Model name: model_name=MEAM_LAMMPS_JelinekGrohHorstemeyer_2012_AlSiMgCuFe__MO_262519520678_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=3.6200000196695328
cohesive_energy=3.540278409563987
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: 0.015441579426656308
Energy: 0.31014475877957637
Energy: 0.3101447587781348
Energy: 0.015441579426656308
Energy: 0.3101447587781348
Energy: 0.31014475877957637
Energy: 0.015441579426656308
Energy: 0.31014475877957637
Energy: 0.3101447587781348
Energy: 0.015441579426656308
Energy: 0.307808913615673
Energy: 0.018083985336767104
Energy: 0.3084493446950522
Energy: 0.307808913615673
Energy: 0.018083985336767104
Energy: 0.3084493446950522
Energy: 0.307808913615673
Energy: 0.018083985338208628
Energy: 0.3084493446950522
Energy: 0.307808913615673
Energy: 0.6074930720866379
Energy: 0.6788719008289165
Energy: 0.6788719008289165
Energy: 0.6074930720866379
Energy: 0.6788719008289165
Energy: 0.6788719008289165
Energy: 0.6074930720866379
Energy: 0.6788719008289165
Energy: 0.6788719008289165
Energy: 0.6074930720866379
Energy: 0.307808913615673
Energy: 0.3084493446950522
Energy: 0.018083985336767104
Energy: 0.307808913615673
Energy: 0.3084493446950522
Energy: 0.018083985336767104
Energy: 0.307808913615673
Energy: 0.3084493446936107
Energy: 0.018083985336767104
Energy: 0.307808913615673
Energy: 0.015441579426656308
Energy: 0.3101447587781348
Energy: 0.3101447587781348
Energy: 0.015441579426656308
Energy: 0.3101447587781348
Energy: 0.31014475877957637
Energy: 0.015441579426656308
Energy: 0.3101447587781348
Energy: 0.3101447587781348
Energy: 0.015441579426656308
Energy: 0.307808913615673
Energy: 0.018083985336767104
Energy: 0.3084493446950522
Energy: 0.307808913615673
Energy: 0.018083985336767104
Energy: 0.3084493446950522
Energy: 0.307808913615673
Energy: 0.018083985336767104
Energy: 0.3084493446950522
Energy: 0.307808913615673
Energy: 0.6074930720851964
Energy: 0.31533205327301495
Energy: 0.6788719008289165
Energy: 0.6074930720866379
Energy: 0.31533205327301495
Energy: 0.6788719008289165
Energy: 0.6074930720866379
Energy: 0.31533205327301495
Energy: 0.6788719008289165
Energy: 0.6074930720866379

minimum gb energy = 0.015441579426656308 eV
minimum distance =  2.33773875135749 Angstroms
sigma value = 3


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

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Energy: 1.060968025956847
Energy: 0.9864826544126835
Energy: 0.8276701856305014
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Energy: 1.060968025956847
Energy: 0.9864826544126835
Energy: 0.8276701856308867
Energy: 0.937457255424057
Energy: 0.7929339801719512
Energy: 0.9662290854774284
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Energy: 1.0229278643057103
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Energy: 1.0010900904525315
Energy: 0.9347381536561912
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Energy: 1.0455421122338764
Energy: 0.9632648412726871
Energy: 0.7594825326889342
Energy: 1.0455421122345825
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Energy: 1.0129541983366357
Energy: 0.794734633937221
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Energy: 1.0129541983345172
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Energy: 0.794734633937221
Energy: 1.0084595002644612
Energy: 1.0129541983345172
Energy: 0.8112062289136838
Energy: 1.0131850255754828
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Energy: 0.7933712431789035
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Energy: 0.7933712431789035
Energy: 0.8687597431859552
Energy: 0.7942994231520089
Energy: 1.0609680259578742
Energy: 0.9864826544122982
Energy: 0.7942994231516878
Energy: 1.0609680259582595
Energy: 0.9864826544130044
Energy: 0.7942994231520089
Energy: 1.0609680259578742
Energy: 0.9864826544108858
Energy: 0.7942994231520089
Energy: 0.9374572554275881
Energy: 0.7929339801712448
Energy: 0.9662290854777495
Energy: 0.9374572554254693
Energy: 0.7929339801712448
Energy: 0.9662290854767223
Energy: 0.937457255424057
Energy: 0.7929339801712448
Energy: 0.9662290854781347
Energy: 0.9374572554247631
Energy: 0.9355196470892848
Energy: 0.9762982006768701
Energy: 1.0229278643042976
Energy: 0.9355196470906973
Energy: 0.9762982006757787
Energy: 1.022927864302179
Energy: 0.9355196470896701
Energy: 0.9762982006768701
Energy: 1.022927864305004
Energy: 0.9355196470910825
Energy: 0.9855421891096883
Energy: 0.9865099850883822
Energy: 0.7947185355035269
Energy: 0.9855421891107798
Energy: 0.9865099850887034
Energy: 0.7947185355049393
Energy: 0.9855421891093673
Energy: 0.9865099850883822
Energy: 0.7947185355031418
Energy: 0.9855421891107798

minimum gb energy = 0.7594825326875219 eV
minimum distance =  2.25306359854804 Angstroms
sigma value = 75


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

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Energy: 0.8184530700808751
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minimum gb energy = 0.8117995070825564 eV
minimum distance =  2.25159990616769 Angstroms
sigma value = 105


