: 1.2041761447877253
Energy: 1.2035198764939479

minimum gb energy = 1.185528754718511 eV
minimum distance =  2.25512739566083 Angstroms
sigma value = 1


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

Energy: 1.8872748396062706
Energy: 1.1661471315585086
Energy: 1.1692267568961094
Energy: 1.1524634927933872
Energy: 1.3985230207196626
Energy: 1.1653298681287618
Energy: 1.413720279259537
Energy: 1.1653298681298703
Energy: 1.434913246199965
Energy: 1.2831014650563732
Energy: 1.4633497418623675
Energy: 1.2831014650552648
Energy: 1.3039650919860934
Energy: 1.168116201207901
Energy: 1.4361878994784911
Energy: 1.1681162012067927
Energy: 1.3557542074598634
Energy: 1.2244149196764564
Energy: 1.3226053532647504
Energy: 1.2244149196742395
Energy: 1.1668083305952086
Energy: 1.2225946638706322
Energy: 1.3209496587856546
Energy: 1.2225946638695238
Energy: 1.1666139595732608
Energy: 1.1660339760110279
Energy: 1.4375454406761514
Energy: 1.1660339760099194
Energy: 1.1707689384102902
Energy: 1.1727580326701457
Energy: 1.6007194062632715
Energy: 1.1727580326701457
Energy: 1.2541823568912607
Energy: 1.2513978143263755
Energy: 1.5282102284503813
Energy: 1.251397814327484
Energy: 1.5755468816014264
Energy: 1.1319005280286232
Energy: 1.2719074925730187
Energy: 1.1319005280297316
Energy: 1.257909586743142
Energy: 1.1359979216039258
Energy: 1.2814505999301269
Energy: 1.1359979216039258
Energy: 1.7039771247679676
Energy: 1.128754218590539
Energy: 1.2489976926988555
Energy: 1.1287542185916475
Energy: 1.721796580538847
Energy: 1.1307242075573518
Energy: 1.2682514996811056
Energy: 1.1307242075562436
Energy: 1.2459667953146523
Energy: 1.1278020519348333
Energy: 1.57164324877352
Energy: 1.1278020519337248
Energy: 1.3072308283888474
Energy: 1.247293325613997
Energy: 1.5685704646624758
Energy: 1.2472933256128889
Energy: 1.3202338677314263
Energy: 1.1690344143857043
Energy: 1.4319774897696318
Energy: 1.169034414384596
Energy: 1.1829700455400673
Energy: 1.1692574811502525
Energy: 1.3189625951379482
Energy: 1.1692574811502525
Energy: 1.2172503706884419
Energy: 1.1703832306236894
Energy: 1.357622815632987
Energy: 1.1703832306236894
Energy: 1.177420317127573
Energy: 1.1680919113803585
Energy: 1.5791614861070713
Energy: 1.1680919113803585
Energy: 1.213272539285935
Energy: 1.3344672960688104
Energy: 1.6020482593564025
Energy: 1.3344672960677018
Energy: 1.5840278949809758
Energy: 1.2430699331736386
Energy: 1.431793320008873
Energy: 1.24306993317253
Energy: 1.5888208108395379
Energy: 1.1641321781003184
Energy: 1.1681165158737838
Energy: 1.1641321780992102
Energy: 1.377549350235809
Energy: 1.1614736162615011
Energy: 1.16193182120384
Energy: 1.1614736162603931
Energy: 1.5922232504418103
Energy: 1.161520788849445
Energy: 1.1938916966697672
Energy: 1.1615207888483365

minimum gb energy = 1.1278020519337248 eV
minimum distance =  2.25531484902638 Angstroms
sigma value = 17


