Model name: model_name=MEAM_LAMMPS_LeeShimBaskes_2003_Ni__MO_000553624872_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.521391749382019
cohesive_energy=4.450350014532299
mass=58.6934
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: 0.020524749323364476
Energy: 0.5149134763068606
Energy: 0.5149134763068606
Energy: 0.020524749323364476
Energy: 0.5149134763068606
Energy: 0.5149134763068606
Energy: 0.020524749323364476
Energy: 0.5149134763068606
Energy: 0.5149134763068606
Energy: 0.020524749323364476
Energy: 0.5120378536342762
Energy: 0.024074395459241657
Energy: 0.5124647359273594
Energy: 0.5120378536342762
Energy: 0.024074395459241657
Energy: 0.5124647359273594
Energy: 0.5120378536342762
Energy: 0.024074395459241657
Energy: 0.5124647359273594
Energy: 0.5120378536342762
Energy: 1.070061678406803
Energy: 0.2506204577854168
Energy: 1.0560978432483754
Energy: 1.5644670011952675
Energy: 0.021008387951810793
Energy: 1.0560978432483754
Energy: 1.7863884158706962
Energy: 0.021008387950287404
Energy: 1.0560978432483754
Energy: 1.6196288659638405
Energy: 0.5120378536342762
Energy: 0.5124647359273594
Energy: 0.024074395459241657
Energy: 0.5120378536342762
Energy: 0.5124647359273594
Energy: 0.024074395459241657
Energy: 0.5120378536342762
Energy: 0.5124647359273594
Energy: 0.024074395459241657
Energy: 0.5120378536342762
Energy: 0.020524749323364476
Energy: 0.5149134763068606
Energy: 0.5149134763068606
Energy: 0.020524749323364476
Energy: 0.5149134763068606
Energy: 0.5149134763068606
Energy: 0.020524749323364476
Energy: 0.5149134763068606
Energy: 0.5149134763068606
Energy: 0.020524749323364476
Energy: 0.5120378536342762
Energy: 0.024074395459241657
Energy: 0.5124647359258361
Energy: 0.5120378536342762
Energy: 0.024074395459241657
Energy: 0.5124647359273594
Energy: 0.5120378536342762
Energy: 0.024074395459241657
Energy: 0.5124647359258361
Energy: 0.5120378536342762
Energy: 1.2547718271372064
Energy: 0.021008387951810793
Energy: 1.1226638267932207
Energy: 1.2548450255481365
Energy: 0.021008387951810793
Energy: 1.1226638267932207
Energy: 1.2547189192582742
Energy: 0.021008387951810793
Energy: 1.1226638267932207
Energy: 1.2548205539928798

minimum gb energy = 0.020524749323364476 eV
minimum distance =  2.28633982347316 Angstroms
sigma value = 3


