Model name: model_name=EAM_Dynamo_LiuAdams_1998_AlMg__MO_019873715786_000
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=4.03203821182251
cohesive_energy=3.36023026856906
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.0226678915933e-19, 2.6751383040234594e-19, 3.0404185548091196e-19, 3.39920999022708e-19, 3.6789820740561597e-19, 3.9178666101855596e-19, 4.13462508699942e-19, 4.32207975317742e-19, 4.47939747686988e-19, 4.6185144740001e-19, 4.7418019659864e-19, 4.84531859830914e-19, 4.930842787032059e-19, 5.0058406752696e-19, 5.077714319070839e-19, 5.14548639068904e-19, 5.206913842836599e-19, 5.259192866404019e-19, 5.300657197691939e-19, 5.33223609914808e-19, 5.355499703873759e-19, 5.37131318725134e-19, 5.380365485233439e-19, 5.38326542494098e-19, 5.38004504990664e-19, 5.3691342270291e-19, 5.34853023551586e-19, 5.31680713816266e-19, 5.27285943309204e-19, 5.215469466062159e-19, 5.14390023582138e-19, 5.057494849949759e-19, 4.951687105040399e-19, 4.81957161980076e-19, 4.65251266217358e-19, 4.43793314558196e-19, 4.1596190424898195e-19, 3.79879284274668e-19, 3.33654886207134e-19, 2.75499078746202e-19, 2.0352449781701998e-19, 1.130766600801546e-19, -2.6537492459595595e-21, -1.495804922915472e-19]
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: 0.012758013485101954
Energy: 0.014267511135811045
Energy: 0.44878658168735736
Energy: 0.5302535147608508
Energy: 0.5299346472466804
Energy: 0.19360396184318893
Energy: 0.013702974490351627
Energy: 0.013124562054326173
Energy: 0.5234742633577852
Energy: 0.16854356147251162
Energy: 0.3250653462613222
Energy: 0.4284046941589137
Energy: 0.013269645266575134
Energy: 0.07143459534918283
Energy: 0.013090445027314549
Energy: 0.3421130909844898
Energy: 0.29431636344264855
Energy: 0.32536184304576893
Energy: 0.4213257539810368
Energy: 0.07065009006833113
Energy: 0.07165208846883894
Energy: 0.014563225241602324
Energy: 0.28415564758915907
Energy: 0.3808873839651331
Energy: 0.4212991549736397
Energy: 0.42113845576212844
Energy: 0.0707946892143914
Energy: 0.013421927252500283
Energy: 0.07051881602743884
Energy: 0.5235965028439217
Energy: 0.16859008235391612
Energy: 0.3281992401852141
Energy: 0.3262083356964816
Energy: 0.013449613441353958
Energy: 0.07117272723490699
Energy: 0.013037513004581893
Energy: 0.3437402031161225
Energy: 0.3797630241100057
Energy: 0.29709895916376217
Energy: 0.42092534632553974
Energy: 0.07039235190154064
Energy: 0.07153866343775626

minimum gb energy = 0.012758013485101954 eV
minimum distance =  2.82550430439634 Angstroms
sigma value = 5


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

Energy: 0.6149240841719413
Energy: 0.6428314132307953
Energy: 0.6415779355123788
Energy: 0.6847773618053382
Energy: 0.6446947429334297
Energy: 0.6154889816689066
Energy: 0.6635789739046865
Energy: 0.5540559419144852
Energy: 0.6519448430034496
Energy: 0.5767195604102946
Energy: 0.639115569346475
Energy: 0.650281026714776
Energy: 0.6116184721227267
Energy: 0.6622428666969559
Energy: 0.5959522042474844
Energy: 0.6753544665003913
Energy: 0.6617131792371166
Energy: 0.6858485513206658
Energy: 0.6890126843324257
Energy: 0.6674197705689977
Energy: 0.6964570289311192
Energy: 0.6087544330343535
Energy: 0.6707500669091446
Energy: 0.5627994264328205
Energy: 0.6407905025207055
Energy: 0.6331255703803185
Energy: 0.6355725442611942
Energy: 0.7070690198609355
Energy: 0.6343711903485239
Energy: 0.6421427217766732
Energy: 0.5982553218457501
Energy: 0.6313272581727112
Energy: 0.6160485459452593
Energy: 0.6524725110812277
Energy: 0.697977634973187
Energy: 0.5967494425098249
Energy: 0.6318662193119767
Energy: 0.6219638759165336
Energy: 0.5889086422573958
Energy: 0.6434676842881308
Energy: 0.621650870815951
Energy: 0.688071342290415
Energy: 0.6079274254853596
Energy: 0.690370854685288
Energy: 0.6064916532194665
Energy: 0.6488788387602448
Energy: 0.6404199102522526
Energy: 0.6157127974475497
Energy: 0.748800602071988
Energy: 0.5686404756272778
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Energy: 0.5983446670071921
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Energy: 0.6118983874323369
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Energy: 0.6203011100588015
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Energy: 0.6434731672299281
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Energy: 0.6224392125105525
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Energy: 0.6747472112356409
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Energy: 0.6318061402483245
Energy: 0.6388081320436689
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Energy: 0.5891877756807529
Energy: 0.6181821833970008
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Energy: 0.6947320945240201
Energy: 0.6202169851768821
Energy: 0.6733210898711466
Energy: 0.6340685032766036
Energy: 0.6399219134818924
Energy: 0.6721071986025982
Energy: 0.6072211432577624
Energy: 0.7194515766091326
Energy: 0.5633814264642705
Energy: 0.6861960771141083
Energy: 0.6441041612429078
Energy: 0.6220664371790909
Energy: 0.6988628812843634
Energy: 0.6285308560704813
Energy: 0.6425007812656258
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Energy: 0.6360844897341896
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Energy: 0.6251865789652479
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Energy: 0.5749891660797251
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Energy: 0.6758547972462693
Energy: 0.6332086397485978
Energy: 0.6369958985179762
Energy: 0.6159618840041131
Energy: 0.6370200116692599
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Energy: 0.5775764433086072
Energy: 0.6704577057050514
Energy: 0.5931343641661093
Energy: 0.6312455392838883
Energy: 0.6455923737593872
Energy: 0.6099253003999308
Energy: 0.694512604772677
Energy: 0.6568124870147939
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Energy: 0.5925411419150728
Energy: 0.6305928556772148
Energy: 0.6429039877042483
Energy: 0.6921857473783136
Energy: 0.6776598312145496
Energy: 0.613091519423793
Energy: 0.629969528993361
Energy: 0.5772352828296461
Energy: 0.624264240060581
Energy: 0.6181984059465019
Energy: 0.6089484890424105
Energy: 0.6697242541916073
Energy: 0.6346624253322622
Energy: 0.7143980071860769
Energy: 0.6325829537804304
Energy: 0.624918501706419
Energy: 0.623443182699733
Energy: 0.6260469429749598
Energy: 0.6694218286476795
Energy: 0.5732259725549601
Energy: 0.6616304252279446
Energy: 0.5999754757002077
Energy: 0.6280579972417554
Energy: 0.6486880772620363
Energy: 0.6215719685225307
Energy: 0.6630391738832581
Energy: 0.5933215235877219
Energy: 0.6420243228882867
Energy: 0.6338674007382455
Energy: 0.6573838397372465
Energy: 0.6973564493929426
Energy: 0.6530425596685775
Energy: 0.6619256290391217
Energy: 0.57908621986147
Energy: 0.6256296774666851
Energy: 0.6596492574365601
Energy: 0.6464209344485543
Energy: 0.6211291246305612
Energy: 0.5688590470291782
Energy: 0.6580236360909835
Energy: 0.5981688087941548
Energy: 0.6828184194549154
Energy: 0.6239135122188099
Energy: 0.6440739241245922
Energy: 0.6711413022775011
Energy: 0.5978013841522213
Energy: 0.6468901124581058

