Model name: model_name=MEAM_LAMMPS_KoShimLee_2011_AlH__MO_127847080751_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=4.044650807976723
cohesive_energy=3.360264280659711
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: 0.01270851943710829
Energy: 0.2842279579180563
Energy: 0.8252912746851405
Energy: 0.28421533907457797
Energy: 0.012708519436517372
Energy: 0.2842279579184654
Energy: 0.8252912746855268
Energy: 0.39732649609069315
Energy: 0.013139195253480658
Energy: 0.11424740317008049
Energy: 0.01315936685561913
Energy: 0.39732649609130677
Energy: 0.013139195252685193
Energy: 0.11424740316987593
Energy: 0.01270851943710829
Energy: 0.2842279579180563
Energy: 0.21514594317322366
Energy: 0.28421533907457797
Energy: 0.012708519436312822
Energy: 0.28422795791826083
Energy: 0.9847001111454593
Energy: 0.3973264960911022
Energy: 0.01313919525327611
Energy: 0.11424740317008049
Energy: 0.01315936685561913
Energy: 0.3973264960911022
Energy: 0.013139195253071563
Energy: 0.11424740316969413
Energy: 0.01270851943710829
Energy: 0.28422795791826083
Energy: 0.49419783862147787
Energy: 0.2842153390747825
Energy: 0.012708519436312822
Energy: 0.2842279579184654
Energy: 0.21816694230868466
Energy: 0.39732649609089765
Energy: 0.01313919525327611
Energy: 0.11424740317008049
Energy: 0.01315936685582368
Energy: 0.3973264960911022
Energy: 0.01313919525288974
Energy: 0.11424740316987593

minimum gb energy = 0.012708519436312822 eV
minimum distance =  2.83322028926864 Angstroms
sigma value = 5


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

Energy: 0.6659071665246713
Energy: 0.6869063649851196
Energy: 0.7366687999208471
Energy: 0.6863483811495523
Energy: 0.6659071665295136
Energy: 0.6869063649851196
Energy: 0.7328317026716432
Energy: 0.6416147685154518
Energy: 0.6289733091823592
Energy: 0.6725406073598602
Energy: 0.6345432317175239
Energy: 0.6416147685154518
Energy: 0.6289733091848027
Energy: 0.6725406073598602
Energy: 0.624120249200784
Energy: 0.633116230077809
Energy: 0.7172748252015446
Energy: 0.6450988585258826
Energy: 0.624120249195897
Energy: 0.633116230077809
Energy: 0.7172748252064315
Energy: 0.6572967909276607
Energy: 0.6548605787533224
Energy: 0.6595406165869259
Energy: 0.6274134940832699
Energy: 0.6572967909325476
Energy: 0.6548605787533224
Energy: 0.6595406165844825
Energy: 0.6256092038489598
Energy: 0.6244268905075165
Energy: 0.690267577999762
Energy: 0.650474171147606
Energy: 0.6256092038489598
Energy: 0.6244268905050732
Energy: 0.690267577999762
Energy: 0.6510793867508521
Energy: 0.6603396839438661
Energy: 0.6536551734152957
Energy: 0.6268776927357514
Energy: 0.6510793867508521
Energy: 0.6603396839463096
Energy: 0.6536551734128522
Energy: 0.6169969773085066
Energy: 0.6501018213719602
Energy: 0.6770166846157593
Energy: 0.6526501105586077
Energy: 0.6169969773085066
Energy: 0.6501018213695167
Energy: 0.6770166846157593
Energy: 0.6250278623345071
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Energy: 0.6410354529527839
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Energy: 0.6554647666733213
Energy: 0.6823862618833251
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Energy: 0.6786415007798682
Energy: 0.6217578709811893
Energy: 0.6491720552927112
Energy: 0.7042052147476268
Energy: 0.6327090519120746
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Energy: 0.7042052147451834
Energy: 0.6209300511091849
Energy: 0.6354889663017984
Energy: 0.6686251993613764
Energy: 0.6323468604759651
Energy: 0.620930051104298
Energy: 0.6354889663017984
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Energy: 0.6818317302008895
Energy: 0.7028806897427291
Energy: 0.7086131034612523
Energy: 0.6498189222588532
Energy: 0.6818317302008895
Energy: 0.7028806897402857
Energy: 0.6447504375781555
Energy: 0.639214521741341
Energy: 0.6534872522430862
Energy: 0.6352947548699388
Energy: 0.6447504375781555
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Energy: 0.626943129517756
Energy: 0.6300415716596237
Energy: 0.7003379335437521
Energy: 0.6466102842030977
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Energy: 0.6349055903806874
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Energy: 0.6243284447955969
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Energy: 0.6792126641771665
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Energy: 0.6293791265936727
Energy: 0.6915108989996357
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Energy: 0.6542394573253085
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Energy: 0.6560824844335817
Energy: 0.7005304985992051
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Energy: 0.6296216463852156
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Energy: 0.6710300202158483
Energy: 0.6495672832855245
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Energy: 0.6694895500911041
Energy: 0.6535010287221256
Energy: 0.6336284739214726
Energy: 0.7169516236306825
Energy: 0.6557382944749988
Energy: 0.6535010287196823
Energy: 0.6336284739214726
Energy: 0.7169516236306825
Energy: 0.6384305259975849
Energy: 0.6509472813200443
Energy: 0.7179776556982894
Energy: 0.6514384884537854
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Energy: 0.6509472813249313
Energy: 0.7179776557007329
Energy: 0.638924917900332
Energy: 0.657673972532123
Energy: 0.7295832571757181
Energy: 0.6309420605177161
Energy: 0.6389249179027754
Energy: 0.6576739725296796
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Energy: 0.6299212226254893
Energy: 0.6631956521008197
Energy: 0.7108070605844761
Energy: 0.6352321903931717
Energy: 0.6299212226279327
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Energy: 0.703013639768612
Energy: 0.6741466069593272
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Energy: 0.6584626435952602
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Energy: 0.6370203790500459
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Energy: 0.6505497618793333
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Energy: 0.631421504240909
Energy: 0.6364364468654267
Energy: 0.6793428447598443
Energy: 0.6411002414502375
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Energy: 0.6364364468654267
Energy: 0.6793428447622877
Energy: 0.6169479538823477
Energy: 0.6254803103279273
Energy: 0.6722221004477356
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Energy: 0.6722221004526224
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Energy: 0.656705861177452
Energy: 0.6781544904478854
Energy: 0.6349077285599316
Energy: 0.6211019922469951
Energy: 0.6567058611798956
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Energy: 0.6249005301251371
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Energy: 0.6778227717683508
Energy: 0.6347735672181456
Energy: 0.6249005301226938
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Energy: 0.6778227717683508
Energy: 0.620564761246636
Energy: 0.6368003376254153
Energy: 0.6981720893871758
Energy: 0.6472689891122136
Energy: 0.6205647612441925
Energy: 0.6368003376278587
Energy: 0.6981720893920627
Energy: 0.6436205420111782
Energy: 0.6426723290244022
Energy: 0.7004217734007653
Energy: 0.637511726734678
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Energy: 0.6426723290268456
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Energy: 0.651859429904551
Energy: 0.6787669551590981
Energy: 0.7175868613445002
Energy: 0.6627361847381485
Energy: 0.651859429904551
Energy: 0.6787669551590981
Energy: 0.7175868613469438
Energy: 0.643350726186178
Energy: 0.6300792341319138
Energy: 0.6633858566878728
Energy: 0.6555892330594172
Energy: 0.643350726186178
Energy: 0.6300792341319138
Energy: 0.6633858566854294
Energy: 0.6506314490667904
Energy: 0.6330705423466423
Energy: 0.7215165388484398
Energy: 0.628377711867846
Energy: 0.6506314490716772
Energy: 0.6330705423466423
Energy: 0.7215165388435529
Energy: 0.6903755023981498
Energy: 0.6378475942473999
Energy: 0.6857095597738072
Energy: 0.6572640032405822
Energy: 0.6903755023981498
Energy: 0.6378475942449564
Energy: 0.6857095597762508
Energy: 0.6417307561536314
Energy: 0.6501832908700762
Energy: 0.6984822274831789
Energy: 0.6578180847625457
Energy: 0.6417307561511879
Energy: 0.6501832908700762
Energy: 0.6984822274807354
Energy: 0.6248447144498014
Energy: 0.6424465514419934
Energy: 0.6972855182417513
Energy: 0.6354946366309875
Energy: 0.6248447144498014
Energy: 0.6424465514419934
Energy: 0.6972855182393078
Energy: 0.6212440280312264
Energy: 0.6565501783558392
Energy: 0.6805487358891714
Energy: 0.6723588419928095
Energy: 0.6212440280336697
Energy: 0.6565501783582827
Energy: 0.680548735886728
Energy: 0.6194025402451202
Energy: 0.6558412255922189
Energy: 0.6624868284461515
Energy: 0.6208484896999359
Energy: 0.6194025402426768
Energy: 0.6558412255971058
Energy: 0.662486828448595