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

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Energy: 0.9724280496957589
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Energy: 1.0033941657659464
Energy: 0.9785557938245496
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Energy: 1.003394165766724
Energy: 1.0307127894881567
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Energy: 1.0307127894875914
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Energy: 1.0307127894881567
Energy: 1.0136275895963447
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Energy: 0.8964987477802541
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Energy: 0.8880083772530991
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Energy: 0.8960384264376877
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Energy: 0.8960384264372989
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Energy: 0.9329463326813081
Energy: 0.9312772952864916
Energy: 0.9568872772996859
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Energy: 0.9350588492266543
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Energy: 0.8966132110679759
Energy: 0.935058849226831
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Energy: 0.9218211040370892
Energy: 0.9724117619565218
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Energy: 0.921821104037478
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Energy: 0.980946002155368
Energy: 1.0105828224455686
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Energy: 0.9809460021542017
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Energy: 1.0105828224440137
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Energy: 1.006518376867228
Energy: 0.9617955941462811
Energy: 1.010181481871942
Energy: 1.0065183768674046
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Energy: 1.010181481871553
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Energy: 0.9617955941458924
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Energy: 1.006518376868182
Energy: 0.9669534973427205
Energy: 0.9937945964503175
Energy: 0.9322696787239741
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Energy: 0.9669534973425085
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Energy: 0.9726593782850236
Energy: 0.9726200688788419
Energy: 0.9792865989582962
Energy: 0.9726593782854124
Energy: 0.9726200688780643
Energy: 0.9792865989579075
Energy: 0.9726593782846349
Energy: 0.9726200688784531
Energy: 0.9792865989585082
Energy: 0.9726593782854124
Energy: 0.9379966899767844
Energy: 0.9670966163452241
Energy: 0.9365296497774316
Energy: 0.937996689975618
Energy: 0.9670966165189244
Energy: 0.9365296497770429
Energy: 0.9379966899769964
Energy: 0.9670966164046675
Energy: 0.9365296497774316
Energy: 0.937996689975618
Energy: 0.9422556016565817
Energy: 0.9372671250237029
Energy: 0.9486640942171249
Energy: 0.9422556016497964
Energy: 0.9372671250227133
Energy: 0.9486640942175137
Energy: 0.9422556016665127
Energy: 0.9372671250233141
Energy: 0.9486640942173369
Energy: 0.9422556016616356
Energy: 1.1137445476673755
Energy: 0.9295350928587738
Energy: 0.9906093579762022
Energy: 1.1137445476681531
Energy: 0.9295350928585971
Energy: 0.9906093579760255
Energy: 1.1137445476675876
Energy: 0.9295350928582083
Energy: 0.9906093579763791
Energy: 1.1137445476681531
Energy: 0.968259776817991
Energy: 0.947426667351902
Energy: 0.8854412342363586
Energy: 0.9682597768176023
Energy: 0.9474266673544111
Energy: 0.8854412342359698
Energy: 0.968259776817991
Energy: 0.9474266673524675
Energy: 0.8854412342369239
Energy: 0.9682597768173903
Energy: 1.0298134687459617
Energy: 0.9670096902052449
Energy: 0.9454014650458105
Energy: 1.0298134687467393
Energy: 0.9670096902058456
Energy: 0.945401465046376
Energy: 1.0298134687459617
Energy: 0.9670096902071884
Energy: 0.9454014650455984
Energy: 1.0298134687459617
Energy: 1.0195940542193072
Energy: 0.9692280198894557
Energy: 0.9644466627943561
Energy: 1.0195940542200848
Energy: 0.9692280198890669
Energy: 0.9644466627943561
Energy: 1.019594054219873
Energy: 0.9692280198885015
Energy: 0.9644466627943561
Energy: 1.0195940542200848
Energy: 1.002430283215992
Energy: 0.9318861944390702
Energy: 1.0039044565912632
Energy: 1.002430283215992
Energy: 0.9318861944392823
Energy: 1.003904456591652
Energy: 1.002430283215603
Energy: 0.9318861944392823
Energy: 1.003904456591051
Energy: 1.002430283215992

minimum gb energy = 0.8854412342359698 eV
minimum distance =  2.23609850147504 Angstroms
sigma value = 165


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

Energy: 0.9014779777992608
Energy: 0.9473928450676478
Energy: 0.9522602910870119
Energy: 0.8666208854711173
Energy: 0.9473928450676478
Energy: 0.9522602910870119
Energy: 0.9014779777992608
Energy: 0.9473928450669804
Energy: 0.9522602910870119
Energy: 0.8666208854711173
Energy: 0.9931131185415735
Energy: 0.8638202245353492
Energy: 0.9742077838139369
Energy: 0.9931131185482465
Energy: 0.8638202245353492
Energy: 0.9742077838132697
Energy: 0.99311311854491
Energy: 0.8638202245353492
Energy: 0.9742077838139369
Energy: 0.9931131185442427
Energy: 0.9046436698696105
Energy: 0.9224632837859141
Energy: 0.8826558518765893
Energy: 0.9046436698682759
Energy: 0.9224632837845795
Energy: 0.8816296185816623
Energy: 0.9046436698682759
Energy: 0.9224632837845795
Energy: 0.8826558518765893
Energy: 0.9046436698682759
Energy: 0.9876169331174233
Energy: 1.0297511565021116
Energy: 0.8760800287791412
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Energy: 1.0297511565027788
Energy: 0.8760800287784738
Energy: 0.9876169331180906
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Energy: 0.8760800287784738
Energy: 0.9876169331167561
Energy: 0.9312641877374874
Energy: 0.9222343814687365
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Energy: 0.9312641877361529
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Energy: 0.8971473303822902
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Energy: 0.8971473303829272
Energy: 0.9312641877374874
Energy: 0.863395572904144
Energy: 1.0335022325752348
Energy: 1.2190151043295878
Energy: 0.8633955729028095
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Energy: 1.219015104330255
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Energy: 1.2190151043295878
Energy: 0.8633955729034768
Energy: 0.9086891511480135
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Energy: 0.9680970926134738
Energy: 0.9638877631354485
Energy: 0.9268387452580407
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Energy: 0.9638877631347812
Energy: 0.9268387452593753
Energy: 0.9680970926141411
Energy: 0.9638877631354485
Energy: 0.9171293420083901
Energy: 1.001632660885165
Energy: 0.924655059419549
Energy: 0.9171293420077229
Energy: 1.0016326608864998
Energy: 0.924674209727415
Energy: 0.9171293420077229
Energy: 1.001632660885165
Energy: 0.9246550594202163
Energy: 0.9171293420083901
Energy: 0.923973321131511
Energy: 1.1001248556776044
Energy: 1.0530438070887085
Energy: 0.8895786387342957
Energy: 1.1001248556762697
Energy: 1.0530438070900432
Energy: 0.9239733211321784
Energy: 1.1001248556762697
Energy: 1.053043807088041
Energy: 0.8895786387336283
Energy: 0.9258451950269905
Energy: 0.8968036121584384
Energy: 0.9428232579010584
Energy: 0.8955990427846303
Energy: 0.8968036121584384
Energy: 0.9256107214460967
Energy: 0.9258451950283251
Energy: 0.8968036121584384
Energy: 0.9428232579030602
Energy: 0.8955990427846303
Energy: 0.9860725576243697
Energy: 0.8763486931374684
Energy: 0.9858444259658631
Energy: 0.9860725576257041
Energy: 0.8763486931374684
Energy: 0.9858444259645285
Energy: 0.9860725576250369
Energy: 0.8763486931368011
Energy: 0.9858444259651956
Energy: 0.9860725576263715
Energy: 0.9402308562573914
Energy: 0.8893440310407861
Energy: 0.9323522854077643
Energy: 0.9402308562587262
Energy: 0.8893440310407861
Energy: 0.9323522854077643
Energy: 0.9402308562580588
Energy: 0.8893440310407861
Energy: 0.9323522854084315
Energy: 0.9402308562580588
Energy: 0.9630451124951793
Energy: 0.9467073269197719
Energy: 0.8635430932839514
Energy: 0.9630451124951793
Energy: 0.9467073269217736
Energy: 0.8635430932839514
Energy: 0.9630451124958466
Energy: 0.9467073269197719
Energy: 0.8635430932826168
Energy: 0.9630451124965137
Energy: 0.8666208854711173
Energy: 0.9473928450689824
Energy: 0.9522602910870119
Energy: 0.8666208854717846
Energy: 0.9473928450669804
Energy: 0.9522602910863445
Energy: 0.8666208854711173
Energy: 0.9473928450656459
Energy: 0.9522602910856772
Energy: 0.8666208854717846

minimum gb energy = 0.8633955729028095 eV
minimum distance =  2.33490267877961 Angstroms
sigma value = 41