minimum gb energy = 0.5540559419144852 eV
minimum distance =  2.54024276983821 Angstroms
sigma value = 401


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

Energy: 0.607455941799344
Energy: 0.6152227125213018
Energy: 0.6441135283744581
Energy: 0.5927598512872104
Energy: 0.7278811688894616
Energy: 0.5870779015810583
Energy: 0.6150134767040064
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Energy: 0.6585689513607557
Energy: 0.7450562105656039
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Energy: 0.6198102650115743
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Energy: 0.6539674540329131
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Energy: 0.6739531256721485
Energy: 0.6218555511633045
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Energy: 0.646089931662078
Energy: 0.6451782134640245
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Energy: 0.5905661289193315
Energy: 0.5746150132297598
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Energy: 0.5692808592102578
Energy: 0.6360898966645908
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Energy: 0.7214315499125669
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Energy: 0.6991420662161235
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Energy: 0.5632171547184109
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Energy: 0.570519065330104
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Energy: 0.6522127172901253
Energy: 0.6096604572745842
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Energy: 0.6094099417909012
Energy: 0.6870973881781451
Energy: 0.6520966615793596
Energy: 0.6190725886035863
Energy: 0.6288174316099934
Energy: 0.5974477776644178
Energy: 0.6238256161180461
Energy: 0.6138876281924944
Energy: 0.6891220938674433
Energy: 0.5668748812742455
Energy: 0.6004818849766463
Energy: 0.598809664233724
Energy: 0.618123822470351
Energy: 0.6414757577515976
Energy: 0.6117514220040529
Energy: 0.6450533203552926
Energy: 0.5737552623013222
Energy: 0.5739110193229557
Energy: 0.6157257492894167
Energy: 0.6902361088731112
Energy: 0.6423113885089893
Energy: 0.5879429439971166
Energy: 0.6146315132310265
Energy: 0.5951145004078131
Energy: 0.594041422310208
Energy: 0.5769101009512033
Energy: 0.6959863363600107
Energy: 0.6416058488426476
Energy: 0.5715520257633417
Energy: 0.6023130865501515
Energy: 0.571294274068268
Energy: 0.5832959604487845
Energy: 0.6138669564943877
Energy: 0.6585646709349248
Energy: 0.6672156302956215
Energy: 0.5717359676223218
Energy: 0.6036702949169563
Energy: 0.5733046710020221
Energy: 0.6603387220863357
Energy: 0.5722931836791872
Energy: 0.6027272066304037
Energy: 0.6623218895607814
Energy: 0.610601535284105
Energy: 0.6176414409728783
Energy: 0.5883768594517047
Energy: 0.684509031014216
Energy: 0.6219761034966422
Energy: 0.6522894163771282
Energy: 0.6470068145858308
Energy: 0.5667757540487833
Energy: 0.6906947878985656
Energy: 0.5865247744160962
Energy: 0.6519356978793032
Energy: 0.5885962443990234
Energy: 0.6145743430973655
Energy: 0.6052424074192799
Energy: 0.6233303438758776
Energy: 0.6473782673116999
Energy: 0.6535221131132969
Energy: 0.6573766603439021
Energy: 0.6176474169934251
Energy: 0.5875597538525111
Energy: 0.5743496431196106
Energy: 0.6772144151171049
Energy: 0.7139299714487389
Energy: 0.5910293196873518
Energy: 0.638181132774673
Energy: 0.5616368468109617
Energy: 0.6128623822186626
Energy: 0.6073998348267174
Energy: 0.6107586038953571
Energy: 0.6635479190842882
Energy: 0.6431281760889397
Energy: 0.6760382581882646
Energy: 0.6701542604111995
Energy: 0.5990449299579326
Energy: 0.6343872896012198
Energy: 0.6149632454060757
Energy: 0.690186945638747
Energy: 0.5706891564909647
Energy: 0.6260083482159062
Energy: 0.6907172075845421
Energy: 0.5997854612611973
Energy: 0.656815571020852
Energy: 0.6074956617160159
Energy: 0.6369994873015079
Energy: 0.5758054101815159
Energy: 0.6041511538446059
Energy: 0.6125279208080978
Energy: 0.6700800240562591
Energy: 0.6712597661533057
Energy: 0.65273673302897
Energy: 0.6263256768013258
Energy: 0.6170667042354662
Energy: 0.646324683836821
Energy: 0.5813099955327657
Energy: 0.6182127210106791
Energy: 0.6754737655542027
Energy: 0.5799317574066032
Energy: 0.5714160749974913

minimum gb energy = 0.5512697695807217 eV
minimum distance =  2.587042648031 Angstroms
sigma value = 311


