Model name: model_name=MEAM_LAMMPS_WangOhLee_2020_CuMo__MO_380272712420_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.540278409465544
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.015500081132557951
Energy: 0.3224305098907209
Energy: 0.3224305098907209
Energy: 0.015500081132557951
Energy: 0.3224305098907209
Energy: 0.3224305098907209
Energy: 0.015500081132557951
Energy: 0.3224305098907209
Energy: 0.3224305098907209
Energy: 0.015500081132557951
Energy: 0.3193325165071171
Energy: 0.01833853104253412
Energy: 0.31939136116636785
Energy: 0.3193325165071171
Energy: 0.01833853104253412
Energy: 0.31939136116636785
Energy: 0.3193325165071171
Energy: 0.01833853104253412
Energy: 0.31939136116636785
Energy: 0.3193325165071171
Energy: 1.0853450565094578
Energy: 0.48663790638230664
Energy: 0.4898336941145592
Energy: 0.8607331624084332
Energy: 0.17658414262710823
Energy: 0.7289365146135102
Energy: 0.8607684406131622
Energy: 0.015920606697067567
Energy: 0.7289365146120632
Energy: 0.8607746450473512
Energy: 0.3193325165071171
Energy: 0.31939136116636785
Energy: 0.01833853104253412
Energy: 0.3193325165071171
Energy: 0.31939136116636785
Energy: 0.01833853104253412
Energy: 0.3193325165071171
Energy: 0.31939136116636785
Energy: 0.01833853104253412
Energy: 0.3193325165071171
Energy: 0.015500081132557951
Energy: 0.3224305098907209
Energy: 0.3224305098907209
Energy: 0.015500081132557951
Energy: 0.3224305098907209
Energy: 0.3224305098907209
Energy: 0.015500081132557951
Energy: 0.3224305098907209
Energy: 0.3224305098907209
Energy: 0.015500081132557951
Energy: 0.3193325165085639
Energy: 0.01833853104253412
Energy: 0.31939136116636785
Energy: 0.3193325165085639
Energy: 0.01833853104253412
Energy: 0.31939136116636785
Energy: 0.3193325165071171
Energy: 0.01833853104253412
Energy: 0.31939136116636785
Energy: 0.3193325165071171
Energy: 0.8607321684803949
Energy: 0.7076897697382831
Energy: 0.48983369411600597
Energy: 0.8607386285882539
Energy: 0.33334856188528367
Energy: 0.7289365146135102
Energy: 0.8607601459582385
Energy: 0.015920606697067567
Energy: 0.7289365146120632
Energy: 0.8607753531784842

minimum gb energy = 0.015500081132557951 eV
minimum distance =  2.31385935671372 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

Energy: 0.9337580077671226
Energy: 1.068572042306423
Energy: 1.068804641355647
Energy: 0.9118931774994774
Energy: 1.0685720423067453
Energy: 1.0688046413552603
Energy: 0.9337580077685402
Energy: 1.0685720423078406
Energy: 1.0688046413545516
Energy: 0.9118931774990907
Energy: 1.2630950104690102
Energy: 0.8935746872198396
Energy: 1.0512915775804306
Energy: 1.2630950104679792
Energy: 0.8935746872205483
Energy: 1.0512915775815261
Energy: 1.2630950104729408
Energy: 0.8935746872191308
Energy: 1.0512915775811393
Energy: 1.263095010472232
Energy: 0.9968533981934318
Energy: 1.1395601328811054
Energy: 1.2026627307252213
Energy: 1.002808198189345
Energy: 1.1395601328811054
Energy: 1.202662730726317
Energy: 0.9968533981930452
Energy: 1.1395601328786569
Energy: 1.2026627307291522
Energy: 1.002808198189345
Energy: 1.0704882978415713
Energy: 1.2062015275612699
Energy: 0.8326552088008025
Energy: 1.0704882978408623
Energy: 1.2062015275612699
Energy: 0.8326552087997714
Energy: 1.07048829784228
Energy: 1.2062015275633964
Energy: 0.8326552088004803
Energy: 1.0704882978436976
Energy: 0.7999032651249133
Energy: 1.166704748598896
Energy: 1.164026784349431
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Energy: 0.8376267220328681
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Energy: 1.2011741560955607
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Energy: 1.044835341773096
Energy: 0.8874620176976016
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Energy: 1.0448353417741914
Energy: 0.8874620177000502
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Energy: 0.8855546425315429
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Energy: 1.0690735397475313
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Energy: 1.048603389964504
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Energy: 1.0668681823001618
Energy: 0.8328110450875698
Energy: 1.0650322439880406
Energy: 1.066868182299453
Energy: 0.8328110450882786
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Energy: 0.8328110450882786
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Energy: 1.047488073926748
Energy: 1.1101237886017836
Energy: 0.8934799637152198
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Energy: 0.8935440722249375
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Energy: 1.1101237886028792
Energy: 0.8934799637163151
Energy: 1.0474880739274568
Energy: 0.914613605014178
Energy: 0.9933661116181357
Energy: 1.2900868760503097
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Energy: 1.2900868760510185
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Energy: 0.9308340663382024
Energy: 1.1694406135503086
Energy: 1.0699699239835496
Energy: 0.9077195554472974
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Energy: 0.9308340663385889
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Energy: 0.8874632628856625
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Energy: 1.0467121723246882
Energy: 1.0477689585765093
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Energy: 1.0467121723232704
Energy: 1.0477689585800534
Energy: 1.0696247860403627
Energy: 1.2998997816394828
Energy: 0.9957951000303421
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Energy: 1.2998997816401916
Energy: 0.9957951000286023
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Energy: 1.2998997816384517
Energy: 0.9957951000307288
Energy: 1.0696247860421024
Energy: 1.1230443436435322
Energy: 0.897340012252853
Energy: 0.8365162483071387
Energy: 1.1230443436438544
Energy: 0.8973400122525308
Energy: 0.8365162483106827
Energy: 1.1230443436438544
Energy: 0.897340012251113
Energy: 0.836516248311327
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Energy: 0.7959534065830403
Energy: 1.2704792853039752
Energy: 1.1706889033455534
Energy: 0.795953406583749
Energy: 1.2704792853036533
Energy: 1.1706889033452312
Energy: 0.7959534065858755
Energy: 1.2704792853039752
Energy: 1.1706889033452312
Energy: 0.7959534065848445
Energy: 1.072168713663634
Energy: 0.8331109815719123
Energy: 1.0785264722370262
Energy: 1.072168713666147
Energy: 0.8331109815719123
Energy: 1.078526472238444
Energy: 1.0721687136654383
Energy: 0.8331109815719123
Energy: 1.0785264722377352
Energy: 1.0721687136657605
Energy: 0.9011105234237258
Energy: 1.3751130355948906
Energy: 1.0282979601983315
Energy: 0.9011105234247568
Energy: 1.3751130355938597
Energy: 1.0282979601976228
Energy: 0.9011105234244347
Energy: 1.3751130355931507
Energy: 1.0282979601951097
Energy: 0.9011105234230171
Energy: 0.9056410403385619
Energy: 1.0625506593924245
Energy: 0.8894242998244536
Energy: 0.9056410403399796
Energy: 1.0625506593910068
Energy: 0.8894604966434871
Energy: 0.905641040338884
Energy: 1.0625506593906846
Energy: 0.8894242998233581
Energy: 0.9056410403403018
Energy: 0.8831394916820423
Energy: 1.0685720423057143
Energy: 1.0688046413552603
Energy: 0.8834918271548358
Energy: 1.0685720423071317
Energy: 1.068804641355969
Energy: 0.8831394916799158
Energy: 1.0685720423060365
Energy: 1.068804641355647
Energy: 0.8834918271569623
Energy: 1.2630950104736496
Energy: 0.8935746872187441
Energy: 1.051291577582235
Energy: 1.2630950104736496
Energy: 0.8935746872205483
Energy: 1.0512915775818483
Energy: 1.2630950104750673
Energy: 0.8935746872211928
Energy: 1.051291577582235
Energy: 1.2630950104708145
Energy: 1.0550062594387162
Energy: 1.139560132881492
Energy: 1.2026627307287654
Energy: 1.0565637858695078
Energy: 1.1395601328803966
Energy: 1.2026627307294744
Energy: 1.055006259437685
Energy: 1.1395601328786569
Energy: 1.2026627307294744
Energy: 1.05656378586809
Energy: 1.07048829784228
Energy: 1.2062015275609477
Energy: 0.8326552088008025
Energy: 1.0704882978411843
Energy: 1.2062015275616564
Energy: 0.8326552088004803
Energy: 1.07048829784228
Energy: 1.2062015275641051
Energy: 0.8326552088004803
Energy: 1.070488297842602

