Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_AlU__MO_596300673917_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.360254209517775
mass=26.981538
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: 0.011721968121255394
Energy: 0.20667331820391402
Energy: 0.20667331820391402
Energy: 0.011721968121255394
Energy: 0.20667331820391402
Energy: 0.20667331820391402
Energy: 0.011721968121255394
Energy: 0.20667331820391402
Energy: 0.20667331820391402
Energy: 0.011721968121255394
Energy: 0.20627798622764748
Energy: 0.012716853045854131
Energy: 0.20702202849938625
Energy: 0.20627798622764748
Energy: 0.012716853045854131
Energy: 0.20702202849938625
Energy: 0.20627798622764748
Energy: 0.012716853045854131
Energy: 0.20702202849938625
Energy: 0.20627798622764748
Energy: 0.8818175302609235
Energy: 0.38396103479712623
Energy: 0.28345403396208674
Energy: 0.8967896788704928
Energy: 0.18056233160100466
Energy: 0.13015792457316622
Energy: 0.6398273442460135
Energy: 0.014719493943290323
Energy: 0.13015792457316622
Energy: 0.6398301505686709
Energy: 0.20627798622764748
Energy: 0.20702202849938625
Energy: 0.012716853045854131
Energy: 0.20627798622764748
Energy: 0.20702202849938625
Energy: 0.012716853045854131
Energy: 0.20627798622764748
Energy: 0.20702202849938625
Energy: 0.012716853045854131
Energy: 0.20627798622649587
Energy: 0.011721968121255394
Energy: 0.20667331820391402
Energy: 0.20667331820391402
Energy: 0.011721968121255394
Energy: 0.20667331820391402
Energy: 0.20667331820391402
Energy: 0.011721968121255394
Energy: 0.20667331820391402
Energy: 0.20667331820391402
Energy: 0.011721968121255394
Energy: 0.20627798622764748
Energy: 0.012716853045854131
Energy: 0.20702202849938625
Energy: 0.20627798622764748
Energy: 0.012716853045854131
Energy: 0.20702202849938625
Energy: 0.20627798622764748
Energy: 0.012716853045854131
Energy: 0.20702202849938625
Energy: 0.20627798622764748
Energy: 0.6398833612604736
Energy: 0.13015792457316622
Energy: 0.18056233160100466
Energy: 0.6398447162355385
Energy: 0.40791293157909564
Energy: 0.18056233160215632
Energy: 0.6398235232862236
Energy: 0.38396103479827787
Energy: 0.38396103479827787
Energy: 0.6398416767445125

minimum gb energy = 0.011721968121255394 eV
minimum distance =  2.65787412358356 Angstroms
sigma value = 3


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

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Energy: 0.7356467373405599
Energy: 0.7762404774430309
Energy: 0.5626741357787486
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Energy: 0.652222357143175
Energy: 0.5911813657695564
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Energy: 0.6038176589369535
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Energy: 0.7356467373405599
Energy: 0.7762404774424667
Energy: 0.5619074740096538
Energy: 0.7356467373391493
Energy: 0.7762404774421845
Energy: 0.5894706207759375
Energy: 0.7356467373397136
Energy: 0.7762404774438773
Energy: 0.5619074740088074
Energy: 0.652222356036136
Energy: 0.5911813657695564
Energy: 0.7786951690984022
Energy: 0.6522223480260742
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Energy: 0.7786951691105325
Energy: 0.6522223559887689
Energy: 0.5911813657701206
Energy: 0.778695169073603
Energy: 0.6522223533931885
Energy: 0.7921400368897268
Energy: 0.7252568029384591
Energy: 0.7986294899863304
Energy: 0.7989610989039218
Energy: 0.7252568029384591
Energy: 0.7986294899871768
Energy: 0.7921400368885984
Energy: 0.7252568029393055
Energy: 0.7986294899874589
Energy: 0.7989610989050503
Energy: 0.7445070419944917
Energy: 0.7434715403144461
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Energy: 0.5402709914599007
Energy: 0.7445070419944917
Energy: 0.7434715403138819
Energy: 0.5402709914599007
Energy: 0.744507041995338

minimum gb energy = 0.5274761638212013 eV
minimum distance =  2.45848521513901 Angstroms
sigma value = 75


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

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Energy: 0.5040820174911003
Energy: 0.5167133141682686
Energy: 0.592993993795777
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minimum gb energy = 0.5027947899934574 eV
minimum distance =  2.43796388679792 Angstroms
sigma value = 105


