Model name: model_name=EAM_ErcolessiAdams_1994_Al__MO_324507536345_002
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.032082714140415
cohesive_energy=3.360264268222285
mass=26.981538
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.01181052453894576
Energy: 0.18679397671621933
Energy: 0.18679397671854323
Energy: 0.01181052453894576
Energy: 0.18679397671854323
Energy: 0.18679397671621933
Energy: 0.01181052453894576
Energy: 0.18679397671621933
Energy: 0.18679397671854323
Energy: 0.01181052453894576
Energy: 0.1859986952969538
Energy: 0.012361805006675835
Energy: 0.769383037851837
Energy: 0.18599869529579185
Energy: 0.012361805006675835
Energy: 0.769383037851837
Energy: 0.1859986952969538
Energy: 0.012361805006675835
Energy: 0.769383037851837
Energy: 0.18599869529579185
Energy: 0.35203761890861024
Energy: 0.3392276693556334
Energy: 0.24529979853855177
Energy: 0.35195653194581983
Energy: 0.17395497628357073
Energy: 0.11401315583626014
Energy: 0.731899276293452
Energy: 0.012725284948775735
Energy: 0.1140131558350982
Energy: 0.73189927629229
Energy: 0.18599869529811572
Energy: 0.7693830378506751
Energy: 0.012361805006675835
Energy: 0.1859986952969538
Energy: 0.7693830378506751
Energy: 0.012361805006675835
Energy: 0.18599869529811572
Energy: 0.7693830378506751
Energy: 0.012361805006675835
Energy: 0.1859986952969538
Energy: 0.01181052453894576
Energy: 0.18679397671970513
Energy: 0.18679397671854323
Energy: 0.01181052453894576
Energy: 0.18679397671854323
Energy: 0.18679397671970513
Energy: 0.01181052453894576
Energy: 0.18679397671970513
Energy: 0.18679397671854323
Energy: 0.01181052453894576
Energy: 0.18599869529811572
Energy: 0.012361805006675835
Energy: 0.769383037851837
Energy: 0.1859986952969538
Energy: 0.012361805006675835
Energy: 0.7693830378506751
Energy: 0.18599869529811572
Energy: 0.012361805006675835
Energy: 0.7693830378506751
Energy: 0.1859986952969538
Energy: 0.7318992762888042
Energy: 0.3392276693556334
Energy: 0.24529979853971368
Energy: 0.7318992762946139
Energy: 0.24529979853855177
Energy: 0.3392276693567954
Energy: 0.7318992762888042
Energy: 0.24558257549916257
Energy: 0.3392276693556334
Energy: 0.731899276293452

minimum gb energy = 0.01181052453894576 eV
minimum distance =  2.61269478476614 Angstroms
sigma value = 3


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

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Energy: 0.5984531604366303
Energy: 0.5834677501704656
Energy: 0.49524225350265694
Energy: 0.5984531604354919
Energy: 0.5834677501667656
Energy: 0.5184162857757272
Energy: 0.5984531604334994
Energy: 0.5834677501704656
Energy: 0.49524225350294154
Energy: 0.5528461217864156
Energy: 0.4941737212845658
Energy: 0.551671808060146
Energy: 0.5528461217921078
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Energy: 0.5516718080638459
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Energy: 0.4941737212814351
Energy: 0.5516718080621382
Energy: 0.5528461217909694
Energy: 0.511708525463238
Energy: 0.5905310009408936
Energy: 0.5836789739689222
Energy: 0.5268597595800137
Energy: 0.5905310009389013
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Energy: 0.5117085254601331
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Energy: 0.5836655150101971
Energy: 0.5268597595802983
Energy: 0.6054614371440123
Energy: 0.6190402845354812
Energy: 0.44937121215731873
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Energy: 0.6054614371451508
Energy: 0.428267090270503
Energy: 0.6060012020849993
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Energy: 0.6069273675993312
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Energy: 0.5513772720517968
Energy: 0.5496963103594161
Energy: 0.4912351451571295
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Energy: 0.4977169600562388
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Energy: 0.5704221002046341
Energy: 0.44924412154105575
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Energy: 0.572750778659767
Energy: 0.4941525769302578
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Energy: 0.5727507786609053
Energy: 0.49397116059971835
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Energy: 0.4941525769370886
Energy: 0.5507904991912658
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Energy: 0.4913604137234044
Energy: 0.5933565987059795
Energy: 0.5895969619001543
Energy: 0.5463563670337884
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Energy: 0.5463563670275271
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Energy: 0.4283753960020194
Energy: 0.5638721627883203
Energy: 0.5535975915354537
Energy: 0.428375395997776
Energy: 0.5643443307572608
Energy: 0.5572104011228015
Energy: 0.4283753960020194
Energy: 0.5638721627849049
Energy: 0.5535975915397229
Energy: 0.4283753960005964
Energy: 0.5728638189862665
Energy: 0.44923420301043093
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Energy: 0.5728638189848434
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Energy: 0.44923420301612305
Energy: 0.5906585116581022
Energy: 0.5728638189899665
Energy: 0.5498634942703546
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Energy: 0.5344537351957377
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Energy: 0.5541455458605958
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Energy: 0.5498634942717776
Energy: 0.5541455458586036
Energy: 0.5344537351897608
Energy: 0.54986349426637
Energy: 0.47571759875089425
Energy: 0.547784789772407
Energy: 0.4942786595126086
Energy: 0.4757175987543096
Energy: 0.5477847897698455
Energy: 0.4941498163448067
Energy: 0.47571759875744035
Energy: 0.5477847897664301
Energy: 0.4942786595097624
Energy: 0.47571759875601727
Energy: 0.5184162857794271
Energy: 0.5984531604357763
Energy: 0.5834677501690425
Energy: 0.4952422535046493
Energy: 0.5984531604352071
Energy: 0.5834677501653425
Energy: 0.5184162857743041
Energy: 0.598453160433215
Energy: 0.5834677501676194
Energy: 0.49524225350407997
Energy: 0.552846121789831
Energy: 0.494173721283712
Energy: 0.551671808060146
Energy: 0.552846121792677
Energy: 0.49417372128485043
Energy: 0.5516718080638459
Energy: 0.552846121792677
Energy: 0.4941737212814351
Energy: 0.551671808061569
Energy: 0.5528461217966616
Energy: 0.5117085254623841
Energy: 0.5905310009414628
Energy: 0.5836639354780093
Energy: 0.5268597595794445
Energy: 0.590531000939186
Energy: 0.5838657951599907
Energy: 0.5117085254589947
Energy: 0.5905310009454475
Energy: 0.5836660671813381
Energy: 0.5268597595811522
Energy: 0.6054614371460048
Energy: 0.6190402845346274
Energy: 0.44937121216016485
Energy: 0.6054614371431586
Energy: 0.619040284534912
Energy: 0.4493712121581726
Energy: 0.6054614371437278
Energy: 0.6190402845283659
Energy: 0.449371212155611
Energy: 0.6054614371445816

minimum gb energy = 0.4282670902702184 eV
minimum distance =  2.55821373083454 Angstroms
sigma value = 75