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

Energy: 0.9270801151358034
Energy: 0.8314502416507827
Energy: 0.8285834071551319
Energy: 0.8385944238483368
Energy: 0.8314502416481938
Energy: 0.8285834071577209
Energy: 0.9270801151383924
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Energy: 0.8260951800920533
Energy: 0.7399122781642331
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Energy: 0.8260951800946424
Energy: 0.8390017093925068
Energy: 0.7413370955803249
Energy: 0.7858638703765103
Energy: 0.8390017093925068
Energy: 0.7413370955803249
Energy: 0.7857688164290217
Energy: 0.8390017093950959
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Energy: 0.7858638703790994
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Energy: 0.7522080861629524
Energy: 0.7523260954700314
Energy: 0.7933313100264984
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Energy: 0.7523260954674423
Energy: 0.7931996270377857
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Energy: 0.7523260954700314
Energy: 0.7933313100290872
Energy: 0.7522080861629524
Energy: 0.7880087150445687
Energy: 0.8701188616871698
Energy: 0.7931612354132785
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Energy: 0.8701188616845807
Energy: 0.7932548982778989
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Energy: 0.8701188616871698
Energy: 0.7931612354081004
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Energy: 0.7922182731340099
Energy: 0.8131834558423248
Energy: 0.8292473865003545
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Energy: 0.8462334183143041
Energy: 0.7609126496992659
Energy: 0.8632041532323456
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Energy: 0.7609126496940878
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Energy: 0.8491040881934423
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Energy: 0.7731435869006394
Energy: 0.8015235551376249
Energy: 0.805659222311219
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Energy: 0.8152410247583703
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Energy: 0.7731435869032285
Energy: 0.8015235551402139
Energy: 0.805659222311219
Energy: 0.7731435869006394
Energy: 0.9005078122767555
Energy: 0.7717886731344233
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Energy: 0.8322740126784671
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Energy: 0.7423888426424445
Energy: 0.827089952958693
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Energy: 0.7423888426398555
Energy: 0.827089952956104
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Energy: 0.8320051511248171
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Energy: 0.8675768450624473
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Energy: 0.74023426186178
Energy: 0.8675768450624473
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Energy: 0.8675768450650364
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Energy: 0.7870840489210725
Energy: 0.7595544925500669
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Energy: 0.8250180342991923
Energy: 0.9068549399593735
Energy: 0.7603731964253392
Energy: 0.8250180342991923
Energy: 0.9068549399593735
Energy: 0.7603731964279282
Energy: 0.8250180342991923
Energy: 0.9068549399567843
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Energy: 0.9328549746895717
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Energy: 0.8497855043773316
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Energy: 0.8497855043773316
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Energy: 0.8444296089766826
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Energy: 0.7830215773752887
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Energy: 0.8222166233075673
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Energy: 0.7830215773752887
Energy: 0.8663734456903794
Energy: 0.7400656926518316
Energy: 0.8336272160982464
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Energy: 0.8336272160956573
Energy: 0.8663734456877904
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Energy: 0.8336272160982464
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Energy: 0.8289568542837372
Energy: 0.8694048017075359
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Energy: 0.898882664376386
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Energy: 0.8289568542811481
Energy: 0.869404801712714
Energy: 0.832141416040322
Energy: 0.7402959433549314
Energy: 0.8533760100336342
Energy: 0.8122861416146224
Energy: 0.7402959433523424
Energy: 0.8522945246162461
Energy: 0.8124288230106239
Energy: 0.7402959433549314
Energy: 0.8533760100284561
Energy: 0.8122861416146224
Energy: 0.7402959433549314
Energy: 0.7727422456145756
Energy: 0.7867018597272977
Energy: 0.7863290234072107
Energy: 0.7727422456145756
Energy: 0.7865390321017072
Energy: 0.7866796462868333
Energy: 0.7727422456145756
Energy: 0.7867018597272977
Energy: 0.7863290234097997
Energy: 0.7727422456145756
Energy: 0.7527156784319442
Energy: 0.7951578464142078
Energy: 0.7518525886549428
Energy: 0.752715678429355
Energy: 0.7953763511605157
Energy: 0.7518525886523537
Energy: 0.752715678429355
Energy: 0.7951578464116187
Energy: 0.7518525886523537
Energy: 0.7527156784319442
Energy: 0.8707876545989076
Energy: 0.8082883335027777
Energy: 0.7936651242144903
Energy: 0.8707876545989076
Energy: 0.8088925454151719
Energy: 0.7936651242119013
Energy: 0.8707876546014967
Energy: 0.8082883335001887
Energy: 0.7936651242119013
Energy: 0.8707876545989076
Energy: 0.8368535641039928
Energy: 0.826334175193666
Energy: 0.7750195218620699
Energy: 0.8409248017149408
Energy: 0.8275243375345864
Energy: 0.7750195218620699
Energy: 0.8409248017123516
Energy: 0.8269389916424003
Energy: 0.7750195218594809
Energy: 0.8409248017149408

minimum gb energy = 0.7399122781642331 eV
minimum distance =  2.30893519880517 Angstroms
sigma value = 185


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

Energy: 0.7268242372525141
Energy: 0.3628247953457985
Energy: 0.36248209925998254
Energy: 0.5014217016186555
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Energy: 0.6488991867755962
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Energy: 0.5132636258886994
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Energy: 0.46840998772436554
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Energy: 0.36480505146166137
Energy: 0.5929235908853744
Energy: 0.4254358811711754
Energy: 0.3563510361162143
Energy: 0.592923590885067
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Energy: 0.35635103611590696
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Energy: 0.559875173013231
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Energy: 0.6149123902672914
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Energy: 0.559875173013231
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Energy: 0.5901045908426521
Energy: 0.6971518020786736
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Energy: 0.526974262067741
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Energy: 0.5929235908847598
Energy: 0.5443900647396914
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Energy: 0.5929235908847598
Energy: 0.5414741448725793
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Energy: 0.5929235908853744
Energy: 0.5443900647406135
Energy: 0.35635103611559965
Energy: 0.5929235908856817
Energy: 0.37077466292199673
Energy: 0.6176772797409561
Energy: 0.3630466370586
Energy: 0.5176164191039059
Energy: 0.5369387857115898
Energy: 0.3630466370589074
Energy: 0.3707746629201527
Energy: 0.6176772797403415
Energy: 0.36304663705952206
Energy: 0.5176164191048278
Energy: 0.5411863646996125
Energy: 0.5272192696344922
Energy: 0.35705373818519104
Energy: 0.4682981136772647
Energy: 0.4692503968972347
Energy: 0.357053738184269
Energy: 0.5411863647008418
Energy: 0.5272192696335702
Energy: 0.357053738184269
Energy: 0.4682981136757281
Energy: 0.5616701279283006
Energy: 0.6840253802450114
Energy: 0.3808351348666231
Energy: 0.5890848285480966
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Energy: 0.3808351348666231
Energy: 0.5616701279289154
Energy: 0.6840253802453188
Energy: 0.38083513486908177
Energy: 0.5890848285484039

minimum gb energy = 0.35635103611559965 eV
minimum distance =  2.37861138807501 Angstroms
sigma value = 33


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

Energy: 0.7325179397248607
Energy: 0.7672561885723799
Energy: 0.7445424248123026
Energy: 0.6819558030432247
Energy: 0.7672561885740671
Energy: 0.7445424248089283
Energy: 0.7325179397231735
Energy: 0.7672561885757542
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Energy: 0.6819558030432247
Energy: 0.8537906166527451
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Energy: 0.7399740541999404
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Energy: 0.6477102997280585
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Energy: 0.7399740541999404
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Energy: 0.6926100356726624
Energy: 0.8254598649030876
Energy: 0.8439315919109596
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Energy: 0.6846402804285574
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Energy: 0.6886530262210934
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Energy: 0.7911304692059822
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Energy: 0.8041940590646287
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Energy: 0.766283501152048
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Energy: 0.7800313560710085
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Energy: 0.6996139192530952
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Energy: 0.7662835011503608
Energy: 0.7113205368806217
Energy: 0.7800313560710085
Energy: 0.766283501152048
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Energy: 0.7995554763808915
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Energy: 0.7920778523658223
Energy: 0.7419192347287372
Energy: 0.6965993129562028

minimum gb energy = 0.6472523145869219 eV
minimum distance =  2.24360002083985 Angstroms
sigma value = 219