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

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Energy: 0.7172379193308525
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Energy: 0.7051650541620466
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Energy: 0.7129353147438429
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Energy: 0.7225296430930339
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Energy: 0.6694111074713444
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Energy: 0.6716716923096216
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Energy: 0.6775091326190621
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Energy: 0.677659609071648
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Energy: 0.7844215469917548
Energy: 0.6803914676119842
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Energy: 0.6800944612738163
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Energy: 0.7844215469914441
Energy: 0.6803914676110523
Energy: 0.7224408474783804
Energy: 0.7844215469925171
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Energy: 0.7053597233409513
Energy: 0.6080327701060175
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Energy: 0.7053597233406407
Energy: 0.6080327701061587
Energy: 0.7083079101529892
Energy: 0.7053597233395679
Energy: 0.6080327701061587
Energy: 0.7083079101537798
Energy: 0.6957892739236259
Energy: 0.7849668150974985
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Energy: 0.6957892739233152
Energy: 0.7905398639965919
Energy: 0.655096257503973
Energy: 0.6957892739237953
Energy: 0.7849668150965669
Energy: 0.655096257503973
Energy: 0.6957892739236259
Energy: 0.698217328990766
Energy: 0.6837810004628229
Energy: 0.7113106742882197
Energy: 0.6982173289903143
Energy: 0.678094807771845
Energy: 0.7113106742874291
Energy: 0.6982173289896932
Energy: 0.6837810004629923
Energy: 0.7113106742880504
Energy: 0.6982173289900038
Energy: 0.7195661765150131
Energy: 0.648278904881977
Energy: 0.7112732088525504
Energy: 0.7195661765148437
Energy: 0.648168492434393
Energy: 0.7112732088519292
Energy: 0.7195661765151542
Energy: 0.6482789048810453
Energy: 0.7112732088519292
Energy: 0.7195661765156341

minimum gb energy = 0.5891802486497982 eV
minimum distance =  2.47221777423629 Angstroms
sigma value = 165


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

Energy: 0.632776516435774
Energy: 0.7527936323436925
Energy: 0.752804511421785
Energy: 0.632776516435241
Energy: 0.7527847930393637
Energy: 0.7528027323343636
Energy: 0.632776516435774
Energy: 0.7527863988737431
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Energy: 0.632776516435241
Energy: 0.732422762285875
Energy: 0.7424873416172202
Energy: 0.7686478156549349
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Energy: 0.7127258172231784
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Energy: 0.6045614583964245
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Energy: 0.7989150548517525
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Energy: 0.6995517666671068
Energy: 0.7700712107056372
Energy: 0.7063736261173125
Energy: 0.6995419900722141
Energy: 0.7700712107061704
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Energy: 0.7971243544625498
Energy: 0.6226466803461829
Energy: 0.8740883885858546
Energy: 0.7971243535172075
Energy: 0.6226467882666915
Energy: 0.8740883885869207
Energy: 0.7971243544710798
Energy: 0.6226502447179361
Energy: 0.8740883885863876
Energy: 0.7971243535182737
Energy: 0.7130873282425071
Energy: 0.6041103153484393
Energy: 0.8413649881241485
Energy: 0.7130664658929774
Energy: 0.6041028984404632
Energy: 0.8413649874958914
Energy: 0.713084086042735
Energy: 0.6041010162833408
Energy: 0.8413649874985568
Energy: 0.7130927918081913
Energy: 0.7324170465040296
Energy: 0.7690064888101515
Energy: 0.7424464693870808
Energy: 0.7324170616320277
Energy: 0.7690064866088034
Energy: 0.7424464693865477
Energy: 0.7324170475804467
Energy: 0.7690064870947905
Energy: 0.7424464693876139
Energy: 0.7324170930060485
Energy: 0.632776516435774
Energy: 0.752791058947268
Energy: 0.7527971863258152
Energy: 0.6327765164363073
Energy: 0.7526490493593366
Energy: 0.7527943030685974
Energy: 0.632776516435774
Energy: 0.7527952169229534
Energy: 0.7527756850085449
Energy: 0.632776516435774

minimum gb energy = 0.6041010162833408 eV
minimum distance =  2.60141500894629 Angstroms
sigma value = 41