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

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Energy: 1.6721383040977638
Energy: 1.6725818182748968
Energy: 1.3883944002305628
Energy: 1.6721383040977638
Energy: 1.6725818182748968
Energy: 1.4756672219266371
Energy: 1.6721383040903006
Energy: 1.6725818182711651
Energy: 1.3883944002305628
Energy: 1.4852692689730993
Energy: 1.417378431616066
Energy: 1.6460649318097138
Energy: 1.4852692689320526
Energy: 1.4173784316197977
Energy: 1.6460649318134455
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Energy: 1.6460649318134455
Energy: 1.4852692690066152
Energy: 1.613505610746288
Energy: 1.7762953477368375
Energy: 1.7188994597061487
Energy: 1.5510106512284139
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Energy: 1.7188994597061487
Energy: 1.613505610746288
Energy: 1.776295347733106
Energy: 1.7188994597098801
Energy: 1.5510106512321455
Energy: 1.6702045852134733
Energy: 1.6730345995239846
Energy: 1.3367013686786833
Energy: 1.6702045852097418
Energy: 1.6730345995239846
Energy: 1.3367013686786833
Energy: 1.6702045852097418
Energy: 1.6730345995239846
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Energy: 1.6702045852134733
Energy: 1.2761895021001004
Energy: 1.8125330720420212
Energy: 1.6219118514070363
Energy: 1.2761895020963687
Energy: 1.8126681105849718
Energy: 1.622065379249941
Energy: 1.2761895020963687
Energy: 1.8125330720382895
Energy: 1.621911851410768
Energy: 1.2761895020963687
Energy: 1.749654142414825
Energy: 1.3457072652704145
Energy: 1.6045840813516505
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Energy: 1.6045840813441874
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Energy: 1.604584081347919
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Energy: 1.4069983994607715
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Energy: 1.956913057385821
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Energy: 1.659531504928628
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Energy: 1.6578949925599404
Energy: 1.3367863717556343
Energy: 1.6576128270535984
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Energy: 1.6576128270535984
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Energy: 1.65761282705733
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Energy: 1.6747985393622067
Energy: 1.4170836777283309
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Energy: 1.6225455553508485
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Energy: 1.4170836777283309
Energy: 1.6225455553471173
Energy: 1.4522983949375146
Energy: 1.7524120043786917
Energy: 1.7449369082496862
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Energy: 1.4522983949412462
Energy: 1.4808107379600912
Energy: 1.796365699069092
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Energy: 1.64442193327665
Energy: 1.407078917054645
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Energy: 1.7962129782177216
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Energy: 1.7962129808398215
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Energy: 1.672003315434139
Energy: 1.7962129814104715
Energy: 1.5785867268438296
Energy: 1.672003315441602
Energy: 1.7646730615516664
Energy: 1.4420519692607128
Energy: 1.3432847883241796
Energy: 1.7646730615516664
Energy: 1.4426884960710578
Energy: 1.343284788327911
Energy: 1.7646730615553978
Energy: 1.4420519692569813
Energy: 1.3432847883316428
Energy: 1.7646730615553978
Energy: 1.276453568740301
Energy: 1.7466064784413522
Energy: 1.7692022728810777
Energy: 1.276453568740301
Energy: 1.7473564039455596
Energy: 1.8144774854511856
Energy: 1.276453568740301
Energy: 1.7466064784488153
Energy: 1.7692022728773462
Energy: 1.2764535687440324
Energy: 1.6555227994283912
Energy: 1.3366077627350001
Energy: 1.6586169401052793
Energy: 1.6555227994246597
Energy: 1.3366077627350001
Energy: 1.658616940101548
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Energy: 1.3366077627350001
Energy: 1.6586169401052793
Energy: 1.6555227994283912
Energy: 1.4456652413518736
Energy: 1.7199438685194308
Energy: 1.5993336938624818
Energy: 1.4456652413481421
Energy: 1.719943868523162
Energy: 1.5993336938587501
Energy: 1.4456652413518736
Energy: 1.719943868523162
Energy: 1.5993336938587501
Energy: 1.4456652413518736
Energy: 1.4445666074186392
Energy: 1.6271000818424572
Energy: 1.4131244185989855
Energy: 1.4445666074186392
Energy: 1.627100081834994
Energy: 1.4166976670307483
Energy: 1.444566607426102
Energy: 1.6271000818424572
Energy: 1.413124418602717
Energy: 1.4445666074223704
Energy: 1.4527794179608677
Energy: 1.672138304094032
Energy: 1.6725818182748968
Energy: 1.394876701999674
Energy: 1.6721383040977638
Energy: 1.6725818182711651
Energy: 1.4527794179645994
Energy: 1.672138304094032
Energy: 1.6725818182711651
Energy: 1.3948767019959425
Energy: 1.4852692689320526
Energy: 1.417378431616066
Energy: 1.6460649318134455
Energy: 1.4852692689059321
Energy: 1.417378431616066
Energy: 1.646064931817177
Energy: 1.4852692689283213
Energy: 1.4173784316197977
Energy: 1.6460649318134455
Energy: 1.485269268883543
Energy: 1.610749983993531
Energy: 1.776295347733106
Energy: 1.7188994597024172
Energy: 1.5957620492244529
Energy: 1.776295347733106
Energy: 1.7188994597061487
Energy: 1.6107499839972628
Energy: 1.776295347733106
Energy: 1.7188994597061487
Energy: 1.5957620492207216
Energy: 1.6702045852134733
Energy: 1.6730345995239846
Energy: 1.3367013686786833
Energy: 1.6702045852097418
Energy: 1.6730345995239846
Energy: 1.3367013686786833
Energy: 1.6702045852134733
Energy: 1.6730345995277163
Energy: 1.3367013686786833
Energy: 1.6702045852172047

minimum gb energy = 1.2761895020963687 eV
minimum distance =  2.21818552195533 Angstroms
sigma value = 75


