Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_Al__MO_315820974149_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.36025423720221
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
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: 0.012700272037151164
Energy: 0.3554358523457182
Energy: 0.6500434011965356
Energy: 0.3549380379178346
Energy: 0.012700272036561806
Energy: 0.35543585234589953
Energy: 0.2966525398636633
Energy: 0.4785490205754534
Energy: 0.012954956126722882
Energy: 0.1457727484371669
Energy: 0.013005858951660192
Energy: 0.4785490205754534
Energy: 0.012954956126722882
Energy: 0.1457727484371669
Energy: 0.012700272037151164
Energy: 0.3554358523457182
Energy: 0.6500434011961276
Energy: 0.35493803791765327
Energy: 0.012700272036765815
Energy: 0.35543585234589953
Energy: 0.29665253986386736
Energy: 0.4785490205754534
Energy: 0.01295495612731224
Energy: 0.14577274843696286
Energy: 0.0130058589518642
Energy: 0.47854902057563464
Energy: 0.01295495612731224
Energy: 0.14577274843775623
Energy: 0.012700272037151164
Energy: 0.3554358523457182
Energy: 0.29665253986386736
Energy: 0.35493803791765327
Energy: 0.012700272036765815
Energy: 0.35543585234610353
Energy: 0.2966525398636633
Energy: 0.47854902057563464
Energy: 0.012954956126926891
Energy: 0.1457727484371669
Energy: 0.01300585895206821
Energy: 0.47854902057583865
Energy: 0.0129549561271309
Energy: 0.14577274843755222

minimum gb energy = 0.012700272036561806 eV
minimum distance =  2.84040188831272 Angstroms
sigma value = 5


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

Energy: 0.7094732667540617
Energy: 0.738043667874924
Energy: 0.8190510527328704
Energy: 0.7700467385374321
Energy: 0.7094732667516248
Energy: 0.738043667874924
Energy: 0.8085686458330601
Energy: 0.6599562388266937
Energy: 0.6847058484730474
Energy: 0.7649918092446014
Energy: 0.6935319527555962
Energy: 0.6599562388218198
Energy: 0.6847058484730474
Energy: 0.7649918092446014
Energy: 0.6662145410191812
Energy: 0.6436859812112407
Energy: 0.8029146721475053
Energy: 0.6726497931129783
Energy: 0.6662145410167443
Energy: 0.6436859812112407
Energy: 0.8029146721475053
Energy: 0.6885743659241865
Energy: 0.6942212339272223
Energy: 0.7804840574221995
Energy: 0.6511066544400366
Energy: 0.6885743659217495
Energy: 0.6942212339272223
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Energy: 0.6453301543543867
Energy: 0.6445333857351216
Energy: 0.822786723853182
Energy: 0.6682474854343502
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Energy: 0.6445333857351216
Energy: 0.8227867238556189
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Energy: 0.6974204871874269
Energy: 0.71356466445197
Energy: 0.6790128333376384
Energy: 0.6704071110352502
Energy: 0.6974204871898638
Energy: 0.713564664454407
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Energy: 0.8224324452644861
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Energy: 0.6428639785729479
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Energy: 0.6673305549172891
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Energy: 0.6741132356303122
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Energy: 0.668526059192994
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Energy: 0.8112410249423531
Energy: 0.7796713078700556
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Energy: 0.8112410249447901
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Energy: 0.6729892909954378
Energy: 0.7186545030705513
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Energy: 0.6676633199926193
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Energy: 0.6385577094899832
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Energy: 0.642135517014875
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Energy: 0.6661466683308787
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Energy: 0.6529698715979045
Energy: 0.678936227100429
Energy: 0.8595919567882399
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Energy: 0.690473193153965
Energy: 0.663146050486396
Energy: 0.7616587470956717
Energy: 0.7154385523331428
Energy: 0.690473193153965
Energy: 0.663146050488833
Energy: 0.7616587470981088
Energy: 0.7099395171385965
Energy: 0.6692461290412365
Energy: 0.8119662414822385
Energy: 0.6870108925389622
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Energy: 0.8119662414822385
Energy: 0.7360725008700575
Energy: 0.7118095448799194
Energy: 0.7999901742531412
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Energy: 0.7360725008724945
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Energy: 0.7999901742507044
Energy: 0.6708906232111039
Energy: 0.6953349886114036
Energy: 0.8213701019128451
Energy: 0.670235753283393
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Energy: 0.8093745570050195
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Energy: 0.8164707114757738
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Energy: 0.8027562534627242
Energy: 0.6567593247243658
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Energy: 0.8027562534602872
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Energy: 0.6725982593968975
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Energy: 0.6753342221394728
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Energy: 0.7986117799107931
Energy: 0.7283537441014208
Energy: 0.6859113157593789
Energy: 0.7284528522335143
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Energy: 0.6647362297429983
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Energy: 0.6862473875807573
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Energy: 0.6647362297429983
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Energy: 0.6865169822160209
Energy: 0.6588400660594752
Energy: 0.7907512951209265
Energy: 0.6660959256962196
Energy: 0.6865169822160209
Energy: 0.6588400660594752
Energy: 0.7907512951209265
Energy: 0.7390142370400694
Energy: 0.6855811386664395
Energy: 0.7937436709416743
Energy: 0.7047905776146978
Energy: 0.7390142370425062
Energy: 0.6855811386615656
Energy: 0.7937436709441114
Energy: 0.6762740840310362
Energy: 0.6632191768119904
Energy: 0.7938804636354152
Energy: 0.698381549553113
Energy: 0.6762740840359102
Energy: 0.6632191768144274
Energy: 0.7938804636378523
Energy: 0.6409247856143351
Energy: 0.6556135098491168
Energy: 0.8134044045421879
Energy: 0.6674164744293579
Energy: 0.6409247856167721
Energy: 0.6556135098466799
Energy: 0.8134044045373139
Energy: 0.6643819473251477
Energy: 0.6792518753078864
Energy: 0.8147872651038022
Energy: 0.7083576795785982
Energy: 0.6643819473251477
Energy: 0.6792518753078864
Energy: 0.8147872651038022
Energy: 0.6374873359608838
Energy: 0.6851756977675556
Energy: 0.7326706060834671
Energy: 0.6407406279401563
Energy: 0.6374873359633207
Energy: 0.6851756977675556
Energy: 0.7326706060834671

minimum gb energy = 0.6348713248580721 eV
minimum distance =  2.47881788561625 Angstroms
sigma value = 401