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

Energy: 0.7120318571390102
Energy: 0.711915110381511
Energy: 0.7120217174238019
Energy: 0.7120318571170845
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Energy: 0.6909376265194105
Energy: 0.7073096271343049
Energy: 0.6992246581913805
Energy: 0.7211075298811144
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Energy: 0.7446144707335578
Energy: 0.7211075298823555
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Energy: 0.6721598334410249
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Energy: 0.6682231708419982
Energy: 0.6721598334404232
Energy: 0.6651031335401136
Energy: 0.6682231709594492
Energy: 0.7509674765777102
Energy: 0.6751163400312111
Energy: 0.7602241773125153
Energy: 0.7509674765772965
Energy: 0.6751163400306093
Energy: 0.7602241773139822
Energy: 0.7509674765768828
Energy: 0.6751163400318504
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Energy: 0.7133344933277874
Energy: 0.7109946613306871
Energy: 0.7125803840030168
Energy: 0.7133344933275994
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Energy: 0.7133344933273738
Energy: 0.7109946613315145
Energy: 0.7125803839976389
Energy: 0.7133344933273738
Energy: 0.6784026516616817
Energy: 0.7285629411573018
Energy: 0.7134841554993564
Energy: 0.6784026516616817
Energy: 0.72854276332531
Energy: 0.7134841681402835
Energy: 0.6784026516606663
Energy: 0.7287445166912814
Energy: 0.7134844223640637
Energy: 0.6784026516627347
Energy: 0.6071884321851049
Energy: 0.608384337590333
Energy: 0.6080784276412579
Energy: 0.607188432185293
Energy: 0.6083843299424818
Energy: 0.6080697691956259
Energy: 0.6071884321851049
Energy: 0.608387326849409
Energy: 0.608082574316517
Energy: 0.6071884321855187
Energy: 0.6564325672322894
Energy: 0.6056382761746288
Energy: 0.6149292784358796
Energy: 0.6564325535468272
Energy: 0.6056382761750426
Energy: 0.6149165796050957
Energy: 0.6564136543722975
Energy: 0.6056382761731621
Energy: 0.614942253351365
Energy: 0.6564293152156792
Energy: 0.7359105158869426
Energy: 0.60709045333672
Energy: 0.6380667428770589
Energy: 0.735910515887582
Energy: 0.6070904533373592
Energy: 0.6378571304476099
Energy: 0.7359105158867546
Energy: 0.6070904533354788
Energy: 0.6380435621335865
Energy: 0.73591051588777
Energy: 0.7981249546939848
Energy: 0.6988189553443022
Energy: 0.6018105896600248
Energy: 0.7981249546937967
Energy: 0.6988189553443022
Energy: 0.6018105896575802
Energy: 0.7981249546937967
Energy: 0.6988189553445279
Energy: 0.6018105896594229
Energy: 0.798124954693571

minimum gb energy = 0.5987814965948325 eV
minimum distance =  2.52732397475934 Angstroms
sigma value = 185


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

Energy: 0.5207203673792776
Energy: 0.418579590538917
Energy: 0.41701084829356444
Energy: 0.42163511595944897
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Energy: 0.4715674912359099
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Energy: 0.41266390370691186
Energy: 0.4206586657926186
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Energy: 0.4193861914797726
Energy: 0.3959153763008094
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Energy: 0.41857959053867155
Energy: 0.41701084829356444
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Energy: 0.41857959054014476
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Energy: 0.4588207670658849
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Energy: 0.43719061456354386
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Energy: 0.39534407940250166
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Energy: 0.604862472833629
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Energy: 0.4475120254234785
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Energy: 0.4951640210388505
Energy: 0.3928381475865961
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Energy: 0.49516402103909596
Energy: 0.40847291664173263
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Energy: 0.39283814758782376
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Energy: 0.4211633846558894
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Energy: 0.3927059582948327
Energy: 0.41834505928180044
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Energy: 0.4083846161671626
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Energy: 0.46169186504090415
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Energy: 0.5412133688781819
Energy: 0.4616918650423773
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Energy: 0.4163979238161565
Energy: 0.44751202542446067
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Energy: 0.43489328381129305
Energy: 0.5044449390876531
Energy: 0.4163979238154199
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Energy: 0.4951640210381138
Energy: 0.4101168597725444
Energy: 0.4210235729155698
Energy: 0.4951640210388505
Energy: 0.39555390400666784
Energy: 0.4210235729160608
Energy: 0.4951640210386049
Energy: 0.41011685977279
Energy: 0.4210235729160608
Energy: 0.4951640210386049
Energy: 0.4814251404978767
Energy: 0.4328931128497431
Energy: 0.42116338465711706
Energy: 0.5222477052374568
Energy: 0.4253687689183031
Energy: 0.4211633846553984
Energy: 0.48142514049763113
Energy: 0.43289311284753323
Energy: 0.4211633846553984
Energy: 0.522247705238439
Energy: 0.3960859826524074
Energy: 0.3941561925161473
Energy: 0.41938619148001816
Energy: 0.39591537630056384
Energy: 0.3945303137584495
Energy: 0.41938619147952705
Energy: 0.3960859826533895
Energy: 0.3941561925154107
Energy: 0.41938619147928147
Energy: 0.3959153763000728
Energy: 0.449421375659328
Energy: 0.5022130652030344
Energy: 0.4208169776849568
Energy: 0.449365951469735
Energy: 0.5022130652042621
Energy: 0.4208169776849568
Energy: 0.4494213756578547
Energy: 0.5022130652045077
Energy: 0.4208169776852023
Energy: 0.44936595147096275

minimum gb energy = 0.3927059582948327 eV
minimum distance =  2.59729531869613 Angstroms
sigma value = 33