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

Energy: 1.8217282122033838
Energy: 1.4119790583163365
Energy: 1.4154091277119842
Energy: 1.1274915938337555
Energy: 1.1854774613506958
Energy: 1.1363646551878301
Energy: 1.332275763731952
Energy: 1.1363646551844049
Energy: 1.505738696482939
Energy: 1.1324003506065827
Energy: 1.3160997552913472
Energy: 1.1324003506038425
Energy: 1.4820207782588004
Energy: 1.200214515215823
Energy: 1.3227585162162079
Energy: 1.200214515217193
Energy: 1.2877702979250965
Energy: 1.120971748652367
Energy: 1.6286679473932755
Energy: 1.120971748653052
Energy: 1.1220098813242356
Energy: 1.1203946787053956
Energy: 1.621337869682956
Energy: 1.1203946787040255
Energy: 1.1212516651051079
Energy: 1.119929950243308
Energy: 1.2287611149992883
Energy: 1.1199299502453632
Energy: 1.1323512500975856
Energy: 1.1273135367309794
Energy: 1.82831926604264
Energy: 1.1273135367323495
Energy: 1.548899580868342
Energy: 1.1264532642136373
Energy: 1.4731366754922812
Energy: 1.1264532642163776
Energy: 1.3088798857171273
Energy: 1.2049440342906557
Energy: 1.3477578591786687
Energy: 1.2049440342933961
Energy: 1.5726633982475111
Energy: 1.1327398740974266
Energy: 1.1415391092302132
Energy: 1.1327398740967416
Energy: 1.4609862072248916
Energy: 1.156915918028801
Energy: 1.3162826496838187
Energy: 1.1569159180274307
Energy: 1.5200947672250549
Energy: 1.1349606473395772
Energy: 1.1342309351803945
Energy: 1.1349606473416323
Energy: 1.3698757989148076
Energy: 1.1331175674703893
Energy: 1.135546231354123
Energy: 1.1331175674703893
Energy: 1.4849699438488504
Energy: 1.137641398372327
Energy: 1.1448467640230933
Energy: 1.1376413983743823
Energy: 1.7724506331930137
Energy: 1.1805636907130588
Energy: 1.183680144814419
Energy: 1.1805636907123733
Energy: 1.1799343134447489
Energy: 1.1430581033821499
Energy: 1.6517803845268777
Energy: 1.1430581033842053
Energy: 1.1321358593067987
Energy: 1.1334673803996442
Energy: 1.5750278246292873
Energy: 1.1334673803948485
Energy: 1.180628158244105
Energy: 1.1373362651256087
Energy: 1.3604478525473431
Energy: 1.1373362651235535
Energy: 1.1430286182202274
Energy: 1.2782978468893222
Energy: 1.8230136366552763
Energy: 1.2782978468900077
Energy: 1.3322880165392852
Energy: 1.1385688589243428
Energy: 1.4583370202416652
Energy: 1.1385688589236576
Energy: 1.3294026466684614
Energy: 1.1337366901026382
Energy: 1.5035339736082396
Energy: 1.1337366900998977
Energy: 1.3222429270738576
Energy: 1.2002176047542188
Energy: 1.5006379662331522
Energy: 1.2002176047542188
Energy: 1.6553615084771127
Energy: 1.1225800598686977
Energy: 1.2805378584111409
Energy: 1.1225800598659572
Energy: 1.5743633529700083
Energy: 1.1347552317148075
Energy: 1.1199330568411112
Energy: 1.1347552317161775
Energy: 1.350187930516665
Energy: 1.1218676248225814
Energy: 1.1247806776916116
Energy: 1.1218676248205264
Energy: 1.825081258567679
Energy: 1.1240110607957388
Energy: 1.129668938036729
Energy: 1.1240110607964238
Energy: 1.3584396347003458
Energy: 1.124363845638801
Energy: 1.5763811761256465
Energy: 1.124363845639486
Energy: 1.3187878656097147
Energy: 1.2027428093610948
Energy: 1.3118222665387032
Energy: 1.2027428093590395
Energy: 1.1428313054418708
Energy: 1.1338908131454917
Energy: 1.5424351744926137
Energy: 1.1338908131448067
Energy: 1.3148134012745016
Energy: 1.1632750543987114
Energy: 1.5029659787682386
Energy: 1.163275054404877
Energy: 1.1663556612552242
Energy: 1.1657745116197489
Energy: 1.5060371329173736
Energy: 1.165774511622489
Energy: 1.132684221532486
Energy: 1.131584986860671
Energy: 1.4470511019403922
Energy: 1.131584986860671
Energy: 1.142875201909691
Energy: 1.1368180538747517
Energy: 1.4786230868675845
Energy: 1.1368180538747517
Energy: 1.373061412738522
Energy: 1.1850748597443532
Energy: 1.678003608244501
Energy: 1.1850748597436684
Energy: 1.650408812932049
Energy: 1.140220033811734
Energy: 1.1751514959088225
Energy: 1.1402200338083088
Energy: 1.5737116498497863
Energy: 1.1326547198068506
Energy: 1.134084532763038
Energy: 1.1326547198102759
Energy: 1.3604106465989894
Energy: 1.1399272370451599
Energy: 1.161912899373667
Energy: 1.13992723704653

minimum gb energy = 1.119929950243308 eV
minimum distance =  2.25634894649123 Angstroms
sigma value = 89