minimum gb energy = 0.7959534065830403 eV
minimum distance =  2.27334035323579 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 1.0568907529684584
Energy: 0.9197786170009251
Energy: 0.9180136495285394
Energy: 1.0119130814017114
Energy: 0.9197786169991957
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Energy: 1.0568907529684584
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Energy: 1.123587871712482
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Energy: 1.115281678633319
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Energy: 1.063133513022894
Energy: 1.0888399551207752
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minimum gb energy = 0.901964264740084 eV
minimum distance =  2.2671562106586 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 1.148586229437618
Energy: 1.0861322937345015
Energy: 1.0708247786013214
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Energy: 1.0568938298056483
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Energy: 1.015694775030719
Energy: 1.0259032187825714
Energy: 1.070824778601144
Energy: 1.0200282872184507
Energy: 1.0157948855743222
Energy: 1.1644400796468353
Energy: 1.0741111944559911
Energy: 1.17380307640769
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Energy: 1.1644400796474028
Energy: 1.0741111944552106
Energy: 1.1738030764065197
Energy: 1.1517716321210463
Energy: 1.240510299994296
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Energy: 1.0335475407043397
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Energy: 1.017416030291283
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Energy: 1.1157558025548624
Energy: 1.033547540704517
Energy: 1.2232334027089504
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Energy: 0.9731449272862193
Energy: 1.029566880098418
Energy: 1.0443879414417463
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Energy: 1.1186471581350128
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Energy: 0.9770781826556956
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Energy: 1.1303231517244574
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Energy: 1.2222437218199882
Energy: 1.1303231517242447
Energy: 0.9771754146368934
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Energy: 0.9759188024694447
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Energy: 1.2200164539210736
Energy: 0.9759188024676712
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Energy: 1.220016453921854
Energy: 0.9759188024694447
Energy: 1.1181604884805352
Energy: 1.2200164539206837
Energy: 1.1149252152511122
Energy: 1.0618392834129275
Energy: 1.1077284775972194
Energy: 1.1100010369283735
Energy: 1.0618392834142754
Energy: 1.1067469403035584
Energy: 1.0929724825512162
Energy: 1.0618392834137078
Energy: 1.0665070834780241
Energy: 1.1048966068321335
Energy: 1.0370307667084175
Energy: 1.0345252259929887
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Energy: 1.036924914562458
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Energy: 1.0345252259922084
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Energy: 1.075871157954254
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Energy: 1.0632683549150548
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Energy: 1.075871157954857
Energy: 1.0632683549142743
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Energy: 1.0953561337853297
Energy: 1.0936761026912731
Energy: 1.1459746802582043
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Energy: 1.0936761026920536
Energy: 1.1459746802587716
Energy: 1.095356133785897
Energy: 1.093676102693224
Energy: 1.145974680259162
Energy: 1.0953561337865
Energy: 1.0842073708095887
Energy: 1.0409173705039556
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Energy: 1.040917370505729
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Energy: 1.12928933880816
Energy: 1.040917370505339
Energy: 1.0776454994459896
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Energy: 1.0133783479210072
Energy: 1.127532693213073
Energy: 1.1467276510989237
Energy: 1.013378347920617
Energy: 1.1275326932128602
Energy: 1.1467276510985336
Energy: 1.0133783479211846
Energy: 1.1275326932120797
Energy: 1.0893397118064854
Energy: 1.063024455785281
Energy: 1.1014724184297235
Energy: 1.0893397118080463
Energy: 1.063024455785671
Energy: 1.1014724184297235
Energy: 1.0893397118070887
Energy: 1.0630244557854938
Energy: 1.1014724184285531
Energy: 1.0893397118063082
Energy: 1.0478925734936506
Energy: 1.0352226852222806
Energy: 1.0363150687168594
Energy: 1.0478925734936506
Energy: 1.0352226852224933
Energy: 1.036315068716682
Energy: 1.0478925734946438
Energy: 1.0352226852228834
Energy: 1.0363150687155116
Energy: 1.0478925734946438
Energy: 1.102446699815004
Energy: 1.0817022304118327
Energy: 1.044264173496768
Energy: 1.1024466998146136
Energy: 1.0817553781848535
Energy: 1.0442641734975484
Energy: 1.1024466998128402
Energy: 1.0817022304126132
Energy: 1.044264173497158
Energy: 1.1024466998136204
Energy: 1.2226652185348268
Energy: 1.1316339848325452
Energy: 1.209169159800624
Energy: 1.2226652185352174
Energy: 1.1316412918245804
Energy: 1.2091691598014045
Energy: 1.2226652185346496
Energy: 1.1316339848329353
Energy: 1.2091691598010141
Energy: 1.2226652185352174
Energy: 1.0656037612647427
Energy: 1.0473700173890022
Energy: 0.9749940442633356
Energy: 1.0656037612643527
Energy: 1.0473700173893923
Energy: 0.974994044261172
Energy: 1.0656037612639622
Energy: 1.0473700173880442
Energy: 0.9749940442619522
Energy: 1.0656037612651332
Energy: 1.091519323153551
Energy: 1.1187882827781703
Energy: 1.123044417150974
Energy: 1.0915193231533737
Energy: 1.1189597539743141
Energy: 1.1230444171498035
Energy: 1.0915193231549343
Energy: 1.1187882827772124
Energy: 1.1230444171492002
Energy: 1.0915193231553244
Energy: 1.1967877774089186
Energy: 1.0711026649819793
Energy: 1.1416895304067523
Energy: 1.196787777407748
Energy: 1.0395424444575423
Energy: 1.1416895304067523
Energy: 1.1967877774073579
Energy: 1.071102664982937
Energy: 1.1416895304067523
Energy: 1.1967877774081384
Energy: 1.0708305743155524
Energy: 1.01380727890139
Energy: 1.1394529584714335
Energy: 1.0708305743157651
Energy: 1.013919654932063
Energy: 1.1394529584692696
Energy: 1.0708305743149846
Energy: 1.0138072789021706
Energy: 1.1394529584698725
Energy: 1.0708305743151618