minimum gb energy = 0.6169191006842535 eV
minimum distance =  2.53485881870157 Angstroms
sigma value = 401


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

Energy: 0.6524407004518142
Energy: 0.6514851126281906
Energy: 0.7128951178614041
Energy: 0.6538605270450408
Energy: 0.6524407004521168
Energy: 0.6514851126284428
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Energy: 0.631443140344514
Energy: 0.6256359058913538
Energy: 0.6479168588288546
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Energy: 0.6253096344545716
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Energy: 0.6386747276251744
Energy: 0.6427147772126847
Energy: 0.6645625330272834
Energy: 0.674893151299876
Energy: 0.6336390210242141
Energy: 0.6427147772124325
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Energy: 0.674893151297405
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Energy: 0.6560378308254875
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Energy: 0.6653470136776518
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Energy: 0.6253096344556808
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Energy: 0.6748931512976571
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Energy: 0.6541637575720132
Energy: 0.6470418492523152
Energy: 0.648186973671837
Energy: 0.6427441911074543
Energy: 0.654163757572568
Energy: 0.6510263014904027
Energy: 0.6479310995375631
Energy: 0.6537913213713135
Energy: 0.6448790708800627
Energy: 0.6510263014890411
Energy: 0.6479310995350418
Energy: 0.6537913213715655
Energy: 0.6342643058103797
Energy: 0.6335934598035415
Energy: 0.7066164677608799
Energy: 0.6473860541780067
Energy: 0.6342643058089678
Energy: 0.6335934598040961
Energy: 0.7066164677587116
Energy: 0.6413960841169326
Energy: 0.664455026381513
Energy: 0.6859990548110593
Energy: 0.6351070954074968
Energy: 0.6413960841177395
Energy: 0.6644550263823198
Energy: 0.6859990548124713
Energy: 0.6428662000266462
Energy: 0.6606325051045231
Energy: 0.6429682485639602
Energy: 0.6348741939927703
Energy: 0.642866200027201
Energy: 0.6606325051031111
Energy: 0.6429682485658763
Energy: 0.6411221450194198
Energy: 0.6341845844304032
Energy: 0.64289515262378
Energy: 0.6381098468622823
Energy: 0.6411221450202771
Energy: 0.6341845844292939
Energy: 0.6428951526271083
Energy: 0.6288870464716249
Energy: 0.6346438684114787
Energy: 0.6444245145918313
Energy: 0.636377706835522
Energy: 0.6288870464710702
Energy: 0.6346438684117308
Energy: 0.644424514592638
Energy: 0.621345970923954
Energy: 0.6514851126284428
Energy: 0.6968285059854564
Energy: 0.6538605270442338
Energy: 0.6213459709217353
Energy: 0.6514851126281906
Energy: 0.6968285059829854
Energy: 0.6314431403450688
Energy: 0.6256359058916565
Energy: 0.6479168588288546
Energy: 0.6505725375030279
Energy: 0.6314431403422953
Energy: 0.6256359058907992
Energy: 0.6479168588285522

minimum gb energy = 0.6213459709217353 eV
minimum distance =  2.5536497419289 Angstroms
sigma value = 311