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

Energy: 1.932371808777452
Energy: 1.0411391317271104
Energy: 1.0431019713272152
Energy: 1.0638696767498121
Energy: 1.0976322003124188
Energy: 1.1442584307965287
Energy: 1.0391128836841501
Energy: 1.1442584307965287
Energy: 1.0266181146969546
Energy: 1.1440073703900306
Energy: 1.0594103584175392
Energy: 1.1440073703918232
Energy: 1.0267167848902647
Energy: 1.144964213964951
Energy: 1.0584279941050707
Energy: 1.144964213964951
Energy: 1.0352881025216234
Energy: 1.0361203979537337
Energy: 1.0845382519095037
Energy: 1.0361203979537337
Energy: 1.0351203631825912
Energy: 1.0350273442029407
Energy: 1.0853475848592324
Energy: 1.0350273442029407
Energy: 1.0341353108595197
Energy: 1.03355319228961
Energy: 1.095042798679704
Energy: 1.03355319228961
Energy: 1.0411115005842364
Energy: 1.040593666841574
Energy: 1.0256056171724388
Energy: 1.040593666841574
Energy: 1.0574531024227474
Energy: 1.0387933010748909
Energy: 1.0257657857038345
Energy: 1.0387933010748909
Energy: 1.0675924322969215
Energy: 1.1468636146479383
Energy: 1.0566151075911898
Energy: 1.1468636146479383
Energy: 1.0578973452098044
Energy: 1.1474995243471737
Energy: 1.0231562252035469
Energy: 1.1474995243489663
Energy: 1.085516181134961
Energy: 1.0413343353426763
Energy: 1.0390608236093102
Energy: 1.0413343353426763
Energy: 1.0831428277948816
Energy: 1.038574140702067
Energy: 1.039479050719906
Energy: 1.0385741407056521
Energy: 1.0937064320565328
Energy: 1.0327680737823361
Energy: 1.0323418092402812
Energy: 1.0327680737823361
Energy: 1.0273075942846375
Energy: 1.0368219292692484
Energy: 1.0377240365377152
Energy: 1.0368219292692484

minimum gb energy = 1.0231562252035469 eV
minimum distance =  2.27438240511206 Angstroms
sigma value = 13


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

Energy: 1.6972793107676754
Energy: 0.9896828034260522
Energy: 1.2876559818512825
Energy: 0.9843242660864288
Energy: 1.4764243082728794
Energy: 0.9804478814652804
Energy: 1.18730291414827
Energy: 0.980447881469037
Energy: 1.5932525480726716
Energy: 0.9758977429094834
Energy: 1.1582824147179658
Energy: 0.9758977429034728
Energy: 1.324255711648941
Energy: 1.0590658479639958
Energy: 1.1997016254642345
Energy: 1.0590658479639958
Energy: 1.1697723606983879
Energy: 1.0526245781499146
Energy: 1.4691797012667656
Energy: 1.0526245781484118
Energy: 1.1782435298014333
Energy: 0.9792767632558688
Energy: 1.4825499693178887
Energy: 0.9792767632551174
Energy: 1.1774122991400704
Energy: 0.9773909499720287
Energy: 1.1977066647098278
Energy: 0.9773909499690235
Energy: 1.1404173956572434
Energy: 0.9782177822848138
Energy: 1.5125373672591453
Energy: 0.9782177822818087
Energy: 0.9949210120887048
Energy: 0.9801833985369128
Energy: 1.4502376238553623
Energy: 0.9801833985376642
Energy: 0.9794998008819651
Energy: 0.9769711730668599
Energy: 1.4461478662758325
Energy: 0.9769711730668599
Energy: 1.006733229031645
Energy: 0.9859373223306168
Energy: 1.6979608721348618
Energy: 0.9859373223396326
Energy: 1.4787568640611302
Energy: 0.9773480911287217
Energy: 1.1627232234887002
Energy: 0.9773480911294729
Energy: 1.4703387085366717
Energy: 1.0404461025061786
Energy: 1.4762396802558353
Energy: 1.0404461025039249
Energy: 1.4829900435750856
Energy: 1.043719785259573
Energy: 1.3255376655462106
Energy: 1.043719785259573
Energy: 1.4652739652055051
Energy: 0.9799129626046443
Energy: 1.1652542399945192
Energy: 0.9799129626023902
Energy: 1.4573093748735542
Energy: 0.9791691156820039
Energy: 0.9796896343869055
Energy: 0.9791691156789987
Energy: 1.478027745189089
Energy: 0.9769411063615097
Energy: 0.9797860727597204
Energy: 0.9769411063615097
Energy: 1.6986017378706497
Energy: 0.9787757973006975
Energy: 0.9835014440473782
Energy: 0.978775797299195
Energy: 1.2976575544851474
Energy: 0.9792638292526408
Energy: 1.1872766769394374
Energy: 0.9792638292541435
Energy: 1.4481478520624178
Energy: 0.9751883572962349
Energy: 1.1523104757101323
Energy: 0.9751883572954836
Energy: 1.3252820173733706
Energy: 0.9855732678395591
Energy: 1.1986119651575593
Energy: 0.9855732678418132
Energy: 1.1631177705972968
Energy: 1.0480963796926273
Energy: 1.477060061040581
Energy: 1.0480963796948812
Energy: 1.175470077490307
Energy: 0.9818266501657619
Energy: 1.4694736363341168
Energy: 0.981826650168016
Energy: 0.9783257804221143
Energy: 0.9745473721180633
Energy: 1.2035539853412334
Energy: 0.9745473721203173
Energy: 1.1399709440080539
Energy: 0.9963149059701453
Energy: 1.4609418084467423
Energy: 0.996314905971648
Energy: 0.9992809062217719
Energy: 0.995438755144723
Energy: 1.4446974840151474
Energy: 0.9954387551424689
Energy: 0.9753592694663449
Energy: 0.9748582432734801
Energy: 1.485600571548759
Energy: 0.9748582432719775
Energy: 0.9915391912574291
Energy: 0.9816940891370642
Energy: 1.7013111421513383
Energy: 0.9816940891408209
Energy: 1.4474782843694203
Energy: 0.9799734459969816
Energy: 1.3103100929839941
Energy: 0.9799734459947276
Energy: 1.1507746711055138
Energy: 1.044250466040747
Energy: 1.4754963281509788
Energy: 1.0442504660437524
Energy: 1.4793671154274899
Energy: 1.0490289168092903
Energy: 1.3223952767155815
Energy: 1.0490289168062852
Energy: 1.453736976185232
Energy: 0.9816259958050234
Energy: 1.3518939919644113
Energy: 0.9816259958050234
Energy: 1.4659141063661125
Energy: 0.979508089503181
Energy: 0.985549272277969
Energy: 0.9795080895016783
Energy: 1.4409383177309398
Energy: 0.9753157219991722
Energy: 0.9757830764397274
Energy: 0.9753157220029288
Energy: 1.3252943112359457
Energy: 0.976337608202273
Energy: 0.9821382441467282
Energy: 0.9763376081970139