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

Energy: 0.5610687531241724
Energy: 0.4654530328408526
Energy: 0.4711043182633377
Energy: 0.5359385150273065
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minimum gb energy = 0.46416695420484316 eV
minimum distance =  2.55392139826534 Angstroms
sigma value = 105


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

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Energy: 0.47529954544655595
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Energy: 0.4945669301889974
Energy: 0.4729020107767301
Energy: 0.5474188414681477
Energy: 0.5262767235046147
Energy: 0.4729020107754767
Energy: 0.5474188414643875
Energy: 0.5262767235043014
Energy: 0.4729020107757901
Energy: 0.5474188414637607
Energy: 0.5262767235030481
Energy: 0.4729020107765592
Energy: 0.504236122844438
Energy: 0.5217194790259211
Energy: 0.48500770333358106
Energy: 0.5042361228424155
Energy: 0.5216590263183731
Energy: 0.4850077033364012
Energy: 0.5042361228436688
Energy: 0.5217194790278011
Energy: 0.4850077033345211
Energy: 0.5042361228480556
Energy: 0.48953599818136695
Energy: 0.5159827765341044
Energy: 0.5460106904588271
Energy: 0.48953599818136695
Energy: 0.5159835331160808
Energy: 0.5460106904569471
Energy: 0.48953599818011356
Energy: 0.5159827765348735
Energy: 0.5460106904589981
Energy: 0.48953599818088267
Energy: 0.5161342762079391
Energy: 0.4940318380708338
Energy: 0.5056804124309162
Energy: 0.5161342762079391
Energy: 0.4940318380703495
Energy: 0.5056804124309162
Energy: 0.5161342762054608
Energy: 0.49403183806972284
Energy: 0.5056804124309162
Energy: 0.5161342762056031
Energy: 0.4881919369668844
Energy: 0.525312864239925
Energy: 0.5071206447856337
Energy: 0.48819193696893537
Energy: 0.5328082097549625
Energy: 0.5071206447862604
Energy: 0.4881919369701888
Energy: 0.5253128642377315
Energy: 0.5071206447881405
Energy: 0.4881919369681378
Energy: 0.535514256547701
Energy: 0.5245543731536024
Energy: 0.550420074372872
Energy: 0.5355142565502078
Energy: 0.5243736931115149
Energy: 0.5504200743730429
Energy: 0.5355142565511479
Energy: 0.5245543731526624
Energy: 0.5504200743709918
Energy: 0.5355142565487835
Energy: 0.5433871040076956
Energy: 0.4748694144727875
Energy: 0.5285044882585054
Energy: 0.5433871040092338
Energy: 0.4748346581384522
Energy: 0.5285044882591319
Energy: 0.5433871040073822
Energy: 0.47486941447122066
Energy: 0.528504488258961
Energy: 0.5433871040058155

minimum gb energy = 0.4729020107754767 eV
minimum distance =  2.54067820429176 Angstroms
sigma value = 165


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

Energy: 0.47743228718766184
Energy: 0.4708187441892243
Energy: 0.47047282318698785
Energy: 0.45424182930104284
Energy: 0.4708187441886864
Energy: 0.4704728231864501
Energy: 0.4774322871865861
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Energy: 0.47047282318698785
Energy: 0.45424182930104284
Energy: 0.5373044703923746
Energy: 0.4871807364077008
Energy: 0.5497325523650731
Energy: 0.5373044703923746
Energy: 0.4871807364077008
Energy: 0.549732552366149
Energy: 0.5373044703923746
Energy: 0.4871807364066251
Energy: 0.5497325523629218
Energy: 0.5373044703929125
Energy: 0.45029713802875576
Energy: 0.4414064888115258
Energy: 0.45844470641468144
Energy: 0.4502971380282179
Energy: 0.4414064888136772
Energy: 0.4587790938008647
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Energy: 0.45029713802875576
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Energy: 0.5282692536665046
Energy: 0.4585935037381903
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Energy: 0.48299769646350965
Energy: 0.5576374388978403
Energy: 0.4547539999784772
Energy: 0.48299769646028246
Energy: 0.5066715280942672
Energy: 0.5035226156430856
Energy: 0.537101814594237
Energy: 0.4843851285271492
Energy: 0.503522615641472
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Energy: 0.503522615641472
Energy: 0.5371018145953126
Energy: 0.4843851285266114
Energy: 0.4646015663964201
Energy: 0.45732114499791654
Energy: 0.476574394368967
Energy: 0.4419615500029587
Energy: 0.45732114500006804
Energy: 0.4365857915289958
Energy: 0.4646015663964201
Energy: 0.45732114499791654
Energy: 0.47657439436950494
Energy: 0.4419615500013451
Energy: 0.5042847465548079
Energy: 0.4586356311761028
Energy: 0.512961952215827
Energy: 0.5042847465531943
Energy: 0.4586356311761028
Energy: 0.5129619522152891
Energy: 0.5042847465526564
Energy: 0.45863563117502704
Energy: 0.5129619522169027
Energy: 0.5042847465531943
Energy: 0.47054292445286905
Energy: 0.4590213844105686
Energy: 0.46773892781012827
Energy: 0.47054292445286905
Energy: 0.45902138440895507
Energy: 0.4677389277875378
Energy: 0.47054292445286905
Energy: 0.4590213844116443
Energy: 0.4677389278106661
Energy: 0.4705429244544826
Energy: 0.5164595998171068
Energy: 0.5124257440504855
Energy: 0.45633628222908557
Energy: 0.5164595998160311
Energy: 0.5124257440499477
Energy: 0.45633628222800987
Energy: 0.5164595998176447
Energy: 0.5124257440504855
Energy: 0.45633628222962347
Energy: 0.5164595998192584
Energy: 0.4542418293005051
Energy: 0.47081874418814856
Energy: 0.47047282319019074
Energy: 0.4542418293031699
Energy: 0.47081874418707287
Energy: 0.4704728231864501
Energy: 0.4542418293005051
Energy: 0.4708187441892243
Energy: 0.4704728231864501
Energy: 0.4542418293031699

minimum gb energy = 0.4365857915289958 eV
minimum distance =  2.63280206480988 Angstroms
sigma value = 41