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

Energy: 0.5929787138778
Energy: 0.6576935242148682
Energy: 0.6308640371168193
Energy: 0.6232212807072277
Energy: 0.6317316667321493
Energy: 0.5919533985512195
Energy: 0.6145494460618304
Energy: 0.5927388735851938
Energy: 0.6545371102604164
Energy: 0.5807456437964029
Energy: 0.6378632149853013
Energy: 0.5937385302665109
Energy: 0.6186988155550389
Energy: 0.6575398920319554
Energy: 0.6142721216627501
Energy: 0.6474620391240189
Energy: 0.5980920750038743
Energy: 0.6307552650962222
Energy: 0.6230672317142298
Energy: 0.5796722925403064
Energy: 0.6490656226606526
Energy: 0.5624767335796121
Energy: 0.6625985135106817
Energy: 0.6113558052114771
Energy: 0.6644497648496698
Energy: 0.6280498079044765
Energy: 0.5724619430001153
Energy: 0.6154330368138347
Energy: 0.6235297131048434
Energy: 0.609130329519459
Energy: 0.5922397597734103
Energy: 0.6226864681844475
Energy: 0.6212287922484323
Energy: 0.5983495207663756
Energy: 0.6511046927069584
Energy: 0.5816692158206502
Energy: 0.6149843991957057
Energy: 0.5874946401470775
Energy: 0.6056710083308614
Energy: 0.6190635745454078
Energy: 0.6154500736277202
Energy: 0.6125219202758124
Energy: 0.596325193670235
Energy: 0.6601313154318602
Energy: 0.6318186578723205
Energy: 0.6201701893940715
Energy: 0.6321665985789452
Energy: 0.5869535073751011
Energy: 0.6280244934715253
Energy: 0.5824235584162342
Energy: 0.6284045896088201
Energy: 0.602534521527335
Energy: 0.6250421948536603
Energy: 0.6103730012062105
Energy: 0.6127966094428448
Energy: 0.6567387682104413
Energy: 0.6256071998263237
Energy: 0.6347799570995333
Energy: 0.6548747117117751
Energy: 0.6201066815458068
Energy: 0.623189603985622
Energy: 0.6142828762122997
Energy: 0.6479264996274735
Energy: 0.5677980473848792
Energy: 0.6769855766618706
Energy: 0.5984805379958762
Energy: 0.615331166463472
Energy: 0.6146319489671961
Energy: 0.5659733108735594
Energy: 0.604605506938153
Energy: 0.6344626439206877
Energy: 0.6065351851311925
Energy: 0.6003342720318039
Energy: 0.6333082169045797
Energy: 0.5942988107303363
Energy: 0.6161829009445726
Energy: 0.6335497046615903
Energy: 0.5860185507987998
Energy: 0.6292440738431698
Energy: 0.5871160398540554
Energy: 0.623716622156557
Energy: 0.6037364985042258
Energy: 0.5744951064396224
Energy: 0.6093943707991577
Energy: 0.5998359947252495
Energy: 0.6764220848668607
Energy: 0.6334308066221506
Energy: 0.6073016258942519
Energy: 0.6529174692653248
Energy: 0.6190119760573569
Energy: 0.628534472172531
Energy: 0.5786593660178333
Energy: 0.6455128733953347
Energy: 0.6045217268319476
Energy: 0.6394924932209124
Energy: 0.6144253289927101
Energy: 0.6155737127344708
Energy: 0.6337837847401693
Energy: 0.6115800124535852
Energy: 0.6075077815246158
Energy: 0.6062112094692413
Energy: 0.6355957084200788
Energy: 0.6631146213680399
Energy: 0.6488693928349941
Energy: 0.6483430795035711
Energy: 0.5606470591715067
Energy: 0.6527802209801986
Energy: 0.6007751727815873
Energy: 0.6141985593798547
Energy: 0.6267484191612628
Energy: 0.5756205747801586
Energy: 0.6117592415495116
Energy: 0.6441629079129387
Energy: 0.6103967330418235
Energy: 0.5828537806981323
Energy: 0.6375676515858676
Energy: 0.6129294141983647
Energy: 0.6392953689228008
Energy: 0.6755200735294686
Energy: 0.603117440769189
Energy: 0.607296175543971
Energy: 0.5883433073147684
Energy: 0.621877929380155
Energy: 0.624515182480646
Energy: 0.5990082496739504
Energy: 0.6051247710250482
Energy: 0.5933197747048572
Energy: 0.6277069838856687
Energy: 0.6217208913027701
Energy: 0.6177752889582222
Energy: 0.6462350946209702
Energy: 0.6246539825738758
Energy: 0.639283512322197
Energy: 0.5861372671241514
Energy: 0.6469255591858187
Energy: 0.6037523346804042
Energy: 0.631768385819988
Energy: 0.6209889493028001
Energy: 0.6162385618932588
Energy: 0.6715813111492731
Energy: 0.6114620077577528
Energy: 0.6357842116863004
Energy: 0.632770026556475
Energy: 0.6584726907260939
Energy: 0.6383578901984693
Energy: 0.6129381565190356
Energy: 0.6376635259674615
Energy: 0.5643846132302198
Energy: 0.6338275440937143
Energy: 0.5661706443465526
Energy: 0.6416887027157376
Energy: 0.6307285803921835
Energy: 0.5728219031042807
Energy: 0.6076187462209347
Energy: 0.6211886247144626
Energy: 0.6105241051825749
Energy: 0.5788573020456915
Energy: 0.6420286093141756
Energy: 0.5988260414596234
Energy: 0.6238254201980553
Energy: 0.6682021724755178
Energy: 0.5920478845304102
Energy: 0.6440278411097369
Energy: 0.5742212261728841
Energy: 0.6205482289912756
Energy: 0.6015069906553545
Energy: 0.5732359522017516
Energy: 0.6044270992624499
Energy: 0.6308079702992168
Energy: 0.6327743523938092
Energy: 0.6283185314880264
Energy: 0.6364225377346971
Energy: 0.651345005866089
Energy: 0.618117865060281
Energy: 0.6410437943059956
Energy: 0.5843154392821066
Energy: 0.6412936061813654
Energy: 0.6027345065120875
Energy: 0.6343857461676312
Energy: 0.6342867316574702
Energy: 0.6207683172070673
Energy: 0.6635138895432883
Energy: 0.5730041642361583
Energy: 0.6666700113002771
Energy: 0.5999534304353632
Energy: 0.6104588418481298
Energy: 0.6306983730510066
Energy: 0.6017999590668441
Energy: 0.6557247923684864
Energy: 0.6007155424398769
Energy: 0.6167961768712642
Energy: 0.6017174344583509
Energy: 0.6175816234381781
Energy: 0.6111956486611031
Energy: 0.5687439066538553
Energy: 0.6019341264823934
Energy: 0.5841986636262952
Energy: 0.608365037018435
Energy: 0.5864943456460343
Energy: 0.64927884870151
Energy: 0.5766698022801514
Energy: 0.6381164842379573
Energy: 0.6466519199625597
Energy: 0.5802366383226675
Energy: 0.629120046782782
Energy: 0.6283944873417616
Energy: 0.6120166632325118
Energy: 0.6271826771006632
Energy: 0.5834182429645541
Energy: 0.6223425944009009
Energy: 0.6310818636557423
Energy: 0.6373916349339167
Energy: 0.6473499744148725
Energy: 0.6301722011543229
Energy: 0.6343908169579456
Energy: 0.6119515454697584
Energy: 0.6445178017514008
Energy: 0.5787291861767534
Energy: 0.658151120023576
Energy: 0.617583096347235
Energy: 0.6347597865534522
Energy: 0.6012191034379517
Energy: 0.6145997703098627
Energy: 0.6540305840680793
Energy: 0.5587232233558213
Energy: 0.6636780328135047
Energy: 0.6111781595141055
Energy: 0.6222052220220623
Energy: 0.6395669158029794
Energy: 0.5882834601699499
Energy: 0.6294828974719576
Energy: 0.6091373547426113
Energy: 0.5932130705670066
Energy: 0.6084622087686532
Energy: 0.6298049465944948
Energy: 0.6018507281671266
Energy: 0.5708861924655911
Energy: 0.6340914509652549
Energy: 0.5829235000970547
Energy: 0.6102653701563974
Energy: 0.5755718224662077
Energy: 0.6356211918584862
Energy: 0.5799356166850378
Energy: 0.6398093471598892
Energy: 0.6368222567074514
Energy: 0.5893070832431664
Energy: 0.6352619056426144
Energy: 0.6317312510874725
Energy: 0.5934647266104834
Energy: 0.6264812750432233
Energy: 0.5933307328614379
Energy: 0.61035352480448