minimum gb energy = 0.9745473721180633 eV
minimum distance =  2.26888494919782 Angstroms
sigma value = 37


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

Energy: 1.4778798404664195
Energy: 0.8942949740743726
Energy: 0.8951735753128356
Energy: 0.9245365401740653
Energy: 1.445658692787649
Energy: 0.8890433198101314
Energy: 1.166197307101095
Energy: 0.8890433198101314
Energy: 1.4374205552460348
Energy: 1.001776312863957
Energy: 1.1791110945464578
Energy: 1.001776312863957
Energy: 1.4905835929822284
Energy: 1.0045240579287709
Energy: 1.1770545740707714
Energy: 1.0045240579287709
Energy: 1.4419435539905874
Energy: 1.0052604330773016
Energy: 1.185028286135727
Energy: 1.0052604330773016
Energy: 0.8816422564683819
Energy: 0.8884102435465733
Energy: 1.4443769565140627
Energy: 0.8884102435478659
Energy: 0.8856966040963994
Energy: 0.8857090528714081
Energy: 1.4418732551584368
Energy: 0.8857090528714081
Energy: 0.8966953764210214
Energy: 0.8886781514859161
Energy: 1.4817371816353244
Energy: 0.8886781514859161
Energy: 0.8889987646256567
Energy: 0.8919633596854721
Energy: 1.4348954215833838
Energy: 0.8919633596841796
Energy: 0.885613241730024
Energy: 0.8882934656308167
Energy: 1.4409016140637776
Energy: 0.8882934656308167
Energy: 0.8951735751138591
Energy: 0.9245365401740653
Energy: 1.4778798404664195
Energy: 0.8942949741286336
Energy: 1.1661973071023877
Energy: 0.8890433198101314
Energy: 1.445658692787649
Energy: 0.8890433198088388
Energy: 1.1791110945464578
Energy: 1.0017763128652497
Energy: 1.4374205552460348
Energy: 1.001776312863957
Energy: 1.177054574069508
Energy: 1.0045240579287709
Energy: 1.4905835929822284
Energy: 1.0045240579287709
Energy: 1.1850282861370194
Energy: 1.0052604330773016
Energy: 1.44194355399188
Energy: 1.0052604330773016
Energy: 1.4443769565140627
Energy: 0.8884102435478659
Energy: 0.8816422564696745
Energy: 0.8884102435465733
Energy: 1.4418732551584368
Energy: 0.8857090528714081
Energy: 0.8856966040976919
Energy: 0.8857090528714081
Energy: 1.4817371815513622
Energy: 0.8886781514859161
Energy: 0.8966953764197287
Energy: 0.8886781514846235
Energy: 1.4348954215872618
Energy: 0.8919633596841796
Energy: 0.8889987646230716
Energy: 0.8919633596854721
Energy: 1.4409016140624853
Energy: 0.8882934656308167
Energy: 0.8856132417274386
Energy: 0.8882934656308167

minimum gb energy = 0.8816422564683819 eV
minimum distance =  2.27319136133802 Angstroms
sigma value = 25