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

Energy: 0.5122900283663399
Energy: 0.4374058182973759
Energy: 0.4283588073210296
Energy: 0.4622593600781125
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Energy: 0.42835880732979453
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Energy: 0.4180605725239082
Energy: 0.4650217215761875
Energy: 0.43824684775193223
Energy: 0.418060572524743
Energy: 0.5108436937195189
Energy: 0.43824684775629574
Energy: 0.4180605725262228
Energy: 0.46502172157558036
Energy: 0.4819258750001827
Energy: 0.4237327878547878
Energy: 0.42804685271714804
Energy: 0.4819258749987029
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Energy: 0.4121872466261844
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Energy: 0.4427797604720302
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Energy: 0.44277976047369977
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Energy: 0.44908219111378483
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Energy: 0.4168820370513942
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Energy: 0.4540051090302448
Energy: 0.45941806673486607
Energy: 0.44189338375636567
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Energy: 0.45941806673088204
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Energy: 0.45400510903460833
Energy: 0.4594180667329688
Energy: 0.4418933837523815
Energy: 0.4400660776254982
Energy: 0.4616908961767803
Energy: 0.39061572731644034
Energy: 0.44006607762363903
Energy: 0.4616908961726444
Energy: 0.3906157273208418
Energy: 0.44006607762530847
Energy: 0.46169089617533837
Energy: 0.39061572731958966
Energy: 0.4400660776259156
Energy: 0.4374053972250718
Energy: 0.40137949343043966
Energy: 0.4800599777028954
Energy: 0.4374053972244268
Energy: 0.40137949342645557
Energy: 0.4975255487308705
Energy: 0.4374053972210878
Energy: 0.4013794934233442
Energy: 0.48005997770122594
Energy: 0.4374053972252615
Energy: 0.42637476145573294
Energy: 0.4514691954054837
Energy: 0.39469426101416927
Energy: 0.4263747614561503
Energy: 0.4517443749566083
Energy: 0.4018672602414437
Energy: 0.42637476145990666
Energy: 0.45146919540924
Energy: 0.39469426101291716
Energy: 0.426374761459717
Energy: 0.39983363393284355
Energy: 0.4231391749558558
Energy: 0.42228386231452264
Energy: 0.3998336339382695
Energy: 0.42309081025684914
Energy: 0.4222965299676091
Energy: 0.3998336339326539
Energy: 0.42313917495752523
Energy: 0.4222838623222251
Energy: 0.39983363393117405
Energy: 0.4102160169293905
Energy: 0.41878776350690416
Energy: 0.39598537631980196
Energy: 0.4102160169325019
Energy: 0.4188715419506805
Energy: 0.39598537632207853
Energy: 0.4102160169299976
Energy: 0.4187877635106606
Energy: 0.3959853763179428
Energy: 0.4102160169293905
Energy: 0.4117294566817954
Energy: 0.4173745811485827
Energy: 0.3963015200429653
Energy: 0.41172945668574146
Energy: 0.41716750694740157
Energy: 0.3963015200435724
Energy: 0.4117294566863865
Energy: 0.41737458115567816
Energy: 0.39630152004607666
Energy: 0.4117294566882457
Energy: 0.43975156438820406
Energy: 0.4177286108625134
Energy: 0.4123440978558932
Energy: 0.4397515643865345
Energy: 0.4177286108675219
Energy: 0.41234409785964954
Energy: 0.43975156439006324
Energy: 0.41772861086543495
Energy: 0.4123440978588149
Energy: 0.43975156438569984

minimum gb energy = 0.3866960293625396 eV
minimum distance =  2.57446877432205 Angstroms
sigma value = 185