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

Energy: 0.7168248918374925
Energy: 0.6538084493131048
Energy: 0.7926936435875402
Energy: 0.6706096788142497
Energy: 0.716824891838901
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Energy: 0.6934094352146065
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Energy: 0.7207531496047455
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Energy: 0.6456569775885708
Energy: 0.7077438241330762
Energy: 0.76022377844732
Energy: 0.6743056125618795
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Energy: 0.7077438241325229
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Energy: 0.6462749811392288
Energy: 0.6626821865361563
Energy: 0.8425091203088482
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Energy: 0.6490257540386731
Energy: 0.8131924180993998
Energy: 0.6885970940443492
Energy: 0.6577129886429458
Energy: 0.779318768043052
Energy: 0.6548372034731315
Energy: 0.688597094043796
Energy: 0.6577129886431974
Energy: 0.7793187680421971
Energy: 0.6561956890381716
Energy: 0.6840053629463879
Energy: 0.7489629015747341
Energy: 0.6415429867042016
Energy: 0.6561956890395799
Energy: 0.6840053629466394
Energy: 0.7498715249787246
Energy: 0.6460063312721981
Energy: 0.7527661459867548
Energy: 0.762839814221091
Energy: 0.6909093182843485
Energy: 0.6460063312713934
Energy: 0.7527661459865035
Energy: 0.708626705002095
Energy: 0.6463144599745061
Energy: 0.7256052699144828
Energy: 0.7088824380112047
Energy: 0.6939584478014255
Energy: 0.6463144599745061
Energy: 0.7256052699139296
Energy: 0.6846487411694254
Energy: 0.6789332383288976
Energy: 0.6769027764069355
Energy: 0.8044852099998897
Energy: 0.6794865759977108
Energy: 0.6789332383285959
Energy: 0.676902776405829
Energy: 0.7647050783506147
Energy: 0.6632551627706976
Energy: 0.7012985095811997
Energy: 0.8255171093955853
Energy: 0.6628482357824074
Energy: 0.6632551627692893
Energy: 0.7012985095803949
Energy: 0.8358216741740124
Energy: 0.6967702749401624
Energy: 0.6538084493139095
Energy: 0.8169215851194526
Energy: 0.6706096788136965
Energy: 0.6967702749412689
Energy: 0.6538084493142112
Energy: 0.8218177353685443
Energy: 0.6792491532581244
Energy: 0.6934094352146065
Energy: 0.781770799750618
Energy: 0.69331245692435
Energy: 0.6792491532589292
Energy: 0.6934094352146065
Energy: 0.7817707997495115

minimum gb energy = 0.6415429867036484 eV
minimum distance =  2.54632515805047 Angstroms
sigma value = 311