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

Energy: 0.669739215567179
Energy: 0.6545847248152433
Energy: 0.7506839285627406
Energy: 0.6545512107603051
Energy: 0.6697392155674993
Energy: 0.6545847248142825
Energy: 0.7506839285627406
Energy: 0.6793197562967649
Energy: 0.640515005539488
Energy: 0.6664592732377327
Energy: 0.6560911704373195
Energy: 0.6793197562964447
Energy: 0.6405150055398084
Energy: 0.666459273238053
Energy: 0.6488939101563433
Energy: 0.6654221698855473
Energy: 0.6921188473670477
Energy: 0.6579642709490884
Energy: 0.6488939101563433
Energy: 0.6654221698852271
Energy: 0.6921188473667275
Energy: 0.6448557450849103
Energy: 0.6491727770198878
Energy: 0.6863773798646832
Energy: 0.6321046773882195
Energy: 0.6448557450849103
Energy: 0.6491727770198878
Energy: 0.686377379864363
Energy: 0.6571683624461422
Energy: 0.6518468825977554
Energy: 0.6876091589285799
Energy: 0.6596162357945922
Energy: 0.657168362445822
Energy: 0.6518468825980755
Energy: 0.6851695146493849
Energy: 0.662167919783396
Energy: 0.6326301630132032
Energy: 0.6667124774012978
Energy: 0.6379171410327161
Energy: 0.6621679197837163
Energy: 0.632630163012883
Energy: 0.6667124774016181
Energy: 0.6705016404949005
Energy: 0.6944983456695026
Energy: 0.664682983058965
Energy: 0.654151511688097
Energy: 0.6705016404958611
Energy: 0.6944983456701431
Energy: 0.6646829830586448
Energy: 0.6606895145076805
Energy: 0.6381523834945027
Energy: 0.6871676282474756
Energy: 0.640633573548758
Energy: 0.660689514508321
Energy: 0.6381523834948228
Energy: 0.6871676282474756
Energy: 0.6448009988910265
Energy: 0.636633985344293
Energy: 0.6889374418059202
Energy: 0.6376043937144701
Energy: 0.6448009988907062
Energy: 0.636633985344293
Energy: 0.6889374418056
Energy: 0.6605439108900119
Energy: 0.6754118548650273
Energy: 0.7017402220589491
Energy: 0.696576639628618
Energy: 0.660543910890332
Energy: 0.6754118548656677
Energy: 0.7017402226060425
Energy: 0.6790336624055179
Energy: 0.6526434449592181
Energy: 0.7198105600050728
Energy: 0.6486037032068143
Energy: 0.6790336624061584
Energy: 0.6526434449595384
Energy: 0.719810560005393
Energy: 0.6577941879656903
Energy: 0.6818790597930593
Energy: 0.6941683790739567
Energy: 0.6617498507838975
Energy: 0.6577941879660106
Energy: 0.6818790597933795
Energy: 0.6941683790723554
Energy: 0.6560444713866329
Energy: 0.6459706727505546
Energy: 0.6971723373297878
Energy: 0.6506951320708056
Energy: 0.6560444713859924
Energy: 0.6459706727505546
Energy: 0.697172337328827
Energy: 0.6404205030371157
Energy: 0.6638304160829186
Energy: 0.6736901312045166
Energy: 0.6582264638429552
Energy: 0.6404205030374359
Energy: 0.6638304160841995
Energy: 0.6736901312045166
Energy: 0.6625569366441518
Energy: 0.6457063393836436
Energy: 0.6794868463500141
Energy: 0.6327028993008844
Energy: 0.6625569366454328
Energy: 0.6457063393833233
Energy: 0.6794868463493737
Energy: 0.66934515476735
Energy: 0.6616405333961773
Energy: 0.6940792905321513
Energy: 0.6833376509823095
Energy: 0.6693451547670298
Energy: 0.6616405333948965
Energy: 0.6940792882980389
Energy: 0.6876255864218452
Energy: 0.640067501400634
Energy: 0.727459641322409
Energy: 0.6405497934705188
Energy: 0.6876255864218452
Energy: 0.6400675014003137
Energy: 0.7274596413214482
Energy: 0.6726897690809049
Energy: 0.6964994761458468
Energy: 0.6971122874715958
Energy: 0.6636792231441956
Energy: 0.6726897690809049
Energy: 0.6964994761464874
Energy: 0.6971029110491179
Energy: 0.6454075001870117
Energy: 0.6377881339756691
Energy: 0.6861794377224747
Energy: 0.6293716024246051
Energy: 0.6454075001870117
Energy: 0.637788133975349
Energy: 0.6861794377234355
Energy: 0.6587752333426563
Energy: 0.6472752138374402
Energy: 0.7004259064375695
Energy: 0.6379807723780319
Energy: 0.6587752333426563
Energy: 0.6472752138374402
Energy: 0.7004259064372492
Energy: 0.6611806935500308
Energy: 0.6670998403501216
Energy: 0.6963921420239849
Energy: 0.6944917235906986
Energy: 0.6611806935500308
Energy: 0.6670998403488406
Energy: 0.6963921420230242
Energy: 0.6605981829202942
Energy: 0.6298388083400382
Energy: 0.6661389091861122
Energy: 0.641026103603654
Energy: 0.6605981829212549
Energy: 0.6298388083403585
Energy: 0.6661389091854717
Energy: 0.6878484254395036
Energy: 0.6595074600077199
Energy: 0.6865831050503642
Energy: 0.6518616536789704
Energy: 0.6878484254395036
Energy: 0.6595074600073997
Energy: 0.6865831050478021
Energy: 0.6554483122369109
Energy: 0.6319551996590221
Energy: 0.6887849634697123
Energy: 0.649114600695333
Energy: 0.65544831223563
Energy: 0.6319551996590221
Energy: 0.6887849634693921
Energy: 0.6509349441543095
Energy: 0.6578909377174491
Energy: 0.6789838818537423
Energy: 0.6632672106709526
Energy: 0.6509349441546297
Energy: 0.6578909377174491
Energy: 0.6789838817557715
Energy: 0.6790385374245398
Energy: 0.6474734649417796
Energy: 0.6665349159963071
Energy: 0.6405204444418577
Energy: 0.6790385374242196
Energy: 0.6474734649414594
Energy: 0.6665349159975883
Energy: 0.6603452426318054
Energy: 0.656788342664458
Energy: 0.7296633905214537
Energy: 0.6521327002920118
Energy: 0.6603452426314851
Energy: 0.656788342664458
Energy: 0.7161681790630687
Energy: 0.6885608890901961
Energy: 0.6405673714703994
Energy: 0.6798381690415597
Energy: 0.6525578634003364
Energy: 0.6885608890901961
Energy: 0.6405673714700791
Energy: 0.67983816904188
Energy: 0.6523797420463182
Energy: 0.6633363225151379
Energy: 0.7048502847011314
Energy: 0.6551784436902471
Energy: 0.6523797420456776
Energy: 0.6633363225148174
Energy: 0.7048502847014516
Energy: 0.6455568391219244
Energy: 0.6426841136525535
Energy: 0.6863127490266128
Energy: 0.6319920235980643
Energy: 0.6455568391219244
Energy: 0.6426841136522332
Energy: 0.6863127490275734
Energy: 0.6538770211357746
Energy: 0.6521807527481491
Energy: 0.6939854494641733
Energy: 0.664285281309471
Energy: 0.6538770211351341
Energy: 0.6521807527478289
Energy: 0.6939854494616111
Energy: 0.6607070877336624
Energy: 0.6472010873585372
Energy: 0.6660607971683179
Energy: 0.6265436974551172
Energy: 0.6607070877339826
Energy: 0.6472010873578967
Energy: 0.6660607971692787
Energy: 0.6612580143766666
Energy: 0.6887172037306014
Energy: 0.6559577470666353
Energy: 0.6653408840409241
Energy: 0.6612580143769868
Energy: 0.6887172037306014
Energy: 0.655957747067276
Energy: 0.6588545399174209
Energy: 0.6382861231417315
Energy: 0.6868897556162081
Energy: 0.6382787195796685
Energy: 0.6588545399174209
Energy: 0.638286123142372
Energy: 0.6868897556168488
Energy: 0.6563847544744225
Energy: 0.6291388653171224
Energy: 0.688490574904993
Energy: 0.63713375351193
Energy: 0.6563847544747428
Energy: 0.6291388653174427
Energy: 0.688490574904993
Energy: 0.6633469598129712
Energy: 0.6702050795937499
Energy: 0.6997771464111461
Energy: 0.696406339551103
Energy: 0.6633469598126511
Energy: 0.6702050795931095
Energy: 0.699777149079969