minimum gb energy = 0.5587232233558213 eV
minimum distance =  2.53311375835689 Angstroms
sigma value = 39


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

Energy: 0.6182364510426374
Energy: 0.5975553912561375
Energy: 0.7021798221074055
Energy: 0.662204365730936
Energy: 0.572251356692858
Energy: 0.5906813826680373
Energy: 0.5813475407897647
Energy: 0.5677840978774182
Energy: 0.5933287512515123
Energy: 0.5828913581818436
Energy: 0.5721462987222751
Energy: 0.5991951018566964
Energy: 0.5812328862799798
Energy: 0.7298196928626884
Energy: 0.5750314866142342
Energy: 0.5731955543831898
Energy: 0.561456599217579
Energy: 0.5689124595155874
Energy: 0.6062369846450889
Energy: 0.58603153263035
Energy: 0.6393289441873706
Energy: 0.5547507779796482
Energy: 0.606117072775237
Energy: 0.6298035135780341
Energy: 0.6008251726958372
Energy: 0.5874499601070974
Energy: 0.5907897825440904
Energy: 0.6559859294796755
Energy: 0.5553014074906438
Energy: 0.5885219739515088
Energy: 0.6178069808024331
Energy: 0.5979323349832678
Energy: 0.6457028892079989
Energy: 0.6872266260810531
Energy: 0.5445988706917029
Energy: 0.5513650975132615
Energy: 0.5796310358514006
Energy: 0.5567300840616307
Energy: 0.6202491675225077
Energy: 0.6322669466061942
Energy: 0.6082988784284394
Energy: 0.5445255591835862
Energy: 0.5665725209602929
Energy: 0.6305061442534963
Energy: 0.5508283044192427
Energy: 0.647012238185672
Energy: 0.5610550298930796
Energy: 0.5764866801429527
Energy: 0.6321810384618209
Energy: 0.5647149803589292
Energy: 0.5960796679506896
Energy: 0.6096266201124554
Energy: 0.6394062918391198
Energy: 0.5868409010741086
Energy: 0.616373276035712
Energy: 0.5638746315870421
Energy: 0.5651089714624679
Energy: 0.5958759701819838
Energy: 0.6363067610307526
Energy: 0.5752151066304892
Energy: 0.6105340235658688
Energy: 0.5846864054306008
Energy: 0.5643051932516581
Energy: 0.5554251677424038
Energy: 0.6068737757871242
Energy: 0.5821779388111974
Energy: 0.5747616456121484
Energy: 0.6345344303961921
Energy: 0.5814958999253377
Energy: 0.6323503754110028
Energy: 0.5505775926461716
Energy: 0.5947444546289639
Energy: 0.5898229776246968
Energy: 0.5668751627607242
Energy: 0.6245282133071554
Energy: 0.5819137628690547
Energy: 0.59292180029277
Energy: 0.5377761629731028
Energy: 0.5780862274491747
Energy: 0.5927304268509114
Energy: 0.6016303692806529
Energy: 0.5917092766060875
Energy: 0.5701185612101397
Energy: 0.6363917382779919
Energy: 0.5506401859910398
Energy: 0.5844373332960309
Energy: 0.5988238075318393
Energy: 0.5887325025021672
Energy: 0.5878448729150929
Energy: 0.5849372360611019
Energy: 0.569068055142332
Energy: 0.5453299903978875
Energy: 0.5693160088010554
Energy: 0.5675133262649047
Energy: 0.66679356251934
Energy: 0.5874680314750139
Energy: 0.5774899180620197
Energy: 0.5477246041940859
Energy: 0.5382800049822153
Energy: 0.5459017320161317
Energy: 0.5493039870747028
Energy: 0.6691932533112909
Energy: 0.6031753728168423
Energy: 0.5783844966776184
Energy: 0.5305190234914475
Energy: 0.5475366567304089
Energy: 0.5279847784083822
Energy: 0.6086529057033486
Energy: 0.5605301576830912
Energy: 0.5952836079551658
Energy: 0.5424297936131335
Energy: 0.5282004778053494
Energy: 0.5387213032230598
Energy: 0.5799420669688422
Energy: 0.5824690204890747
Energy: 0.5682533083819883
Energy: 0.6533415710143442
Energy: 0.5852520474036603
Energy: 0.6479467505680171
Energy: 0.5371792251008372
Energy: 0.5842564152132225
Energy: 0.5613034209052861
Energy: 0.5692360693092886
Energy: 0.6378471720129256
Energy: 0.5936936903633754
Energy: 0.578125294471548
Energy: 0.5503292821819415
Energy: 0.5859847297457813
Energy: 0.6184266564266204
Energy: 0.6005632803375461
Energy: 0.5654632653787064
Energy: 0.5967639599683597
Energy: 0.6757799807409381
Energy: 0.5499297935322093
Energy: 0.5873741523527837
Energy: 0.6137848630811116
Energy: 0.610594211479511
Energy: 0.6479280107826323
Energy: 0.6524858898012966
Energy: 0.5399923050420338
Energy: 0.5513835539237387
Energy: 0.5803153165958387
Energy: 0.575325284426117
Energy: 0.6621565005337532
Energy: 0.6357410647034192
Energy: 0.5715448669024399
Energy: 0.5700672530959524
Energy: 0.5550485975871027
Energy: 0.6403460501792615
Energy: 0.5508804237628401
Energy: 0.6469030090212543
Energy: 0.5794376767827059
Energy: 0.577669519773
Energy: 0.6516621019598016
Energy: 0.5643596233543248
Energy: 0.5959447826786007
Energy: 0.6492921641144659
Energy: 0.6236818115075121
Energy: 0.6065816926765123
Energy: 0.6112101663645203
Energy: 0.5639885440045478
Energy: 0.5655216864911738
Energy: 0.5959756516045901
Energy: 0.5953969152521678
Energy: 0.5884621873595359
Energy: 0.640371088844742
Energy: 0.590588208273981
Energy: 0.5640212441638487
Energy: 0.5899150679996007
Energy: 0.6127395586181033
Energy: 0.5610332924682833
Energy: 0.573339328124134
Energy: 0.6126353971080488
Energy: 0.5843773905425125
Energy: 0.6388776070476878
Energy: 0.5496636444033065
Energy: 0.5896476199135308
Energy: 0.5762776976345126
Energy: 0.612182604110345
Energy: 0.6214926176355786
Energy: 0.5939510169144343
Energy: 0.5802140640531205
Energy: 0.5576006925410641
Energy: 0.5798531658020206
Energy: 0.6054306241763703
Energy: 0.6060627023577372
Energy: 0.5954119534105207
Energy: 0.6094074034885074
Energy: 0.6532430078202954
Energy: 0.5482404889357788
Energy: 0.5927418275944641
Energy: 0.6220697589734362
Energy: 0.6356696934796047
Energy: 0.587071988063077
Energy: 0.5852272523285084
Energy: 0.5571422706719997
Energy: 0.585601617496487
Energy: 0.6234111933238812
Energy: 0.5674643100093508
Energy: 0.6662901237318256
Energy: 0.5555361538225155
Energy: 0.5776311889095567
Energy: 0.6411255477884577
Energy: 0.5597370689561076
Energy: 0.6517349899008054
Energy: 0.5494184854442066
Energy: 0.6571320940038705
Energy: 0.5489317773770213
Energy: 0.5741700022924531
Energy: 0.6423756654905147