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

Energy: 0.1862774694219166
Energy: 0.2419935921356479
Energy: 0.24194130927996604
Energy: 0.14332914663291318
Energy: 0.24199359213614335
Energy: 0.24194130927724106
Energy: 0.18627746942142118
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Energy: 0.14332914663291318
Energy: 0.18153120809476306
Energy: 0.24992772076257183
Energy: 0.2622136458088239
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Energy: 0.2622136458083285
Energy: 0.1815312080969926
Energy: 0.14417674937656177
Energy: 0.24938904294315534
Energy: 0.15941565936583396
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Energy: 0.24938904294662345
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Energy: 0.15941565936855895
Energy: 0.1441767493787913
Energy: 0.21739953654353825
Energy: 0.2420616633558088
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Energy: 0.18480967755809216
Energy: 0.19021519486579017
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Energy: 0.22020785774445117
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Energy: 0.18184865264463637
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Energy: 0.1433291466331609
Energy: 0.24199359213416155
Energy: 0.24194130927897511
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Energy: 0.2419413092767456
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Energy: 0.24199359213614335
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Energy: 0.181531208095754
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Energy: 0.2622136458095671
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Energy: 0.15941565936880667
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Energy: 0.17693027759539687
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Energy: 0.24207703330028565
Energy: 0.24269382824386898
Energy: 0.1437103386878166
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Energy: 0.27590035261565476
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Energy: 0.2761569608789838
Energy: 0.1655495622972014
Energy: 0.2426671524833747
Energy: 0.27615696088220415
Energy: 0.14369523037607437
Energy: 0.24266715248139292
Energy: 0.2761569608804701
Energy: 0.1655495622942287
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Energy: 0.2761569608802224
Energy: 0.18480967755933078
Energy: 0.19021519486678107
Energy: 0.24180260693084984
Energy: 0.18480967755982622
Energy: 0.19021519486529473
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Energy: 0.190215194865047
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Energy: 0.1439210634603044
Energy: 0.15920925454823248
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Energy: 0.1433291466331609
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Energy: 0.24269382824362126
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Energy: 0.24207703329756067
Energy: 0.2759003526168934
Energy: 0.24266641788575605
Energy: 0.17595582545381455
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Energy: 0.1759558254530714
Energy: 0.27590035261862744
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Energy: 0.17532747779651792
Energy: 0.20577523625373806
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Energy: 0.17532747779354524
Energy: 0.20577523625621533
Energy: 0.2422336793159992
Energy: 0.17532747779280208
Energy: 0.20577523625547212
Energy: 0.24223367931451287
Energy: 0.2761569608777451
Energy: 0.14369523037384488
Energy: 0.24266715248362244
Energy: 0.27615696088071784
Energy: 0.1436952303763221
Energy: 0.24266715248263152
Energy: 0.2761569608789838
Energy: 0.1436952303743403
Energy: 0.24266715248461332
Energy: 0.2761569608789838
Energy: 0.18480967755759672
Energy: 0.19021519486653338
Energy: 0.2418026069325839
Energy: 0.18480967755809216
Energy: 0.190215194865047
Energy: 0.24180260692862032
Energy: 0.1848096775571013
Energy: 0.1902151948647993
Energy: 0.24180260693084984
Energy: 0.18480967755660582
Energy: 0.1439210634607999
Energy: 0.15920925454872795
Energy: 0.24940435397186675
Energy: 0.14392106345956124
Energy: 0.15920925454872795
Energy: 0.24940435396988497
Energy: 0.14392106346377254
Energy: 0.1592092545484802
Energy: 0.24940435397310537
Energy: 0.14392106346129532
Energy: 0.18184865264537953
Energy: 0.2202078577449466
Energy: 0.2500698402680849
Energy: 0.18184865264513178
Energy: 0.22020785774395576
Energy: 0.2500698402693235
Energy: 0.1818486526443886
Energy: 0.22020785774321255
Energy: 0.25006984026882806
Energy: 0.18184865264092048

minimum gb energy = 0.14332914663291318 eV
minimum distance =  2.64421479999075 Angstroms
sigma value = 33


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

Energy: 0.39593487004953576
Energy: 0.40616400267543873
Energy: 0.4061403739294622
Energy: 0.363898072479674
Energy: 0.4061640026740788
Energy: 0.40614037392674224
Energy: 0.39593487005633543
Energy: 0.40616400266999897
Energy: 0.40614037393218194
Energy: 0.363898072479674
Energy: 0.413772653014502
Energy: 0.3722372290278132
Energy: 0.38740827101809167
Energy: 0.4137726530131421
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Energy: 0.4137726530104222
Energy: 0.43329504615016157
Energy: 0.36003745734896225
Energy: 0.4118120098747152
Energy: 0.43913906025366267
Energy: 0.3600374573503222
Energy: 0.4094378615331634
Energy: 0.44140499686934
Energy: 0.36003745735168213
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Energy: 0.44140499686800483
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Energy: 0.37170503807999544
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Energy: 0.39429563453124217
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Energy: 0.40479790644054325
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Energy: 0.38753281827900193
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Energy: 0.40313054859791414
Energy: 0.38753281827900193
Energy: 0.40479790644054325
Energy: 0.3733053757131348
Energy: 0.40700621740777854
Energy: 0.45746615387638356
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Energy: 0.4075916757915403
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Energy: 0.3733053757117748
Energy: 0.4070062174091385
Energy: 0.45746615387638356
Energy: 0.37330537570905503
Energy: 0.35846494782367383
Energy: 0.4086865952093588
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Energy: 0.40845151207347524
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Energy: 0.4086865952079989
Energy: 0.4083776711859423
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Energy: 0.36148849647711156
Energy: 0.41228302352307306
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Energy: 0.4077253964755043
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Energy: 0.36148849647167186
Energy: 0.4122830235271528
Energy: 0.39037644574277924
Energy: 0.36148849647711156
Energy: 0.4057140922859761
Energy: 0.3859775892967844
Energy: 0.40659190741959245
Energy: 0.4057140922832563
Energy: 0.375331822259434
Energy: 0.40659190741551265
Energy: 0.4057140922832563
Energy: 0.3859775892967844
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Energy: 0.3980465832504715
Energy: 0.4074677617923924
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Energy: 0.4074677617883127
Energy: 0.39984870184708593
Energy: 0.3916967208992651
Energy: 0.4074677617896727
Energy: 0.39307155470930977
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Energy: 0.3917571306741313
Energy: 0.39307155470794986
Energy: 0.40806980336338405
Energy: 0.39175713068090623
Energy: 0.39307155470794986
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Energy: 0.3708013226120597
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Energy: 0.37080132260661997
Energy: 0.4136812138109943
Energy: 0.41876853365620953
Energy: 0.37080132260933985

minimum gb energy = 0.3394780802484368 eV
minimum distance =  2.55742378275519 Angstroms
sigma value = 219


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

Energy: 0.4194325841705291
Energy: 0.49583182426575667
Energy: 0.4957448502675805
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Energy: 0.4253665652221762
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Energy: 0.4199577275382705
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Energy: 0.5234042860990653
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Energy: 0.419494080669318
Energy: 0.5234042860990653
Energy: 0.49561465937079796
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Energy: 0.49533572158010486
Energy: 0.4993216877932512
Energy: 0.5168293664269694
Energy: 0.4953357215810049
Energy: 0.4993216877932512
Energy: 0.5168293664269694

minimum gb energy = 0.4194325841705291 eV
minimum distance =  2.62587153707011 Angstroms
sigma value = 15


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

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Energy: 0.5773355624653814
Energy: 0.5847078760797119
Energy: 0.5036908922297569
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minimum gb energy = 0.4826897091509036 eV
minimum distance =  2.56227434272556 Angstroms
sigma value = 293