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

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Energy: 1.0136415637773812
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Energy: 0.9930202631354866
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Energy: 0.8198214491311889
Energy: 0.9930202631354866
Energy: 1.0447635486106008
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Energy: 0.9930202631354866
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Energy: 1.0254851401079965
Energy: 0.9829814653013644
Energy: 0.9333715546187196
Energy: 1.0254851401079965
Energy: 0.9829814653013644

minimum gb energy = 0.8198214491311889 eV
minimum distance =  2.31243854227832 Angstroms
sigma value = 15


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

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Energy: 1.0442430460802745
Energy: 0.9404416325983188
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Energy: 1.0133139756235046
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minimum gb energy = 0.928834913795203 eV
minimum distance =  2.24520199663417 Angstroms
sigma value = 293


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

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Energy: 0.927772177477264
Energy: 0.9404628150430238
Energy: 0.9270949210740471
Energy: 0.9277721774775162
Energy: 0.9404628150437805
Energy: 0.9270949210740471
Energy: 0.927772177477264
Energy: 1.0068186276164208
Energy: 1.005412495320905
Energy: 1.003442631468289
Energy: 1.0068186276164208
Energy: 1.005412495320905
Energy: 1.0034426314680365
Energy: 1.0068186276171776
Energy: 1.005412495320905
Energy: 1.003442631468289
Energy: 1.006818627616673
Energy: 0.9491571052854381
Energy: 0.959306867300939
Energy: 0.9291179047131317
Energy: 0.9491571052849338
Energy: 0.9593068673004347
Energy: 0.9291179047128795
Energy: 0.9491571052849338
Energy: 0.959306867300939
Energy: 0.9291179047126273
Energy: 0.9491571052849338
Energy: 0.9773322587443625
Energy: 1.1124530215110573
Energy: 0.9264093938462269
Energy: 0.9773322587445918
Energy: 1.1124530215115616
Energy: 0.9264093938464791
Energy: 0.9773322587443625
Energy: 1.112453021513075
Energy: 0.9264093938464791
Energy: 0.9773322587445918
Energy: 0.9272555589689621
Energy: 0.9309610620356876
Energy: 0.9267359562137942
Energy: 0.9272555589684578
Energy: 0.9309610620361919
Energy: 0.9267359562137942
Energy: 0.9272555589681826
Energy: 0.9309610620359626
Energy: 0.9267359562137942
Energy: 0.9272555589689621
Energy: 0.9752538274226584
Energy: 0.9643911823312851
Energy: 0.9302617998395977
Energy: 0.9752538274213975
Energy: 0.9643911823315373
Energy: 0.9302617998385888
Energy: 0.9752538274219018
Energy: 0.9643911823333028
Energy: 0.9302617998390934
Energy: 0.9752538274216497
Energy: 0.9536443997532975
Energy: 1.037095809702322
Energy: 1.0379541015457114
Energy: 0.9536443997532975
Energy: 1.037095809702322
Energy: 1.0379541015459637
Energy: 0.9536443997532975
Energy: 1.0370958097025742
Energy: 1.0379541015454592
Energy: 0.9536443997530454
Energy: 0.975386581727569
Energy: 0.9303589472859529
Energy: 0.9644272406358964
Energy: 0.9753865817278211
Energy: 0.9303589472864572
Energy: 0.9644272406358964
Energy: 0.9753865817270645
Energy: 0.930358947286205
Energy: 0.9644272406353918
Energy: 0.9753865817280734
Energy: 0.9272534181879568
Energy: 0.9267470414501144
Energy: 0.9306694981903065
Energy: 0.9272534181879568
Energy: 0.9267470414501144
Energy: 0.9306694981903065
Energy: 0.9272534181881861
Energy: 0.9267470414498622
Energy: 0.9306694981895269
Energy: 0.9272534181884614
Energy: 0.9773920447159854
Energy: 0.9264030670981191
Energy: 1.1122395807554484
Energy: 0.9773920447162148
Energy: 0.9264030670981191
Energy: 1.1122395807554484
Energy: 0.9773920447157103
Energy: 0.9264030670981191
Energy: 1.1122395807562053
Energy: 0.9773920447157103
Energy: 0.9492570440184424
Energy: 0.9289446773321639
Energy: 0.9595287679830741
Energy: 0.9492570440189468
Energy: 0.928944677332416
Energy: 0.9595287679830741
Energy: 0.9492570440166769
Energy: 0.928944677332416
Energy: 0.9595287679830741
Energy: 0.9492570440181902
Energy: 1.0063006160098007
Energy: 1.0034056343335012
Energy: 1.0053757982933316
Energy: 1.006300616008792
Energy: 1.0034056343335012
Energy: 1.0053757982930795
Energy: 1.0063006160085397
Energy: 1.0034056343335012
Energy: 1.0053757982933316
Energy: 1.0063006160082875
Energy: 0.9277581261397629
Energy: 0.9271442313087215
Energy: 0.9403609877240752
Energy: 0.9277581261395108
Energy: 0.9271442313082171
Energy: 0.940360987722837
Energy: 0.9277581261400153
Energy: 0.9271442313087215
Energy: 0.940360987723823
Energy: 0.9277581261405196
Energy: 1.0097513271400864
Energy: 0.931116936765297
Energy: 0.930976687815342
Energy: 1.0097513271400864
Energy: 0.9311169367660537
Energy: 0.9309766878155942
Energy: 1.0097513271400864
Energy: 0.9311169367625227
Energy: 0.9309766878160987
Energy: 1.0097513271400864
Energy: 0.9277721774777683
Energy: 0.9404628150437805
Energy: 0.927094921073795
Energy: 0.9277721774777683
Energy: 0.9404628150440328
Energy: 0.927094921073795
Energy: 0.9277721774775162
Energy: 0.9404628150437805
Energy: 0.927094921073795
Energy: 0.9277721774780207
Energy: 1.006818627616673
Energy: 1.005412495320905
Energy: 1.0034426314680365
Energy: 1.006818627616673
Energy: 1.0054124953211572
Energy: 1.003442631468289
Energy: 1.006818627616673
Energy: 1.005412495320905
Energy: 1.0034426314680365
Energy: 1.006818627616673
Energy: 0.9491571052836726
Energy: 0.9593068673002053
Energy: 0.9291179047128795
Energy: 0.949157105281655
Energy: 0.9593068673012142
Energy: 0.9291179047131317
Energy: 0.9491571052826637
Energy: 0.959306867300939
Energy: 0.9291179047128795
Energy: 0.9491571052826637
Energy: 0.9773322587448668
Energy: 1.1124530215108053
Energy: 0.9264093938467315
Energy: 0.9773322587443625
Energy: 1.1124530215128228
Energy: 0.9264093938462269
Energy: 0.9773322587445918
Energy: 1.1124530215115616
Energy: 0.9264093938464791
Energy: 0.9773322587440872

minimum gb energy = 0.9264030670976146 eV
minimum distance =  2.24828584271953 Angstroms
sigma value = 293