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

Energy: 0.7434745218977219
Energy: 0.681959725492096
Energy: 0.7956989482797036
Energy: 0.6837749893350427
Energy: 0.7434745218980412
Energy: 0.6819597254924153
Energy: 0.8529904408886583
Energy: 0.716716896762292
Energy: 0.7282497835968851
Energy: 0.7374721938471429
Energy: 0.7199761197318962
Energy: 0.7167168967619725
Energy: 0.7282497835968851
Energy: 0.7374721938474622
Energy: 0.6934187803250665
Energy: 0.7030395117304998
Energy: 0.8013451975897545
Energy: 0.6820281558191831
Energy: 0.6934187803250665
Energy: 0.7030395117301803
Energy: 0.7747481810918407
Energy: 0.6799123002205035
Energy: 0.6819408237723312
Energy: 0.7530085689556997
Energy: 0.6756067278025815
Energy: 0.6799123002205035
Energy: 0.6819408237700952
Energy: 0.7530085689563385
Energy: 0.704798478252849
Energy: 0.702446051398436
Energy: 0.806033087798886
Energy: 0.6861180725015258
Energy: 0.704798478252849
Energy: 0.7024460513981166
Energy: 0.8041420529201422
Energy: 0.6816683344417754
Energy: 0.6844574181798626
Energy: 0.7555484971013677
Energy: 0.6741339483138424
Energy: 0.681668334442095
Energy: 0.6844574181798626
Energy: 0.7555484971004094
Energy: 0.6898554533859735
Energy: 0.7446376970387352
Energy: 0.7350830910149397
Energy: 0.7145368870818518
Energy: 0.6898554533859735
Energy: 0.7446376970393738
Energy: 0.7350830910149397
Energy: 0.6730537182089885
Energy: 0.6813186654291997
Energy: 0.8180185029956304
Energy: 0.6724932522567487
Energy: 0.6730537182080303
Energy: 0.6813186654295191
Energy: 0.8180185029959499
Energy: 0.6790612187495582
Energy: 0.6691763877688555
Energy: 0.8342978095300916
Energy: 0.6851117556782693
Energy: 0.6790612187498776
Energy: 0.6691763877691749
Energy: 0.8342978095300916
Energy: 0.6929085001769975
Energy: 0.7103080763124875
Energy: 0.7906960465213132
Energy: 0.7554428228922351
Energy: 0.6929085001769975
Energy: 0.7103080763128069
Energy: 0.7906960465209938
Energy: 0.6996495102024819
Energy: 0.7057260475345485
Energy: 0.7763677269496733
Energy: 0.6848372143569806
Energy: 0.6996495102028013
Energy: 0.7057260475351872
Energy: 0.7763677269496733
Energy: 0.7071144211662607
Energy: 0.7001119245704197
Energy: 0.7367122575540875
Energy: 0.6959273255785844
Energy: 0.7071144211653023
Energy: 0.7001119245701003
Energy: 0.736712257553768
Energy: 0.6873248389207154
Energy: 0.6914388912985455
Energy: 0.7383466499042102
Energy: 0.7107207925523421
Energy: 0.6873248389207154
Energy: 0.6914388912982261
Energy: 0.7383466499045297
Energy: 0.6687076446162324
Energy: 0.6840750241751943
Energy: 0.8309854508290606
Energy: 0.6739529720228772
Energy: 0.6687076446162324
Energy: 0.6840750241745553
Energy: 0.8309854508290606
Energy: 0.6867864993523389
Energy: 0.7141083261413107
Energy: 0.7379489594734252
Energy: 0.6939071202346829
Energy: 0.6867864993523389
Energy: 0.7141083261419496
Energy: 0.737948959473106
Energy: 0.7040726967420721
Energy: 0.6960630036972549
Energy: 0.7499065953106702
Energy: 0.7018334576200207
Energy: 0.704072696741114
Energy: 0.6960630036975743
Energy: 0.7499065953103508
Energy: 0.71612469689743
Energy: 0.6803641899572812
Energy: 0.7564631028640907
Energy: 0.6902318020401589
Energy: 0.7161246968980688
Energy: 0.680364189957891
Energy: 0.7564631028644102
Energy: 0.7080861063155872
Energy: 0.7559479850332603
Energy: 0.7786476113946248
Energy: 0.6984913078661564
Energy: 0.7080861063159066
Energy: 0.7559479850329408
Energy: 0.7786476113946248
Energy: 0.6782480747226938
Energy: 0.7309794567171599
Energy: 0.7908525182441973
Energy: 0.6721447114304634
Energy: 0.6782480747223745
Energy: 0.7309794567171599
Energy: 0.7908525182432392
Energy: 0.675636718023714
Energy: 0.685904531103426
Energy: 0.8307237675056678
Energy: 0.6803647822053347
Energy: 0.6756367180240334
Energy: 0.685904531103426
Energy: 0.8307237675056678
Energy: 0.6856093669466565
Energy: 0.7263588796830158
Energy: 0.7400698246693438
Energy: 0.7448668518386756
Energy: 0.6856093669466565
Energy: 0.7263588796836545
Energy: 0.7400698246693438
Energy: 0.6836615945205793
Energy: 0.68336510999814
Energy: 0.7923849076906468
Energy: 0.6859254842568627
Energy: 0.6836615945199404
Energy: 0.68336510999814
Energy: 0.7923849076903274
Energy: 0.7260088723979263
Energy: 0.6860972035318441
Energy: 0.7859904622215472
Energy: 0.7192618880435894
Energy: 0.7260088723979263
Energy: 0.6860972035318441
Energy: 0.7859904622215472
Energy: 0.6812159588636202
Energy: 0.6910274453409169
Energy: 0.7730879607716149
Energy: 0.6953210139362777
Energy: 0.6812159588633008
Energy: 0.6910274453412363
Energy: 0.7730879607709762
Energy: 0.7020008283122843
Energy: 0.6875705059034533
Energy: 0.806066631393611
Energy: 0.685799829345549
Energy: 0.7020008283119649
Energy: 0.6875705059031337
Energy: 0.8060666313932916
Energy: 0.7083629600860127
Energy: 0.719911635745504
Energy: 0.7758644753765275
Energy: 0.7296019593651238
Energy: 0.7083629600860127
Energy: 0.7199116357458233
Energy: 0.7758644753762082
Energy: 0.7303270711311496
Energy: 0.6793391705969765
Energy: 0.8683449111159708
Energy: 0.6791876823502017
Energy: 0.7303270711311496
Energy: 0.6793391705966572
Energy: 0.8683449111169291
Energy: 0.71909119595933
Energy: 0.721481455704704
Energy: 0.7480034655220466
Energy: 0.7089961723193675
Energy: 0.71909119595933
Energy: 0.721481455704704
Energy: 0.7480034655220466
Energy: 0.7076020375317582
Energy: 0.7067397000512801
Energy: 0.801028621752783
Energy: 0.6869191844743767
Energy: 0.7076020375320777
Energy: 0.7067397000512801
Energy: 0.8010286217524636
Energy: 0.6809533033083959
Energy: 0.6769211181192222
Energy: 0.7472836012017704
Energy: 0.6914188870238103
Energy: 0.6809533033083959
Energy: 0.6769211181189029
Energy: 0.7472836012014509
Energy: 0.7009766335057064
Energy: 0.7027849255413855
Energy: 0.8238486063509519
Energy: 0.6925037977225176
Energy: 0.7009766335060258
Energy: 0.7027849255413855
Energy: 0.8238486063506326
Energy: 0.6735678990185301
Energy: 0.6793607401337589
Energy: 0.7320449573040543
Energy: 0.6889646717972276
Energy: 0.673567899017572
Energy: 0.6793607401340783
Energy: 0.7320449573043737
Energy: 0.6980568913973099
Energy: 0.7353719587700249
Energy: 0.7850879325268578
Energy: 0.7152355852861148
Energy: 0.6980568913979487
Energy: 0.7353719587700249
Energy: 0.7850879325265385
Energy: 0.6746978066698646
Energy: 0.6812553168741456
Energy: 0.8191522675597792
Energy: 0.6752212074139997
Energy: 0.6746978066705035
Energy: 0.6812553168731874
Energy: 0.8191522675604179
Energy: 0.6849352487402032
Energy: 0.6663053316989725
Energy: 0.8337236747234769
Energy: 0.6860354432099459
Energy: 0.684935248740842
Energy: 0.666305331699292
Energy: 0.8337236747241156
Energy: 0.6937284678981838
Energy: 0.709742506037544
Energy: 0.7810700291286033
Energy: 0.7552943722312214
Energy: 0.6937284678985032
Energy: 0.7097425060369051
Energy: 0.7810700291289228

minimum gb energy = 0.6663053316989725 eV
minimum distance =  2.52943316369909 Angstroms
sigma value = 39