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

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Energy: 0.565238275007713
Energy: 0.4902510772158978
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Energy: 0.49025107721630434
Energy: 0.5468697058131808
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Energy: 0.4902510772158978
Energy: 0.5493508643270091
Energy: 0.515188325298418
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Energy: 0.515188325298418
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Energy: 0.5712868639763455
Energy: 0.5549731105244736
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Energy: 0.489536013337663
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Energy: 0.5549731105250835
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Energy: 0.5712868639763455
Energy: 0.5032134828226097
Energy: 0.6407873737003688
Energy: 0.4830775095292519
Energy: 0.5032134828217965
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Energy: 0.4830775095292519
Energy: 0.5032134828222031
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Energy: 0.48307750952884526
Energy: 0.5032134828215931
Energy: 0.48640807723876905
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Energy: 0.4893464539639611
Energy: 0.4864080772397855
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Energy: 0.48640807724080204
Energy: 0.48559070835353096
Energy: 0.48934645396436766
Energy: 0.48640807723998886
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Energy: 0.4904830788256888
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Energy: 0.5094570997115193
Energy: 0.5659932863911334
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Energy: 0.5659932863911334
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Energy: 0.5659932863911334
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Energy: 0.4903290922478144
Energy: 0.5317360562454713
Energy: 0.5347407306293339
Energy: 0.49032909224801763
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Energy: 0.534740730630147
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Energy: 0.5317360562483174
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Energy: 0.48668882122191787
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Energy: 0.48668882121846185
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Energy: 0.4856369389457097
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Energy: 0.48923871374613775
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Energy: 0.4866888212209014
Energy: 0.503301698125301
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Energy: 0.503301698125911
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Energy: 0.5718616124538672
Energy: 0.4895406730760179
Energy: 0.554919539373896
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Energy: 0.5549195393743026
Energy: 0.5718616124532574
Energy: 0.4895406730760179
Energy: 0.554919539373896
Energy: 0.5718616124532574
Energy: 0.5493494020414934
Energy: 0.5386170170179259
Energy: 0.5150929984412979
Energy: 0.5493494020408837
Energy: 0.5386170170177226
Energy: 0.5150929984396715
Energy: 0.5493494020414934
Energy: 0.5386170170181291
Energy: 0.515092998440078
Energy: 0.5493494020406803
Energy: 0.49029125130918827
Energy: 0.5652050304904647
Energy: 0.5493378830138015
Energy: 0.49029125130959483
Energy: 0.5652050304912778
Energy: 0.5493378830245761
Energy: 0.4902912513093916
Energy: 0.5652050304908712
Energy: 0.5493378830186806
Energy: 0.49029125130918827
Energy: 0.5463893661280925
Energy: 0.4990115210730279
Energy: 0.49905933434361344
Energy: 0.546389366127076
Energy: 0.49901152107343444
Energy: 0.4990593343458496
Energy: 0.5463893661284991
Energy: 0.49901152107343444
Energy: 0.49905933434462985
Energy: 0.5463893661276858
Energy: 0.4902510772158978
Energy: 0.5468697058133841
Energy: 0.565238275007713
Energy: 0.4902510772165077
Energy: 0.5468697058133841
Energy: 0.565238275007713
Energy: 0.4902510772158978
Energy: 0.5468697058135874
Energy: 0.5652382750081196
Energy: 0.490251077216101
Energy: 0.5493508643272125
Energy: 0.5151883252990279
Energy: 0.5385825717418736
Energy: 0.5493508643268058
Energy: 0.5151883252982148
Energy: 0.5385825717416702
Energy: 0.5493508643268058
Energy: 0.5151883252988245
Energy: 0.5385825717410604
Energy: 0.5493508643268058
Energy: 0.571286863975939
Energy: 0.5549731105246769
Energy: 0.48953601333745966
Energy: 0.571286863975329
Energy: 0.5549731105236604
Energy: 0.48953601333806956
Energy: 0.5712868639767522
Energy: 0.5549731105242703
Energy: 0.48953601333745966
Energy: 0.5712868639765488
Energy: 0.5032134828213899
Energy: 0.6407873737005721
Energy: 0.48307750952986167
Energy: 0.5032134828226097
Energy: 0.6407873737005721
Energy: 0.48307750952986167
Energy: 0.5032134828217965
Energy: 0.6407873737007754
Energy: 0.4830775095292519
Energy: 0.5032134828224064

minimum gb energy = 0.48307750952884526 eV
minimum distance =  2.64181299740522 Angstroms
sigma value = 293