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

Energy: 0.6119588570800202
Energy: 0.6524939355265279
Energy: 0.658162507164102
Energy: 0.6032293680622864
Energy: 0.6524939355265279
Energy: 0.658162507162754
Energy: 0.6119588570786721
Energy: 0.6524939355278758
Energy: 0.658162507162754
Energy: 0.6032293680609385
Energy: 0.6548170923462621
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Energy: 0.6239558964189824
Energy: 0.5927366752898654
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Energy: 0.6995030267898613
Energy: 0.5790165828726634
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Energy: 0.6800972945531425
Energy: 0.6319686811097629
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Energy: 0.6572310674071545
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Energy: 0.6572310674085026
Energy: 0.6442418593411892
Energy: 0.6559768576744366
Energy: 0.6327643764327215
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Energy: 0.6442418593411892
Energy: 0.6681424599022618
Energy: 0.6416249534869051
Energy: 0.5920839024193879
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Energy: 0.6487704328647727
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Energy: 0.5947060347302358

minimum gb energy = 0.5790165828726634 eV
minimum distance =  2.49788502104046 Angstroms
sigma value = 219


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

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Energy: 0.6688048699864511
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Energy: 0.731403795391062
Energy: 0.7340588882789709
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Energy: 0.7314052557524572
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Energy: 0.6733272817019035
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Energy: 0.6733272817027955
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Energy: 0.6900373808182073
Energy: 0.6908657079786614
Energy: 0.7644360263439117
Energy: 0.6900373808182073

minimum gb energy = 0.6543736041015212 eV
minimum distance =  2.56039458137204 Angstroms
sigma value = 15


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

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Energy: 0.7692154216272746
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minimum gb energy = 0.6752619309492114 eV
minimum distance =  2.50345256708779 Angstroms
sigma value = 293


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

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Energy: 0.6469764951021709
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Energy: 0.7959621387671508
Energy: 0.7709647669712736
Energy: 0.6469764951023725
Energy: 0.7959621387671508
Energy: 0.7084058994659852
Energy: 0.8442726549704832
Energy: 0.6504326413350066
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Energy: 0.8442726549706847
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Energy: 0.7084058994659852
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Energy: 0.7051289022255139
Energy: 0.7088052836892993
Energy: 0.6480542631174727
Energy: 0.7051289022255139
Energy: 0.7088052836892993
Energy: 0.6480542631172712
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Energy: 0.7088052836892993
Energy: 0.6480542631174727
Energy: 0.7051289022255139
Energy: 0.6986795415053761
Energy: 0.7743663945175218
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Energy: 0.6772782688665571
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Energy: 0.6772782688665571
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Energy: 0.8380525904419188
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Energy: 0.6772782688663556
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Energy: 0.6540977025331309
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Energy: 0.698594199802834
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Energy: 0.6480549842839004
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Energy: 0.7051788669745899
Energy: 0.7084397982264298
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Energy: 0.7958145046554715
Energy: 0.6470460357283263
Energy: 0.7708731244500217
Energy: 0.79581450465527
Energy: 0.8011154192974113
Energy: 0.7244889070458617
Energy: 0.7180184584009713
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Energy: 0.7244889070458617
Energy: 0.7180184584009713
Energy: 0.8011154192972096
Energy: 0.7244889070458617
Energy: 0.7180184584007697
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Energy: 0.6719020330654003
Energy: 0.7201985478462536
Energy: 0.6765827050697053
Energy: 0.6719020330651989
Energy: 0.7201985476702156
Energy: 0.6765827050699067
Energy: 0.671902033064796
Energy: 0.7201985475197682
Energy: 0.6765827050697053
Energy: 0.6719020330654003
Energy: 0.7225090897555375
Energy: 0.734649536606963
Energy: 0.7346492232944741
Energy: 0.7225090897557389
Energy: 0.7346495366067615
Energy: 0.7346492232944741
Energy: 0.7225090897557389
Energy: 0.734649536606963
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Energy: 0.7225090897559404
Energy: 0.6719702879314869
Energy: 0.6766359576338385
Energy: 0.7683670061340923
Energy: 0.6719702879314869
Energy: 0.6766359576334355
Energy: 0.7683670061340923
Energy: 0.6719702879316884
Energy: 0.6766359576338385
Energy: 0.7683670061338906
Energy: 0.67197028793189
Energy: 0.8011420831754316
Energy: 0.7180266172914754
Energy: 0.7244980725635626
Energy: 0.8011420831752302
Energy: 0.7180266172914754
Energy: 0.7244980725635626
Energy: 0.8011420831758346
Energy: 0.7180266172914754
Energy: 0.724498072563764
Energy: 0.8011420831756332
Energy: 0.7959621387671508
Energy: 0.7709647669712736
Energy: 0.6469764951021709
Energy: 0.7959621387671508
Energy: 0.7709647669704676
Energy: 0.6469764951021709
Energy: 0.7959621387671508
Energy: 0.7709647669708706
Energy: 0.6469764951023725
Energy: 0.7959621387671508
Energy: 0.7084058994657836
Energy: 0.8442726549716922
Energy: 0.6504326413348052
Energy: 0.7084058994659852
Energy: 0.8442726549714907
Energy: 0.650432641334402
Energy: 0.7084058994657836
Energy: 0.8442726549710876
Energy: 0.6504326413350066
Energy: 0.7084058994659852

minimum gb energy = 0.6469764951021709 eV
minimum distance =  2.51011516777664 Angstroms
sigma value = 293