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

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Energy: 1.3518725062422656
Energy: 1.350610321982517
Energy: 1.5402042793576898
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Energy: 1.350610321980696
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Energy: 1.5402042793576898
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Energy: 1.6015211764692385
Energy: 1.6618566641490025
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minimum gb energy = 1.338514736266628 eV
minimum distance =  2.21396603115411 Angstroms
sigma value = 105


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

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Energy: 1.5375271078042565
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Energy: 1.6537117461079043
Energy: 1.5373159032434598
Energy: 1.6392557163909816
Energy: 1.6537117461079043
Energy: 1.5375271078022024
Energy: 1.6392557163909816
Energy: 1.7780179673167993
Energy: 1.6261247345671725
Energy: 1.6630339181317908
Energy: 1.7765901514425537
Energy: 1.6261247345651184
Energy: 1.663033918133845
Energy: 1.7780179673188534
Energy: 1.6261247345651184
Energy: 1.663033918133845
Energy: 1.7765901514425537
Energy: 1.761889409086451
Energy: 1.6748296047782218
Energy: 1.6758605496611143
Energy: 1.7327057754535786
Energy: 1.6748296047802758
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Energy: 1.7618894090885053
Energy: 1.6748296047802758
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Energy: 1.732705775455633
Energy: 1.5765302421527958
Energy: 1.459754400927584
Energy: 1.5848615091580356
Energy: 1.57653024215485
Energy: 1.45975440092553
Energy: 1.58486150916009
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Energy: 1.58486150916009
Energy: 1.57653024215485
Energy: 1.745953884295338
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Energy: 1.6541255474685939
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Energy: 1.7459538842973918
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Energy: 1.6182917505524186
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Energy: 1.629795449562477
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Energy: 1.6554618106368715
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Energy: 1.629795449562477
Energy: 1.6182917505544727
Energy: 1.4999831674553665
Energy: 1.7932995201261739
Energy: 1.7902264068077327
Energy: 1.500265477662153
Energy: 1.7932995201241198
Energy: 1.7902264068097866
Energy: 1.4999831674553665
Energy: 1.7932995201241198
Energy: 1.7902264068077327
Energy: 1.500265477662153
Energy: 1.6953677017897704
Energy: 1.516185750200542
Energy: 1.6249411863787182
Energy: 1.6953677017877162
Energy: 1.516185750200542
Energy: 1.6249411863787182
Energy: 1.6953677017897704
Energy: 1.5161857501984877
Energy: 1.6249411863787182
Energy: 1.6953677017877162
Energy: 1.5915369079113488
Energy: 1.6187117390615888
Energy: 1.6512689951106578
Energy: 1.5954124364489748
Energy: 1.6187117390615888
Energy: 1.6512689951127122
Energy: 1.5915369079113488
Energy: 1.6187117390615888
Energy: 1.6512689951106578
Energy: 1.5954124364489748
Energy: 1.6217852449552745
Energy: 1.6219825336617577
Energy: 1.4788725814898231
Energy: 1.621712887445936
Energy: 1.6219430129573111
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Energy: 1.6217852449532204