minimum gb energy = 0.5279847784083822 eV
minimum distance =  2.5397705095513 Angstroms
sigma value = 21


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

Energy: 0.6679090767779885
Energy: 0.6555079460449819
Energy: 0.5527638259390181
Energy: 0.7166370424708975
Energy: 0.5883425895563826
Energy: 0.5725203037115036
Energy: 0.6563486403850011
Energy: 0.5373784642853743
Energy: 0.6630208807958217
Energy: 0.6497474942934868
Energy: 0.6462746780928389
Energy: 0.5869427383605252
Energy: 0.6256160818267094
Energy: 0.6714665769082961
Energy: 0.6292937735524583
Energy: 0.5968259866065895
Energy: 0.6386156451870845
Energy: 0.6554583516808081
Energy: 0.5466355447501212
Energy: 0.6569729719315986
Energy: 0.6563575835910589
Energy: 0.6008057645955297
Energy: 0.587569571578997
Energy: 0.5624774626527251
Energy: 0.6328038235580504
Energy: 0.5722709147233116
Energy: 0.587794731643258
Energy: 0.6160158903580297
Energy: 0.5260576250672088
Energy: 0.5635848307656319
Energy: 0.6086788136075068
Energy: 0.5865281689110549
Energy: 0.5772561959923905
Energy: 0.619785641158509
Energy: 0.5421566949430323
Energy: 0.5191490823438975
Energy: 0.5585431534727947
Energy: 0.6255891000231868
Energy: 0.6625590522852456
Energy: 0.5751878071159077
Energy: 0.6068421871369791
Energy: 0.6097704905236421
Energy: 0.5225561318853886
Energy: 0.7335052246470356
Energy: 0.5362923013459129
Energy: 0.5452832089552829
Energy: 0.5402843187344879
Energy: 0.5186454216490101
Energy: 0.562543927346862
Energy: 0.5724210076653724
Energy: 0.5457844151537562
Energy: 0.6177899491620894
Energy: 0.5831424702256076
Energy: 0.566795655466417
Energy: 0.5210427139792548
Energy: 0.5973641656276496
Energy: 0.5307362297468293
Energy: 0.5785308439850604
Energy: 0.6181481654079192
Energy: 0.6371424060790537
Energy: 0.614545493832589
Energy: 0.5928908549698693
Energy: 0.674288298392242
Energy: 0.6662354245204807
Energy: 0.6727764313684824
Energy: 0.53262547427149
Energy: 0.6257389764272735
Energy: 0.5599912404924198
Energy: 0.6145692576089529
Energy: 0.6774682847877418
Energy: 0.5552872962989803
Energy: 0.6864298164657804
Energy: 0.5714752635275255
Energy: 0.6873758387279129
Energy: 0.5563197724216031
Energy: 0.5204239498258342
Energy: 0.6710020369814385
Energy: 0.6048251377570216
Energy: 0.6568297340987223
Energy: 0.6669306597559669
Energy: 0.5637451099548744
Energy: 0.6534076243000481
Energy: 0.6550737495318254
Energy: 0.6723513434679165
Energy: 0.662956650815812
Energy: 0.6020363680978661
Energy: 0.7039525562548431
Energy: 0.5893988242696776
Energy: 0.5828206436841944
Energy: 0.5678157349587672
Energy: 0.6320040988713916
Energy: 0.5207711579598191
Energy: 0.5986677392973204
Energy: 0.5831556220136835
Energy: 0.6207619809279192
Energy: 0.600508454996767
Energy: 0.6211905046399713
Energy: 0.6790758954756895
Energy: 0.6303903165614485
Energy: 0.6178290767520603
Energy: 0.6069424475521469
Energy: 0.5781020320815242
Energy: 0.5340198515901872
Energy: 0.6600630871334161
Energy: 0.6623201864509938
Energy: 0.5267769507741233
Energy: 0.579801033697273
Energy: 0.6066563328874346
Energy: 0.6949039915977148
Energy: 0.5738123408697361
Energy: 0.6130632281051082
Energy: 0.6752120977956444
Energy: 0.5262859363526052
Energy: 0.5636883846102455
Energy: 0.614796278858757
Energy: 0.6094784883290332
Energy: 0.6393987158366057
Energy: 0.5352256551018761
Energy: 0.5602562338813111
Energy: 0.518096566926216
Energy: 0.5594491989361783
Energy: 0.6088538911104343
Energy: 0.6511344144673198
Energy: 0.5733964844070701
Energy: 0.5230042064341356
Energy: 0.6190649138039057
Energy: 0.5182785894539242
Energy: 0.5491630538757443
Energy: 0.5333531465925513
Energy: 0.5634662437262422
Energy: 0.5202976640432098
Energy: 0.520140971812241
Energy: 0.593800976792457
Energy: 0.5547794381981624
Energy: 0.5772118942475525
Energy: 0.5607557186180298
Energy: 0.5610868507355213
Energy: 0.5670396938175656
Energy: 0.5208167609685315
Energy: 0.5856197311727392
Energy: 0.5374875430356484
Energy: 0.5792258129144239
Energy: 0.6190757268094834
Energy: 0.6482132905041643
Energy: 0.5396745114601375
Energy: 0.6011515676759762
Energy: 0.6688514580082843
Energy: 0.5242091404518161
Energy: 0.6535031675088937
Energy: 0.5333767473543727
Energy: 0.5635380751918495
Energy: 0.6493395926614536
Energy: 0.5749576410136747
Energy: 0.6033709243038986
Energy: 0.618437382714593
Energy: 0.6292630122491919
Energy: 0.646920359958004
Energy: 0.7105260211451496
Energy: 0.530220599866687
Energy: 0.5918506626087054
Energy: 0.5964392495488511
Energy: 0.6295579395668089
Energy: 0.6288809999833489
Energy: 0.5961424431097001
Energy: 0.5648826491220288
Energy: 0.6741091804424714
Energy: 0.6665925154774831
Energy: 0.7178452100779963
Energy: 0.5206077603279854
Energy: 0.60525914832825
Energy: 0.5997612013363357
Energy: 0.637088260514751
Energy: 0.5306187733936962
Energy: 0.5713101011171208
Energy: 0.5967663153625846