minimum gb energy = 0.9674195523376499 eV
minimum distance =  2.25719024081123 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.9456013331643522
Energy: 1.0081763477413463
Energy: 1.0100498954928208
Energy: 0.9121846027502385
Energy: 1.0081763477413463
Energy: 1.0100498954934904
Energy: 0.9456013331643522
Energy: 1.0081763477400065
Energy: 1.0100498954928208
Energy: 0.9121846027502385
Energy: 1.065478724647657
Energy: 1.0725200980310592
Energy: 1.071397878107995
Energy: 1.0654787246483268
Energy: 1.0725200980317287
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Energy: 1.0654787246483268
Energy: 1.0725200980310592
Energy: 1.0713978781046463
Energy: 1.0654787246483268
Energy: 0.9909851833592054
Energy: 1.1756974184791982
Energy: 1.0869944781418284
Energy: 0.9909851833592054
Energy: 1.1756974184791982
Energy: 0.9091070718460218
Energy: 0.9909851833585356
Energy: 1.1756974184791982
Energy: 1.0869944781418284
Energy: 0.9909851833612148
Energy: 1.0646388893913685
Energy: 1.1313100032190198
Energy: 0.9219472047372849
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Energy: 1.0574747073872348
Energy: 1.0390637763382364
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Energy: 1.0574747073865651
Energy: 1.0390637763389063
Energy: 1.0126714177039609
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Energy: 1.039063776339576
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Energy: 1.0574747073879047
Energy: 0.9085171908872653
Energy: 1.1406609578163704
Energy: 1.0724125401841742
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Energy: 1.0724125401835043
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Energy: 1.071279062980131
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Energy: 1.0712790629808007
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Energy: 1.1011365933480355
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Energy: 1.0709938736647822
Energy: 1.1011365933487052
Energy: 1.0266386807852002
Energy: 1.0746157685078956
Energy: 1.0846063369064545
Energy: 1.0266386807845302
Energy: 1.0746157685065558
Energy: 1.0845817105488498
Energy: 1.0266386807852002
Energy: 1.0746157685058861
Energy: 1.0846063369071242
Energy: 1.0266386807845302
Energy: 0.9564429415839334
Energy: 1.0737021584286623
Energy: 1.2115132880579573
Energy: 0.9215185777948637
Energy: 1.0737021584300022
Energy: 1.2115132880572874
Energy: 0.9564429415866126
Energy: 1.0737021584286623
Energy: 1.2115132880566175
Energy: 0.9215185778029011
Energy: 1.0589894073797979
Energy: 1.0143719264360997
Energy: 1.0859797942117522
Energy: 1.1531878540687037
Energy: 1.0143719264340905
Energy: 1.0465217312838795
Energy: 1.0589894073797979
Energy: 1.0143719264334206
Energy: 1.0859797942130915
Energy: 1.1531878540680338
Energy: 1.0909591148830309
Energy: 0.9220716429286239
Energy: 1.146426516655929
Energy: 1.0909591148823612
Energy: 0.9220716429272843
Energy: 1.1464265166565988
Energy: 1.0909591148816915
Energy: 0.9220716429272843
Energy: 1.1464265166565988
Energy: 1.0909591148816915
Energy: 1.0300537482962655
Energy: 1.0402748422801629
Energy: 1.1357876445832873
Energy: 1.030053748295596
Energy: 1.0402748422794932
Energy: 1.1357876445826178
Energy: 1.030053748295596
Energy: 1.0402748422801629
Energy: 1.135787644581948
Energy: 1.0300537482969354
Energy: 1.0231865644009748
Energy: 1.0136412714810459
Energy: 0.9085126024362407
Energy: 1.0231865644009748
Energy: 1.0136412715975243
Energy: 0.9085126024355707
Energy: 1.0231865644009748
Energy: 1.013641271594845
Energy: 0.9085126024362407
Energy: 1.0231865644003049
Energy: 0.9121846027509081
Energy: 1.0081763477406764
Energy: 1.0100498954928208
Energy: 0.9121846027502385
Energy: 1.0081763477400065
Energy: 1.0100498954928208
Energy: 0.9121846027509081
Energy: 1.0081763477406764
Energy: 1.0100498954934904
Energy: 0.9121846027495687

minimum gb energy = 0.9085126024355707 eV
minimum distance =  2.34572094553441 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.91240276907372
Energy: 1.0121600307290968
Energy: 1.0279148497533166
Energy: 0.8846983650942833
Energy: 1.0121600307290968
Energy: 1.0279148497559152
Energy: 0.9124027690711214
Energy: 1.0121600307264984
Energy: 1.027914849758514
Energy: 0.8846983650942833
Energy: 1.0844327238492797
Energy: 0.8970156726650923
Energy: 1.0104786435407902
Energy: 1.0844327238466809
Energy: 0.8970156726624937
Energy: 1.010478643543389
Energy: 1.0844327238440823
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Energy: 1.0844327238440823
Energy: 0.8736866536229692
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Energy: 0.8721669180917129
Energy: 0.9471175424304754
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Energy: 0.8536485724383386
Energy: 0.910844960076922
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Energy: 0.8538259169354611
Energy: 0.9038682163722865
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Energy: 0.8390801116786102
Energy: 0.810742557998079
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Energy: 0.8107943448080459
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Energy: 0.8107425579928819
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Energy: 0.8789368936409407
Energy: 1.1553976627299853
Energy: 0.820020994737969
Energy: 0.878936893638342
Energy: 1.1553976627273868
Energy: 0.8201031415775173
Energy: 0.8789368936409407
Energy: 1.1553976627273868
Energy: 0.8200209947405676
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Energy: 1.0461656196561129
Energy: 0.9016726636547456
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Energy: 1.0461656196535143
Energy: 0.9016726636521469
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Energy: 0.940239067579127
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Energy: 1.0706632434973438
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Energy: 1.0706632434947452
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Energy: 0.8130018697999161
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Energy: 0.8789537409718452
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Energy: 1.0646105921802003
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Energy: 0.79008010326623
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Energy: 0.9122889350727895
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Energy: 0.8871204293530407
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Energy: 1.0344508312467706
Energy: 0.8204224001047867
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Energy: 1.04664798911154
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Energy: 0.7904475579606781
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Energy: 0.8615689975434729
Energy: 0.9693065388907365
Energy: 0.8763680878425888
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Energy: 0.9693065388881379
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Energy: 0.8615689975408743
Energy: 0.8109362561484639
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Energy: 0.8907597702014985
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Energy: 0.8907597702014985
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Energy: 1.0424833390491741
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Energy: 0.9171672734660596
Energy: 1.0424833390543715
Energy: 0.8906731160013882
Energy: 1.0745049279746375
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Energy: 1.0095919708438403
Energy: 1.074504927977236
Energy: 0.9124151681019138
Energy: 1.0095919708438403
Energy: 1.0745049279746375
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Energy: 1.0745049279746375
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Energy: 0.9824972383171549
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Energy: 0.9083428936347543
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Energy: 0.9352024978581525
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Energy: 0.9884630607705366
Energy: 0.9385622114038735
Energy: 1.0599973464235428
Energy: 0.9884630607705366
Energy: 0.9385622114012747
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Energy: 0.9884630607705366
Energy: 0.9385622114012747
Energy: 1.0599973464235428
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Energy: 0.8786292740620991
Energy: 0.8857208378140876
Energy: 0.9977082914620876
Energy: 0.8786292740646978
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Energy: 0.9977082914620876
Energy: 0.8786292740620991
Energy: 0.8857208378166864
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Energy: 0.8924286473472686
Energy: 0.9724794142013576
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Energy: 0.8924286473472686
Energy: 0.9702288022992916
Energy: 0.9452746051800714
Energy: 0.8924286473472686
Energy: 0.9724794142013576
Energy: 0.9452746051800714
Energy: 0.892428647349867
Energy: 0.8110302276144289
Energy: 0.8076581261740581
Energy: 0.812327810645631
Energy: 0.8110302276118302
Energy: 0.804536150001469
Energy: 0.8126922300379396
Energy: 0.8110302276144289
Energy: 0.8076581261740581
Energy: 0.8123278106768146
Energy: 0.8110302276118302
Energy: 0.9304444855897387
Energy: 0.813163216709103
Energy: 0.8153271896957089
Energy: 0.9304444855897387
Energy: 0.8131564393015613
Energy: 0.8153271896957089
Energy: 0.9304444855923373
Energy: 0.813163216709103
Energy: 0.8153271896957089
Energy: 0.9304444855923373
Energy: 1.15309514672356
Energy: 0.8388378324180359
Energy: 0.9874990818492518
Energy: 1.15309514672356
Energy: 0.838527966773882
Energy: 0.9874990818466534
Energy: 1.1530951467209611
Energy: 0.8388378324180359
Energy: 0.9874990818466534
Energy: 1.15309514672356
Energy: 1.0460037999323057
Energy: 0.9017775640757915
Energy: 0.7924132719319574
Energy: 1.0460037999323057
Energy: 0.9017775640731929
Energy: 0.792413271929359
Energy: 1.0460037999219112
Energy: 0.9017775640731929
Energy: 0.792413271929359
Energy: 1.0460037999452987

minimum gb energy = 0.7784423095822006 eV
minimum distance =  2.25256402881096 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