Energy: 1.6219825336617577
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Energy: 1.6217128874479898
Energy: 1.7564184105682035
Energy: 1.6521824837133803
Energy: 1.672195943225674
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Energy: 1.6721959432236202
Energy: 1.7564184105661493
Energy: 1.6521824837133803
Energy: 1.6721959432236202
Energy: 1.7564184105682035
Energy: 1.6267850851289205
Energy: 1.6481424396573154
Energy: 1.6874838524049849
Energy: 1.6267850851329915
Energy: 1.6481424396573154
Energy: 1.6874838524132016
Energy: 1.6267850851309744
Energy: 1.6481424396593694
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Energy: 1.6267850851309744
Energy: 1.6595837509314513
Energy: 1.6448004978815822
Energy: 1.6338455404465881
Energy: 1.6595837509314513
Energy: 1.626173393250786
Energy: 1.6514515786725565
Energy: 1.6595837509314513
Energy: 1.6448004978815822
Energy: 1.651353968782827
Energy: 1.6595837509314513
Energy: 1.6562800037117125
Energy: 1.6679496929848234
Energy: 1.5353573909065743
Energy: 1.6562800037137668
Energy: 1.6679496929848234
Energy: 1.5353573909106826
Energy: 1.6562800037158207
Energy: 1.6679496929848234
Energy: 1.5353573909086284
Energy: 1.656280003717875
Energy: 1.6525851197350265
Energy: 1.5925626390241947
Energy: 1.6604935407312544
Energy: 1.6525851197370804
Energy: 1.5925626390241947
Energy: 1.6604935407292
Energy: 1.6525851197370804
Energy: 1.5925626390241947
Energy: 1.6604935407312544
Energy: 1.6525851197370804
Energy: 1.595425102881366
Energy: 1.6222098991720029
Energy: 1.6227166776816686
Energy: 1.59542510288342
Energy: 1.622209899174057
Energy: 1.6227166776837227
Energy: 1.595425102881366
Energy: 1.6222098991699487
Energy: 1.6227166776796142
Energy: 1.595425102881366
Energy: 1.5843838880951093
Energy: 1.6450714096770744
Energy: 1.6171363525983986
Energy: 1.5843838880971632
Energy: 1.63869668235301
Energy: 1.6171363525983986
Energy: 1.5843838880971632
Energy: 1.64507140967502
Energy: 1.617136352590182
Energy: 1.5843838880971632
Energy: 1.8851012772483657
Energy: 1.644547943955652
Energy: 1.6777224782846376
Energy: 1.885101277246312
Energy: 1.6445714230354618
Energy: 1.677722478286654
Energy: 1.8851012772442575
Energy: 1.644547943955652
Energy: 1.677722478286654
Energy: 1.8851012772483657
Energy: 1.5024499399857927
Energy: 1.6246707689065043
Energy: 1.4975091906740423
Energy: 1.5024499399857927
Energy: 1.6246707689044502
Energy: 1.4975091906719882
Energy: 1.5024499399857927
Energy: 1.6246707689023958
Energy: 1.4975091906740423
Energy: 1.5024499399857927
Energy: 1.6709949414719427
Energy: 1.764392674640188
Energy: 1.6151154461579755
Energy: 1.6709949414698888
Energy: 1.7638834107103778
Energy: 1.6151154461600294
Energy: 1.6709949414698888
Energy: 1.7643926746422418
Energy: 1.6151154461620838
Energy: 1.6709949414698888
Energy: 1.6627997965307941
Energy: 1.677821406890156
Energy: 1.6763268135328948
Energy: 1.6627997965328483
Energy: 1.683053717303003
Energy: 1.6763268135328948
Energy: 1.6627997965307941
Energy: 1.6778214068922102
Energy: 1.6763268135349492
Energy: 1.6627997965307941
Energy: 1.6541566816860256
Energy: 1.5370297270594815
Energy: 1.654869796131417
Energy: 1.6541566816880797
Energy: 1.5370339623571885
Energy: 1.654869796131417
Energy: 1.6541566816901336
Energy: 1.5370297270594815
Energy: 1.654869796131417
Energy: 1.6541566816901336