minimum gb energy = 0.518096566926216 eV
minimum distance =  2.5923498335015 Angstroms
sigma value = 113


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

Energy: 0.6610149120989652
Energy: 0.7276058740921404
Energy: 0.7157660349264325
Energy: 0.7041646338569035
Energy: 0.6939798657781393
Energy: 0.6825939669250687
Energy: 0.7274342644091127
Energy: 0.7037378805806361
Energy: 0.733438854782622
Energy: 0.6911960095315558
Energy: 0.7217377780887049
Energy: 0.7114968672798676
Energy: 0.7001006744855808
Energy: 0.7428242926821708
Energy: 0.6949426551723452
Energy: 0.7278240857103125
Energy: 0.66473770617173
Energy: 0.7008357956219307
Energy: 0.7122201324210369
Energy: 0.6585904130355207
Energy: 0.6892391073194621
Energy: 0.6547041521613688
Energy: 0.7198122856200209
Energy: 0.6575325494753683
Energy: 0.6482892630316202
Energy: 0.6575128553128055
Energy: 0.6415883274843083
Energy: 0.7062934982235006
Energy: 0.6011448122751899
Energy: 0.7094254512376885
Energy: 0.6685828310173859
Energy: 0.7013525183393314
Energy: 0.6982659263424786
Energy: 0.6784297305537375
Energy: 0.6668227710463333
Energy: 0.5838991401323446
Energy: 0.6482651093530986
Energy: 0.6385223465949682
Energy: 0.6834280204250025
Energy: 0.6002185200118826
Energy: 0.6111987602230394
Energy: 0.6560447931359165
Energy: 0.6421904589508428
Energy: 0.6473462991435242
Energy: 0.6211715287834603
Energy: 0.6280707397164365
Energy: 0.6322184669570197
Energy: 0.6072862744974121
Energy: 0.7095523027948283
Energy: 0.6080847096414546
Energy: 0.650732544505582
Energy: 0.6681898900040338
Energy: 0.6883649050676095
Energy: 0.6674556443907425
Energy: 0.6451842090448909
Energy: 0.6738984851585732
Energy: 0.6494618604106911
Energy: 0.6593800579544765
Energy: 0.6452049535118219
Energy: 0.6442436531200942
Energy: 0.6301485049155549
Energy: 0.5982101101514622
Energy: 0.6711099810259233
Energy: 0.6457577462799158
Energy: 0.6825926991934624
Energy: 0.6267712425407671
Energy: 0.6762924465899548
Energy: 0.6739887276726101
Energy: 0.615705842421606
Energy: 0.6367623026911478
Energy: 0.6475866716872537
Energy: 0.6415353756803653
Energy: 0.6061809901501559
Energy: 0.6451637577892394
Energy: 0.6438487268617925
Energy: 0.6228670228869357
Energy: 0.6987173413202644
Energy: 0.5956896320953041
Energy: 0.6580965801145255
Energy: 0.643327147732975
Energy: 0.645016526561301
Energy: 0.6340138568499707
Energy: 0.6092419473220821
Energy: 0.6815962931565005
Energy: 0.6713681067392571
Energy: 0.6822989354408343
Energy: 0.6318790668830472
Energy: 0.6384063968275472
Energy: 0.6668739714898337
Energy: 0.6390798591460113
Energy: 0.6712400076394863
Energy: 0.6686096514129
Energy: 0.650135663303399
Energy: 0.6619818261446541
Energy: 0.6673200652165189
Energy: 0.6612183750658286
Energy: 0.5845719147152154
Energy: 0.6804912375821343
Energy: 0.6019313832384735
Energy: 0.6815491642399795
Energy: 0.6307818845601451
Energy: 0.6617708916809208
Energy: 0.6727030446883625
Energy: 0.6320233010103758
Energy: 0.6573319625682625
Energy: 0.64493712251178
Energy: 0.6452451056905854
Energy: 0.6659251425553131
Energy: 0.688077841073327
Energy: 0.6929008002864694
Energy: 0.6418330713884471
Energy: 0.7181959818132352
Energy: 0.6401547556154391
Energy: 0.6942804479268214
Energy: 0.6148253576555106
Energy: 0.6675124136350639
Energy: 0.6462726323124556
Energy: 0.6445754826296984
Energy: 0.6756341138000322
Energy: 0.6137458704619773
Energy: 0.6733311859160301
Energy: 0.617279032880265
Energy: 0.659108773921229
Energy: 0.6552433685301343
Energy: 0.6632362386380544
Energy: 0.6922201177313381
Energy: 0.6651304076321294
Energy: 0.7190122481898645
Energy: 0.6858724045656588
Energy: 0.6956801094795607
Energy: 0.7077393492292952
Energy: 0.7192064795281025
Energy: 0.7063822412391497
Energy: 0.6539272362751908
Energy: 0.733200740230614
Energy: 0.6642501906944499
Energy: 0.7029646334869486
Energy: 0.6497431732003707
Energy: 0.6574542429147232
Energy: 0.7458854816978083
Energy: 0.6731053906481086
Energy: 0.7356401635665333
Energy: 0.6868404961494198
Energy: 0.739694577515097
Energy: 0.6939590376300521
Energy: 0.6554808252235301
Energy: 0.7404243058835681
Energy: 0.6661015811655189
Energy: 0.750894000204542
Energy: 0.6594442727660492
Energy: 0.719426159912786
Energy: 0.6949948524023003
Energy: 0.6551246825629449
Energy: 0.7413816634404545
Energy: 0.6438377208040811