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

Energy: 0.8712293708697201
Energy: 0.871664074521109
Energy: 0.8718298249413577
Energy: 0.8712293708697201
Energy: 0.8716640745206531
Energy: 0.8718298249413577
Energy: 0.8712293708701759
Energy: 0.871664074521109
Energy: 0.8718298249413577
Energy: 0.8712293708697201
Energy: 0.8699664341588681
Energy: 0.8716259800480364
Energy: 0.8718370440875973
Energy: 0.8699664341584122
Energy: 0.8716259800475805
Energy: 0.8718370440875973
Energy: 0.8699664341584122
Energy: 0.8716259800475805
Energy: 0.8718370440875973
Energy: 0.8699664341584122
Energy: 0.8690768522743009
Energy: 0.86957995475568
Energy: 1.029364822528506
Energy: 0.8690768522747568
Energy: 0.86957995475568
Energy: 1.0293648225275944
Energy: 0.8690768522747568
Energy: 0.8695799547561357
Energy: 1.029364822528506
Energy: 0.8690768522747568
Energy: 1.0302705522387858
Energy: 0.8695956612427201
Energy: 0.8691761648790239
Energy: 1.0302705522383298
Energy: 0.8695956612422642
Energy: 0.8691761648790239
Energy: 1.0302705522387858
Energy: 0.8695956612427201
Energy: 0.8691761648790239
Energy: 1.0302705522383298
Energy: 0.8719911059637514
Energy: 0.8717746004212041
Energy: 0.8698903598847505
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598847505
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598852064
Energy: 0.8719911059632955
Energy: 0.8716640745206531
Energy: 0.8718298249409018
Energy: 0.8712293708697201
Energy: 0.871664074521109
Energy: 0.8718298249409018
Energy: 0.8712293708697201
Energy: 0.8716640745206531
Energy: 0.8718298249413577
Energy: 0.8712293708701759
Energy: 0.871664074521109
Energy: 0.8716259800480364
Energy: 0.8718370440871415
Energy: 0.8699664341588681
Energy: 0.8716259800480364
Energy: 0.8718370440871415
Energy: 0.8699664341584122
Energy: 0.8716259800475805
Energy: 0.8718370440875973
Energy: 0.8699664341593238
Energy: 0.8716259800480364
Energy: 0.8695799547561357
Energy: 1.029364822528506
Energy: 0.8690768522738452
Energy: 0.8695799547561357
Energy: 1.0293648225289618
Energy: 0.8690768522743009
Energy: 0.869579954755224
Energy: 1.0293648225280503
Energy: 0.8690768522747568
Energy: 0.8695799547561357
Energy: 0.8695956612427201
Energy: 0.8691761648790239
Energy: 1.0302705522387858
Energy: 0.8695956612422642
Energy: 0.8691761648790239
Energy: 1.0302705522387858
Energy: 0.8695956612427201
Energy: 0.8691761648785681
Energy: 1.0302705522378741
Energy: 0.8695956612427201
Energy: 0.8717746004216599
Energy: 0.8698903598847505
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598852064
Energy: 0.8719911059632955
Energy: 0.8717746004216599
Energy: 0.8698903598847505
Energy: 0.8719911059637514
Energy: 0.8717746004212041
Energy: 0.8718298249413577
Energy: 0.8712293708701759
Energy: 0.871664074521109
Energy: 0.8718298249413577
Energy: 0.8712293708697201
Energy: 0.8716640745206531
Energy: 0.871829824940446
Energy: 0.8712293708701759
Energy: 0.8716640745206531
Energy: 0.8718298249409018
Energy: 0.8718370440875973
Energy: 0.8699664341579563
Energy: 0.8716259800489481
Energy: 0.8718370440875973
Energy: 0.8699664341584122
Energy: 0.8716259800480364
Energy: 0.8718370440871415
Energy: 0.8699664341584122
Energy: 0.8716259800471248
Energy: 0.8718370440871415
Energy: 1.0293648225280503
Energy: 0.8690768522743009
Energy: 0.8695799547561357
Energy: 1.0293648225280503
Energy: 0.8690768522747568
Energy: 0.8695799547561357
Energy: 1.029364822528506
Energy: 0.8690768522747568
Energy: 0.869579954755224
Energy: 1.0293648225275944
Energy: 0.8691761648790239
Energy: 1.0302705522374183
Energy: 0.8695956612418083
Energy: 0.8691761648790239
Energy: 1.0302705522387858
Energy: 0.8695956612427201
Energy: 0.8691761648790239
Energy: 1.0302705522378741
Energy: 0.8695956612431758
Energy: 0.8691761648790239
Energy: 0.8698903598842946
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598852064
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598847505
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598847505
Energy: 0.8712293708697201
Energy: 0.871664074521109
Energy: 0.8718298249409018
Energy: 0.8712293708706318
Energy: 0.8716640745206531
Energy: 0.8718298249409018
Energy: 0.8712293708706318
Energy: 0.871664074521109
Energy: 0.8718298249409018
Energy: 0.8712293708697201
Energy: 0.8699664341588681
Energy: 0.8716259800480364
Energy: 0.8718370440875973
Energy: 0.8699664341584122
Energy: 0.8716259800475805
Energy: 0.8718370440871415
Energy: 0.8699664341593238
Energy: 0.8716259800484921
Energy: 0.8718370440871415
Energy: 0.8699664341575005
Energy: 0.8690768522738452
Energy: 0.8695799547561357
Energy: 1.0293648225280503
Energy: 0.8690768522747568
Energy: 0.869579954755224
Energy: 1.0293648225275944
Energy: 0.8690768522743009
Energy: 0.86957995475568
Energy: 1.0293648225280503
Energy: 0.8690768522747568
Energy: 1.0302705522387858
Energy: 0.8695956612427201
Energy: 0.8691761648790239
Energy: 1.0302705522383298
Energy: 0.8695956612422642
Energy: 0.8691761648790239
Energy: 1.0302705522378741
Energy: 0.8695956612422642
Energy: 0.8691761648785681
Energy: 1.0302705522383298
Energy: 0.8719911059632955
Energy: 0.8717746004207483
Energy: 0.8698903598847505
Energy: 0.8719911059632955
Energy: 0.8717746004216599
Energy: 0.8698903598852064
Energy: 0.8719911059632955
Energy: 0.8717746004212041
Energy: 0.8698903598847505
Energy: 0.8719911059632955
Energy: 0.871664074521109
Energy: 0.8718298249413577
Energy: 0.8712293708701759
Energy: 0.871664074521109
Energy: 0.8718298249413577
Energy: 0.8712293708701759
Energy: 0.871664074521109
Energy: 0.8718298249409018
Energy: 0.8712293708697201
Energy: 0.871664074521109
Energy: 0.8716259800480364
Energy: 0.8718370440880531
Energy: 0.8699664341588681
Energy: 0.8716259800480364
Energy: 0.8718370440875973
Energy: 0.8699664341588681
Energy: 0.8716259800475805
Energy: 0.8718370440875973
Energy: 0.8699664341593238
Energy: 0.8716259800480364

minimum gb energy = 0.8690768522738452 eV
minimum distance =  2.30784564205812 Angstroms
sigma value = 15