minimum gb energy = 1.45975440092553 eV
minimum distance =  2.18168037093458 Angstroms
sigma value = 165


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

Energy: 1.481704269156542
Energy: 1.6050914434725903
Energy: 1.6032936009387837
Energy: 1.4259024636761048
Energy: 1.6050914434725903
Energy: 1.6032936009387837
Energy: 1.481704269156542
Energy: 1.6050914434718848
Energy: 1.6032936009366683
Energy: 1.4259024636761048
Energy: 1.6710509098279425
Energy: 1.4237828946536297
Energy: 1.69572844457763
Energy: 1.6710509098272373
Energy: 1.4237828946557451
Energy: 1.695728444566347
Energy: 1.671050909826532
Energy: 1.4237828946557451
Energy: 1.6957284445804508
Energy: 1.671050909826532
Energy: 1.5433259153301153
Energy: 1.6215931250087656
Energy: 1.435347687450275
Energy: 1.5433259153294099
Energy: 1.6215931250080602
Energy: 1.4356120741164862
Energy: 1.5433259153308203
Energy: 1.6215931250080602
Energy: 1.435347687450275
Energy: 1.5433259153301153
Energy: 1.7081816415809445
Energy: 1.7584333832523196
Energy: 1.4443394321555039
Energy: 1.7081816415802393
Energy: 1.7584333832516144
Energy: 1.444339432156209
Energy: 1.7081816415802393
Energy: 1.7584333832509091
Energy: 1.4443394321540934
Energy: 1.7081816415795341
Energy: 1.598236341176129
Energy: 1.6223434935455165
Energy: 1.5379177026463637
Energy: 1.5982363411747187
Energy: 1.6223434935483374
Energy: 1.5379177026463637
Energy: 1.598236341176834
Energy: 1.622343493546927
Energy: 1.5379177026435429
Energy: 1.598236341175424
Energy: 1.4234253410832944
Energy: 1.7786432362317743
Energy: 1.7041205415591207
Energy: 1.4234253410839997
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Energy: 1.7786432362331845
Energy: 1.7041205415577103
Energy: 1.4234253410832944
Energy: 1.6051853512293208
Energy: 1.5964573528459847
Energy: 1.7654626679237901
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Energy: 1.5964573528466897
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Energy: 1.6051853512286156
Energy: 1.5964573528466897
Energy: 1.7654626679259058
Energy: 1.6051853512286156
Energy: 1.6824440579556281
Energy: 1.5783130672720553
Energy: 1.57691955736172
Energy: 1.6824440579563331
Energy: 1.5783130672685293
Energy: 1.5769195573624253
Energy: 1.6824440579584488
Energy: 1.5783130672685293
Energy: 1.5769195573624253
Energy: 1.6824440579563331
Energy: 1.6112393484814276
Energy: 1.731323375543105
Energy: 1.5960656031724298
Energy: 1.611239348482838
Energy: 1.7313233755416946
Energy: 1.5959693203444925
Energy: 1.6112393484821326
Energy: 1.7313233755409894
Energy: 1.5960656031724298
Energy: 1.611239348482838
Energy: 1.5423218032547243
Energy: 1.7042709414053863
Energy: 1.779007290465156
Energy: 1.4870434647679969
Energy: 1.7042709414067965
Energy: 1.7790072904637457
Energy: 1.5423218032554293
Energy: 1.7042709414060913
Energy: 1.779007290464451
Energy: 1.4870434647672919
Energy: 1.557214105725343
Energy: 1.5364451555872454
Energy: 1.734525814706007
Energy: 1.5350574311636842
Energy: 1.5364451555879504
Energy: 1.6382656948305847
Energy: 1.557214105726048
Energy: 1.5364451555872454
Energy: 1.7345258147081224
Energy: 1.5350574311636842
Energy: 1.7020723961770534
Energy: 1.4446138258274503
Energy: 1.7030672874671062
Energy: 1.7020723961763482
Energy: 1.4446138258302708
Energy: 1.7030672874656958
Energy: 1.7020723961777584
Energy: 1.4446138258309762
Energy: 1.7030672874685167
Energy: 1.7020723961770534
Energy: 1.5972350721649988
Energy: 1.434681072081498
Energy: 1.6345918449418146
Energy: 1.5972350721664093
Energy: 1.4346810720829084
Energy: 1.6345918449425199
Energy: 1.5972350721649988
Energy: 1.434681072081498
Energy: 1.6345918449418146
Energy: 1.597235072165704
Energy: 1.6077734049808738
Energy: 1.6095803512791407
Energy: 1.423596958370964
Energy: 1.6077734049801686
Energy: 1.6095803512784355
Energy: 1.423596958370964
Energy: 1.607773404981579
Energy: 1.6095803512798457
Energy: 1.4235969583702586
Energy: 1.6077734049808738
Energy: 1.42590246367681
Energy: 1.6050914434718848
Energy: 1.6032936009380787
Energy: 1.42590246367681
Energy: 1.6050914434718848
Energy: 1.6032936009387837
Energy: 1.42590246367681
Energy: 1.6050914434718848
Energy: 1.6032936009380787
Energy: 1.42590246367681

minimum gb energy = 1.4234253410832944 eV
minimum distance =  2.28257633445518 Angstroms
sigma value = 41