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

Energy: 0.49371235280644765
Energy: 0.49433250190574746
Energy: 0.4943038648742671
Energy: 0.49371235280644765
Energy: 0.49433250190464517
Energy: 0.4943038648735322
Energy: 0.4937123528068151
Energy: 0.49433250190501254
Energy: 0.4943038648738996
Energy: 0.49371235280644765
Energy: 0.4942131890046603
Energy: 0.4939553480536934
Energy: 0.49440754999235903
Energy: 0.49421318900355804
Energy: 0.4939553480544283
Energy: 0.4944075499916242
Energy: 0.4942131890031906
Energy: 0.4939553480536934
Energy: 0.49440754999309394
Energy: 0.4942131890046603
Energy: 0.49375028087829054
Energy: 0.49388536580278564
Energy: 0.5333606404043599
Energy: 0.493750280878658
Energy: 0.4938853657991113
Energy: 0.5334116978607619
Energy: 0.493750280878658
Energy: 0.4938853658024182
Energy: 0.5332597726643853
Energy: 0.493750280878658
Energy: 0.5335008540350464
Energy: 0.49375184882269196
Energy: 0.49375272812365145
Energy: 0.5333367493261509
Energy: 0.49375184882195716
Energy: 0.4937527281240189
Energy: 0.5336243441374259
Energy: 0.4937518488223246
Energy: 0.49375272812328397
Energy: 0.5335701917656778
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Energy: 0.4939522980019085
Energy: 0.4942365186487514
Energy: 0.4943873292547901
Energy: 0.49395229800227586
Energy: 0.4942365186480165
Energy: 0.49438732925405526
Energy: 0.4939522980019085
Energy: 0.49423651864764906
Energy: 0.49438732925405526
Energy: 0.49433250190464517
Energy: 0.4943038648724299
Energy: 0.49371235280718256
Energy: 0.49433250190538003
Energy: 0.4943038648750019
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Energy: 0.49433250190538003
Energy: 0.4943038648742671
Energy: 0.49371235280791737
Energy: 0.49433250190538003
Energy: 0.4939553480544283
Energy: 0.49440754999088926
Energy: 0.49421318900539524
Energy: 0.4939553480536934
Energy: 0.49440754999346137
Energy: 0.49421318900429295
Energy: 0.4939553480544283
Energy: 0.49440754999235903
Energy: 0.4942131890064975
Energy: 0.4939553480536934
Energy: 0.4938853658009485
Energy: 0.5332360791491267
Energy: 0.49375028087792316
Energy: 0.49388536580168335
Energy: 0.5333233005630612
Energy: 0.49375028087829054
Energy: 0.4938853658009485
Energy: 0.5332157069598066
Energy: 0.49375028087829054
Energy: 0.49388536580205084
Energy: 0.4937518488223246
Energy: 0.4937527281240189
Energy: 0.5336837663468045
Energy: 0.4937518488245292
Energy: 0.49375272812438625
Energy: 0.5337868462705038
Energy: 0.49375184882195716
Energy: 0.49375272812291654
Energy: 0.5337172361253214
Energy: 0.4937518488230594
Energy: 0.4939522980019085
Energy: 0.49423651864764906
Energy: 0.4943873292533204
Energy: 0.4939522980019085
Energy: 0.4942365186472816
Energy: 0.49438732925442275
Energy: 0.4939522980019085
Energy: 0.4942365186472816
Energy: 0.4943873292526022
Energy: 0.4939522980019085
Energy: 0.49430386487316474
Energy: 0.4937123528068151
Energy: 0.49433250190354283
Energy: 0.49430386487169503
Energy: 0.49371235280755
Energy: 0.4943325019061149
Energy: 0.49430386487463446
Energy: 0.49371235280644765
Energy: 0.49433250190391026
Energy: 0.49430386487316474
Energy: 0.49440754999382885
Energy: 0.49421318900758304
Energy: 0.4939553480544283
Energy: 0.4944075499927265
Energy: 0.4942131890046603
Energy: 0.4939553480536934
Energy: 0.49440754999235903
Energy: 0.49421318900355804
Energy: 0.4939553480544283
Energy: 0.49440754999088926
Energy: 0.5332834528290051
Energy: 0.49375028087829054
Energy: 0.4938853657998462
Energy: 0.5332837595466203
Energy: 0.49375028087718825
Energy: 0.49388536580205084
Energy: 0.5331731510639766
Energy: 0.49375028087755574
Energy: 0.4938853658005811
Energy: 0.5331872672764115
Energy: 0.4937527281254886
Energy: 0.5337423882463326
Energy: 0.49375184882195716
Energy: 0.49375272812438625
Energy: 0.5337521726758395
Energy: 0.4937518488215897
Energy: 0.49375272812438625
Energy: 0.5335311282693518
Energy: 0.49375184882195716
Energy: 0.49375272812512117
Energy: 0.49423651864581186
Energy: 0.4943873292518674
Energy: 0.4939522980019085
Energy: 0.4942365186414026
Energy: 0.4943873292518674
Energy: 0.4939522980019085
Energy: 0.4942365186487514
Energy: 0.4943873292529529
Energy: 0.4939522980019085
Energy: 0.4942365186472816
Energy: 0.49371235280755
Energy: 0.49433250190648226
Energy: 0.4943038648750019
Energy: 0.4937123528060803
Energy: 0.49433250190464517
Energy: 0.49430386487316474
Energy: 0.49371235280718256
Energy: 0.49433250190538003
Energy: 0.49430386487316474
Energy: 0.4937123528060803
Energy: 0.49421318900539524
Energy: 0.4939553480536934
Energy: 0.49440754999199166
Energy: 0.4942131890024557
Energy: 0.4939553480540608
Energy: 0.49440754999235903
Energy: 0.4942131890064975
Energy: 0.4939553480536934
Energy: 0.49440754999199166
Energy: 0.4942131890039255
Energy: 0.49375028087755574
Energy: 0.4938853658013159
Energy: 0.5331791359672438
Energy: 0.49375028087718825
Energy: 0.49388536580205084
Energy: 0.53323767652255
Energy: 0.49375028087792316
Energy: 0.49388536580350384
Energy: 0.5331998139152271
Energy: 0.49375028087829054
Energy: 0.5337386666398484
Energy: 0.49375184882269196
Energy: 0.49375272812438625
Energy: 0.5337927015485366
Energy: 0.49375184882269196
Energy: 0.49375272812475374
Energy: 0.5335851273820088
Energy: 0.49375184882195716
Energy: 0.49375272812512117
Energy: 0.5337346266391052
Energy: 0.49438732925405526
Energy: 0.4939522980019085
Energy: 0.4942365186516908
Energy: 0.4943873292526022
Energy: 0.4939522980019085
Energy: 0.4942365186491188
Energy: 0.49438732925368783
Energy: 0.4939522980019085
Energy: 0.4942365186487514
Energy: 0.4943873292533204
Energy: 0.49433250190391026
Energy: 0.4943038648724299
Energy: 0.49371235280791737
Energy: 0.4943325019061149
Energy: 0.49430386487279726
Energy: 0.49371235280718256
Energy: 0.49433250190391026
Energy: 0.49430386487316474
Energy: 0.4937123528068151
Energy: 0.4943325019061149
Energy: 0.4939553480544283
Energy: 0.49440754999235903
Energy: 0.4942131890024557
Energy: 0.4939553480536934
Energy: 0.49440754999199166
Energy: 0.49421318900355804
Energy: 0.4939553480544283
Energy: 0.49440754999199166
Energy: 0.49421318900613004
Energy: 0.4939553480536934

minimum gb energy = 0.4937123528060803 eV
minimum distance =  2.61033200976008 Angstroms
sigma value = 15