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

Energy: 0.7076114819507057
Energy: 0.7274743252040582
Energy: 0.8000012279146819
Energy: 0.7273435566207932
Energy: 0.7076114819495749
Energy: 0.7274743252048121
Energy: 0.8000012279150589
Energy: 0.6914281370018669
Energy: 0.7050672902109363
Energy: 0.7701067265954102
Energy: 0.705706542458934
Energy: 0.691428136999982
Energy: 0.7050672902120672
Energy: 0.770106726595787
Energy: 0.7052029962978047
Energy: 0.6994154595437276
Energy: 0.7152261122791757
Energy: 0.7305559907642402
Energy: 0.7052029962989357
Energy: 0.6994154595422198
Energy: 0.7152261122799297
Energy: 0.6916087312596646
Energy: 0.7308906326594415
Energy: 0.7673066105802221
Energy: 0.7620022304578884
Energy: 0.6916087312604186
Energy: 0.7308906326568029
Energy: 0.7673066105783715
Energy: 0.7371869081349627
Energy: 0.7072649316778871
Energy: 0.7789805020930566
Energy: 0.731602734369083
Energy: 0.7371869081345858
Energy: 0.7072649316782641
Energy: 0.7789805020923027
Energy: 0.6919554309906856
Energy: 0.7067430358814981
Energy: 0.8325603273882293
Energy: 0.7787308441220824
Energy: 0.6919554309906856
Energy: 0.706743035881875
Energy: 0.8325603273878524
Energy: 0.7656731958557302
Energy: 0.7459078363262017
Energy: 0.7094914084351582
Energy: 0.6874627521660551
Energy: 0.7656731958534684
Energy: 0.7459078363277096
Energy: 0.6959096158420821
Energy: 0.6924868871307056
Energy: 0.7159060034526039
Energy: 0.7283033275147192
Energy: 0.7158351400941197
Energy: 0.6924868871288206
Energy: 0.7159060034533579
Energy: 0.7283033275147192
Energy: 0.7657082593011817
Energy: 0.6871828737836387
Energy: 0.7774181438604338
Energy: 0.7688724743479204
Energy: 0.7657082592985429
Energy: 0.6871828737817539
Energy: 0.7638628257604979
Energy: 0.6919495415826383
Energy: 0.7787172472842968
Energy: 0.8325644517417299
Energy: 0.706818715498557
Energy: 0.6919495415830154
Energy: 0.7787172472858047
Energy: 0.8325644517432379
Energy: 0.7370879683597882
Energy: 0.7317371702535737
Energy: 0.8531477739560389
Energy: 0.7089939633229622
Energy: 0.7370879683579032
Energy: 0.7317371702547045
Energy: 0.8258975515015808
Energy: 0.6916997809619713
Energy: 0.7620301333241298
Energy: 0.7750211376771312
Energy: 0.7308823610457378
Energy: 0.6916997809627251
Energy: 0.7620301333263916
Energy: 0.7750211376778853
Energy: 0.7052463278018004
Energy: 0.7305400609639335
Energy: 0.8437326385622455
Energy: 0.6993915952384443
Energy: 0.7052463278018004
Energy: 0.7305400609609178
Energy: 0.7868161761648788
Energy: 0.6913950483765466
Energy: 0.7055677810420385
Energy: 0.7700704715857333
Energy: 0.7054010594972863
Energy: 0.6913950483742849
Energy: 0.7055677810401537
Energy: 0.7700704715857333
Energy: 0.7076114819507057
Energy: 0.7274743252044353
Energy: 0.8000012279139279
Energy: 0.7273435566200394
Energy: 0.7076114819499518
Energy: 0.7274743252044353
Energy: 0.8000012279150589
Energy: 0.6914281370014899
Energy: 0.7050672902101823
Energy: 0.7701067265950332
Energy: 0.7057065424585571
Energy: 0.691428136999982
Energy: 0.7050672902124442
Energy: 0.770106726595787
Energy: 0.7052029962981817
Energy: 0.6994154595433507
Energy: 0.7152261122791757
Energy: 0.7305559907646172
Energy: 0.7052029962985588
Energy: 0.6994154595422198
Energy: 0.7152261122791757
Energy: 0.6916087312589106
Energy: 0.7308906326590645
Energy: 0.7673066105795024
Energy: 0.7620022304590194
Energy: 0.6916087312604186
Energy: 0.7308906326564257
Energy: 0.7673066105791253
Energy: 0.7371869081349627
Energy: 0.7072649316782641
Energy: 0.7789805020919258
Energy: 0.731602734369083
Energy: 0.7371869081345858
Energy: 0.7072649316782641
Energy: 0.7789805020934337
Energy: 0.6919554309906856
Energy: 0.7067430358826289
Energy: 0.8325603273886063
Energy: 0.7787308441224592
Energy: 0.6919554309910625
Energy: 0.7067430358837599
Energy: 0.8325603273874753
Energy: 0.7656731958557302
Energy: 0.7459078363277096
Energy: 0.6959096158401972
Energy: 0.6874627521653013
Energy: 0.7656731958538454
Energy: 0.7459078363265788
Energy: 0.6959096158417051
Energy: 0.6924868871303285
Energy: 0.7159060034529808
Energy: 0.7283033275150961
Energy: 0.7158351400941197
Energy: 0.6924868871288206
Energy: 0.7159060034537349
Energy: 0.7283033275147192
Energy: 0.7657082593008047
Energy: 0.6871828737828848
Energy: 0.7638628257616289
Energy: 0.7688724743475436
Energy: 0.7657082592985429
Energy: 0.6871828737821307
Energy: 0.7638628257612518
Energy: 0.6919495415822613
Energy: 0.7787172472842968
Energy: 0.8325644517424838
Energy: 0.7068187154981801
Energy: 0.6919495415826383
Energy: 0.7787172472854278
Energy: 0.8325644517428609
Energy: 0.7370879683594111
Energy: 0.7317371702531966
Energy: 0.7956391045693316
Energy: 0.7089939633229622
Energy: 0.7370879683579032
Energy: 0.7317371702547045
Energy: 0.7956391045715934
Energy: 0.6916997809619713
Energy: 0.7620301333248838
Energy: 0.7750211376782621
Energy: 0.7308823610453609
Energy: 0.691699780963102
Energy: 0.7620301333263916
Energy: 0.7750211376782621
Energy: 0.7052463278025544
Energy: 0.7305400609635567
Energy: 0.7868161761641247
Energy: 0.6993915952380673
Energy: 0.7052463278002925
Energy: 0.7305400609609178
Energy: 0.7868161761660096
Energy: 0.6913950483761697
Energy: 0.7055677810424154
Energy: 0.7700704715857333
Energy: 0.705401059499548
Energy: 0.691395048373908
Energy: 0.7055677810409076
Energy: 0.7700704715857333
Energy: 0.7076114819510828
Energy: 0.7274743252040582
Energy: 0.800001227914305
Energy: 0.7273435566196622
Energy: 0.7076114819499518
Energy: 0.7274743252040582
Energy: 0.800001227914305
Energy: 0.6914281370018669
Energy: 0.7050672902109363
Energy: 0.7701067265954102
Energy: 0.7057065424585571
Energy: 0.691428137000359
Energy: 0.7050672902128212
Energy: 0.7701067265954102