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

Energy: 0.6542992221562439
Energy: 0.6936390558907493
Energy: 0.6936175952731611
Energy: 0.6542992221562439
Energy: 0.6936133175715872
Energy: 0.6936267667754565
Energy: 0.6542992221566082
Energy: 0.6936342765074425
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Energy: 0.6542992221562439
Energy: 0.7002076167297033
Energy: 0.6552137378793365
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Energy: 0.7004569482679446
Energy: 0.7002080342859281
Energy: 0.692481260089897
Energy: 0.6547511598280841
Energy: 0.6728075463233306
Energy: 0.6929127781918184
Energy: 0.6547876610236633
Energy: 0.6728076740783628
Energy: 0.6924794745379352
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Energy: 0.6924788357973554
Energy: 0.6729038168960679
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Energy: 0.6542992221566082
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Energy: 0.6552137378793365
Energy: 0.7004569315000705
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Energy: 0.6552137378797006
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Energy: 0.7002077646093331
Energy: 0.6552137378793365
Energy: 0.6547494741800826
Energy: 0.6728083697478943
Energy: 0.692611065048713
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Energy: 0.6547114129193721
Energy: 0.6929318460180485
Energy: 0.6729040046466314
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Energy: 0.692490625234176
Energy: 0.6729034313368549
Energy: 0.6547159883073503
Energy: 0.6924905220863747
Energy: 0.6729035828655038
Energy: 0.6547158970927668
Energy: 0.6551935211529453
Energy: 0.7002089154228327
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Energy: 0.6934458735900647
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Energy: 0.6542992221562439
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Energy: 0.6936365202768554
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Energy: 0.6552137378793365
Energy: 0.7004575852491883
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Energy: 0.6552137378789722
Energy: 0.7004577432458695
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Energy: 0.6547724797264827
Energy: 0.6728076537531958
Energy: 0.6926133558902728
Energy: 0.6547466158597605
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Energy: 0.67290398096148
Energy: 0.6546981479342503
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Energy: 0.6547005714066523
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Energy: 0.6729043651064436
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Energy: 0.7004412449952014
Energy: 0.6551935211529453
Energy: 0.7002094501961836
Energy: 0.7004417104823004
Energy: 0.6551935211529453
Energy: 0.7002094089259157
Energy: 0.7004412420465695
Energy: 0.6551935211533095
Energy: 0.7002090188967992
Energy: 0.6542992221577006
Energy: 0.6936271460143989
Energy: 0.6937686786995663
Energy: 0.6542992221562439
Energy: 0.6936280296554579
Energy: 0.6936277642478162
Energy: 0.6542992221569723
Energy: 0.6936260185522374
Energy: 0.6936235308095402
Energy: 0.6542992221562439
Energy: 0.7002077445979655
Energy: 0.6552137378793365
Energy: 0.7004571864739149
Energy: 0.7002077782076112
Energy: 0.6552137378789722
Energy: 0.7004576431227828
Energy: 0.700207662736346
Energy: 0.6552137378797006
Energy: 0.7004572576556602
Energy: 0.7002076879707952
Energy: 0.6924737763400752
Energy: 0.6547657825659146
Energy: 0.672808957009776
Energy: 0.6926091707250607
Energy: 0.6547598289610063
Energy: 0.6728080998816388
Energy: 0.6924712673603289
Energy: 0.6547515087423754
Energy: 0.672808535813637
Energy: 0.6924837529901545
Energy: 0.6729024923671287
Energy: 0.6547004606502747
Energy: 0.6924885764387225
Energy: 0.6729034030500295
Energy: 0.6547010162307648
Energy: 0.6924871958017329
Energy: 0.6729037710099224
Energy: 0.6546980195738347
Energy: 0.6924931324276362
Energy: 0.6729038499833324
Energy: 0.7004412534217321
Energy: 0.6551935211529453
Energy: 0.7002093224953826
Energy: 0.70044141092626
Energy: 0.6551935211529453
Energy: 0.7002089915455284
Energy: 0.7004413626429824
Energy: 0.6551935211529453
Energy: 0.7002089686357708
Energy: 0.700441417250156
Energy: 0.693641212703606
Energy: 0.6936278172780136
Energy: 0.6542992221566082
Energy: 0.6936236818896889
Energy: 0.693619534097464
Energy: 0.6542992221566082
Energy: 0.6936354301185014
Energy: 0.6936168031284695
Energy: 0.6542992221558798
Energy: 0.6936377527925256
Energy: 0.6552137378789722
Energy: 0.7004571930293363
Energy: 0.7002076402484861
Energy: 0.6552137378793365
Energy: 0.7004569233902362
Energy: 0.7002078056615341
Energy: 0.6552137378789722
Energy: 0.7004573937265592
Energy: 0.700207712612972
Energy: 0.6552137378786079