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

Energy: 1.9053090285102938
Energy: 0.7940440078481075
Energy: 0.7975950297962312
Energy: 0.812091583940759
Energy: 1.6397764770051797
Energy: 0.7913957903523487
Energy: 1.017374590670321
Energy: 0.7913957903523487
Energy: 1.7181970573153387
Energy: 0.790363117851388
Energy: 1.0228447893291157
Energy: 0.7903631178523974
Energy: 1.3660247394814844
Energy: 0.799104662052665
Energy: 1.2171329419633796
Energy: 0.799104662052665
Energy: 1.4458133820175016
Energy: 0.8823814680533963
Energy: 1.4537765462297332
Energy: 0.8823814680533963
Energy: 1.3341952967653286
Energy: 0.880318904730874
Energy: 1.4399245906888725
Energy: 0.880318904730874
Energy: 1.3425487023190683
Energy: 0.7844789448586309
Energy: 1.4247385540645368
Energy: 0.7844789448606496
Energy: 1.0233821833570131
Energy: 0.7925386586607109
Energy: 1.634966236290089
Energy: 0.7925386586627298
Energy: 1.0354518835005955
Energy: 0.785028510223982
Energy: 1.6381336552216637
Energy: 0.7850285102260007
Energy: 1.0365543701848383
Energy: 0.7869530639579978
Energy: 1.6247813058264222
Energy: 0.7869530639569884
Energy: 0.8972846991864446
Energy: 0.7876394862965783
Energy: 1.627690025074411
Energy: 0.7876394862965783
Energy: 0.9007440734824247
Energy: 0.7870948929155406
Energy: 1.6245514601689905
Energy: 0.7870948929175593
Energy: 0.898533980037584
Energy: 0.7815548513472957
Energy: 1.6326731787475395
Energy: 0.7815548513472957
Energy: 0.92652988990663
Energy: 0.7896937388924843
Energy: 1.7649899637988178
Energy: 0.7896937388934937
Energy: 1.1245090178667254
Energy: 0.7779690651153199
Energy: 1.6230625893167014
Energy: 0.7779690651143105
Energy: 1.1223309203300154
Energy: 0.7880808415201506
Energy: 1.7092646789139558
Energy: 0.7880808415201506
Energy: 1.244138000289226
Energy: 0.7816572766924432
Energy: 1.7103446477440825
Energy: 0.7816572766924432
Energy: 1.1201786164733751
Energy: 0.8815341474417866
Energy: 1.2327144428614083
Energy: 0.8815341474427959
Energy: 1.4575743918679076
Energy: 0.8772339199262342
Energy: 1.3468459897146254
Energy: 0.8772339199262342
Energy: 1.638691351576635
Energy: 0.8778313601253597
Energy: 1.3364773407703479
Energy: 0.8778313601243504
Energy: 1.6314666540161062
Energy: 0.798915576972645
Energy: 1.0222839281958191
Energy: 0.7989155769736545
Energy: 1.6375960712545288
Energy: 0.7882399140159619
Energy: 0.8966621945721781
Energy: 0.7882399140159619
Energy: 1.7155409097007566
Energy: 0.7937115410383909
Energy: 1.0185929846036756
Energy: 0.7937115410383909
Energy: 1.6298777193157767
Energy: 0.7982336607754771
Energy: 0.7899198629457514
Energy: 0.7982336607754771
Energy: 1.6343686856527675
Energy: 0.789797883399701
Energy: 0.7911088382280063
Energy: 0.789797883399701
Energy: 1.70337546870953
Energy: 0.8006171185196814
Energy: 0.8046385236332889
Energy: 0.8006171185186721

minimum gb energy = 0.7779690651143105 eV
minimum distance =  2.26992089725465 Angstroms
sigma value = 41