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

Energy: 1.4502763689641058
Energy: 1.4689379497000732
Energy: 1.4688708988773609
Energy: 1.450276368966842
Energy: 1.4689379497000732
Energy: 1.4688708988773609
Energy: 1.4502763689641058
Energy: 1.4689379497000732
Energy: 1.4688708988773609
Energy: 1.450276368966842
Energy: 1.3586078292247774
Energy: 1.2605420245442178
Energy: 1.591446298258224
Energy: 1.3586078292220414
Energy: 1.2605420245442178
Energy: 1.5914462982554878
Energy: 1.3586078292247774
Energy: 1.2605420245442178
Energy: 1.591446298258224
Energy: 1.3586078292220414
Energy: 1.4188164539258603
Energy: 1.350109545139436
Energy: 1.3879899961461213
Energy: 1.4399743563661838
Energy: 1.350109545139436
Energy: 1.3680265402905227
Energy: 1.4259389201507138
Energy: 1.350109545139436
Energy: 1.3680265402905227
Energy: 1.4399743563634477
Energy: 1.320113532044603
Energy: 1.315444953500277
Energy: 1.280914461006564
Energy: 1.3201135320473392
Energy: 1.3154449534975412
Energy: 1.280914461003828
Energy: 1.320113532044603
Energy: 1.315444953500277
Energy: 1.280914461006564
Energy: 1.320113532044603
Energy: 1.3402410398549305
Energy: 1.623600948980249
Energy: 1.2826692637692894
Energy: 1.3402410398494584
Energy: 1.623600948980249
Energy: 1.2826692637692894
Energy: 1.3402410398521944
Energy: 1.623600948980249
Energy: 1.2826692637692894
Energy: 1.3402410398521944
Energy: 1.2620731138789119
Energy: 1.4669368001796765
Energy: 1.4653533084418178
Energy: 1.2620731138789119
Energy: 1.4669368001796765
Energy: 1.4653533084418178
Energy: 1.2620731138789119
Energy: 1.4669368001796765
Energy: 1.465353308444554
Energy: 1.2620731138789119
Energy: 1.3119911850370887
Energy: 1.467176884197124
Energy: 1.4599907437328254
Energy: 1.3119911850370887
Energy: 1.467176884197124
Energy: 1.4599907437355615
Energy: 1.3119911850370887
Energy: 1.467176884197124
Energy: 1.4599907437328254
Energy: 1.3119911850398247
Energy: 1.3537723541342095
Energy: 1.3338626362548465
Energy: 1.4554890320394467
Energy: 1.3537723541342095
Energy: 1.3338626362548465
Energy: 1.4554890320421827
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Energy: 1.4554890320394467
Energy: 1.3537723541314732
Energy: 1.4926395458089141
Energy: 1.6689970406549315
Energy: 1.4490067736511547
Energy: 1.4926395458089141
Energy: 1.6689970406549315
Energy: 1.449006773648419
Energy: 1.492639545806178
Energy: 1.6689970406576675
Energy: 1.4490067736511547
Energy: 1.4926395458089141
Energy: 1.2854122181320575
Energy: 1.4385369473678635
Energy: 1.3397098728899315
Energy: 1.2854122181320575
Energy: 1.4385369473678635
Energy: 1.3397098728926677
Energy: 1.2854122181320575
Energy: 1.4385369473678635
Energy: 1.3397098728899315
Energy: 1.2854122181347936
Energy: 1.2808977338752654
Energy: 1.2751566432925636
Energy: 1.2751818678363807
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Energy: 1.2808977338752654
Energy: 1.2751566432925636
Energy: 1.2751818678363807
Energy: 1.2808977338725291
Energy: 1.3609323675091547
Energy: 1.4970142616722943
Energy: 1.423488301841851
Energy: 1.3609323675091547
Energy: 1.4970142616722943
Energy: 1.423488301844587
Energy: 1.3609323675091547
Energy: 1.4970142616722943
Energy: 1.423488301844587
Energy: 1.3609323675091547
Energy: 1.4930533999883309
Energy: 1.255410664473298
Energy: 1.5165578132766868
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Energy: 1.5165578132766868
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Energy: 1.4710074991100897
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Energy: 1.2551422031535815
Energy: 1.4710074991100897
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Energy: 1.2551422031563177
Energy: 1.4710074991100897
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Energy: 1.2551422031535815
Energy: 1.4710074991100897
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Energy: 1.462811475911278
Energy: 1.3111179089485754
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Energy: 1.3111179089485754
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Energy: 1.462811475911278
Energy: 1.3111179089485754
Energy: 1.2561524127257278
Energy: 1.35227055286207
Energy: 1.4336113264286898
Energy: 1.4617602951042845
Energy: 1.352270552859334
Energy: 1.4336113264286898
Energy: 1.4617602951042845
Energy: 1.35227055286207
Energy: 1.4336113264286898
Energy: 1.4617602950988122
Energy: 1.352270552859334