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

Energy: 0.5306269858073592
Energy: 0.5602569482348272
Energy: 0.5579678399942082
Energy: 0.5177172947859081
Energy: 0.5602569482331616
Energy: 0.5579678399958736
Energy: 0.5306269858006969
Energy: 0.5602569482348272
Energy: 0.5579678399925426
Energy: 0.5177172947859081
Energy: 0.5591675751015447
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Energy: 0.5591675751032102
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Energy: 0.5855941997531754
Energy: 0.5316395236515051
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Energy: 0.5316395236481739
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Energy: 0.5532588673750009
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Energy: 0.5760697608871186
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Energy: 0.5532588673766665
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Energy: 0.5760697608854531
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Energy: 0.5838519351256445
Energy: 0.504813303783842
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Energy: 0.5299369601069603
Energy: 0.5600092265260074
Energy: 0.5381521823519985
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Energy: 0.5710752900490788
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Energy: 0.5710752900474131
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Energy: 0.5433268763911415
Energy: 0.5437166128478254
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Energy: 0.57249170328394
Energy: 0.5437166128461598
Energy: 0.506098545922551
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Energy: 0.5437166128461598
Energy: 0.5061249245166102
Energy: 0.5724917032872711
Energy: 0.5437166128478254
Energy: 0.5736996410512541
Energy: 0.5058216040318201
Energy: 0.5588940771796298
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Energy: 0.5042533998114801
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Energy: 0.6081407499630125
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Energy: 0.6008433687107767
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Energy: 0.6008433687091111
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Energy: 0.5587317866906726
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Energy: 0.5728997066871886
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Energy: 0.5603470399487593
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Energy: 0.5685912413257989
Energy: 0.5299966145150007
Energy: 0.5283355476844201
Energy: 0.6459270203104348
Energy: 0.5070860653662328
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Energy: 0.507086065369564
Energy: 0.5283355476794234
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Energy: 0.5283355476860857
Energy: 0.528782804558884
Energy: 0.5242549978161175
Energy: 0.5396540892252515
Energy: 0.5285295313159745
Energy: 0.524257341618102
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Energy: 0.5287828045622152
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Energy: 0.5285295313159745
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Energy: 0.5208402541380344
Energy: 0.5632786086540892
Energy: 0.5362181458190239
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Energy: 0.5743749561322293
Energy: 0.5750461787335774
Energy: 0.5718903627840352
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Energy: 0.548558393410246
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Energy: 0.5576613285246637
Energy: 0.548558393406915
Energy: 0.5168943339264077
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Energy: 0.5485583934135773
Energy: 0.5984999418420875
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Energy: 0.584672017681165
Energy: 0.5547465076317625
Energy: 0.517606255961316
Energy: 0.5846720176794994
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Energy: 0.5310800733267934
Energy: 0.5846720176778338
Energy: 0.5547465076317625
Energy: 0.5176062559529883
Energy: 0.5100583688182342
Energy: 0.6153844047331757
Energy: 0.5590475554493961
Energy: 0.5100583688165686
Energy: 0.6153844047331757
Energy: 0.5590475554493961
Energy: 0.5100583688149031
Energy: 0.6153844047315101
Energy: 0.5590475554527272
Energy: 0.5100583688215652
Energy: 0.5935002568168756
Energy: 0.511349864946279
Energy: 0.5792288648486104
Energy: 0.5935002568185411
Energy: 0.5113498649529411
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Energy: 0.5113498649496099
Energy: 0.5792288648486104
Energy: 0.5935002568202067
Energy: 0.5469502237205991
Energy: 0.5569769174765147
Energy: 0.5131567685007795
Energy: 0.5469502237239301
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Energy: 0.5469502237172679
Energy: 0.6112033555443641
Energy: 0.5390086880331558
Energy: 0.5065691559876752
Energy: 0.6112033555393674
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Energy: 0.5065691559843442
Energy: 0.6112033555393674
Energy: 0.5390086880331558
Energy: 0.5065691559860096
Energy: 0.6112033555426986
Energy: 0.5605466673142877
Energy: 0.5592392453825024
Energy: 0.5624964237499188
Energy: 0.5605466673142877
Energy: 0.5592392453874991
Energy: 0.5624964237482533
Energy: 0.5605466673159532
Energy: 0.5592392453808368
Energy: 0.5624964237449221
Energy: 0.5605466673159532
Energy: 0.5634392899993432
Energy: 0.5444370055226085
Energy: 0.5117497316702214
Energy: 0.5634392900043399
Energy: 0.544437005532602
Energy: 0.5117497316652247
Energy: 0.5634392899993432
Energy: 0.544437005532602
Energy: 0.5117497316652247
Energy: 0.5634392900010088
Energy: 0.517719766452203
Energy: 0.5672876323791034
Energy: 0.5432664697049521
Energy: 0.5177197664538684
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Energy: 0.5432664697066176
Energy: 0.5177197664571996
Energy: 0.5672876323807688
Energy: 0.5432664697049521
Energy: 0.5177197664538684
Energy: 0.5570118101927939
Energy: 0.5261061359250525
Energy: 0.5178394584585089
Energy: 0.5570118101927939
Energy: 0.5331456846960263
Energy: 0.5247801112993088
Energy: 0.5570118101944594
Energy: 0.5261061359300494
Energy: 0.5178394584618401
Energy: 0.5570118101927939
Energy: 0.6579818791518071
Energy: 0.5072034152846391
Energy: 0.5480876228433348
Energy: 0.6579818791518071
Energy: 0.5072034152846391
Energy: 0.5480876228483316
Energy: 0.6579818791501414
Energy: 0.5072034152813081
Energy: 0.5480876228450005
Energy: 0.6579818791534726
Energy: 0.5243910761138919
Energy: 0.5984922574182564
Energy: 0.5242663547716736
Energy: 0.5243910761155575
Energy: 0.5984922574199218
Energy: 0.5242663547666768
Energy: 0.5243910761155575
Energy: 0.5984922574215873
Energy: 0.5242663547683424
Energy: 0.5243910761138919
Energy: 0.5506499782770211
Energy: 0.505694479437015
Energy: 0.6359707538827236
Energy: 0.5506499782836835
Energy: 0.5056750530045664
Energy: 0.6359707538893858
Energy: 0.5506499782820178
Energy: 0.505694479437015
Energy: 0.6359707538910514
Energy: 0.5506499782803523
Energy: 0.5685759659082723
Energy: 0.5215284233573491
Energy: 0.558234621829027
Energy: 0.5685759659132691
Energy: 0.5215284233573491
Energy: 0.558234621829027
Energy: 0.568575965909938
Energy: 0.521528423365677
Energy: 0.5582346218273614
Energy: 0.5685759659132691
Energy: 0.5580632310168513
Energy: 0.536303765128138
Energy: 0.5203659171342966
Energy: 0.558063231021848
Energy: 0.5363037651264725
Energy: 0.5203626147371101
Energy: 0.558063231018517
Energy: 0.536303765128138
Energy: 0.5203659171342966
Energy: 0.5580632310135202
Energy: 0.5109198849092044
Energy: 0.5264423541664045
Energy: 0.5521277438198656
Energy: 0.5109198849075388
Energy: 0.5264423541647388
Energy: 0.5521277438182001
Energy: 0.5109198849042077
Energy: 0.5264423541714012
Energy: 0.5521277438182001
Energy: 0.5109198849075388
Energy: 0.517748809900849
Energy: 0.5550865558864306
Energy: 0.5833240642644066
Energy: 0.517748809900849
Energy: 0.5550865558880962
Energy: 0.5833240642710689
Energy: 0.5177488099041803
Energy: 0.5550865558897619
Energy: 0.5833240642677378
Energy: 0.517748809900849