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

Energy: 1.9442417713632094
Energy: 0.7143451705486475
Energy: 0.7135541897140414
Energy: 0.7295629514743087
Energy: 1.7436009150309146
Energy: 0.7066866225578184
Energy: 0.8901182276772167
Energy: 0.7066866225578184
Energy: 1.7457655937436973
Energy: 0.7047021918845817
Energy: 0.8952532818787945
Energy: 0.7047021918837542
Energy: 1.4957728958618461
Energy: 0.7125096764642892
Energy: 1.0849288164364015
Energy: 0.7125096764626343
Energy: 1.5890602164865386
Energy: 0.7011106594585514
Energy: 1.2567302396446138
Energy: 0.7011106594610341
Energy: 1.4340407792431047
Energy: 1.0074030587621958
Energy: 1.2525930095379545
Energy: 1.0074030587621958
Energy: 1.4395550127913148
Energy: 0.7804958282760533
Energy: 1.4328450659816194
Energy: 0.7804958282760533
Energy: 1.260206788293215
Energy: 0.7862944745182734
Energy: 1.2816955559452123
Energy: 0.7862944745182734
Energy: 1.0768806225655918
Energy: 0.7041999844057233
Energy: 1.5890855864252604
Energy: 0.704199984392483
Energy: 1.0744697052639698
Energy: 0.7013476149949351
Energy: 1.5938407517124067
Energy: 0.7013476149941076
Energy: 0.9059287744509917
Energy: 0.7167538382126294
Energy: 1.718404727988217
Energy: 0.7167538382084918
Energy: 0.8862443091744696
Energy: 0.7024154259139087
Energy: 1.7452625644601147
Energy: 0.7024154259139087
Energy: 0.891712432052239
Energy: 0.7063781550417174
Energy: 1.7450371463777883
Energy: 0.7063781550417174
Energy: 0.7200944793543204
Energy: 0.7129568552721025
Energy: 1.6393855622655735
Energy: 0.7129568552737575
Energy: 0.7040420572558452
Energy: 0.7046507363790286
Energy: 1.7416681765017843
Energy: 0.704650736376546
Energy: 0.7098623737681403
Energy: 0.7050527934277088
Energy: 1.7492700236375311
Energy: 0.7050527934277088
Energy: 0.8946093420617156
Energy: 0.7088359270736176
Energy: 1.755298648896447
Energy: 0.7088359270744452
Energy: 0.8855821826705396
Energy: 0.7023565927077174
Energy: 1.7402999732783972
Energy: 0.7023565927060624
Energy: 0.8953491749686033
Energy: 0.7076513390759793
Energy: 1.4347732617707756
Energy: 0.7076513390759793
Energy: 1.2518154663329313
Energy: 0.7064108691142831
Energy: 1.4326662933133418
Energy: 0.7064108691142831
Energy: 1.2826401803283358
Energy: 0.7026567077065805
Energy: 1.5838251281269986
Energy: 0.7026567077256134
Energy: 1.2530942201589756
Energy: 0.7792635923792379
Energy: 1.4410365687138273
Energy: 0.7792635923742729
Energy: 1.5901442838823525
Energy: 0.7764975147091685
Energy: 1.4306294651379474
Energy: 0.7764975147075135
Energy: 1.2825615816484701
Energy: 0.7818079790650029
Energy: 1.251857763285981
Energy: 0.7818079790633478
Energy: 1.5847350353408822
Energy: 0.7022414545214829
Energy: 1.0705300730949918
Energy: 0.7022414545198278
Energy: 1.591132395013401
Energy: 0.7056497160565615
Energy: 1.2491179883849426
Energy: 0.7056497160549065
Energy: 1.5967419315554072
Energy: 0.7089158324567875
Energy: 0.8965907734054445
Energy: 0.7089158324551325
Energy: 1.7397887065948
Energy: 0.702762083955221
Energy: 0.8845322033639071
Energy: 0.7027620839543934
Energy: 1.5938446117391307
Energy: 0.7083564429408877
Energy: 0.8927116407693532
Energy: 0.7083564429408877
Energy: 1.5896315460938073
Energy: 0.7118696398435793
Energy: 0.7157183097833663
Energy: 0.7118696398427519
Energy: 1.741797842253305
Energy: 0.7030663342934625
Energy: 0.7036540206620888
Energy: 0.7030663342934625
Energy: 1.7342107624300158
Energy: 0.7121328341728471
Energy: 0.7188109365484031
Energy: 0.7121328341620893

minimum gb energy = 0.7011106594585514 eV
minimum distance =  2.26716332831691 Angstroms
sigma value = 15