minimum gb energy = 0.6542992221558798 eV
minimum distance =  2.6441047473346 Angstroms
sigma value = 15


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

Energy: 0.7061963944682945
Energy: 0.7212737596472119
Energy: 0.7213636707590689
Energy: 0.7061963944682945
Energy: 0.7212737468768186
Energy: 0.7213636708943801
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Energy: 0.7212737466490888
Energy: 0.7213636707227798
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Energy: 0.7854991563758119
Energy: 0.6543777480597611
Energy: 0.6610444082359165
Energy: 0.7854961267825855
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Energy: 0.6746997832950955
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Energy: 0.6655851977921549
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Energy: 0.6788993495543085
Energy: 0.7470990586819068
Energy: 0.7084897259268899
Energy: 0.6610240289199294
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Energy: 0.6610240289215802
Energy: 0.7470990586835277
Energy: 0.7084897259268899
Energy: 0.6610240289199294
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Energy: 0.6301338879764455
Energy: 0.7377528019999304
Energy: 0.6936025814346877
Energy: 0.6301338879764455
Energy: 0.7377553724678679
Energy: 0.6936025814346877
Energy: 0.6301338879764455
Energy: 0.7364635116181477
Energy: 0.6936025814346877
Energy: 0.6301338879764455
Energy: 0.7511071683595033
Energy: 0.6724387573367909
Energy: 0.6929325726408635
Energy: 0.7511071683595033
Energy: 0.6724387573367909
Energy: 0.6929325726408635
Energy: 0.7511071683595033
Energy: 0.67243875733517
Energy: 0.6929325726408635
Energy: 0.7511071683595033
Energy: 0.667663665815911
Energy: 0.7360659144985691
Energy: 0.7462298905740024
Energy: 0.667663665815911
Energy: 0.7360659144985691
Energy: 0.7462298905740024
Energy: 0.667663665815911
Energy: 0.7360659144985691
Energy: 0.7462298905740024
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Energy: 0.8020888290501946
Energy: 0.6306827430620933
Energy: 0.729202092946866
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Energy: 0.729202092946866
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Energy: 0.6306827430604424
Energy: 0.7292020929485169
Energy: 0.8020888290501946
Energy: 0.653823596427465
Energy: 0.6360841806697807
Energy: 0.6737033506404786
Energy: 0.653823596427465
Energy: 0.6360841806697807
Energy: 0.6737033506388276
Energy: 0.653823596427465
Energy: 0.6360841806697807
Energy: 0.6737033506388276
Energy: 0.653823596427465
Energy: 0.7704353556542471
Energy: 0.7612231470738618
Energy: 0.6326275966206281
Energy: 0.7704353556525964
Energy: 0.7612231470738618
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Energy: 0.7704353556542471
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Energy: 0.7704353556525964
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Energy: 0.6988804492288286
Energy: 0.7919824366314662
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Energy: 0.7919824366314662
Energy: 0.6352290850912787
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Energy: 0.7919824366331172
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Energy: 0.7235671858596188
Energy: 0.6889423869176874
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Energy: 0.6889488451958602
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Energy: 0.7146164475114875
Energy: 0.7219754259779468
Energy: 0.7260228867611306
Energy: 0.7146164475098367
Energy: 0.7219754259779468
Energy: 0.7260228867578288
Energy: 0.7146164475098367
Energy: 0.7219754259779468
Energy: 0.7260228867644323
Energy: 0.7146164475098367
Energy: 0.6364754420650424
Energy: 0.806960231699877
Energy: 0.7336373459251266
Energy: 0.6364754420650424
Energy: 0.8069602317015278
Energy: 0.7336373459251266
Energy: 0.6364754420650424
Energy: 0.8069602317048294
Energy: 0.7336373459251266
Energy: 0.6364754420650424