minimum gb energy = 0.6871828737817539 eV
minimum distance =  2.53732004678934 Angstroms
sigma value = 21


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

Energy: 0.7300188806570573
Energy: 0.7839652563841715
Energy: 0.7975216997126918
Energy: 0.7838432664832068
Energy: 0.7300188806570573
Energy: 0.783965256384629
Energy: 0.7975216997122341
Energy: 0.7749022061773976
Energy: 0.7264163205932849
Energy: 0.7376749027723482
Energy: 0.7339069441502817
Energy: 0.7749022061773976
Energy: 0.7264163205932849
Energy: 0.7376749027723482
Energy: 0.7329727048947251
Energy: 0.7476416462241503
Energy: 0.7602657871176229
Energy: 0.7337563508174558
Energy: 0.7329727048951621
Energy: 0.7476416462255022
Energy: 0.7602657871180805
Energy: 0.7681503141808418
Energy: 0.7210272683489094
Energy: 0.7597653771162437
Energy: 0.6972768576544467
Energy: 0.7681503141808418
Energy: 0.7210272683489094
Energy: 0.759765377117159
Energy: 0.7087292495405247
Energy: 0.7780101887427501
Energy: 0.7277432460786828
Energy: 0.7347057228628903
Energy: 0.7087292495405247
Energy: 0.7780101887436653
Energy: 0.7277432460791404
Energy: 0.756821279874217
Energy: 0.7208636674960615
Energy: 0.796905997325468
Energy: 0.7508216880580934
Energy: 0.7568212798746746
Energy: 0.7208636674960615
Energy: 0.7969059973245528
Energy: 0.7523161677840544
Energy: 0.7841182627004523
Energy: 0.7244937557261183
Energy: 0.7226663326160665
Energy: 0.7523161677840544
Energy: 0.7841182627013675
Energy: 0.7244937557274703
Energy: 0.7304971546695843
Energy: 0.7366045593151405
Energy: 0.7336456386224091
Energy: 0.7251695535112226
Energy: 0.7304971546695843
Energy: 0.7366045593160558
Energy: 0.7336456386224091
Energy: 0.7359629436063388
Energy: 0.7201874523909998
Energy: 0.7264396837436632
Energy: 0.7303856015061784
Energy: 0.7359629436063388
Energy: 0.7201874523914573
Energy: 0.7264396837436632
Energy: 0.7490700118956327
Energy: 0.728667678645922
Energy: 0.7431901996201857
Energy: 0.7131938355718818
Energy: 0.7490700118960903
Energy: 0.7286676786463797
Energy: 0.7431901996201857
Energy: 0.7430218968556831
Energy: 0.7956860713060341
Energy: 0.778815297955932
Energy: 0.7283368678448837
Energy: 0.7430218968561406
Energy: 0.7956860713064917
Energy: 0.778815297955932
Energy: 0.6961066218511304
Energy: 0.7231399004487322
Energy: 0.7545971693243674
Energy: 0.7414284670735928
Energy: 0.696106621851588
Energy: 0.7231399004496474
Energy: 0.7545971693243674
Energy: 0.743395254456523
Energy: 0.7547888065742637
Energy: 0.7801103067493623
Energy: 0.722853537565648
Energy: 0.7433952544551501
Energy: 0.7547888065738062
Energy: 0.78011030674982
Energy: 0.7504922376550052
Energy: 0.7237120081895466
Energy: 0.8006996041597231
Energy: 0.7413297734002121
Energy: 0.7504922376554628
Energy: 0.7237120081900043
Energy: 0.8006996041592654
Energy: 0.7686312008104156
Energy: 0.72443785363144
Energy: 0.786448983900853
Energy: 0.7245877607099037
Energy: 0.7686312008104156
Energy: 0.7244378536309823
Energy: 0.7706253502620704
Energy: 0.7115075376353324
Energy: 0.7532343514533459
Energy: 0.7361206552739676
Energy: 0.7417168941483048
Energy: 0.711507537618421
Energy: 0.7532343514524307
Energy: 0.736120655274883
Energy: 0.7736682195238977
Energy: 0.7418495632800467
Energy: 0.8333912411476204
Energy: 0.7246378318628599
Energy: 0.7736682195234402
Energy: 0.7418495632805042
Energy: 0.8333912411476204
Energy: 0.7335009927286168
Energy: 0.7421113026467248
Energy: 0.7238137035938015
Energy: 0.7450162291727993
Energy: 0.7335009927286168
Energy: 0.7421113026467248
Energy: 0.7238137035933437
Energy: 0.7372920568153438
Energy: 0.7154470644226152
Energy: 0.7844731240007091
Energy: 0.7036852246618736
Energy: 0.7372920568153438
Energy: 0.7154470644244458
Energy: 0.7844731240007091
Energy: 0.7198423833024572
Energy: 0.7282336114554331
Energy: 0.7313399494958278
Energy: 0.7285569490282754
Energy: 0.7198423833019996
Energy: 0.7282336114554331
Energy: 0.7313399494958278
Energy: 0.7372793784623007
Energy: 0.7035635621503595
Energy: 0.7844418771524425
Energy: 0.7136691781170289
Energy: 0.7372793784613857
Energy: 0.7035635621494443
Energy: 0.7844418771519849
Energy: 0.7322389190798808
Energy: 0.7449990879620845
Energy: 0.7237818940850151
Energy: 0.7421972616316216
Energy: 0.7322389190785288
Energy: 0.744999087961627
Energy: 0.7237818940859304
Energy: 0.7735147195494746
Energy: 0.7245893586072354
Energy: 0.7816320161040616
Energy: 0.7419107642955319
Energy: 0.7735147195503899
Energy: 0.7245893586072354
Energy: 0.7816320161045194
Energy: 0.7330909989060024
Energy: 0.7417998600945421
Energy: 0.7355247610809216
Energy: 0.7532132896767998
Energy: 0.7330909989110362
Energy: 0.7417998600936269
Energy: 0.7355247610813793
Energy: 0.7686089079628126
Energy: 0.7268624100551758
Energy: 0.8221320275532363
Energy: 0.7338270915036048
Energy: 0.7686089079623549
Energy: 0.7268624100551758
Energy: 0.8221320275532363