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

Energy: 1.6766849866251123
Energy: 0.6690023903400198
Energy: 0.9983676749510855
Energy: 0.6654924360763511
Energy: 1.8255599341933062
Energy: 0.6463701314863917
Energy: 0.8005603304036956
Energy: 0.6463701314849897
Energy: 1.8256398026864455
Energy: 0.646511017801593
Energy: 0.8047126741055729
Energy: 0.646511017802294
Energy: 1.5741513994908187
Energy: 0.652440431838312
Energy: 1.1234336549222126
Energy: 0.6524404318397141
Energy: 1.6932708592158079
Energy: 0.6430556926573485
Energy: 1.1197268071782975
Energy: 0.6430556926587506
Energy: 1.5653748078414487
Energy: 0.643468612460146
Energy: 1.1143641041067744
Energy: 0.643468612460146
Energy: 1.2799287189277482
Energy: 0.6519912828202727
Energy: 1.4154443699960408
Energy: 0.6519912828265819
Energy: 1.4241832510865442
Energy: 0.712538835433869
Energy: 1.1284040325759348
Energy: 0.7125388354247556
Energy: 1.2798407834614665
Energy: 0.7064126564910467
Energy: 1.4194024308680788
Energy: 0.7064126564889435
Energy: 1.2774309869289426
Energy: 0.708725982211805
Energy: 1.5626396809071632
Energy: 0.7087259821332901
Energy: 1.1241800239692294
Energy: 0.6507357965686212
Energy: 1.4915765696489656
Energy: 0.6507357965720627
Energy: 0.9530594049740728
Energy: 0.6419822916404138
Energy: 1.6920734894313738
Energy: 0.6419822920713538
Energy: 1.1160434060688635
Energy: 0.6452813175432113
Energy: 1.6944712241516986
Energy: 0.6452813175446134
Energy: 0.8143792023949438
Energy: 0.6522970853343524
Energy: 1.489777394524905
Energy: 0.6522970853336513
Energy: 0.8037752541344584
Energy: 0.6444853586201085
Energy: 1.8206064996947555
Energy: 0.6444853586453456
Energy: 0.8073053427582206
Energy: 0.6555315596834462
Energy: 1.6980764287360806
Energy: 0.6555315596827451
Energy: 0.6578376007841436
Energy: 0.6540668415055922
Energy: 1.7018781181025902
Energy: 0.6540668415062932
Energy: 0.6439260781631907
Energy: 0.6441920788370673
Energy: 1.8190516945988613
Energy: 0.6441920788391704
Energy: 0.6545692398033812
Energy: 0.6495038685192065
Energy: 1.5672175605554544
Energy: 0.6495038685171034
Energy: 0.805637421936241
Energy: 0.6516231843127019
Energy: 1.8304939742101094
Energy: 0.651623184314805
Energy: 0.7963422055978273
Energy: 0.6439168835873973
Energy: 1.8198319761760053
Energy: 0.6439168835859953
Energy: 0.8128021315066587
Energy: 0.6524622305963653
Energy: 1.5713568189419491
Energy: 0.6524622426262309
Energy: 1.1148774923355025
Energy: 0.6464649051691539
Energy: 1.5609167870294667
Energy: 0.6464649051698549
Energy: 1.1320233291200292
Energy: 0.6421112986777804
Energy: 1.6909034974272714
Energy: 0.6421112986763785
Energy: 1.124071850654617
Energy: 0.6496543654338529
Energy: 1.3053248819157774
Energy: 0.6496543654345538
Energy: 1.4238316269392126
Energy: 0.70684547687723
Energy: 1.5684765234262659
Energy: 0.7068454768800342
Energy: 1.1179541364556491
Energy: 0.7070219098229924
Energy: 1.4200340228540254
Energy: 0.7070219098229924
Energy: 1.4215159942900961
Energy: 0.7122054189473324
Energy: 1.3071703504406291
Energy: 0.7122054189508374
Energy: 1.4270410114397323
Energy: 0.6511780344847986
Energy: 1.4172577694883794
Energy: 0.651178034524056
Energy: 1.4225206974366431
Energy: 0.6434164254903538
Energy: 1.1146337507634854
Energy: 0.6434164254889518
Energy: 1.6910426917175143
Energy: 0.6433415734810976
Energy: 0.9531419349560437
Energy: 0.6433415734832006
Energy: 1.4423155847438986
Energy: 0.6551379855664434
Energy: 1.1217548818296292
Energy: 0.6551379855685465
Energy: 1.6942916925397948
Energy: 0.6462504583655136
Energy: 0.8029642533109058
Energy: 0.6462504583641115
Energy: 1.8227557296074657
Energy: 0.6457369393321682
Energy: 0.8021370957395522
Energy: 0.6457369393321682
Energy: 1.8683807715275378
Energy: 0.6562819456627449
Energy: 0.6640524686043323
Energy: 0.6562819444834276
Energy: 1.8240149067365652
Energy: 0.6474944810918124
Energy: 0.6503083664361885
Energy: 0.6474944810939154
Energy: 1.8233374958627127
Energy: 0.6497749843707572
Energy: 0.6519997544977868
Energy: 0.6497749843707572

minimum gb energy = 0.6419822916404138 eV
minimum distance =  2.2718726026251 Angstroms
sigma value = 85