Energy: 0.6959672321137267
Energy: 0.3900386149860383
Energy: 0.9817986214461704
Energy: 0.4454113513594698
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Energy: 0.6457350757942624
Energy: 0.3833650111095109
Energy: 0.6989681404979279
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Energy: 0.6005513324492033
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Energy: 0.40801231329871684
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Energy: 0.615641018399871
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Energy: 0.39003861498665526
Energy: 0.9817986214467874
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Energy: 0.39098337511599773
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Energy: 1.0202574622766973
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Energy: 0.39128149380811167
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Energy: 0.39128149380687777
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Energy: 0.520089924347815
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Energy: 1.0202574622757716
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Energy: 0.3925792659104095
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Energy: 0.6414852611751498
Energy: 0.7397470708382499
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Energy: 0.7397470708382499
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Energy: 0.6411823407175963
Energy: 0.4120744536413455
Energy: 0.3835742341725339
Energy: 0.641182340716054
Energy: 0.4833531794698822
Energy: 0.38357423417376774
Energy: 0.6411823407179047
Energy: 0.4120744536413455
Energy: 0.38357423417315084
Energy: 0.6411823407179047
Energy: 0.6177924727797934
Energy: 0.5064459034556652
Energy: 0.38981369527931337
Energy: 0.5195664012691633
Energy: 0.5677431750979884
Energy: 0.38981369527931337
Energy: 0.6177924727819526
Energy: 0.5064459034550484
Energy: 0.38981369527838794
Energy: 0.5195664012685464
Energy: 0.41194166755505723
Energy: 0.4126386248419277
Energy: 0.38344934046879137
Energy: 0.48337738556377724
Energy: 0.4840002790435289
Energy: 0.3834493404706422
Energy: 0.41194166755289796
Energy: 0.4126386248419277
Energy: 0.38344934046817436
Energy: 0.4833773855640857
Energy: 0.6082243981793303
Energy: 0.6950449488361968
Energy: 0.4080123132980999
Energy: 0.615641018399871
Energy: 0.6950449488365052
Energy: 0.4080123132990253
Energy: 0.6082243981774795
Energy: 0.6950449488352715
Energy: 0.4080123132984083
Energy: 0.6156410183995625

minimum gb energy = 0.3833650111085854 eV
minimum distance =  2.3963863538493 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.7739337927794953
Energy: 0.8554892153059765
Energy: 0.8325480880402063
Energy: 0.7572799698544775
Energy: 0.8554892153059765
Energy: 0.8325480880368193
Energy: 0.7739337927794953
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Energy: 0.8325480880385129
Energy: 0.7572799698544775
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Energy: 0.8210730391540549
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Energy: 0.9052255631836396
Energy: 0.6922845883381334
Energy: 0.8505271029710105
Energy: 0.9174220649729454
Energy: 0.6922845883364399
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Energy: 0.8281333999432796
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Energy: 0.9901139097576825
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Energy: 0.9656261970610581
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Energy: 0.9532512657795159
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Energy: 0.8495859638360512
Energy: 0.9477187615087543
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Energy: 0.8264850740431939
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Energy: 0.8259185825356608
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Energy: 0.7428363948017308
Energy: 1.0025984415674358
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Energy: 0.8252126232122547
Energy: 0.9410315643442895
Energy: 0.7586930596953576
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Energy: 0.758693059697051
Energy: 0.8252126232105612
Energy: 0.9410315643459829
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Energy: 0.8950085152278228
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minimum gb energy = 0.6922845883364399 eV
minimum distance =  2.24667886109463 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

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Energy: 0.863392983310467
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Energy: 1.113897514942304
Energy: 0.863392983310467
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Energy: 1.113897514942304
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Energy: 1.0565115478659324
Energy: 1.2143099393920358
Energy: 1.1183851086566672
Energy: 1.056511547867053
Energy: 1.2143099393920358
Energy: 1.1183851086566672

minimum gb energy = 0.863392983310467 eV
minimum distance =  2.32420982741506 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

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Energy: 1.3010239620560464
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minimum gb energy = 0.9971718936145805 eV
minimum distance =  2.2669844956132 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 1.155185060710897
Energy: 1.3060514254568723
Energy: 1.1298198917606912
Energy: 1.1551850607106442
Energy: 1.0630937324273115
Energy: 1.2541279866902297
Energy: 1.0850225391242225
Energy: 1.0630937324273115
Energy: 1.2541279866904829
Energy: 1.0850225391244757
Energy: 1.0630937324268053
Energy: 1.2541279866904829
Energy: 1.0850225391244757
Energy: 1.0630937324268053
Energy: 1.0184801257002403
Energy: 1.0521203600540856
Energy: 1.0844667993269896
Energy: 1.0184801256995037
Energy: 1.0521203600553286
Energy: 1.0844667993269896
Energy: 1.01848012570001
Energy: 1.0521203600548223
Energy: 1.0844667993267365
Energy: 1.0184801257010228
Energy: 1.0753785930071
Energy: 1.1012412609580426
Energy: 1.1274426862383302
Energy: 1.0753785930055813
Energy: 1.1012412609590556
Energy: 1.1274426862385833
Energy: 1.0753785930071
Energy: 1.1012412609400923
Energy: 1.1274426862385833
Energy: 1.0753785930076065
Energy: 1.1451424617984136
Energy: 1.2787407072699657
Energy: 1.2783903932500007
Energy: 1.1451424617984136
Energy: 1.2787407072702188
Energy: 1.278390393250507
Energy: 1.1451424617981607
Energy: 1.2787407072704722
Energy: 1.2783903932500007
Energy: 1.1451424617981607
Energy: 1.0749184052833505
Energy: 1.1274068487547428
Energy: 1.1010558455536554
Energy: 1.0749184052836036
Energy: 1.1274068487544895
Energy: 1.1010558455539086
Energy: 1.0749184052830973
Energy: 1.127406848754996
Energy: 1.1010558455539086
Energy: 1.074918405282844
Energy: 1.0183997520727586
Energy: 1.08447431216171
Energy: 1.0521494610225477
Energy: 1.0183997520724826
Energy: 1.08447431216171
Energy: 1.0521494610228237
Energy: 1.0183997520727586
Energy: 1.0844743121614573
Energy: 1.0521494610235602
Energy: 1.0183997520724826
Energy: 1.0633766375136706
Energy: 1.085365963844746
Energy: 1.2539396608210116
Energy: 1.063376637514453
Energy: 1.0853659638444928
Energy: 1.253939660821265
Energy: 1.0633766375141769
Energy: 1.0853659638444928
Energy: 1.2539396608210116
Energy: 1.063376637514453
Energy: 1.1554045376201119
Energy: 1.1290505048267396
Energy: 1.305993404915459
Energy: 1.1554045376201119
Energy: 1.1290505048269928
Energy: 1.305993404915459
Energy: 1.155404537620871
Energy: 1.1290505048277522
Energy: 1.305993404915459
Energy: 1.1554045376206181
Energy: 1.28960779547898
Energy: 1.10243975870418
Energy: 1.1382982198403127
Energy: 1.2896077954807519
Energy: 1.102439758703927
Energy: 1.1382982198403127
Energy: 1.289607795479233
Energy: 1.102439758703927
Energy: 1.1382982198398062
Energy: 1.2896077954784737
Energy: 1.1259842683621328
Energy: 1.2753073689433063
Energy: 1.3847796702430881
Energy: 1.125984268362386
Energy: 1.2753073689428003
Energy: 1.3847796702425819
Energy: 1.1259842683621328
Energy: 1.2753073689433063
Energy: 1.3847796702430881
Energy: 1.125984268362386
Energy: 1.0802722798201125
Energy: 0.9952325214235054
Energy: 0.9939670813711825
Energy: 1.0802722798198594
Energy: 0.9952325214237586
Energy: 0.993967081373461
Energy: 1.0802722798188467
Energy: 0.9952325214235054
Energy: 0.9939670813727014
Energy: 1.0802722798196063
Energy: 1.1258284414257562
Energy: 1.384640709240509
Energy: 1.275487644103047
Energy: 1.1258284414252502
Energy: 1.384640709240509
Energy: 1.2754876441025405
Energy: 1.1258284414247437
Energy: 1.384640709240509
Energy: 1.2754876441035532
Energy: 1.1258284414255033
Energy: 1.2897551910013105
Energy: 1.138721748392654
Energy: 1.1023504158417698
Energy: 1.2897551910010576
Energy: 1.138721748392654
Energy: 1.1023504158415167
Energy: 1.2897551910013105
Energy: 1.1387217483918946
Energy: 1.1023504158415167
Energy: 1.2897551910015639
Energy: 1.1551850607111505
Energy: 1.3060514254566191
Energy: 1.129819891760185
Energy: 1.155185060710897
Energy: 1.3060514254568723
Energy: 1.1298198917604378
Energy: 1.155185060710897
Energy: 1.3060514254571254
Energy: 1.129819891760185
Energy: 1.1551850607106442
Energy: 1.0630937324275875
Energy: 1.2541279866907362
Energy: 1.0850225391244757
Energy: 1.063093732426575
Energy: 1.2541279866899766
Energy: 1.085022539124729
Energy: 1.0630937324273115
Energy: 1.2541279866902297
Energy: 1.0850225391244757
Energy: 1.0630937324270813