minimum gb energy = 0.6265436974551172 eV
minimum distance =  2.53496264517896 Angstroms
sigma value = 39


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

Energy: 0.6591971462750097
Energy: 0.6795905556594573
Energy: 0.66870409525405
Energy: 0.6795913688853521
Energy: 0.6591971462750097
Energy: 0.6795905556609692
Energy: 0.6836896010197034
Energy: 0.6555142140359751
Energy: 0.6615871141143526
Energy: 0.6217715236086848
Energy: 0.6622145091285642
Energy: 0.6555142140337072
Energy: 0.6615871141128405
Energy: 0.6217715236098188
Energy: 0.654374115042415
Energy: 0.6247377044120113
Energy: 0.6586957912252506
Energy: 0.6406189427046767
Energy: 0.6543741150427929
Energy: 0.6247377044123894
Energy: 0.6586957912248727
Energy: 0.6472366039206117
Energy: 0.6616584883955129
Energy: 0.622610443191849
Energy: 0.6829437967152616
Energy: 0.6472366039228795
Energy: 0.6616584883974027
Energy: 0.6226104431922269
Energy: 0.6684688840712183
Energy: 0.6391526700963102
Energy: 0.6629550629149025
Energy: 0.640651092689872
Energy: 0.6684688840704625
Energy: 0.6391526700963102
Energy: 0.6629550629141466
Energy: 0.6471738669852227
Energy: 0.6386568197648468
Energy: 0.6541689076846661
Energy: 0.6693854231647778
Energy: 0.6471738669844669
Energy: 0.6386568197648468
Energy: 0.6541689076835321
Energy: 0.7147921235148281
Energy: 0.6397243655062
Energy: 0.6718949189484456
Energy: 0.6401834432648775
Energy: 0.714792123515962
Energy: 0.6397243655050661
Energy: 0.6718949189488236
Energy: 0.6476096819439934
Energy: 0.6639290468576593
Energy: 0.6823015434233027
Energy: 0.6636743473269188
Energy: 0.6476096819432373
Energy: 0.6639290468576593
Energy: 0.6823015434233027
Energy: 0.7147983795194068
Energy: 0.6402186690686056
Energy: 0.6680049682799923
Energy: 0.6397140381169887
Energy: 0.7147983795190288
Energy: 0.6402186690689835
Energy: 0.6680049682811261
Energy: 0.6472654091759006
Energy: 0.6693506467844558
Energy: 0.6541915389932721
Energy: 0.6385957302243309
Energy: 0.6472654091755227
Energy: 0.6693506467833218
Energy: 0.6541915389917603
Energy: 0.6686355215137951
Energy: 0.6406681898434228
Energy: 0.6637727807295066
Energy: 0.639150317233482
Energy: 0.6686355215100155
Energy: 0.6406681898422889
Energy: 0.6637312596720616
Energy: 0.6473962312497492
Energy: 0.6831248330643501
Energy: 0.6226043723538327
Energy: 0.6616658241915743
Energy: 0.6473962312486152
Energy: 0.6831248330632161
Energy: 0.6226043723538327
Energy: 0.6549967624795079
Energy: 0.6406970431963709
Energy: 0.6626051683182193
Energy: 0.6247936430144301
Energy: 0.6549967624813977
Energy: 0.640697043194481
Energy: 0.6626051683189751
Energy: 0.6556008786942347
Energy: 0.6621496113056634
Energy: 0.6217357452411347
Energy: 0.6615739578824176
Energy: 0.6556008786931007
Energy: 0.6621496113049073
Energy: 0.6217357452392449
Energy: 0.6591971462753877
Energy: 0.6795905556583234
Energy: 0.6712373877446358
Energy: 0.6795913688857299
Energy: 0.6591971462750097
Energy: 0.6795905556605911
Energy: 0.6712373877453917
Energy: 0.6555142140352193
Energy: 0.6615871141147304
Energy: 0.6217715236090627
Energy: 0.6622145091274303
Energy: 0.6555142140333294
Energy: 0.6615871141132187
Energy: 0.6217715236090627
Energy: 0.6543741150443049
Energy: 0.6247377044120113
Energy: 0.6586957912256285
Energy: 0.6406189427050546
Energy: 0.654374115042415
Energy: 0.6247377044123894
Energy: 0.6586957912267625
Energy: 0.6472366039206117
Energy: 0.6616584883966466
Energy: 0.6226104431914711
Energy: 0.6829437967156397
Energy: 0.6472366039228795
Energy: 0.6616584883962687
Energy: 0.622610443192605
Energy: 0.6684688840715963
Energy: 0.6391526700966881
Energy: 0.6589204372290066
Energy: 0.6406510926894938
Energy: 0.6684688840704625
Energy: 0.6391526700963102
Energy: 0.6589204372293846
Energy: 0.6471738669852227
Energy: 0.6386568197648468
Energy: 0.6541689076835321
Energy: 0.669385423162888
Energy: 0.6471738669844669
Energy: 0.6386568197648468
Energy: 0.6541689076850441
Energy: 0.7147921235148281
Energy: 0.639724365505822
Energy: 0.6407792650762885
Energy: 0.6401834432652556
Energy: 0.7147921235163399
Energy: 0.6397243655043101
Energy: 0.6407792650770443
Energy: 0.6476096819432373
Energy: 0.6639290468576593
Energy: 0.6823015434233027
Energy: 0.6636743473257849
Energy: 0.6476096819439934
Energy: 0.6639290468572814
Energy: 0.6823015434236808
Energy: 0.7147983795197849
Energy: 0.6402186690693614
Energy: 0.6437243327831874
Energy: 0.6397140381162326
Energy: 0.7147983795194068
Energy: 0.6402186690689835
Energy: 0.6437243327854553
Energy: 0.6472654091755227
Energy: 0.6693506467829439
Energy: 0.6541915389951621
Energy: 0.6385957302243309
Energy: 0.6472654091755227
Energy: 0.669350646781432
Energy: 0.6541915389932721
Energy: 0.6686355215134172
Energy: 0.6406681898430447
Energy: 0.6613104241425426
Energy: 0.6391503172342379
Energy: 0.6686355215103935
Energy: 0.6406681898419109
Energy: 0.6613104253843806
Energy: 0.6473962312500927
Energy: 0.6831248330639721
Energy: 0.6226043723538327
Energy: 0.6616658241919522
Energy: 0.6473962312486152
Energy: 0.683124833063594
Energy: 0.6226043723534548
Energy: 0.6549967624798858
Energy: 0.6406970431967489
Energy: 0.6626051683174633
Energy: 0.624793643014052
Energy: 0.6549967624810198
Energy: 0.6406970431948591
Energy: 0.6626051683185973
Energy: 0.6556008786942347
Energy: 0.6621496113056634
Energy: 0.6217357452396228
Energy: 0.6615739578824176
Energy: 0.6556008786934786
Energy: 0.6621496113060413
Energy: 0.6217357452403789
Energy: 0.6591971462753877
Energy: 0.6795905556594573
Energy: 0.6712373877442578
Energy: 0.6795913688849741
Energy: 0.6591971462750097
Energy: 0.6795905556609692
Energy: 0.6712373877442578
Energy: 0.6555142140363531
Energy: 0.6615871141147304
Energy: 0.6217715236083068
Energy: 0.6622145091274303
Energy: 0.6555142140333294
Energy: 0.6615871141128405
Energy: 0.6217715236098188