Energy: 0.7310178675949941
Energy: 0.7148921189565053
Energy: 0.6939480208957725
Energy: 0.6937502107491993
Energy: 0.6524823640498181
Energy: 0.7057946986341878
Energy: 0.6967637530150315
Energy: 0.7367386733109117
Energy: 0.7040476998768865
Energy: 0.6991535369464281
Energy: 0.7088676558622058
Energy: 0.7034253985303573
Energy: 0.744564357762277
Energy: 0.6451207149818378
Energy: 0.7281253209211581
Energy: 0.6630079696270444
Energy: 0.7022121586914111
Energy: 0.6742160210436411
Energy: 0.6748668803365182
Energy: 0.7107521415925422
Energy: 0.6551337893233415
Energy: 0.731692295816753
Energy: 0.6590045341432328
Energy: 0.6675741991020433
Energy: 0.6579517340784202
Energy: 0.6425543795639248
Energy: 0.7093443228726857
Energy: 0.66752546357836
Energy: 0.697032563772907
Energy: 0.6745409643411975
Energy: 0.6832900829964761
Energy: 0.7059162532067177
Energy: 0.6563320816843164
Energy: 0.6668739412393073
Energy: 0.5839482855648569
Energy: 0.6630205203409579
Energy: 0.6383818041251583
Energy: 0.6861413330557009
Energy: 0.6010870543439264
Energy: 0.6133145885018163
Energy: 0.6560761422068438
Energy: 0.663885141951085
Energy: 0.6485627951102918
Energy: 0.6363637211995439
Energy: 0.6899538198898949
Energy: 0.6329751687528627
Energy: 0.6097261692660711
Energy: 0.709681853000512
Energy: 0.6051671521927493
Energy: 0.6506418795816645
Energy: 0.6320059213650671
Energy: 0.6910050603482552
Energy: 0.6703007768531954
Energy: 0.6203110356143837
Energy: 0.6753017289842077
Energy: 0.5911789380268915
Energy: 0.6540634098242789
Energy: 0.6451761484819243
Energy: 0.6541222550411888
Energy: 0.6152350657456814
Energy: 0.647024387417704
Energy: 0.6711125015185051
Energy: 0.6752440490728234
Energy: 0.6844088138251986
Energy: 0.6377546622342021
Energy: 0.677171970301865
Energy: 0.6771164859296516
Energy: 0.6362397707393564
Energy: 0.6373135213700213
Energy: 0.6438210282469276
Energy: 0.647682095412821
Energy: 0.6049914396886966
Energy: 0.6443091677755768
Energy: 0.6593388013228129
Energy: 0.6520068811114335
Energy: 0.7007553624357875
Energy: 0.6006586176272201
Energy: 0.6529786799932705
Energy: 0.6477214140184784
Energy: 0.6452610180890986
Energy: 0.607946047803823
Energy: 0.613852368368032
Energy: 0.6899489205386046
Energy: 0.6399479791054684
Energy: 0.681948197369461
Energy: 0.6315583239209875
Energy: 0.6406222300074674
Energy: 0.6657914037482754
Energy: 0.6467107163576242
Energy: 0.66726940354682
Energy: 0.6644383593080665
Energy: 0.6497053225979696
Energy: 0.6633892428290428
Energy: 0.6540143037555741
Energy: 0.6626446111889582
Energy: 0.5892351714760634
Energy: 0.6777773440351695
Energy: 0.5920388912386088
Energy: 0.6627522255517321
Energy: 0.6692820248417634
Energy: 0.6473577967519241
Energy: 0.5910492555997607
Energy: 0.6313222760416314
Energy: 0.6586033942690879
Energy: 0.6530116099160287
Energy: 0.6613982040073003
Energy: 0.660090700907542
Energy: 0.6569188554594704
Energy: 0.6976052485715082
Energy: 0.7102023958143855
Energy: 0.7037401917846601
Energy: 0.6375646744927342
Energy: 0.6947414314114712
Energy: 0.6355767601138603
Energy: 0.6693210144881768
Energy: 0.6531737036967399
Energy: 0.6135109669106639
Energy: 0.6743664426973378
Energy: 0.6144214191402444
Energy: 0.6759452203220125
Energy: 0.6193608053485382
Energy: 0.6599326713459914
Energy: 0.6910494712553067
Energy: 0.664271985892986
Energy: 0.6900838201064041
Energy: 0.6656598384652163
Energy: 0.7259123539294262
Energy: 0.6751287610025415
Energy: 0.7033840984186716
Energy: 0.7097079398447794
Energy: 0.7079286224487814
Energy: 0.7152616751116798
Energy: 0.6538779194022883
Energy: 0.7450209028839557
Energy: 0.6662778671366214
Energy: 0.7014725604254026
Energy: 0.6701992443976524
Energy: 0.6947526571260741
Energy: 0.7467585091810628
Energy: 0.6964633692523753
Energy: 0.7352527318848958
Energy: 0.6874554225200218
Energy: 0.7117474722465715
Energy: 0.6954019878421158
Energy: 0.6550283011569078
Energy: 0.7414785083697947
Energy: 0.6655239232044944
Energy: 0.754052168596778
Energy: 0.6603347163026182
Energy: 0.7257559894541298
Energy: 0.694969340989136
Energy: 0.6534678936466138
Energy: 0.7404661666033082
Energy: 0.6433788488753488
Energy: 0.6784199941459119
Energy: 0.7154808142551846
Energy: 0.691893107552829
Energy: 0.6949816518442518
Energy: 0.6523498584934218
Energy: 0.7394137362185484