minimum gb energy = 0.9939670813696637 eV
minimum distance =  2.26717298363032 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 0.9455303573212153
Energy: 0.9459746137175937
Energy: 0.9459427273363912
Energy: 0.9455303573216729
Energy: 0.9459746137175937
Energy: 0.9459427273363912
Energy: 0.945530357320758
Energy: 0.9459746137175937
Energy: 0.9459427273354762
Energy: 0.9455303573221305
Energy: 1.12697784003903
Energy: 0.9464193855378369
Energy: 1.1292889959856438
Energy: 1.12697784003903
Energy: 0.9464193855401245
Energy: 1.1292889959856438
Energy: 1.1269778400385728
Energy: 0.9464193855378369
Energy: 1.1292889959856438
Energy: 1.126977840038115
Energy: 0.9442635835121956
Energy: 0.9440338543965147
Energy: 1.1612185357638496
Energy: 0.9442635835135683
Energy: 0.9440338543965147
Energy: 1.1612185357652223
Energy: 0.944263583512653
Energy: 0.9440338543951421
Energy: 1.1612185357647649
Energy: 0.9442635835135683
Energy: 1.161755776571473
Energy: 0.943928456640793
Energy: 0.9435377526494654
Energy: 1.1617557765719306
Energy: 0.9439284566403353
Energy: 0.9435377526499228
Energy: 1.1617557765710156
Energy: 0.943928456640793
Energy: 0.9435377526508381
Energy: 1.161755776570558
Energy: 1.129965979822609
Energy: 0.9459349041245229
Energy: 1.1271520121515597
Energy: 1.1299659798230666
Energy: 0.9459349041240652
Energy: 1.127152012151102
Energy: 1.129965979822609
Energy: 0.9459349041245229
Energy: 1.127152012151102
Energy: 1.1299659798230666
Energy: 0.9459746137175937
Energy: 0.9459427273368486
Energy: 0.9455303573212153
Energy: 0.9459746137175937
Energy: 0.9459427273359335
Energy: 0.9455303573221305
Energy: 0.9459746137175937
Energy: 0.9459427273368486
Energy: 0.9455303573212153
Energy: 0.9459746137171361
Energy: 0.9464193855382944
Energy: 1.1292889959856438
Energy: 1.1269778400367425
Energy: 0.9464193855387518
Energy: 1.1292889959856438
Energy: 1.12697784003903
Energy: 0.9464193855401245
Energy: 1.1292889959861014
Energy: 1.1269778400394876
Energy: 0.9464193855382944
Energy: 0.9440338543965147
Energy: 1.1612185357647649
Energy: 0.9442635835121956
Energy: 0.9440338543960574
Energy: 1.1612185357638496
Energy: 0.9442635835135683
Energy: 0.9440338543965147
Energy: 1.1612185357652223
Energy: 0.944263583512653
Energy: 0.9440338543965147
Energy: 0.943928456640793
Energy: 0.9435377526503804
Energy: 1.1617557765728457
Energy: 0.9439284566403353
Energy: 0.9435377526494654
Energy: 1.1617557765719306
Energy: 0.9439284566403353
Energy: 0.9435377526508381
Energy: 1.161755776571473
Energy: 0.9439284566403353
Energy: 0.9459349041245229
Energy: 1.127152012151102
Energy: 1.129965979822609
Energy: 0.9459349041245229
Energy: 1.1271520121520173
Energy: 1.1299659798230666
Energy: 0.9459349041249802
Energy: 1.1271520121515597
Energy: 1.129965979822609
Energy: 0.9459349041249802
Energy: 0.9459427273354762
Energy: 0.9455303573216729
Energy: 0.9459746137180515
Energy: 0.9459427273354762
Energy: 0.945530357320758
Energy: 0.9459746137175937
Energy: 0.9459427273354762
Energy: 0.9455303573221305
Energy: 0.9459746137175937
Energy: 0.9459427273359335
Energy: 1.1292889959856438
Energy: 1.126977840038115
Energy: 0.9464193855382944
Energy: 1.1292889959861014
Energy: 1.1269778400385728
Energy: 0.9464193855392095
Energy: 1.1292889959856438
Energy: 1.1269778400399453
Energy: 0.9464193855382944
Energy: 1.1292889959856438
Energy: 1.16121853576568
Energy: 0.9442635835131107
Energy: 0.9440338543946847
Energy: 1.1612185357647649
Energy: 0.9442635835121956
Energy: 0.9440338543960574
Energy: 1.1612185357647649
Energy: 0.9442635835131107
Energy: 0.9440338543960574
Energy: 1.1612185357647649
Energy: 0.9435377526490077
Energy: 1.1617557765719306
Energy: 0.943928456640793
Energy: 0.9435377526503804
Energy: 1.161755776572388
Energy: 0.9439284566412505
Energy: 0.9435377526503804
Energy: 1.161755776572388
Energy: 0.9439284566412505
Energy: 0.9435377526503804
Energy: 1.127152012151102
Energy: 1.1299659798230666
Energy: 0.9459349041245229
Energy: 1.127152012151102
Energy: 1.129965979822609
Energy: 0.9459349041245229
Energy: 1.1271520121515597
Energy: 1.1299659798230666
Energy: 0.9459349041245229
Energy: 1.127152012151102
Energy: 0.9455303573212153
Energy: 0.9459746137175937
Energy: 0.9459427273354762
Energy: 0.9455303573216729
Energy: 0.9459746137175937
Energy: 0.9459427273368486
Energy: 0.945530357320758
Energy: 0.9459746137175937
Energy: 0.9459427273354762
Energy: 0.9455303573216729
Energy: 1.1269778400385728
Energy: 0.9464193855378369
Energy: 1.1292889959861014
Energy: 1.126977840038115
Energy: 0.9464193855401245
Energy: 1.1292889959856438
Energy: 1.126977840038115
Energy: 0.9464193855382944
Energy: 1.1292889959856438
Energy: 1.126977840038115
Energy: 0.944263583512653
Energy: 0.9440338543955996
Energy: 1.1612185357647649
Energy: 0.9442635835131107
Energy: 0.9440338543965147
Energy: 1.1612185357647649
Energy: 0.944263583512653
Energy: 0.9440338543974298
Energy: 1.1612185357652223
Energy: 0.9442635835131107
Energy: 1.161755776571473
Energy: 0.943928456640793
Energy: 0.9435377526499228
Energy: 1.161755776572388
Energy: 0.9439284566412505
Energy: 0.9435377526508381
Energy: 1.1617557765719306
Energy: 0.9439284566403353
Energy: 0.9435377526503804
Energy: 1.161755776570558
Energy: 1.129965979822609
Energy: 0.9459349041249802
Energy: 1.127152012151102
Energy: 1.1299659798230666
Energy: 0.9459349041245229
Energy: 1.1271520121506446
Energy: 1.129965979822609
Energy: 0.9459349041249802
Energy: 1.127152012151102
Energy: 1.1299659798230666
Energy: 0.9459746137175937
Energy: 0.9459427273359335
Energy: 0.945530357320758
Energy: 0.9459746137175937
Energy: 0.9459427273359335
Energy: 0.9455303573221305
Energy: 0.9459746137175937
Energy: 0.9459427273345609
Energy: 0.945530357320758
Energy: 0.9459746137175937
Energy: 0.9464193855401245
Energy: 1.1292889959861014
Energy: 1.1269778400385728
Energy: 0.9464193855378369
Energy: 1.1292889959856438
Energy: 1.12697784003903
Energy: 0.9464193855396669
Energy: 1.1292889959861014
Energy: 1.1269778400394876
Energy: 0.9464193855378369