Energy: 0.7682998560169717
Energy: 0.6336287246912031
Energy: 0.7727599690585576
Energy: 0.7682998560153208
Energy: 0.6336287246912031
Energy: 0.7727599690585576
Energy: 0.7682998560153208
Energy: 0.6336287246912031
Energy: 0.7727599690585576
Energy: 0.7682998560186225
Energy: 0.6817623762772612
Energy: 0.7786705584242247
Energy: 0.6387901569569124
Energy: 0.681762376278912
Energy: 0.7786705584258756
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Energy: 0.681762376278912
Energy: 0.7786705584258756
Energy: 0.6387901569569124
Energy: 0.681762376278912
Energy: 0.7351060351179585
Energy: 0.7697272466689729
Energy: 0.636842879614491
Energy: 0.7350921850109717
Energy: 0.7697272466689729
Energy: 0.6368428796128401
Energy: 0.7351069174599696
Energy: 0.7697272466706236
Energy: 0.6368428796128401
Energy: 0.7351044887748964
Energy: 0.7205135920333722
Energy: 0.7475477676536169
Energy: 0.7507157584898098
Energy: 0.7205135920333722
Energy: 0.7475477676536169
Energy: 0.7507157584914605
Energy: 0.7205135920333722
Energy: 0.7475477676536169
Energy: 0.7507157584914605
Energy: 0.7205135920333722
Energy: 0.8296970826751833
Energy: 0.7224905866652196
Energy: 0.6301303054461338
Energy: 0.8296970826751833
Energy: 0.7224905866635687
Energy: 0.6301303054461338
Energy: 0.8296970826751833
Energy: 0.7224905866635687
Energy: 0.6301303054461338
Energy: 0.8296970826751833
Energy: 0.6334981617201916
Energy: 0.6853976641731548
Energy: 0.664920059124943
Energy: 0.6334981617201916
Energy: 0.6853976641748057
Energy: 0.6649200591232922
Energy: 0.6334981617201916
Energy: 0.6853976641731548
Energy: 0.6649200591232922
Energy: 0.6334981617185406
Energy: 0.6860963587375326
Energy: 0.6648525229751506
Energy: 0.6837010153218586
Energy: 0.6860971870507813
Energy: 0.6648525229751506
Energy: 0.6837010153218586
Energy: 0.6860962707374815
Energy: 0.6648525229751506
Energy: 0.6837010153218586
Energy: 0.6860968459547093
Energy: 0.7774207587205315
Energy: 0.6773296886541403
Energy: 0.7331431165199759
Energy: 0.7774207587188807
Energy: 0.6773296886541403
Energy: 0.733143116518355
Energy: 0.7774207587221824
Energy: 0.6773296886541403
Energy: 0.733143116518355
Energy: 0.7774207587205315
Energy: 0.6598336739042223
Energy: 0.9174101705577603
Energy: 0.659809786515005
Energy: 0.6598336739042223
Energy: 0.9174101705577603
Energy: 0.659809786515005
Energy: 0.6598336739042223
Energy: 0.9174101705577603
Energy: 0.659809786515005
Energy: 0.6598336739042223
Energy: 0.705494970174837
Energy: 0.6343543931311029
Energy: 0.8198269840145286
Energy: 0.705494955371505
Energy: 0.6343543931311029
Energy: 0.8198269840145286
Energy: 0.7054949388965341
Energy: 0.6343543931311029
Energy: 0.8198269840145286
Energy: 0.7054949534589895
Energy: 0.6829320467658537
Energy: 0.6593925303491501
Energy: 0.7412434196313148
Energy: 0.6829320467658537
Energy: 0.6593925303491501
Energy: 0.7412434196296639
Energy: 0.6829320467658537
Energy: 0.6593925303491501
Energy: 0.7412434196296639
Energy: 0.6829320467658537
Energy: 0.6991127962406848
Energy: 0.6609819413585459
Energy: 0.6369275869437052
Energy: 0.6718097211871458
Energy: 0.6609819413585459
Energy: 0.6369275869437052
Energy: 0.6718241211158198
Energy: 0.6609819413585459
Energy: 0.6369275869437052
Energy: 0.6717321418502686
Energy: 0.6372522302622091
Energy: 0.6506979418408894
Energy: 0.7906664536799719
Energy: 0.6372522302622091
Energy: 0.6506979418392386
Energy: 0.7906664536816228
Energy: 0.6372522302622091
Energy: 0.6506979418425402
Energy: 0.7906664536799719
Energy: 0.6372522302622091
Energy: 0.714989672752356
Energy: 0.7257869473122247
Energy: 0.720005766080249
Energy: 0.714989672752356
Energy: 0.7257869473138756
Energy: 0.7200057660818999
Energy: 0.714989672752356
Energy: 0.7257869473138756
Energy: 0.720005766080249
Energy: 0.7149896727507052

minimum gb energy = 0.6301303054461338 eV
minimum distance =  2.50557586111881 Angstroms
sigma value = 437