minimum gb energy = 0.6961066218511304 eV
minimum distance =  2.49125065849346 Angstroms
sigma value = 113


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

Energy: 0.7756427523156323
Energy: 0.7599627879231226
Energy: 0.764610581143827
Energy: 0.7584590001898454
Energy: 0.7756427523148429
Energy: 0.7599627879243764
Energy: 0.7646105811443377
Energy: 0.7679405123792499
Energy: 0.7481354797399734
Energy: 0.7476341370127426
Energy: 0.7837441945230977
Energy: 0.7679405123779497
Energy: 0.7481354797412272
Energy: 0.7476341370137641
Energy: 0.7733229647958034
Energy: 0.7419207433925762
Energy: 0.7608938127259216
Energy: 0.7391526351320923
Energy: 0.7733229647965464
Energy: 0.7419207433935976
Energy: 0.7608938127266647
Energy: 0.7277379996987473
Energy: 0.7534964801745162
Energy: 0.7867217571584703
Energy: 0.7659334373485444
Energy: 0.727737999696472
Energy: 0.753496480175027
Energy: 0.7867217571597706
Energy: 0.7626296664848895
Energy: 0.6906329976706237
Energy: 0.717372154334516
Energy: 0.730777115708582
Energy: 0.7626296664879543
Energy: 0.690632997672156
Energy: 0.7173721543365592
Energy: 0.7118264247410376
Energy: 0.7443457979266334
Energy: 0.7860465782599306
Energy: 0.7303538440825326
Energy: 0.7118264247417806
Energy: 0.7443457979238471
Energy: 0.7860465782594198
Energy: 0.7523394974810321
Energy: 0.6961708234835965
Energy: 0.7498662459249749
Energy: 0.7236043543696619
Energy: 0.7523394974817751
Energy: 0.6961708234828535
Energy: 0.7498662459259965
Energy: 0.7156309823567851
Energy: 0.7348974776351813
Energy: 0.7608700081679309
Energy: 0.7384065198761894
Energy: 0.7156309823557635
Energy: 0.734897477636203
Energy: 0.7608700081687204
Energy: 0.735243642419915
Energy: 0.7115525546403253
Energy: 0.7724045931942038
Energy: 0.7125641474321958
Energy: 0.7352436424196365
Energy: 0.7115525546403253
Energy: 0.7724045931919283
Energy: 0.723605986848243
Energy: 0.7216461861395219
Energy: 0.7575939607341152
Energy: 0.7428611792268184
Energy: 0.723605986849543
Energy: 0.7216461861382218
Energy: 0.7575939607323506
Energy: 0.7439740083061667
Energy: 0.7294896653749045
Energy: 0.8086106175016466
Energy: 0.7255624393711602
Energy: 0.7439740083023589
Energy: 0.7294896653728613
Energy: 0.8086106175011357
Energy: 0.733773843788001
Energy: 0.7296237647621021
Energy: 0.7954919834700603
Energy: 0.7438879072594655
Energy: 0.7337738437867009
Energy: 0.7296237647603375
Energy: 0.795491983471825
Energy: 0.7509383579638859
Energy: 0.732749661616292
Energy: 0.7978626204558199
Energy: 0.7309453685614778
Energy: 0.7509383579643968
Energy: 0.7327496616178244
Energy: 0.776083537366965
Energy: 0.7553680397689977
Energy: 0.7669101697325033
Energy: 0.8289156468229749
Energy: 0.7532804900669733
Energy: 0.7553680397700194
Energy: 0.7669101697309708
Energy: 0.8289156468234856
Energy: 0.7421086188360317
Energy: 0.742303940132415
Energy: 0.7972273801152991
Energy: 0.7678606544406308
Energy: 0.7421086188355209
Energy: 0.7423039401319041
Energy: 0.8147864152080824
Energy: 0.7535835737280492
Energy: 0.7311718983227612
Energy: 0.7984248509781653
Energy: 0.7539031659812859
Energy: 0.753583573726749
Energy: 0.7311718983191855
Energy: 0.7984248509779331
Energy: 0.7509963315994928
Energy: 0.7279414550660744
Energy: 0.8287731843078457
Energy: 0.7252463268490801
Energy: 0.7509963316022789
Energy: 0.7279414550653315
Energy: 0.8287731843080779
Energy: 0.726678880245623
Energy: 0.7048102906370537
Energy: 0.7968845529010375
Energy: 0.725069918493135
Energy: 0.7266788802458551
Energy: 0.7048102906380753
Energy: 0.7968845528977405
Energy: 0.7531247292167156
Energy: 0.7350485075532756
Energy: 0.8069674319093267
Energy: 0.7472138080755022
Energy: 0.7531247292167156
Energy: 0.7350485075540649
Energy: 0.8165621108238477
Energy: 0.7252004920224177
Energy: 0.7218362753984594
Energy: 0.7854559908918339
Energy: 0.7237204918989978
Energy: 0.7252004920224177
Energy: 0.7218362753989702
Energy: 0.7854559908925769
Energy: 0.737676259646036
Energy: 0.70739238691993
Energy: 0.7635655686372472
Energy: 0.7495989841981814
Energy: 0.7376762596465468
Energy: 0.7073923869214624
Energy: 0.7820506159882733
Energy: 0.7279544643405528
Energy: 0.7357918037181786
Energy: 0.7533824168125727
Energy: 0.7186493536125937
Energy: 0.7279544643390204
Energy: 0.7357918037192
Energy: 0.7533824168148946
Energy: 0.7332321587775017