minimum gb energy = 0.9435377526490077 eV
minimum distance =  2.33636921699311 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.0745457070598896
Energy: 1.2503954874275496
Energy: 1.3723286784028927
Energy: 1.0745457070598896
Energy: 1.2503954874296237
Energy: 1.3723286784028927
Energy: 1.0745457070598896
Energy: 1.2503954874275496
Energy: 1.3723286784028927
Energy: 1.0745457070598896
Energy: 1.0159989923350934
Energy: 1.0583134300201644
Energy: 1.1858825752648212
Energy: 1.0159989923703139
Energy: 1.0583134300201644
Energy: 1.185882575262747
Energy: 1.0159989923723876
Energy: 1.0583134300201644
Energy: 1.1858825752648212
Energy: 1.0159989923620178
Energy: 1.2004152367586778
Energy: 1.0591285789411928
Energy: 1.2724645439410902
Energy: 1.200415236760752
Energy: 1.0591285789411928
Energy: 1.2724645439410902
Energy: 1.2004152367586778
Energy: 1.0591285789411928
Energy: 1.2724645439410902
Energy: 1.2004152367586778
Energy: 1.0583963245730854
Energy: 1.061447959194221
Energy: 0.9905386612765115
Energy: 1.0583963245710115
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Energy: 1.0583963245730854
Energy: 1.061447959194221
Energy: 0.9905386612765115
Energy: 1.0583963245710115
Energy: 1.171137819124522
Energy: 1.06403155844531
Energy: 1.1699473858480791
Energy: 1.171137819124522
Energy: 1.064031558443236
Energy: 1.1699473858480791
Energy: 1.171137819124522
Energy: 1.06403155844531
Energy: 1.1699473858480791
Energy: 1.171137819124522
Energy: 1.088553564637731
Energy: 1.254376765622207
Energy: 0.9912348852976842
Energy: 1.088553564637731
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Energy: 0.9912348852976842
Energy: 1.0885535646356568
Energy: 1.254376765622207
Energy: 0.9912348852976842
Energy: 1.088553564637731
Energy: 1.0610390339592561
Energy: 1.0828047442588693
Energy: 1.0873779046458882
Energy: 1.0610390339592561
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Energy: 1.0610390339592561
Energy: 1.0828047442547213
Energy: 1.0873779046458882
Energy: 1.0610390339592561
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Energy: 1.2264224162900816
Energy: 1.1791475484119966
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Energy: 1.1791475484119966
Energy: 1.0087851641450873
Energy: 1.2264224162900816
Energy: 1.1791475484099225
Energy: 1.0087851641471615
Energy: 1.2829539574871516
Energy: 1.053991064302265
Energy: 1.0511126444563224
Energy: 1.2829539574850775
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Energy: 1.0511126444542485
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Energy: 1.053991064302265
Energy: 1.0511126444542485
Energy: 1.2829539574850775
Energy: 1.0061023663869963
Energy: 1.1063754166061528
Energy: 1.1168043237242904
Energy: 1.0061023663869963
Energy: 1.1063754166061528
Energy: 1.1168043237242904
Energy: 1.0061023663869963
Energy: 1.1063754166061528
Energy: 1.1168043237263645
Energy: 1.0061023663869963
Energy: 1.118965352145841
Energy: 0.9991626732626794
Energy: 1.0676881146414499
Energy: 1.1189653521479148
Energy: 0.9991626732626794
Energy: 1.0676881146414499
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Energy: 0.9991626732626794
Energy: 1.0676881146414499
Energy: 1.118965352145841
Energy: 1.1179191781508382
Energy: 0.9906657915953937
Energy: 1.2054265735219851
Energy: 1.1179191781508382
Energy: 0.9906657915953937
Energy: 1.2054265735219851
Energy: 1.1179191781508382
Energy: 0.9906657915974678
Energy: 1.2054265735219851
Energy: 1.1179191781508382
Energy: 1.1607654012616118
Energy: 0.9904538642577352
Energy: 1.0374539435250136
Energy: 1.1607654012616118
Energy: 0.9904538642577352
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Energy: 1.1607654012616118
Energy: 0.9904538642577352
Energy: 1.0374539435250136
Energy: 1.1607654012616118
Energy: 1.0063938174593012
Energy: 1.0587096740787199
Energy: 1.257574482923856
Energy: 1.0063938174593012
Energy: 1.0587096740787199
Energy: 1.2575744829217819
Energy: 1.0063938174593012
Energy: 1.0587096740787199
Energy: 1.2575744829217819
Energy: 1.0063938174593012
Energy: 1.1913949789290637
Energy: 1.2879686725640838
Energy: 1.0073896401608469
Energy: 1.1913949789290637
Energy: 1.2879686725661574
Energy: 1.0073896401608469
Energy: 1.1913949789290637
Energy: 1.2879686725640838
Energy: 1.0073896401608469
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Energy: 1.0020896370806736
Energy: 1.139675799226081
Energy: 1.1403479540371977
Energy: 1.0020896370785994
Energy: 1.139675799226081
Energy: 1.1403479540392716
Energy: 1.0020896370806736
Energy: 1.139675799226081
Energy: 1.1403479540392716
Energy: 1.0020896370785994
Energy: 1.0583895106548502
Energy: 1.206228332964071
Energy: 1.1269282997616246
Energy: 1.0583895106548502
Energy: 1.2062283329619974
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Energy: 1.0583895106548502
Energy: 1.206228332964071
Energy: 1.1269282997595504
Energy: 1.0583895106548502
Energy: 1.118731242410467
Energy: 1.0587182004827498
Energy: 1.1900909800486223
Energy: 1.118731242412541
Energy: 1.0587182004827498
Energy: 1.1900909800486223
Energy: 1.118731242410467
Energy: 1.058718200484824
Energy: 1.1900909800486223
Energy: 1.118731242412541
Energy: 1.0009676245633334
Energy: 1.1473704368787532
Energy: 1.085022022083288
Energy: 1.0009676245633334
Energy: 1.1473704368787532
Energy: 1.0850220220812141
Energy: 1.0009676245612593
Energy: 1.1473704368787532
Energy: 1.0850220220812141
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Energy: 1.0065456871318648
Energy: 1.040646300993637
Energy: 1.162084422264895
Energy: 1.0065456871318648
Energy: 1.040646300993637
Energy: 1.162084422264895
Energy: 1.0065456871297906
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Energy: 1.162084422266969
Energy: 1.0497023124316798
Energy: 1.0648082551627356
Energy: 1.1014049616298125
Energy: 1.0497023124296057
Energy: 1.0648082551627356
Energy: 1.1014049616318866
Energy: 1.0497023124316798
Energy: 1.0648082551627356
Energy: 1.1014049616277386
Energy: 1.0497023124296057
Energy: 1.4653860351781798
Energy: 1.3616418204630214
Energy: 0.9921438621209353
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Energy: 1.3616418204609473
Energy: 0.9921438621209353
Energy: 1.4653860351781798
Energy: 1.3616418204609473
Energy: 0.9921438621209353
Energy: 1.4653860351781798
Energy: 1.0597241615429829
Energy: 1.0624459232605032
Energy: 1.0877082196283714
Energy: 1.059724161540909
Energy: 1.0624459232625771
Energy: 1.0877082196262975
Energy: 1.059724161540909
Energy: 1.0624459232605032
Energy: 1.0877082196283714
Energy: 1.059724161540909
Energy: 0.9953500350086878
Energy: 1.130070969746058
Energy: 1.0530425762809605
Energy: 0.9953500350086878
Energy: 1.130070969748132
Energy: 1.0530425762809605
Energy: 0.9953500350086878
Energy: 1.130070969746058