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

Energy: 0.9608706931502038
Energy: 0.9375614052301895
Energy: 0.9830470486505256
Energy: 0.9492284969335693
Energy: 0.9375614052260569
Energy: 0.9830470237971195
Energy: 0.9608706931522701
Energy: 0.937561405224028
Energy: 0.9830470268849679
Energy: 0.9492284969335693
Energy: 0.9887383382033113
Energy: 0.9344966369624694
Energy: 0.9184627638323226
Energy: 0.9887383382012448
Energy: 0.9344966369624694
Energy: 0.9184627638302562
Energy: 0.9887383382012448
Energy: 0.934496636960403
Energy: 0.9184627638302562
Energy: 0.9887383382012448
Energy: 0.9973201923422845
Energy: 0.9487763167543871
Energy: 1.0704797580392853
Energy: 0.9973201923422845
Energy: 0.9487763167523208
Energy: 1.0704797580413516
Energy: 0.9973201923422845
Energy: 0.9487763167543871
Energy: 1.070479758043418
Energy: 0.9973201923443507
Energy: 0.9113651503560066
Energy: 0.948975635273479
Energy: 0.9117859776663102
Energy: 0.9113651503539404
Energy: 0.9489756352714126
Energy: 0.9117859776642813
Energy: 0.9113651503560066
Energy: 0.9489756352714126
Energy: 0.9117859776663102
Energy: 0.911365150358073
Energy: 1.0051175515539297
Energy: 0.9346862908315046
Energy: 1.0494112818094625
Energy: 1.0051175515539297
Energy: 0.9346862908294384
Energy: 1.0494112818094625
Energy: 1.0051175515539297
Energy: 0.9346862908294384
Energy: 1.0494112818115287
Energy: 1.0051175515539297
Energy: 0.9615958648330001
Energy: 0.992290507296542
Energy: 0.9113041876267773
Energy: 0.9615958648330001
Energy: 0.9922905073048075
Energy: 0.9113041876288437
Energy: 0.9615958648371327
Energy: 0.992290507290343
Energy: 0.91130418763091
Energy: 0.9615958648350663
Energy: 0.9496608770935878
Energy: 1.0014813094384565
Energy: 1.0220845556443001
Energy: 0.9519416685102841
Energy: 1.0014813094343238
Energy: 1.0220845556443001
Energy: 0.9496608770977205
Energy: 1.0014813094343238
Energy: 1.0220845556443001
Energy: 0.9519416685123506
Energy: 0.933508916477889
Energy: 1.0118158536328083
Energy: 1.0127571152009636
Energy: 0.9335089164758227
Energy: 1.0118158536348747
Energy: 1.0127571152009636
Energy: 0.9335089164737562
Energy: 1.0118158536369408
Energy: 1.01275711520303
Energy: 0.9335089164758227
Energy: 1.1133517949755667
Energy: 0.9384413340061325
Energy: 0.9372327915687638
Energy: 1.1133517949796994
Energy: 0.9387973482018923
Energy: 0.9418400706902708
Energy: 1.1133517949755667
Energy: 0.9384413339524449
Energy: 0.9372327915666975
Energy: 1.1133517949755667
Energy: 0.9309793513307743
Energy: 1.122657371502147
Energy: 0.9852375187791159
Energy: 0.9309755030092228
Energy: 1.1226573715000807
Energy: 0.9851314661077726
Energy: 0.9309793513349071
Energy: 1.1226573715000807
Energy: 0.9852375187811825
Energy: 0.9309755030092228
Energy: 0.9636504135986238
Energy: 0.9033311608895419
Energy: 0.9834108630197184
Energy: 0.9636504135965575
Energy: 0.9033311608895419
Energy: 0.983410863017652
Energy: 0.9636504135924248
Energy: 0.9033311608875131
Energy: 0.9834108630155854
Energy: 0.9636504135965575
Energy: 1.0025647997818532
Energy: 0.9117009060777087
Energy: 1.0355138121361398
Energy: 1.002564799783882
Energy: 0.9119277712224075
Energy: 1.0355138121361398
Energy: 1.002564799783882
Energy: 0.9117009060797752
Energy: 1.0355138121361398
Energy: 1.002564799783882
Energy: 1.0462609973193073
Energy: 0.9111095602514014
Energy: 0.9939269750057288
Energy: 1.0462609973172408
Energy: 0.9111095602514014
Energy: 0.9939269750015961
Energy: 1.0462609973193073
Energy: 0.9111095602514014
Energy: 0.9939269750036623
Energy: 1.0462609973193073
Energy: 0.9077415516655801
Energy: 0.9086121185441698
Energy: 1.107789615887853
Energy: 0.9077415516655801
Energy: 0.9086121185462361
Energy: 1.1077896160014276
Energy: 0.9077415516655801
Energy: 0.9086121185441698
Energy: 1.1077896159498062
Energy: 0.9077415516676463
Energy: 0.9943528570055976
Energy: 1.0252215182245084
Energy: 0.9231148452354477
Energy: 0.9943528570055976
Energy: 1.025221518222442
Energy: 0.9231148305460669
Energy: 0.9943528570076637
Energy: 1.025221518222442
Energy: 0.9231148452375139
Energy: 0.9943528570055976
Energy: 0.9230342869584964
Energy: 1.0588094491535356
Energy: 1.0108066600302912
Energy: 0.9230342869584964
Energy: 1.0588094491576683
Energy: 1.0108066600282248
Energy: 0.9230342869605629
Energy: 1.0588094491556017
Energy: 1.0108066600282248
Energy: 0.9230342869584964
Energy: 0.9258609436869637
Energy: 1.0594826213978568
Energy: 1.0069045961086425
Energy: 0.9258609436869637
Energy: 1.059482621404056
Energy: 1.0069045961066139
Energy: 0.9258609436869637
Energy: 1.0594826214019895
Energy: 1.0069045961086425
Energy: 0.9258609436869637
Energy: 0.9273349681221202
Energy: 0.9185900654030195
Energy: 0.9185369708221925
Energy: 0.9273349681489828
Energy: 0.9185900654050858
Energy: 0.9185369708201262
Energy: 0.9273349681448501
Energy: 0.9185900654030195
Energy: 0.9185369708221925
Energy: 0.9273349681634474
Energy: 0.9264710974368477
Energy: 1.0301035592405943
Energy: 0.957369438932008
Energy: 0.9264710974347813
Energy: 1.0301035592405943
Energy: 0.957369438932008
Energy: 0.9264710974368477
Energy: 1.030103559244727
Energy: 0.9573694389340743
Energy: 0.926471097438914
Energy: 0.9964524316851415
Energy: 0.9232390037386368
Energy: 0.9591318039246982
Energy: 0.996452431687208
Energy: 0.9232390037427696
Energy: 0.9591318039246982
Energy: 0.9964524316851415
Energy: 0.9232390037407031
Energy: 0.9591318039246982
Energy: 0.996452431687208
Energy: 0.9672212415677304
Energy: 0.9354360984733743
Energy: 1.0188319924209395
Energy: 0.9672212415677304
Energy: 0.9354360984754407
Energy: 1.018831992425072
Energy: 0.967221241565664
Energy: 0.9354360984754407
Energy: 1.0188319924271385
Energy: 0.967221241565664
Energy: 0.9444171760382829
Energy: 1.1468167339767907
Energy: 0.9118008649145337
Energy: 0.9444171760403494
Energy: 1.1468167339747244
Energy: 0.9118008649166001
Energy: 0.9444171760403494
Energy: 1.1468167339747244
Energy: 0.9118008649166001
Energy: 0.9444171760403494
Energy: 0.9535095242175796
Energy: 0.9535993759628045
Energy: 0.9339054515214279
Energy: 0.9506334129467591
Energy: 0.9534997171163794
Energy: 0.933905451523494
Energy: 0.953509524219646
Energy: 0.9535993759648709
Energy: 0.9339054515193613
Energy: 0.9506334129488254
Energy: 0.9169293266875708
Energy: 0.9361211235882798
Energy: 0.9040569403047121
Energy: 0.9169293266896372
Energy: 0.9361211235841472
Energy: 0.9040569403047121
Energy: 0.9169293266937698
Energy: 0.9361211235882798
Energy: 0.9040569403026457
Energy: 0.9169293266896372
Energy: 0.9959012175632072
Energy: 0.9434498511916275
Energy: 0.9614133453949575
Energy: 0.9959012175590742