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

Energy: 0.6433654244677887
Energy: 0.6055745549927788
Energy: 0.6056810801024094
Energy: 0.6433654244671871
Energy: 0.6055745549933802
Energy: 0.6056810801024094
Energy: 0.6433654244677887
Energy: 0.6055745549939816
Energy: 0.6056810801012065
Energy: 0.6433654244671871
Energy: 0.730704916199169
Energy: 0.6247083002412869
Energy: 0.5925036039155088
Energy: 0.7307052310563525
Energy: 0.6247083002412869
Energy: 0.5925036039143059
Energy: 0.7307007234400487
Energy: 0.6247083002412869
Energy: 0.5925036039155088
Energy: 0.7306762802854124
Energy: 0.7294019418134708
Energy: 0.6365501630996122
Energy: 0.7463891159103144
Energy: 0.7294019418134708
Energy: 0.6365501630996122
Energy: 0.7463891157912564
Energy: 0.7294019418134708
Energy: 0.6365501631002136
Energy: 0.7463891158062925
Energy: 0.7294019418134708
Energy: 0.6760700241913241
Energy: 0.7893480584609059
Energy: 0.6444471873653943
Energy: 0.6760700241907227
Energy: 0.7893480585054126
Energy: 0.6444471873659958
Energy: 0.6760700241907227
Energy: 0.7893480588715256
Energy: 0.6444471873653943
Energy: 0.6760700241913241
Energy: 0.7071307217537077
Energy: 0.5898749964436686
Energy: 0.7097532370969308
Energy: 0.7071307217543091
Energy: 0.5898749964436686
Energy: 0.7097533980411861
Energy: 0.7071307217537077
Energy: 0.5898749964436686
Energy: 0.7097534874903406
Energy: 0.7071307217543091
Energy: 0.6349166416082979
Energy: 0.7750099066039103
Energy: 0.6154831606182622
Energy: 0.6349166416082979
Energy: 0.7750099066033089
Energy: 0.6154831606182622
Energy: 0.6349166416076963
Energy: 0.7750099066033089
Energy: 0.6154831606182622
Energy: 0.6349166416082979
Energy: 0.7070118066514554
Energy: 0.61012723539167
Energy: 0.6476408915295331
Energy: 0.707020571541174
Energy: 0.61012723539167
Energy: 0.6476408915295331
Energy: 0.7071894204075534
Energy: 0.61012723539167
Energy: 0.6476408915295331
Energy: 0.78088816535207
Energy: 0.6632480864243371
Energy: 0.7483938899597933
Energy: 0.6880502290013115
Energy: 0.66324808642554
Energy: 0.7483938899567861
Energy: 0.6880502290001087
Energy: 0.6632480864243371
Energy: 0.7483938899736264
Energy: 0.6880502290013115
Energy: 0.66324808642554
Energy: 0.9583253959896143
Energy: 0.690669960538341
Energy: 0.602342125569791
Energy: 0.9583253959908171
Energy: 0.6906699605389424
Energy: 0.6023421255691898
Energy: 0.9583253959896143
Energy: 0.6906699605389424
Energy: 0.602342125569791
Energy: 0.9583253959908171
Energy: 0.6908684094332226
Energy: 0.6715810284885144
Energy: 0.6678687267661069
Energy: 0.6908684094332226
Energy: 0.671581028694125
Energy: 0.6678677862055331
Energy: 0.6908684094338242
Energy: 0.6715810287386041
Energy: 0.6678705541501653
Energy: 0.6908684094332226
Energy: 0.674748135153968
Energy: 0.720668025252245
Energy: 0.6382421080218913
Energy: 0.6747496385021011
Energy: 0.720668025253448
Energy: 0.6382421080212898
Energy: 0.6747534648726757
Energy: 0.720668025252245
Energy: 0.6382421080218913
Energy: 0.6747494952473753
Energy: 0.6642102867474485
Energy: 0.6132916254742748
Energy: 0.5922436596908626
Energy: 0.6642102867468472
Energy: 0.6132916254742748
Energy: 0.5922437380778383
Energy: 0.66421028674805
Energy: 0.6132916254742748
Energy: 0.5922332666302376
Energy: 0.6642102867462457
Energy: 0.6023105644595793
Energy: 0.6282693605166849
Energy: 0.6022109542893842
Energy: 0.6023105644601807
Energy: 0.6282693605190905
Energy: 0.6022109542893842
Energy: 0.6023105644601807
Energy: 0.6282693605190905
Energy: 0.6022109542893842
Energy: 0.6023105644601807
Energy: 0.7169167538602403
Energy: 0.5921669656166242
Energy: 0.7531461201180805
Energy: 0.7169167538596387
Energy: 0.5921669656160228
Energy: 0.7531461201180805
Energy: 0.7169167538608417
Energy: 0.5921669656166242
Energy: 0.7531461201180805
Energy: 0.7169167538596387

minimum gb energy = 0.5898749964436686 eV
minimum distance =  2.57597402726383 Angstroms
sigma value = 33