minimum gb energy = 0.5838991401323446 eV
minimum distance =  2.52858151919151 Angstroms
sigma value = 365


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

Energy: 0.6076666437162461
Energy: 0.6353785308019619
Energy: 0.6110959983454737
Energy: 0.6305791107385412
Energy: 0.6300613894353043
Energy: 0.6305717273983958
Energy: 0.633976194049978
Energy: 0.5767416566456642
Energy: 0.7170407110755571
Energy: 0.5795693780363433
Energy: 0.5288400317408328
Energy: 0.5764423856342673
Energy: 0.5811164387351412
Energy: 0.7187578869711166
Energy: 0.5790038800534072
Energy: 0.7642481884957395
Energy: 0.5786993116022827
Energy: 0.5755242194458099
Energy: 0.5862106134172708
Energy: 0.5803900381378938
Energy: 0.5766314036514939
Energy: 0.5801441470725089
Energy: 0.765044856228351
Energy: 0.5788257042940204
Energy: 0.6323433557731614
Energy: 0.6307049041425353
Energy: 0.580108804241412
Energy: 0.6298039388147576
Energy: 0.5757430919106622
Energy: 0.7136462559411267
Energy: 0.575336273496996
Energy: 0.7116045135536737
Energy: 0.5283096668357363
Energy: 0.5763833265365484
Energy: 0.7177077989448382
Energy: 0.5745849423046967
Energy: 0.7654092495484575
Energy: 0.5749284277319997
Energy: 0.6309624174655891
Energy: 0.63046090955799
Energy: 0.5785127659541203
Energy: 0.634398797533384
Energy: 0.5794054582947112
Energy: 0.7649704553267352
Energy: 0.5792528655890721
Energy: 0.5769934026139355
Energy: 0.5867312520640934
Energy: 0.580832160572654
Energy: 0.7135219618679128
Energy: 0.5790654957576779
Energy: 0.7646059691009703
Energy: 0.5794101764712424
Energy: 0.5751887020581261
Energy: 0.5867773788053386
Energy: 0.5804489805508459
Energy: 0.7645952704286986
Energy: 0.5741820659817984
Energy: 0.7658414386563265
Energy: 0.5766602189551262
Energy: 0.6315271902743491
Energy: 0.6307170465766541
Energy: 0.5757032166021173
Energy: 0.6347035871117032
Energy: 0.5754202180098575
Energy: 0.7196915382346776
Energy: 0.575001463993176
Energy: 0.7116257558271646
Energy: 0.7115653507743758
Energy: 0.5753280861692902
Energy: 0.7166856523201709
Energy: 0.5730973857723898
Energy: 0.7653232454425384
Energy: 0.5785468032326861
Energy: 0.631646500892362
Energy: 0.6309454653627175
Energy: 0.5804768588248337
Energy: 0.6310673816357564
Energy: 0.5796275337119601
Energy: 0.7645434461404953
Energy: 0.5788174629890989
Energy: 0.574503757632321
Energy: 0.5864423977990212
Energy: 0.5805287005613224
Energy: 0.7645226016203819
Energy: 0.5796670684485612
Energy: 0.7142768654368274
Energy: 0.5792003680818458
Energy: 0.5769780646667992
Energy: 0.5875117574990949
Energy: 0.5810066027889511
Energy: 0.7143256919008162
Energy: 0.5774063666652022
Energy: 0.7646240494466977
Energy: 0.575306735663001
Energy: 0.6306852768221173
Energy: 0.6303622872130882
Energy: 0.6281170897109684
Energy: 0.6341866539772751
Energy: 0.5760803060049674
Energy: 0.7148209675845179
Energy: 0.5754670714380627
Energy: 0.5284591697208627
Energy: 0.5812205808811972
Energy: 0.5747948300731113
Energy: 0.7176356223141773
Energy: 0.5792521981726058
Energy: 0.7644442335496682
Energy: 0.5786798551885178
Energy: 0.6296413331593312
Energy: 0.57696376889712
Energy: 0.5804717727531616
Energy: 0.5765109209353425
Energy: 0.5793177308881517
Energy: 0.7641809461821766
Energy: 0.5790350748592912
Energy: 0.576645165962568
Energy: 0.57562843553767
Energy: 0.5803158131806585
Energy: 0.6306147787535185
Energy: 0.5762983397649459
Energy: 0.7146164305845709
Energy: 0.5796513174431961
Energy: 0.5806989391474264
Energy: 0.5281606336735994
Energy: 0.5741535465223849
Energy: 0.7178858817468331
Energy: 0.5748922537502036
Energy: 0.7649603041095873
Energy: 0.5755067993435216
Energy: 0.6305996044401058
Energy: 0.6301168565548383
Energy: 0.6305800919155677
Energy: 0.6340787263196405
Energy: 0.5796186853864963
Energy: 0.7128706926495852
Energy: 0.5794006685149796
Energy: 0.5288673185453056
Energy: 0.5768646062022271
Energy: 0.5814784871289471
Energy: 0.7137567980743328

minimum gb energy = 0.5281606336735994 eV
minimum distance =  2.53426959536247 Angstroms
sigma value = 23