Energy: 0.943449851189561
Energy: 0.9614133453970236
Energy: 0.9959012175632072
Energy: 0.943449851189561
Energy: 0.9614133453990901
Energy: 0.9959012175652733
Energy: 0.930752465680431
Energy: 1.0665737926395873
Energy: 0.9920089894136999
Energy: 0.9307487438173736
Energy: 1.0665737926375207
Energy: 0.9920089894136999
Energy: 0.9307524656783646
Energy: 1.0665737926395873
Energy: 0.9920089894116334
Energy: 0.9307487438153073
Energy: 1.0085615601149023
Energy: 0.9022810282149717
Energy: 0.9809070757048389
Energy: 1.0085615601149023
Energy: 0.9022810282149717
Energy: 0.9809070757048389
Energy: 1.0085615601149023
Energy: 0.9022810282149717
Energy: 0.9809070757048389
Energy: 1.0085615601128357
Energy: 1.0338705764665663
Energy: 0.9266664122264087
Energy: 1.0351558274281016
Energy: 1.0338705764644998
Energy: 0.9266664122305411
Energy: 1.0351558274281016
Energy: 1.0338705764665663
Energy: 0.9266664122243421
Energy: 1.0351558274281016
Energy: 1.0338705764624334
Energy: 0.9952182336431885
Energy: 0.907841955664136
Energy: 0.9746491417319982
Energy: 0.9916893784658916
Energy: 0.9075885564808599
Energy: 0.9746491417319982
Energy: 0.9952182336369895
Energy: 0.9078419556662023
Energy: 0.9746491417319982
Energy: 0.9916893784679579
Energy: 0.9272629491562863
Energy: 0.906877538650252
Energy: 1.0248963620181506
Energy: 0.9272629491562863
Energy: 0.9068775386523183
Energy: 1.0248963620160845
Energy: 0.9272629491583528
Energy: 0.9068775386523183
Energy: 1.0248963620181506
Energy: 0.9272629491604192
Energy: 1.0120264423155874
Energy: 1.0308199630864285
Energy: 0.9230952219636639
Energy: 1.0120264423135212
Energy: 1.0308199630843622
Energy: 0.9231160090332013
Energy: 1.0120264423155874
Energy: 1.0308199630864285
Energy: 0.9230952219636639
Energy: 1.0120264423176537
Energy: 0.9029251891287471
Energy: 1.0535369870308342
Energy: 1.0043292778725037
Energy: 0.9029251891287471
Energy: 1.0535369870329008
Energy: 1.0043292778704374
Energy: 0.9029251891308133
Energy: 1.0535369870329008
Energy: 1.0043292778704374
Energy: 0.9029251891308133
Energy: 0.9601396543786997
Energy: 1.0034156241346441
Energy: 0.9136947216503578
Energy: 0.9482148958403805
Energy: 1.0034156241346441
Energy: 0.9136947216482915
Energy: 0.9601396543725007
Energy: 1.0034156241325776
Energy: 0.9136947216482915
Energy: 0.948214895838314
Energy: 0.9595795825396655
Energy: 1.0011988631923194
Energy: 1.0039948161865633
Energy: 0.9481260387645567
Energy: 1.0011988631923194
Energy: 0.990140505576633
Energy: 0.9595795825396655
Energy: 1.0011988631943858
Energy: 1.0039948161844967
Energy: 0.9481260387645567
Energy: 0.9089825830152752
Energy: 1.1311338967611675
Energy: 1.0234249611365407
Energy: 0.9089825830132088
Energy: 1.1311338967611675
Energy: 1.0234249611365407
Energy: 0.9089825830111424
Energy: 1.131133896763234
Energy: 1.0234249611344741
Energy: 0.9089825830132088
Energy: 1.0740261130689992
Energy: 0.9229238133641959
Energy: 0.9500186018677088
Energy: 1.0740261130689992
Energy: 0.9229238133662623
Energy: 0.9500186018635759
Energy: 1.0740261130628002
Energy: 0.9229238133662623
Energy: 0.9500186018697749
Energy: 1.0740261130628002
Energy: 0.9292597562449209
Energy: 1.0086795175963579
Energy: 0.9076234787661286
Energy: 0.9292597562449209
Energy: 1.0086795175963579
Energy: 0.9073502423895838
Energy: 0.9292597562469873
Energy: 1.0086795176004903
Energy: 0.9076234787619957
Energy: 0.9292597562449209
Energy: 1.028787405728857
Energy: 1.0050855316835623
Energy: 0.9119050471316259
Energy: 1.0287874057267907
Energy: 1.0050855316835623
Energy: 0.9119050471336922
Energy: 1.0287874057267907
Energy: 1.0050855316835623
Energy: 0.9119050471316259
Energy: 1.0287874057309234
Energy: 1.000907863103028
Energy: 1.0001501176719279
Energy: 0.9259147445607224
Energy: 1.0009078631009616
Energy: 1.0001501176739942
Energy: 0.9259147445607224
Energy: 1.000907863103028
Energy: 1.0001501176719279
Energy: 0.9259147445566274
Energy: 1.0009078631009616
Energy: 1.0438196337229888
Energy: 0.9760447853118088
Energy: 0.9024374121758015
Energy: 1.0438196337229888
Energy: 0.9760447853118088
Energy: 0.9024374121758015
Energy: 1.0438196337229888
Energy: 0.9760447853118088
Energy: 0.9024374121758015
Energy: 1.0438196337250552
Energy: 0.9346815135299078
Energy: 1.0078589065229444
Energy: 0.9643720760531095
Energy: 0.9346815135299078
Energy: 1.0078589065250108
Energy: 0.9643720760531095
Energy: 0.9346815135278415
Energy: 1.0078589065250108
Energy: 0.9643720760510432
Energy: 0.9346815135299078
Energy: 1.00852797890026
Energy: 0.9391914612497655
Energy: 0.9403258987071699
Energy: 1.0085279788981938
Energy: 0.9394220027868879
Energy: 0.940331496952288
Energy: 1.00852797890026
Energy: 0.9391914612497655
Energy: 0.9403258987071699
Energy: 1.0085279789023265
Energy: 1.1127278268057677
Energy: 0.9032781976808888
Energy: 0.987322644706444
Energy: 1.1127278268099003
Energy: 0.9032781976829551
Energy: 0.987322644706444
Energy: 1.1127278268037013
Energy: 0.9032781976808888
Energy: 0.987322644706444
Energy: 1.1127278268057677
Energy: 0.9490515635434009
Energy: 1.163250218071059
Energy: 0.9522435856588193
Energy: 0.9490515635434009
Energy: 1.163250218071059
Energy: 0.9522435856588193
Energy: 0.9490515635434009
Energy: 1.1632502180731255
Energy: 0.9522435856588193
Energy: 0.9490515635434009
Energy: 1.0075827638252233
Energy: 0.9119329684255957
Energy: 1.0724915635674663
Energy: 1.0075827638272896
Energy: 0.9119328508670811
Energy: 1.0724915635633336
Energy: 1.0075827638252233
Energy: 0.9119329684255957
Energy: 1.0724915635674663
Energy: 1.0075827638252233
Energy: 1.0137151838544012
Energy: 0.9228444193250945
Energy: 1.0116655249647275
Energy: 1.0137151838544012
Energy: 0.9228444193250945
Energy: 1.0116655249626614
Energy: 1.0137151838482021
Energy: 0.9228444193250945
Energy: 1.0116655249647275
Energy: 1.013715183852335
Energy: 1.0305706861249275
Energy: 0.9493055918380873
Energy: 0.9235019006804275
Energy: 1.030570686126994
Energy: 0.9493055918380873
Energy: 0.9235011564350508
Energy: 1.0305706861290602
Energy: 0.9493055918380873
Energy: 0.9235019006742284
Energy: 1.0305706861249275
Energy: 0.9025225667375798
Energy: 0.9001847141391708
Energy: 0.9072896296766116
Energy: 0.902522566739646
Energy: 0.9001847141391708
Energy: 0.9072896296807444
Energy: 0.9025225667417123
Energy: 0.9001847141391708
Energy: 0.9072896296724791
Energy: 0.902522566739646
Energy: 0.9266780277319946
Energy: 0.9989772316511475
Energy: 1.0010852013677267
Energy: 0.9266780277299285
Energy: 0.9989772316573465
Energy: 1.0010852013697928
Energy: 0.9266780277319946
Energy: 0.9989772316511475
Energy: 1.0010852013697928
Energy: 0.9266780277319946