minimum gb energy = 0.6217357452392449 eV
minimum distance =  2.62411745140111 Angstroms
sigma value = 21


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

Energy: 0.6713775244170507
Energy: 0.690567917975106
Energy: 0.6939219687919451
Energy: 0.7284959351657412
Energy: 0.6713775244161329
Energy: 0.6905679179746472
Energy: 0.6809632473197351
Energy: 0.6756918001993207
Energy: 0.6678866426734277
Energy: 0.644348987299687
Energy: 0.6680285517092451
Energy: 0.6756918001997797
Energy: 0.6678866426743453
Energy: 0.6443489872987691
Energy: 0.6747999293955441
Energy: 0.6637494340398696
Energy: 0.6761771572423025
Energy: 0.6659904193032725
Energy: 0.674799929396003
Energy: 0.6637494340398696
Energy: 0.6761771572427613
Energy: 0.6621133700689755
Energy: 0.6688327037302848
Energy: 0.6512579330425103
Energy: 0.654852597471371
Energy: 0.6621133700680577
Energy: 0.6688327037312024
Energy: 0.6512579330429691
Energy: 0.6548252141099109
Energy: 0.6273132820823175
Energy: 0.6743189116401601
Energy: 0.6757055011672514
Energy: 0.6548252141094519
Energy: 0.6273132820832353
Energy: 0.6743189116397013
Energy: 0.6620466515103509
Energy: 0.6356106017385081
Energy: 0.7169662031159663
Energy: 0.6618019944660696
Energy: 0.6620466515089745
Energy: 0.6356106017375903
Energy: 0.7169662031159663
Energy: 0.6545434850106862
Energy: 0.6898569923066754
Energy: 0.6499503159462844
Energy: 0.665842335611034
Energy: 0.6545434850097686
Energy: 0.6898569923062166
Energy: 0.6499503159472021
Energy: 0.6678593482174181
Energy: 0.6460719231359988
Energy: 0.721943086845958
Energy: 0.6590227026125233
Energy: 0.667859348217877
Energy: 0.6460719231369166
Energy: 0.7219430868454991
Energy: 0.6547330569826612
Energy: 0.6621284680700817
Energy: 0.6627478396422936
Energy: 0.7109363228395665
Energy: 0.6547330569826612
Energy: 0.6621284680705407
Energy: 0.6627478396422936
Energy: 0.6562019952090556
Energy: 0.6703128949772897
Energy: 0.6541371916703539
Energy: 0.6586602643083497
Energy: 0.6562019952095145
Energy: 0.6703128949777486
Energy: 0.6541371916708127
Energy: 0.6994644059399844
Energy: 0.7046082295257885
Energy: 0.6632860747827183
Energy: 0.6507399967265518
Energy: 0.6994644059390875
Energy: 0.7046082295253296
Energy: 0.6632860747818007
Energy: 0.6336194353301856
Energy: 0.6489161122940891
Energy: 0.6493686061875017
Energy: 0.6501874457560615
Energy: 0.6336194353301856
Energy: 0.6489161122945478
Energy: 0.6493686061875017
Energy: 0.7093083573466814
Energy: 0.6508238904778108
Energy: 0.6559295453582334
Energy: 0.657849249878992
Energy: 0.7093083573457638
Energy: 0.6508238904787284
Energy: 0.6559295453573157
Energy: 0.6336694397688882
Energy: 0.6488396437086468
Energy: 0.6526711418215447
Energy: 0.6335013013275134
Energy: 0.6336694397688882
Energy: 0.6488396437086468
Energy: 0.6526711418215447
Energy: 0.6983765229425389
Energy: 0.6422902311100249
Energy: 0.6560095782211137
Energy: 0.6572429947680463
Energy: 0.6983765229425389
Energy: 0.6422902311104839
Energy: 0.656009578220655
Energy: 0.6295043030847359
Energy: 0.692092891796234
Energy: 0.6528333049622363
Energy: 0.6433499267684698
Energy: 0.6295043030856537
Energy: 0.6920928917957752
Energy: 0.6528333049622363
Energy: 0.6976926949691316
Energy: 0.6422686304929516
Energy: 0.7028806294482034
Energy: 0.6571314652150411
Energy: 0.6976926949686728
Energy: 0.6422686304943281
Energy: 0.70288062944958
Energy: 0.6295355926683011
Energy: 0.6717297465221439
Energy: 0.6587414920400977
Energy: 0.6512974586735308
Energy: 0.6295355926687599
Energy: 0.6717297465230616
Energy: 0.6587414920405567
Energy: 0.6779884626265837
Energy: 0.6423658569525545
Energy: 0.704990029188913
Energy: 0.6492157247328951
Energy: 0.6779884626275016
Energy: 0.6423658569530135
Energy: 0.704990029188913
Energy: 0.6298600375686286
Energy: 0.6912430174243038
Energy: 0.6429908914330363
Energy: 0.6912436841620524
Energy: 0.6298600375695463
Energy: 0.691243017423845
Energy: 0.6429908914321187
Energy: 0.6779887070572631
Energy: 0.6483153377097313
Energy: 0.7049190861483338
Energy: 0.6423041994024768
Energy: 0.6779887070568043
Energy: 0.6483153377092725
Energy: 0.7049190861464983
Energy: 0.62954704505733
Energy: 0.6512571197426268
Energy: 0.6587620835730013
Energy: 0.6717497673833386
Energy: 0.6295470450577887
Energy: 0.6512571197426268
Energy: 0.6587620835725424
Energy: 0.6976579644097259
Energy: 0.6570351336634702
Energy: 0.6514378875835567
Energy: 0.6422047930090415
Energy: 0.6976579644092672
Energy: 0.6570351336630114
Energy: 0.6514378875844743
Energy: 0.6295560092270501
Energy: 0.6432521765798008
Energy: 0.6529238632741726
Energy: 0.6921648577561681
Energy: 0.6295560092279678
Energy: 0.6432521765798008
Energy: 0.6529238632741726
Energy: 0.6979287241575999
Energy: 0.6571370323947467
Energy: 0.727418397253182
Energy: 0.6423206220825658
Energy: 0.697928724157141
Energy: 0.6571370323947467
Energy: 0.7274183972527233

minimum gb energy = 0.6273132820823175 eV
minimum distance =  2.51090661795365 Angstroms
sigma value = 113