Energy: 1.0530425762809605
Energy: 0.9953500350086878
Energy: 1.0321462653083338
Energy: 1.1633467551908687
Energy: 1.0741408537878816
Energy: 1.0321462653083338
Energy: 1.1633467551908687
Energy: 1.0741408537878816
Energy: 1.0321462653083338
Energy: 1.1633467551908687
Energy: 1.0741408537878816
Energy: 1.0321462653083338
Energy: 1.0062412121157152
Energy: 1.399426447070996
Energy: 1.1368695798883537
Energy: 1.0062412121157152
Energy: 1.399426447066848
Energy: 1.1368695798862796
Energy: 1.006241212117789
Energy: 1.399426447070996
Energy: 1.1368695798862796
Energy: 1.0062412121157152
Energy: 1.1616058433647083
Energy: 0.9982553615136018
Energy: 1.0650312902766612
Energy: 1.1616058433626342
Energy: 0.9982553615115278
Energy: 1.0650312902745873
Energy: 1.1616058433647083
Energy: 0.9982553615136018
Energy: 1.0650312902766612
Energy: 1.1616058433626342
Energy: 1.2390820116920136
Energy: 1.181090310867979
Energy: 1.1461119904478108
Energy: 1.2390820116940877
Energy: 1.181090310865905
Energy: 1.1461119904498847
Energy: 1.2390820116920136
Energy: 1.181090310865905
Energy: 1.1461119904478108
Energy: 1.2390820116920136
Energy: 1.1773036981970473
Energy: 0.9915477414909616
Energy: 1.0335697825163803
Energy: 1.1773036981970473
Energy: 0.9915477414888875
Energy: 1.0335697825163803
Energy: 1.1773036981970473
Energy: 0.9915477414909616
Energy: 1.0335697825163803
Energy: 1.1773036981970473
Energy: 1.057874464606493
Energy: 1.0594749222043096
Energy: 1.1503169632965617
Energy: 1.057874464606493
Energy: 1.0594749222043096
Energy: 1.1503169632944878
Energy: 1.057874464606493
Energy: 1.0594749222043096
Energy: 1.1503169632965617
Energy: 1.057874464606493
Energy: 1.1563355943272196
Energy: 1.1538624368893733
Energy: 1.007034864304902
Energy: 1.1563355943272196
Energy: 1.1538624368914474
Energy: 1.007034864304902
Energy: 1.1563355943272196
Energy: 1.1538624368914474
Energy: 1.007034864304902
Energy: 1.1563355943272196
Energy: 1.0560128096503576
Energy: 1.1409347975402553
Energy: 1.1377812918544858
Energy: 1.0560128096524317
Energy: 1.1409347975402553
Energy: 1.1377812918544858
Energy: 1.0560128096503576
Energy: 1.1409347975402553
Energy: 1.1377812918544858
Energy: 1.0560128096524317
Energy: 1.0742871867964532
Energy: 1.0991572748852116
Energy: 1.2020367863066828
Energy: 1.0742871867964532
Energy: 1.0991572748831377
Energy: 1.2020367863087569
Energy: 1.0742871867964532
Energy: 1.0991572748831377
Energy: 1.2020367863087569
Energy: 1.0742871867964532
Energy: 1.0740680817785115
Energy: 1.1648702547522858
Energy: 1.1480380837142907
Energy: 1.0740680817805857
Energy: 1.1648702547543597
Energy: 1.1480380837142907
Energy: 1.0740680817805857
Energy: 1.1648702547543597
Energy: 1.1480380837122166
Energy: 1.0740680817805857
Energy: 1.05652157359867
Energy: 1.2788479923874003
Energy: 1.1821073216808409
Energy: 1.05652157359867
Energy: 1.2788479923874003
Energy: 1.1821073216808409
Energy: 1.05652157359867
Energy: 1.2788479923874003
Energy: 1.182107321678767
Energy: 1.056521573596596
Energy: 1.4666938919167756
Energy: 1.0068583893528673
Energy: 1.3129662339168087
Energy: 1.4666938919147015
Energy: 1.0068583893507932
Energy: 1.3129662339168087
Energy: 1.4666938919167756
Energy: 1.0068583893528673
Energy: 1.3129662339168087
Energy: 1.4666938919147015
Energy: 1.1924777642636812
Energy: 1.1393876130127467
Energy: 1.0066441196342408
Energy: 1.1924777642616071
Energy: 1.1393876130168947
Energy: 1.0066441196321667
Energy: 1.1924777642616071
Energy: 1.1393876130127467
Energy: 1.0066441196321667
Energy: 1.1924777642616071
Energy: 1.2288961591409964
Energy: 1.1662701146711911
Energy: 0.9904003138811709
Energy: 1.2288961591409964
Energy: 1.1662701146691172
Energy: 0.9904003138790969
Energy: 1.2288961591409964
Energy: 1.1662701146711911
Energy: 0.9904003138811709
Energy: 1.2288961591409964
Energy: 1.0825941571101911
Energy: 1.0807376856490876
Energy: 1.0464626594687343
Energy: 1.0825941571101911
Energy: 1.0807376856470137
Energy: 1.0464626594666606
Energy: 1.0825941571101911
Energy: 1.0807376856470137
Energy: 1.0464626594687343
Energy: 1.0825941571122653
Energy: 1.1318215263847893
Energy: 1.132636078418812
Energy: 1.0518416785990796
Energy: 1.1318215266957394
Energy: 1.132636078418812
Energy: 1.0518416785990796
Energy: 1.1318215269963197
Energy: 1.132636078418812
Energy: 1.0518416785990796
Energy: 1.131821526892695
Energy: 1.0067652790296855
Energy: 1.0866423004794583
Energy: 1.1205507500183443
Energy: 1.0067652790317594
Energy: 1.0866423004815324
Energy: 1.1205507500183443
Energy: 1.0067652790296855
Energy: 1.0866423004794583
Energy: 1.1205507500183443
Energy: 1.0067652790317594
Energy: 1.1398312030417235
Energy: 1.0539811005193438
Energy: 1.0519484510696775
Energy: 1.1398312030396496
Energy: 1.0539811005069375
Energy: 1.0519484510676036
Energy: 1.1398312030396496
Energy: 1.05398110053801
Energy: 1.0519484510676036
Energy: 1.1398312030375757
Energy: 1.2928770670183884
Energy: 0.9989429079355657
Energy: 1.2658932373835055
Energy: 1.2928770670183884
Energy: 0.9989429079355657
Energy: 1.2658932373835055
Energy: 1.2928770670183884
Energy: 0.9989429079355657
Energy: 1.2658932373855796
Energy: 1.2928770670183884
Energy: 1.060625389578933
Energy: 1.4130096609218452
Energy: 1.0607755633888714
Energy: 1.060625389578933
Energy: 1.4130096609197715
Energy: 1.0607755633867975
Energy: 1.0606253895768591
Energy: 1.4130096609197715
Energy: 1.0607755633888714
Energy: 1.060625389578933
Energy: 1.308462733035304
Energy: 0.9913877102993212
Energy: 1.2516372516382266
Energy: 1.30846273303323
Energy: 0.9913877103013574
Energy: 1.2516372516361525
Energy: 1.30846273303323
Energy: 0.9913877102993212
Energy: 1.2516372516361525
Energy: 1.30846273303323
Energy: 1.073496382716165
Energy: 1.0061458211988112
Energy: 1.1397176131405775
Energy: 1.073496382716165
Energy: 1.006145821200885
Energy: 1.1397176131405775
Energy: 1.073496382716165
Energy: 1.0061458211988112
Energy: 1.1397176131405775
Energy: 1.073496382716165
Energy: 1.1064188963712556
Energy: 1.1073861450389406
Energy: 1.0085848497491186
Energy: 1.1064188963733295
Energy: 1.1073861450389406
Energy: 1.0085848497470447
Energy: 1.1064188963712556
Energy: 1.1073861450389406
Energy: 1.0085848497470447
Energy: 1.1064188963733295
Energy: 1.0520048301903975
Energy: 1.1056278674300242
Energy: 1.0782495517189004
Energy: 1.0520048301924714
Energy: 1.1056278674300242
Energy: 1.0782495517189004
Energy: 1.0520048301903975
Energy: 1.1056278674300242
Energy: 1.0782495517189004
Energy: 1.0520048301924714
Energy: 1.0539455450336042
Energy: 1.0986846604718743
Energy: 1.0992310646903451
Energy: 1.0539455450336042
Energy: 1.0986846604698004
Energy: 1.0992310646944932
Energy: 1.0539455450356783
Energy: 1.0986846604718743
Energy: 1.099231064692419
Energy: 1.0539455450356783