minimum gb energy = 0.9001847141391708 eV
minimum distance =  2.25525718200691 Angstroms
sigma value = 437


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

Energy: 0.9185616936246106
Energy: 0.9215336897296355
Energy: 0.9212716678226779
Energy: 0.918561693623858
Energy: 0.9215336897288826
Energy: 0.9212716678241836
Energy: 0.9185616936246106
Energy: 0.9215336897288826
Energy: 0.9212716678234307
Energy: 0.918561693623858
Energy: 1.0551968260873235
Energy: 0.9020430795481457
Energy: 0.8989975265812896
Energy: 1.055196826088829
Energy: 0.9020430795488984
Energy: 0.8989975265812896
Energy: 1.0551968260873235
Energy: 0.9020430795488984
Energy: 0.8989975265805368
Energy: 1.0551968260880762
Energy: 1.044968957867722
Energy: 0.8875620278005363
Energy: 1.116486088379849
Energy: 1.044968957866969
Energy: 0.8875620278005363
Energy: 1.1164860883806018
Energy: 1.044968957867722
Energy: 0.8875620278005363
Energy: 1.1164860883790961
Energy: 1.044968957867722
Energy: 0.9708591430992047
Energy: 1.0520896593003326
Energy: 0.9650106663833543
Energy: 0.9708591430999576
Energy: 1.0520896593003326
Energy: 0.9650106663833543
Energy: 0.9708591431007104
Energy: 1.0520896593010856
Energy: 0.9650106663833543
Energy: 0.9708591431007104
Energy: 0.9738921898228827
Energy: 0.9173897714461624
Energy: 1.106999890793007
Energy: 0.9738921898236357
Energy: 0.9173897714461624
Energy: 1.1069998907945124
Energy: 0.9738921898221299
Energy: 0.9173897714461624
Energy: 1.106999890793007
Energy: 0.9738921898221299
Energy: 1.00494645423252
Energy: 0.9819264530113164
Energy: 0.9008242860390815
Energy: 1.004946454233273
Energy: 0.9819264530113164
Energy: 0.9008242860383286
Energy: 1.00494645423252
Energy: 0.9819264530113164
Energy: 0.9008242860383286
Energy: 1.004946454233273
Energy: 1.0276557242535667
Energy: 0.9311940159718516
Energy: 0.8876962135338367
Energy: 1.0276557242535667
Energy: 0.9311940159726045
Energy: 0.8876962135330839
Energy: 1.0276557242528137
Energy: 0.9311940159718516
Energy: 0.8876962135345895
Energy: 1.0276557242550721
Energy: 0.9722708077039705
Energy: 1.0184423722542646
Energy: 0.9599303170067348
Energy: 0.9722708077039705
Energy: 1.0184423722550173
Energy: 0.9599303170067348
Energy: 0.9722708077039705
Energy: 1.0184423722542646
Energy: 0.9599303170067348
Energy: 0.9722708077039705
Energy: 0.9199968861224808
Energy: 0.9151651037833459
Energy: 0.9167128266350404
Energy: 0.9199968861202223
Energy: 0.9151651037810876
Energy: 0.9167128266342877
Energy: 0.9199968861194695
Energy: 0.9151651037833459
Energy: 0.9167128266350404
Energy: 0.9199968861126943
Energy: 0.9637427219257236
Energy: 0.9787871441193081
Energy: 1.0488412474768956
Energy: 0.9637427219249707
Energy: 0.9787871441193081
Energy: 1.0488412474753899
Energy: 0.9637427219257236
Energy: 0.9787871441193081
Energy: 1.0488412474768956
Energy: 0.9637427219242181
Energy: 0.9555903233268982
Energy: 0.898511705813306
Energy: 1.0256938430945337
Energy: 0.9555903233261456
Energy: 0.8985117058155645
Energy: 1.0256938430945337
Energy: 0.9555903233268982
Energy: 0.8985117058140588
Energy: 1.0256938430945337
Energy: 0.9555903233253927
Energy: 0.979486994165951
Energy: 0.8991033627657606
Energy: 1.0512426043004046
Energy: 0.9794869941667038
Energy: 0.8991033627665135
Energy: 1.0512426042996519
Energy: 0.9794869941667038
Energy: 0.8991033627657606
Energy: 1.0512426043004046
Energy: 0.979486994165951
Energy: 0.9154538743268993
Energy: 0.9362981136385836
Energy: 0.9165593197553079
Energy: 0.9154538743261467
Energy: 0.9362981136641791
Energy: 0.9165593197545551
Energy: 0.9154538743268993
Energy: 0.9362981136566509
Energy: 0.9165593197553079
Energy: 0.9154538743253938
Energy: 0.9783216331680726
Energy: 0.9012929888815313
Energy: 0.9598576318594635
Energy: 0.9783216331688255
Energy: 0.901292988882284
Energy: 0.9598576318594635
Energy: 0.9783216331680726
Energy: 0.9012929888815313
Energy: 0.9598576318594635
Energy: 0.9783216331680726

minimum gb energy = 0.8875620278005363 eV
minimum distance =  2.26438975141676 Angstroms
sigma value = 33