Energy: 0.6992326651913641
Energy: 0.803959786799831
Energy: 0.7562509601836762
Energy: 0.7332321587785232
Energy: 0.6992326651931284
Energy: 0.8039597867990416
Energy: 0.7384338857855973
Energy: 0.7266592334151181
Energy: 0.774925105607374
Energy: 0.7329007149100055
Energy: 0.738433885786619
Energy: 0.7266592334151181
Energy: 0.774925105607374
Energy: 0.7418837952128113
Energy: 0.7392880663950135
Energy: 0.7638076809988729
Energy: 0.77873806376917
Energy: 0.7418837952135543
Energy: 0.7392880663952457
Energy: 0.7638076809978512
Energy: 0.7249060213064271
Energy: 0.7684455572309152
Energy: 0.7887894050631015
Energy: 0.7434105333938213
Energy: 0.7249060213071701
Energy: 0.768445557231426
Energy: 0.7887894050658877
Energy: 0.7866674164019475
Energy: 0.7379379842828245
Energy: 0.7739804238373678
Energy: 0.7918283846356182
Energy: 0.7866674164019475
Energy: 0.7379379842825458
Energy: 0.7739804238358352
Energy: 0.7357030288604529
Energy: 0.7718747080650449
Energy: 0.7801283295181335
Energy: 0.7739456608612655
Energy: 0.7357030288637499
Energy: 0.7718747080655557
Energy: 0.7801283295168796
Energy: 0.7798534403601872
Energy: 0.7375835564758391
Energy: 0.7490906427842732
Energy: 0.7980581977233776
Energy: 0.7798534403609766
Energy: 0.7375835564737959
Energy: 0.7490906427852948
Energy: 0.7211663731343603
Energy: 0.7574987511731803
Energy: 0.771611383461525
Energy: 0.7369380971914236
Energy: 0.7211663731343603
Energy: 0.7574987511719264
Energy: 0.7716113834602712
Energy: 0.7399801945140049
Energy: 0.7386086225918846
Energy: 0.7600915430345913
Energy: 0.7662634015991048
Energy: 0.7399801945153051
Energy: 0.7386086225934171
Energy: 0.7600915430348234
Energy: 0.7238229268566884
Energy: 0.7017402394138346
Energy: 0.7251556326974761
Energy: 0.7266233016881861
Energy: 0.7238229268539019
Energy: 0.7017402394125808
Energy: 0.7251556326967331
Energy: 0.7180987012189977
Energy: 0.7220301458352117
Energy: 0.7712625947912775
Energy: 0.7419676321977355
Energy: 0.7180987012176974
Energy: 0.7220301458379981
Energy: 0.7712625947922991
Energy: 0.7258994487714042
Energy: 0.7022856047311462
Energy: 0.7357651895861526
Energy: 0.716089363692453
Energy: 0.7258994487736795
Energy: 0.7022856047326784
Energy: 0.7357651895853632
Energy: 0.7090306235668552
Energy: 0.701308801454542
Energy: 0.7558101753778077
Energy: 0.7388910045942604
Energy: 0.709030623564812
Energy: 0.7013088014550529
Energy: 0.7558101753788293
Energy: 0.7215778713265676
Energy: 0.7090288847377899
Energy: 0.7180346053895421
Energy: 0.7048713384856009
Energy: 0.7215778713263354
Energy: 0.7090288847380221
Energy: 0.7180346053854557
Energy: 0.7122423617104966
Energy: 0.7136294046668467
Energy: 0.7501778076219567
Energy: 0.7344007684017566
Energy: 0.712242361711286
Energy: 0.7136294046655929
Energy: 0.7501778076191705
Energy: 0.7245817391060844
Energy: 0.7312985600957802
Energy: 0.7565186373646022
Energy: 0.7160469151067754
Energy: 0.7245817391058056
Energy: 0.7312985600973125
Energy: 0.7565186373613052
Energy: 0.7249592713919091
Energy: 0.7243691116541989
Energy: 0.8382889612676223
Energy: 0.7274148201203884
Energy: 0.7249592713908876
Energy: 0.7243691116564742
Energy: 0.8382889612668328
Energy: 0.7263695682062252
Energy: 0.7562424482945508
Energy: 0.7426729783988761
Energy: 0.7250941733236642
Energy: 0.726369568206504
Energy: 0.7562424482927861
Energy: 0.742672978396833
Energy: 0.7665021521985609
Energy: 0.724543658816721
Energy: 0.8331082422900057
Energy: 0.7411643436158325
Energy: 0.76650215219805
Energy: 0.7245436588164422
Energy: 0.8331082422877303
Energy: 0.7263805696351939
Energy: 0.7123613845072296
Energy: 0.8057469309967445
Energy: 0.7431040312693503
Energy: 0.726380569634451
Energy: 0.7123613845067189
Energy: 0.8057469309967445
Energy: 0.7669601887465949
Energy: 0.7247110448186209
Energy: 0.7951709118876096
Energy: 0.7400618835910227
Energy: 0.7669601887463626
Energy: 0.7247110448160669
Energy: 0.795170911887888
Energy: 0.7288410117973644
Energy: 0.7279817709369044
Energy: 0.8233879434840229
Energy: 0.7231703965268976
Energy: 0.7288410117988967
Energy: 0.7279817709340718
Energy: 0.8233879434840229
Energy: 0.7316515464309127
Energy: 0.720087845241444
Energy: 0.790466120478967
Energy: 0.7255242728364433
Energy: 0.7316515464314235
Energy: 0.7200878452419549
Energy: 0.790466120480778