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

Energy: 0.673711425863591
Energy: 0.7075441109536368
Energy: 0.6694671041339747
Energy: 0.706282104401068
Energy: 0.6737114258633582
Energy: 0.7075441109559647
Energy: 0.6694671041329505
Energy: 0.7096915173981296
Energy: 0.6880064443209098
Energy: 0.6663962074079636
Energy: 0.6980494814540458
Energy: 0.7096915173991539
Energy: 0.6880064443219341
Energy: 0.6663962074048908
Energy: 0.6822550038435045
Energy: 0.6927583339390758
Energy: 0.7092489338621962
Energy: 0.681229586755933
Energy: 0.6822550038422007
Energy: 0.6927583339398208
Energy: 0.7092489338594027
Energy: 0.6641282958727167
Energy: 0.6919954703468219
Energy: 0.7217698893893244
Energy: 0.6762716922281844
Energy: 0.6641282958722047
Energy: 0.6919954703470548
Energy: 0.7217698893877879
Energy: 0.6822303971957078
Energy: 0.6481438258926843
Energy: 0.6786113142246727
Energy: 0.6690704680005578
Energy: 0.682230397193147
Energy: 0.6481438258931963
Energy: 0.6786113142231361
Energy: 0.6552463429379335
Energy: 0.6941409884263847
Energy: 0.7431621109623427
Energy: 0.6497102540658511
Energy: 0.6552463429417978
Energy: 0.6941409884268969
Energy: 0.743162110961039
Energy: 0.6549783046279795
Energy: 0.6460913891579603
Energy: 0.6876058646173142
Energy: 0.6598772824433873
Energy: 0.654978304636686
Energy: 0.6460913891584724
Energy: 0.6876058646198752
Energy: 0.6544826358100151
Energy: 0.6782118305062629
Energy: 0.7280427120653924
Energy: 0.6582339838828575
Energy: 0.6544826358120637
Energy: 0.6782118305072874
Energy: 0.7280427120672082
Energy: 0.6475320069389618
Energy: 0.6578563120830152
Energy: 0.7069957451457086
Energy: 0.6613223389576801
Energy: 0.6475320069384496
Energy: 0.6578563120840396
Energy: 0.7069957451444049
Energy: 0.6376053197114303
Energy: 0.6714471691158292
Energy: 0.7069048696730881
Energy: 0.6632833153362118
Energy: 0.6376053197098938
Energy: 0.6714471691133149
Energy: 0.7069048696712722
Energy: 0.6592241336336417
Energy: 0.6717817995189423
Energy: 0.7134272914236054
Energy: 0.6642268698374368
Energy: 0.6592241336348988
Energy: 0.6717817995181974
Energy: 0.7134272914223017
Energy: 0.6442940690824305
Energy: 0.6736855299010667
Energy: 0.7223265158953914
Energy: 0.6633142169714978
Energy: 0.6442940690819183
Energy: 0.6736855298982731
Energy: 0.7223265158946
Energy: 0.6676625662187986
Energy: 0.671912047836823
Energy: 0.709003268272147
Energy: 0.6708947735396341
Energy: 0.6676625662231286
Energy: 0.6719120478357988
Energy: 0.720139122486527
Energy: 0.6709700078729337
Energy: 0.7116563373240072
Energy: 0.7455102088803535
Energy: 0.6977801081188174
Energy: 0.6709700078739581
Energy: 0.71165633732424
Energy: 0.7455102088836592
Energy: 0.6669797129536896
Energy: 0.679129988114237
Energy: 0.7410783612219487
Energy: 0.686782092159825
Energy: 0.6669797129544345
Energy: 0.6791299881157735
Energy: 0.7410783612227403
Energy: 0.6734600681454322
Energy: 0.676203808439847
Energy: 0.7173764209098183
Energy: 0.6767466894922227
Energy: 0.6734600681410557
Energy: 0.6762038084434321
Energy: 0.7173764209103305
Energy: 0.704462303994896
Energy: 0.6708841356486255
Energy: 0.7446519576148334
Energy: 0.6588494948945275
Energy: 0.7044623039925679
Energy: 0.6708841356465769
Energy: 0.7446519576153456
Energy: 0.6410321135801463
Energy: 0.6677148405601631
Energy: 0.7117618428860164
Energy: 0.6613072429771744
Energy: 0.6410321135952783
Energy: 0.6677148405593715
Energy: 0.7117618428878322
Energy: 0.7046962972095069
Energy: 0.6821954172648942
Energy: 0.7293572342137868
Energy: 0.6889627363652188
Energy: 0.7046962972089948
Energy: 0.6821954172669428
Energy: 0.729357234211226
Energy: 0.6381875356286171
Energy: 0.6757405048541082
Energy: 0.7029086680558609
Energy: 0.6312834310060286
Energy: 0.6381875356270806
Energy: 0.6757405048561568
Energy: 0.7029086680533003
Energy: 0.6506742397936346
Energy: 0.6450960353062748
Energy: 0.7246233102054879
Energy: 0.691421913600508
Energy: 0.6506742397941468
Energy: 0.6450960353052505
Energy: 0.7246233102034859
Energy: 0.6544753616500157
Energy: 0.6605675078325112
Energy: 0.687687203347381
Energy: 0.647154064130166
Energy: 0.6544753616456855
Energy: 0.6605675078340477
Energy: 0.6876872033456117
Energy: 0.6550274150478497
Energy: 0.6504087504002678
Energy: 0.731784870292807