minimum gb energy = 0.5031216637556415 eV
minimum distance =  2.57541110484847 Angstroms
sigma value = 437


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

Energy: 0.514678180146794
Energy: 0.5402655258760215
Energy: 0.5400771767517127
Energy: 0.514678180146794
Energy: 0.5402655258778418
Energy: 0.5400771767498924
Energy: 0.5146781801474007
Energy: 0.5402655258766283
Energy: 0.54007717675414
Energy: 0.514678180146794
Energy: 0.5940711696392218
Energy: 0.5069439693576283
Energy: 0.5594285174978741
Energy: 0.5940711696380082
Energy: 0.5069439693558079
Energy: 0.5594285174972674
Energy: 0.5940711696392218
Energy: 0.5069439693582352
Energy: 0.5594285174978741
Energy: 0.5940711696380082
Energy: 0.5708125982259801
Energy: 0.4976928063554131
Energy: 0.6139924856131618
Energy: 0.5708125982271937
Energy: 0.49769280635601987
Energy: 0.6139924856149821
Energy: 0.5708125982265867
Energy: 0.4976928063554131
Energy: 0.6139924856125549
Energy: 0.5708125982271937
Energy: 0.5472289639333092
Energy: 0.5769443046835273
Energy: 0.5498130031169964
Energy: 0.5472289639345229
Energy: 0.5769443046835273
Energy: 0.5498130031182101
Energy: 0.5472289639333092
Energy: 0.5769443046835273
Energy: 0.5498130031176033
Energy: 0.5472289639345229
Energy: 0.5627913493347156
Energy: 0.5146980005693474
Energy: 0.6187974565971412
Energy: 0.5627913493383565
Energy: 0.5146980005711678
Energy: 0.6187974565959278
Energy: 0.5627913493383565
Energy: 0.5146980005687407
Energy: 0.6187974565977482
Energy: 0.5627913493383565
Energy: 0.555178619208768
Energy: 0.5530737583164421
Energy: 0.5057114361507813
Energy: 0.5551786192111953
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Energy: 0.505711436148961
Energy: 0.5551786192099816
Energy: 0.5530737583158353
Energy: 0.5057114361507813
Energy: 0.555178619208768
Energy: 0.5682467264871328
Energy: 0.5210855496349207
Energy: 0.497874613157795
Energy: 0.5682467264883464
Energy: 0.5210855496324935
Energy: 0.4978746131565815
Energy: 0.5682467264871328
Energy: 0.5210855496349207
Energy: 0.497874613157795
Energy: 0.5682467264883464
Energy: 0.538457447078375
Energy: 0.5503910174873907
Energy: 0.5434707429280342
Energy: 0.5384574470801953
Energy: 0.550391017489818
Energy: 0.5434707429262138
Energy: 0.5384574470777682
Energy: 0.5503910174886044
Energy: 0.5434707429280342
Energy: 0.5384574470795885
Energy: 0.6695412843040811
Energy: 0.56067595407884
Energy: 0.5150724749406789
Energy: 0.6695412843077218
Energy: 0.5606759540782332
Energy: 0.5150724749382516
Energy: 0.6695412843089353
Energy: 0.56067595407884
Energy: 0.5150724749406789
Energy: 0.6695412843150034
Energy: 0.5450192448719466
Energy: 0.5617655989448956
Energy: 0.5637172254232472
Energy: 0.5450192448719466
Energy: 0.5617655989473228
Energy: 0.5637172254220336
Energy: 0.5450192448719466
Energy: 0.5617655989448956
Energy: 0.5637172254226404
Energy: 0.5450192448719466
Energy: 0.5425955054214774
Energy: 0.5262423955154092
Energy: 0.622721973017728
Energy: 0.5425955054220843
Energy: 0.5042478343186092
Energy: 0.622721973017728
Energy: 0.5425955054214774
Energy: 0.5042478343192159
Energy: 0.622721973017728
Energy: 0.5425955054220843
Energy: 0.5870372360406488
Energy: 0.507388747551779
Energy: 0.5490263603892034
Energy: 0.5870372360418624
Energy: 0.5073887475529926
Energy: 0.5490263603879899
Energy: 0.5870372360406488
Energy: 0.507388747551779
Energy: 0.5490263603916307
Energy: 0.5870372360424692
Energy: 0.515012907152723
Energy: 0.5869958983636251
Energy: 0.5177894942496494
Energy: 0.5150129071533298
Energy: 0.5869958983933306
Energy: 0.5177894942496494
Energy: 0.515012907152723
Energy: 0.5869958983587708
Energy: 0.5177894942496494
Energy: 0.515012907152723
Energy: 0.6220397710283138
Energy: 0.5218972799759647
Energy: 0.5438746819788277
Energy: 0.622039771027707
Energy: 0.5218972799765715
Energy: 0.5438746819830753
Energy: 0.6220397710283138
Energy: 0.5218972799765715
Energy: 0.5438746819782209
Energy: 0.6220397710283138

minimum gb energy = 0.4976928063554131 eV
minimum distance =  2.57895644211383 Angstroms
sigma value = 33