minimum gb energy = 0.9904003138790969 eV
minimum distance =  2.24987826858571 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.0102809885046184
Energy: 1.065743002537816
Energy: 1.0659731038906368
Energy: 1.010280988503863
Energy: 1.065743002538572
Energy: 1.0659731038906368
Energy: 1.010280988503863
Energy: 1.065743002538572
Energy: 1.065973103891392
Energy: 1.0102809885046184
Energy: 1.2718902350856978
Energy: 0.9900431634020601
Energy: 1.1459176479234596
Energy: 1.2718902350856978
Energy: 0.9900431634020601
Energy: 1.145917647922704
Energy: 1.2718902350856978
Energy: 0.9900431634020601
Energy: 1.145917647922704
Energy: 1.2718902350856978
Energy: 1.1343128103453406
Energy: 0.9755646658758368
Energy: 1.3031206046941797
Energy: 1.1343128103445854
Energy: 0.9755646658773479
Energy: 1.3031206046941797
Energy: 1.1343128103445854
Energy: 0.9755646658765924
Energy: 1.3031206046941797
Energy: 1.1343128103445854
Energy: 1.0521862033027303
Energy: 1.1325048905588433
Energy: 1.1246678376949906
Energy: 1.052186203324608
Energy: 1.1325048905588433
Energy: 1.1246678376949906
Energy: 1.0521862034522698
Energy: 1.1325048905595985
Energy: 1.1246678376949906
Energy: 1.0521862033185634
Energy: 1.093057103566377
Energy: 1.0081085888941104
Energy: 1.2592126663581644
Energy: 1.093057103434216
Energy: 1.0081085888948662
Energy: 1.2592126663581644
Energy: 1.0930571037733074
Energy: 1.0081085888941104
Energy: 1.2592126663574088
Energy: 1.0930571034039922
Energy: 1.1152088128496003
Energy: 1.0886420979806601
Energy: 0.9921527974395137
Energy: 1.115208812850356
Energy: 1.0886420979799043
Energy: 0.9921527974395137
Energy: 1.115208812848089
Energy: 1.0886420979799043
Energy: 0.9921527974395137
Energy: 1.1152088128496003
Energy: 1.1896456607013057
Energy: 1.0341267865687882
Energy: 0.9753961576028525
Energy: 1.1896456606831716
Energy: 1.0341267865695438
Energy: 0.9753961576020967
Energy: 1.1896456605253205
Energy: 1.0341267865687882
Energy: 0.9753961576028525
Energy: 1.1896456604958863
Energy: 1.0504739775437317
Energy: 1.1354302564089176
Energy: 1.0544695484797817
Energy: 1.0504739775444871
Energy: 1.135430256409673
Energy: 1.0544695483982114
Energy: 1.0504739775437317
Energy: 1.1354302564089176
Energy: 1.0544695484178572
Energy: 1.0504739775444871
Energy: 1.3727431242412411
Energy: 1.1404909512408745
Energy: 1.007457596891089
Energy: 1.3727431242419967
Energy: 1.1404909512408745
Energy: 1.007457596891089
Energy: 1.3727431242412411
Energy: 1.1404909512408745
Energy: 1.0074575968918444
Energy: 1.3727431242404855
Energy: 1.0527130531938218
Energy: 1.1358276044716262
Energy: 1.1657558417486336
Energy: 1.0527130531945774
Energy: 1.1358276044731375
Energy: 1.1657558417486336
Energy: 1.0527130531938218
Energy: 1.1358276044806934
Energy: 1.1657558417493894
Energy: 1.0527130531953333
Energy: 1.0422363192568276
Energy: 0.9858003554376237
Energy: 1.1803718017487415
Energy: 1.0422363192568276
Energy: 0.9858003554361126
Energy: 1.2475480662419751
Energy: 1.0422363192568276
Energy: 0.9858003554383793
Energy: 1.2475480662419751
Energy: 1.0422363192575832
Energy: 1.1336344158004243
Energy: 0.9911855898985843
Energy: 1.185879347424152
Energy: 1.1336344157989129
Energy: 0.9911855898985843
Energy: 1.185879347424152
Energy: 1.1336344157989129
Energy: 0.9911855898993397
Energy: 1.185879347424152
Energy: 1.1336344157996687
Energy: 1.0078935472173878
Energy: 1.220968225651122
Energy: 1.0084176901926918
Energy: 1.007893547216632
Energy: 1.220968225651122
Energy: 1.0084176901934474
Energy: 1.0078935472173878
Energy: 1.2209682256503662
Energy: 1.0084176901926918
Energy: 1.007893547216632
Energy: 1.247736839655689
Energy: 1.0640199285123495
Energy: 1.2356741753755665
Energy: 1.247736839655689
Energy: 1.064019928513105
Energy: 1.2356741762025676
Energy: 1.247736839655689
Energy: 1.0640199285123495
Energy: 1.235674175247939
Energy: 1.247736839655689

minimum gb energy = 0.9753961576020967 eV
minimum distance =  2.28221097351954 Angstroms
sigma value = 33