Energy: 0.6961026914182574
Energy: 0.6550274150504106
Energy: 0.6504087504005006
Energy: 0.7317848702956008
Energy: 0.6708979255688385
Energy: 0.6639386081813994
Energy: 0.7006677975380037
Energy: 0.6597458727224158
Energy: 0.6708979255716322
Energy: 0.6639386081816786
Energy: 0.7006677975369794
Energy: 0.6697302977645356
Energy: 0.6735778476285352
Energy: 0.6754471807639905
Energy: 0.7237090732180195
Energy: 0.669730297766817
Energy: 0.6735778476282557
Energy: 0.675447180763711
Energy: 0.6672239350840885
Energy: 0.705620415797393
Energy: 0.6965781798829107
Energy: 0.6708082429767378
Energy: 0.6672239350820399
Energy: 0.7056204157953442
Energy: 0.6965781798780684
Energy: 0.6973650656717416
Energy: 0.6696997111908104
Energy: 0.6717689746847839
Energy: 0.7405253768015929
Energy: 0.6973650656717416
Energy: 0.6696997111897862
Energy: 0.6717689746822233
Energy: 0.6818116461890914
Energy: 0.7269287908711878
Energy: 0.7098080075123095
Energy: 0.7088823969321583
Energy: 0.6818116461878343
Energy: 0.7269287908699307
Energy: 0.7098080075117974
Energy: 0.7096479431191773
Energy: 0.6702667648081936
Energy: 0.7182643549463781
Energy: 0.7376920855595804
Energy: 0.7096479431179202
Energy: 0.6702667648035842
Energy: 0.7182643549458659
Energy: 0.6654641511426702
Energy: 0.6987662190317651
Energy: 0.718042666682573
Energy: 0.6949735076745318
Energy: 0.6654641511421581
Energy: 0.6987662190335808
Energy: 0.7180426666838301
Energy: 0.6666817692989545
Energy: 0.6742181230149842
Energy: 0.7170634378525449
Energy: 0.7053008911534105
Energy: 0.6666817693023068
Energy: 0.6742181230147516
Energy: 0.7170634378517998
Energy: 0.669648723854354
Energy: 0.6468224291672837
Energy: 0.6765105448189465
Energy: 0.6709973468213184
Energy: 0.6696487238535626
Energy: 0.6468224291657472
Energy: 0.6765105448209949
Energy: 0.6493015074808394
Energy: 0.6670941881469771
Energy: 0.7396540435004314
Energy: 0.6831308226650074
Energy: 0.6493015074795356
Energy: 0.6670941881466979
Energy: 0.7396540434963342
Energy: 0.6507494282223738
Energy: 0.6550398202656
Energy: 0.6695839971402756
Energy: 0.6481445528634164
Energy: 0.6507494282210702
Energy: 0.6550398202712338
Energy: 0.6695839971389719
Energy: 0.6504728237813767
Energy: 0.6444539354060713
Energy: 0.7298352424619653
Energy: 0.6831193116886108
Energy: 0.6504728237826339
Energy: 0.6444539354050469
Energy: 0.7298352424599166
Energy: 0.6437443904141859
Energy: 0.6476167829408167
Energy: 0.6639289291127415
Energy: 0.6382905513305579
Energy: 0.6437443904180038
Energy: 0.6476167829379766
Energy: 0.6639289291114377
Energy: 0.6492251874531341
Energy: 0.6544775863041278
Energy: 0.7072242692269896
Energy: 0.6816024692704794
Energy: 0.6492251874539255
Energy: 0.6544775863013342
Energy: 0.7072242692251737
Energy: 0.6523252519394767
Energy: 0.6450073292619821
Energy: 0.6932949362552974
Energy: 0.6635074553206818
Energy: 0.6523252519422703
Energy: 0.64500732926147
Energy: 0.6932949362547853
Energy: 0.6625638402023546
Energy: 0.6661383419548764
Energy: 0.7447990129356714
Energy: 0.679684219003956
Energy: 0.662563840203891
Energy: 0.6661383419515707
Energy: 0.7447990129366958
Energy: 0.667898008520807
Energy: 0.6756645712639097
Energy: 0.705983065919968
Energy: 0.6763446882371125
Energy: 0.6678980085195033
Energy: 0.6756645712633974
Energy: 0.7059830659215043
Energy: 0.6844455432593736
Energy: 0.6673135275550852
Energy: 0.7350980020532027
Energy: 0.6949160552803847
Energy: 0.6844455432563008
Energy: 0.6673135275591825
Energy: 0.735098002054227
Energy: 0.6496011088004903
Energy: 0.6622065315665828
Energy: 0.7492699267082586
Energy: 0.7030626212586741
Energy: 0.6496011087999782
Energy: 0.6622065315698887
Energy: 0.7492699267059306
Energy: 0.6734302593031621
Energy: 0.6671154870069389
Energy: 0.7225974918101751
Energy: 0.6932999097332871
Energy: 0.6734302593013464
Energy: 0.6671154870056352
Energy: 0.7225974918109667
Energy: 0.6871526901245043
Energy: 0.6632462472763484
Energy: 0.7431731801489458
Energy: 0.6395568441579289
Energy: 0.6871526901270651
Energy: 0.6632462472756036
Energy: 0.7431731801509944
Energy: 0.6472771182429645
Energy: 0.6686200637071192
Energy: 0.7095806783280428
Energy: 0.6759805364476147
Energy: 0.6472771182432437
Energy: 0.668620063706095
Energy: 0.709580678324225