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

Energy: 1.8804961319097413
Energy: 0.5773990905941023
Energy: 0.5767163553677778
Energy: 0.6133357707902296
Energy: 1.865524477138585
Energy: 0.5786421413406937
Energy: 0.7179544279871456
Energy: 0.5786421413394778
Energy: 1.693040106730249
Energy: 0.5780886128089998
Energy: 0.7177128903645179
Energy: 0.5780886128083917
Energy: 1.4495281862599754
Energy: 0.5766246011252825
Energy: 0.9977580376931726
Energy: 0.5766246011240664
Energy: 1.7504371804857664
Energy: 0.575015596601977
Energy: 0.998394031439518
Energy: 0.5750155966007611
Energy: 1.4560696187178104
Energy: 0.5767333624894777
Energy: 0.999348549520335
Energy: 0.5767333624906936
Energy: 1.450911588006126
Energy: 0.5786495952360846
Energy: 1.2693564277124116
Energy: 0.5786495952391246
Energy: 1.5192137508684558
Energy: 0.575498040279386
Energy: 1.0715239499631142
Energy: 0.575498040278778
Energy: 1.4534179121522701
Energy: 0.5764733438689013
Energy: 1.2679045285784183
Energy: 0.5764733438810614
Energy: 1.4615371292479187
Energy: 0.689312443312639
Energy: 1.513550084102753
Energy: 0.689312443312639
Energy: 1.27217013207832
Energy: 0.5765996858587648
Energy: 1.3904124355944003
Energy: 0.5765996818337404
Energy: 1.2088486987298483
Energy: 0.5742623682913263
Energy: 1.5131817397550504
Energy: 0.5742623683089582
Energy: 1.2690894026714927
Energy: 0.5749008481816875
Energy: 1.5761782257633192
Energy: 0.5749008481822956
Energy: 1.0009416026875047
Energy: 0.5802346639583599
Energy: 1.3870122365072668
Energy: 0.5802346639571438
Energy: 0.9182713680186363
Energy: 0.5741541908567189
Energy: 1.74391297651595
Energy: 0.5741541908567189
Energy: 0.9953772290642984
Energy: 0.5786265563979399
Energy: 1.5788287196154356
Energy: 0.578626556397332
Energy: 0.7266405869894926
Energy: 0.5767884240163815
Energy: 1.5701008472607296
Energy: 0.5767884240175976
Energy: 0.7190427406198424
Energy: 0.5753767345620115
Energy: 1.8019854797497181
Energy: 0.5753767345620115
Energy: 0.7290369601759694
Energy: 0.5745222164274458
Energy: 1.7992519032738246
Energy: 0.5745222128977493
Energy: 0.6543912299570105
Energy: 0.575577736637612
Energy: 1.7981351391734162
Energy: 0.575577736637004
Energy: 0.6404085901398391
Energy: 0.5720895635037853
Energy: 1.856978219581522
Energy: 0.5720895635050012
Energy: 0.6429577759119716
Energy: 0.5726837965743475
Energy: 1.6289762224160798
Energy: 0.5726837965743475
Energy: 0.7840460723959575
Energy: 0.5760222865466145
Energy: 1.8539421433155907
Energy: 0.5760222865453984
Energy: 0.7793815559638332
Energy: 0.5745578922583015
Energy: 1.8599675407528595
Energy: 0.5745578922570855
Energy: 0.7786429726208256
Energy: 0.5727800659061717
Energy: 1.5464043238969167
Energy: 0.5727800659122518
Energy: 1.0093985210993088
Energy: 0.5750634628675546
Energy: 1.6994448345952928
Energy: 0.5750634628675546
Energy: 1.009864256924437
Energy: 0.5738807754655437
Energy: 1.6922259518024403
Energy: 0.5738807754649359
Energy: 1.145577539584008
Energy: 0.5810232599210726
Energy: 1.5520708699835177
Energy: 0.5810232599216806
Energy: 1.279867364766035
Energy: 0.5736355061448926
Energy: 1.6902673535090171
Energy: 0.573635506152161
Energy: 1.2760474659911634
Energy: 0.5739391759142899
Energy: 1.4561869528852251
Energy: 0.5739391757337964
Energy: 1.3991332188850232
Energy: 0.6900056801295024
Energy: 1.2212995836077514
Energy: 0.6900056801276783
Energy: 1.3299219329517322
Energy: 0.6894306765686223
Energy: 1.4619612588143183
Energy: 0.6894306765722702
Energy: 1.518697361581794
Energy: 0.7904364883907546
Energy: 1.204473686516954
Energy: 0.7904364883913626
Energy: 1.6406300786747057
Energy: 0.5763747099028727
Energy: 1.206605825476878
Energy: 0.5763747098785527
Energy: 1.3850753477187971
Energy: 0.5827935105118769
Energy: 0.9963360601886662
Energy: 0.582793510900832
Energy: 1.751306827171366
Energy: 0.5751253817079195
Energy: 1.0083483184099462
Energy: 0.5751253817091354
Energy: 1.804546490499908
Energy: 0.5769447023264256
Energy: 0.9952325559151248
Energy: 0.5769447023276416
Energy: 1.5711590791750583
Energy: 0.5771086022602473
Energy: 0.7141330339499375
Energy: 0.5771086022602473
Energy: 1.8638319369376821
Energy: 0.5751288141407804
Energy: 0.711778795675945
Energy: 0.5751288141401724
Energy: 1.798369995420231
Energy: 0.5819089432445568
Energy: 0.7226336641998184
Energy: 0.5819089432433407
Energy: 1.567234287057088
Energy: 0.5766026598859014
Energy: 0.5767111587551133
Energy: 0.5766026598877255
Energy: 1.8604355569934234
Energy: 0.5762592182696641
Energy: 0.5758700505303037
Energy: 0.576259218270272
Energy: 1.6859918498099904
Energy: 0.5854479558604111
Energy: 0.5774491759665555
Energy: 0.5854479558610189

minimum gb energy = 0.5720895635037853 eV
minimum distance =  2.25951310944525 Angstroms
sigma value = 113


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

Energy: 0.020465948678971058
Energy: 0.5089311499691571
Energy: 1.4236608503634547
Energy: 0.02135087962196314
Energy: 1.0520721445171617
Energy: 0.14072776104753298
Energy: 1.0443301504616356
Energy: 0.14072776104753298
Energy: 0.02138429034857635
Energy: 0.14090456041507313
Energy: 1.0427407258191181
Energy: 0.14090456041600796
Energy: 0.02258072596931321
Energy: 0.14345978925132852
Energy: 1.048516083322779
Energy: 0.1434597892517959
Energy: 1.043801658240625
Energy: 0.14220637137524697
Energy: 1.0476717276058667
Energy: 0.14220637137571435
Energy: 0.03249785454539849
Energy: 0.14078355623012934
Energy: 1.042808732654871
Energy: 0.14078355622966193

minimum gb energy = 0.020465948678971058 eV
minimum distance =  2.45546129093771 Angstroms
sigma value = 1