minimum gb energy = 0.6906329976706237 eV
minimum distance =  2.49164196949963 Angstroms
sigma value = 365


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

Energy: 0.7214315861176304
Energy: 0.5895099799083697
Energy: 0.730536766265575
Energy: 0.5895099799077937
Energy: 0.7214315861182062
Energy: 0.5895099799077937
Energy: 0.5564872337724658
Energy: 0.7214315861176304
Energy: 0.5895099799083697
Energy: 0.5415534161254973
Energy: 0.5895099799072179
Energy: 0.7214315861176304
Energy: 0.5895099799072179
Energy: 0.5796707251241031
Energy: 0.7214315861176304
Energy: 0.5895099799083697
Energy: 0.6155671416944314
Energy: 0.5895099799089456
Energy: 0.7214315861170545
Energy: 0.5895099799077937
Energy: 0.5564872696782693
Energy: 0.7214315861164788
Energy: 0.5895099799083697
Energy: 0.6983704916538699
Energy: 0.5895099799083697
Energy: 0.7214315861182062
Energy: 0.5895099799083697
Energy: 0.5564864024308878
Energy: 0.7214315861164788
Energy: 0.5895099799077937
Energy: 0.6047206387001111
Energy: 0.5895099799083697
Energy: 0.7214315861176304
Energy: 0.5895099799089456
Energy: 0.5564863103767411
Energy: 0.7214315861176304
Energy: 0.5895099799089456
Energy: 0.5415534160967318
Energy: 0.5895099799083697
Energy: 0.7214315861164788
Energy: 0.5895099799089456
Energy: 0.5564872521115828
Energy: 0.7214315861170545
Energy: 0.5895099799077937
Energy: 0.5564871098916527
Energy: 0.5895099799083697
Energy: 0.7214315861176304
Energy: 0.5895099799077937
Energy: 0.5564872706037933
Energy: 0.7214315861176304
Energy: 0.5895099799083697
Energy: 0.5747994903637633
Energy: 0.5895099799083697
Energy: 0.7214315861170545
Energy: 0.5895099799089456
Energy: 0.5564855882340662
Energy: 0.7214315861176304
Energy: 0.5895099799077937
Energy: 0.5812566134608931
Energy: 0.5895099799089456
Energy: 0.7214315861182062
Energy: 0.5895099799083697
Energy: 0.5564849693290668
Energy: 0.7214315861176304
Energy: 0.5895099799077937
Energy: 0.5564871099929474
Energy: 0.5895099799083697
Energy: 0.7214315861182062
Energy: 0.5895099799083697
Energy: 0.5564872377733155
Energy: 0.7214315861182062
Energy: 0.5895099799083697
Energy: 0.5796707262263561
Energy: 0.5895099799083697
Energy: 0.7214315861164788
Energy: 0.5895099799083697
Energy: 0.5564872712150685
Energy: 0.7214315861170545
Energy: 0.5895099799077937
Energy: 0.5564872167197644
Energy: 0.5895099799083697
Energy: 0.7214315861170545
Energy: 0.5895099799077937
Energy: 0.5564870959206113
Energy: 0.7214315861176304
Energy: 0.5895099799077937
Energy: 0.5564845740009866
Energy: 0.5895099799089456
Energy: 0.7214315861187821
Energy: 0.5895099799083697
Energy: 0.5564863206387504
Energy: 0.7214315861170545
Energy: 0.5895099799077937
Energy: 0.5564703659289307
Energy: 0.5895099799072179
Energy: 0.7214315861176304
Energy: 0.5895099799072179
Energy: 0.5564793080657351
Energy: 0.7214315861187821
Energy: 0.5895099799083697
Energy: 0.5564870261362056
Energy: 0.5895099799077937
Energy: 0.7214315861176304
Energy: 0.5895099799089456
Energy: 0.5564872528149392
Energy: 0.7214315861176304
Energy: 0.5895099799083697
Energy: 0.556482283700813
Energy: 0.5895099799083697
Energy: 0.7214315861182062
Energy: 0.5895099799089456
Energy: 0.5564852997847451
Energy: 0.7214315861176304
Energy: 0.5895099799077937
Energy: 0.5564872119890961
Energy: 0.5895099799077937
Energy: 0.7214315861170545
Energy: 0.5895099799077937
Energy: 0.556484108535069
Energy: 0.7214315861170545
Energy: 0.5895099799072179
Energy: 0.5564841410276886
Energy: 0.5895099799083697
Energy: 0.7214315861182062
Energy: 0.5895099799072179
Energy: 0.5564867605535047
Energy: 0.7214315861176304
Energy: 0.5895099799083697
Energy: 0.5564667517495007
Energy: 0.5895099799089456
Energy: 0.7214315861176304
Energy: 0.5895099799077937
Energy: 0.556485627824717
Energy: 0.7214315861170545
Energy: 0.5895099799083697
Energy: 0.5564643529428392
Energy: 0.5895099799072179
Energy: 0.7214315861176304
Energy: 0.5895099799089456
Energy: 0.5564728781425671

minimum gb energy = 0.5415534160967318 eV
minimum distance =  2.63631378382343 Angstroms
sigma value = 23