minimum gb energy = 0.6312834310060286 eV
minimum distance =  2.52096564169787 Angstroms
sigma value = 365


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

Energy: 0.6800300725014995
Energy: 0.5225120001556683
Energy: 0.6173097684085413
Energy: 0.522512000156823
Energy: 0.6800300725020768
Energy: 0.5225120001556683
Energy: 0.6173097684085413
Energy: 0.6800300725026541
Energy: 0.5225120001574003
Energy: 0.6860001536784104
Energy: 0.5225120001562457
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.7195325442559503
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.616955243098972
Energy: 0.5225120001556683
Energy: 0.6800300725026541
Energy: 0.522512000156823
Energy: 0.5924940247797716
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.6048672154886027
Energy: 0.522512000156823
Energy: 0.6800300725009222
Energy: 0.5225120001556683
Energy: 0.6048672154909122
Energy: 0.6800300725020768
Energy: 0.522512000156823
Energy: 0.5924401556664707
Energy: 0.5225120001562457
Energy: 0.6800300725009222
Energy: 0.5225120001556683
Energy: 0.5924401556647387
Energy: 0.6800300725020768
Energy: 0.5225120001556683
Energy: 0.6054605072060031
Energy: 0.5225120001562457
Energy: 0.6800300725020768
Energy: 0.522512000156823
Energy: 0.6162526436790272
Energy: 0.6800300725020768
Energy: 0.5225120001562457
Energy: 0.6173097684079638
Energy: 0.522512000156823
Energy: 0.6800300725020768
Energy: 0.5225120001556683
Energy: 0.6173097684068092
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.5924940247791943
Energy: 0.522512000156823
Energy: 0.6800300725026541
Energy: 0.5225120001556683
Energy: 0.6267679034231974
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.6162648812846642
Energy: 0.5225120001556683
Energy: 0.6800300725026541
Energy: 0.522512000156823
Energy: 0.592481647625521
Energy: 0.6800300725014995
Energy: 0.5225120001550909
Energy: 0.616955243098972
Energy: 0.5225120001579777
Energy: 0.6800300725026541
Energy: 0.5225120001556683
Energy: 0.616955243098972
Energy: 0.6800300725026541
Energy: 0.522512000156823
Energy: 0.5924816476243664
Energy: 0.5225120001550909
Energy: 0.6800300725020768
Energy: 0.5225120001562457
Energy: 0.5924816476243664
Energy: 0.6800300725026541
Energy: 0.5225120001562457
Energy: 0.5924940247786169
Energy: 0.5225120001556683
Energy: 0.6800300725020768
Energy: 0.522512000156823
Energy: 0.5924940247786169
Energy: 0.6800300725014995
Energy: 0.522512000156823
Energy: 0.6173024358115914
Energy: 0.5225120001574003
Energy: 0.6800300725026541
Energy: 0.5225120001562457
Energy: 0.617302435811014
Energy: 0.6800300725026541
Energy: 0.522512000156823
Energy: 0.5924940247786169
Energy: 0.5225120001574003
Energy: 0.6800300725026541
Energy: 0.5225120001550909
Energy: 0.5924940247774623
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.5924940247791943
Energy: 0.5225120001562457
Energy: 0.6800300725020768
Energy: 0.522512000156823
Energy: 0.5924940247786169
Energy: 0.6800300725020768
Energy: 0.522512000156823
Energy: 0.5924940247780397
Energy: 0.5225120001562457
Energy: 0.6800300725020768
Energy: 0.5225120001556683
Energy: 0.5924940247791943
Energy: 0.6800300725026541
Energy: 0.5225120001562457
Energy: 0.5924940247797716
Energy: 0.5225120001562457
Energy: 0.6800300725009222
Energy: 0.522512000156823
Energy: 0.5924940247774623
Energy: 0.6800300725020768
Energy: 0.5225120001562457
Energy: 0.5924940247797716
Energy: 0.5225120001562457
Energy: 0.6800300725020768
Energy: 0.5225120001562457
Energy: 0.5924940247774623
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.5924940247774623
Energy: 0.522512000156823
Energy: 0.6800300725014995
Energy: 0.5225120001562457
Energy: 0.5924940247791943
Energy: 0.6800300725026541
Energy: 0.5225120001562457
Energy: 0.5924940247780397
Energy: 0.522512000156823
Energy: 0.6800300725020768
Energy: 0.5225120001562457
Energy: 0.5924940247780397

minimum gb energy = 0.5225120001550909 eV
minimum distance =  2.66161612044689 Angstroms
sigma value = 23