Energy: 1.3485731797489628
Energy: 1.4433526763509283
Energy: 1.3392032966038283
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Energy: 1.3391446171602566
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Energy: 1.4418995604374278
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Energy: 1.4418995604374278
Energy: 1.3152555076118735
Energy: 1.3391446171602566
Energy: 1.4988053264382464
Energy: 1.4260655628760397
Energy: 1.34988759539702
Energy: 1.4988053264382464
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Energy: 1.4988053264382464
Energy: 1.4377054850184547
Energy: 1.34988759539702
Energy: 1.4921960036155504
Energy: 1.311273712902701
Energy: 1.4615615876359873
Energy: 1.4708400893036282
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Energy: 1.311273712902701
Energy: 1.4615615876359873
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Energy: 1.2541692224385648
Energy: 1.4582777105632918
Energy: 1.3559889453538256
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Energy: 1.4582777105605556
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Energy: 1.4582777105605556
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Energy: 1.5172250566111543
Energy: 1.2556839434505582
Energy: 1.4937332477086849
Energy: 1.5172250566111543
Energy: 1.2556839434532943
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Energy: 1.5172250566111543
Energy: 1.2556839434532943
Energy: 1.4937332477086849
Energy: 1.5172250566111543
Energy: 1.25559623301015
Energy: 1.4953734720149123
Energy: 1.359329069928506
Energy: 1.2555962330074137
Energy: 1.4953734720176486
Energy: 1.3593290699312424
Energy: 1.25559623301015
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Energy: 1.3593290699312424
Energy: 1.25559623301015
Energy: 1.275231207174139
Energy: 1.2753720219092792
Energy: 1.2814007172653117
Energy: 1.275231207174139
Energy: 1.2753720219092792
Energy: 1.281400717268048
Energy: 1.275231207174139
Energy: 1.275372021912015
Energy: 1.2814007172653117
Energy: 1.2752312071714031
Energy: 1.3568935685506152
Energy: 1.6402296442665132
Energy: 1.2832516908591494
Energy: 1.3568935685506152
Energy: 1.6402296442637774
Energy: 1.2832516908591494
Energy: 1.3568935685506152
Energy: 1.6402296442665132
Energy: 1.2832516908591494
Energy: 1.3568935685506152
Energy: 1.459882591607567
Energy: 1.469739036126219
Energy: 1.4934523549913292
Energy: 1.459882591607567
Energy: 1.469739036126219
Energy: 1.4934523549968013
Energy: 1.459882591607567
Energy: 1.469739036126219
Energy: 1.4934523550132177
Energy: 1.459882591607567
Energy: 1.3519582102250944
Energy: 1.457351734668652
Energy: 1.4239259400886153
Energy: 1.3519582102196224
Energy: 1.457351734668652
Energy: 1.4239259400913513
Energy: 1.3519582102223584
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Energy: 1.4239259400886153
Energy: 1.3519582102223584
Energy: 1.401656260178519
Energy: 1.5101807489359163
Energy: 1.2542279528380968
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Energy: 1.2542279528380968
Energy: 1.401656260178519
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Energy: 1.2542279528380968
Energy: 1.401656260178519
Energy: 1.466169962887665
Energy: 1.4637978462952095
Energy: 1.2554206056526915
Energy: 1.466169962822049
Energy: 1.4637978463116257
Energy: 1.2554206056499555
Energy: 1.4661699628302574
Energy: 1.4637978462760566
Energy: 1.2554206056526915
Energy: 1.4661699628685125
Energy: 1.2858441477109444
Energy: 1.6231540607335662
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Energy: 1.6231540607363022
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Energy: 1.3549925048440956
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Energy: 1.4048269562026907
Energy: 1.512597217956528
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Energy: 1.4002514349251851
Energy: 1.4048269562026907
Energy: 1.512597217956528
Energy: 1.4002514349306572
Energy: 1.4048269562054265
Energy: 1.5897058632689172
Energy: 1.460070040917334
Energy: 1.3600768462616775
Energy: 1.5897058632661811
Energy: 1.460070040917334
Energy: 1.3600768462644135
Energy: 1.5897058632689172
Energy: 1.460070040917334
Energy: 1.3600768462644135
Energy: 1.5897058632661811
Energy: 1.4712052992547138
Energy: 1.3443049220992798
Energy: 1.451357998827175
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Energy: 1.3443049115071284
Energy: 1.451357998827175
Energy: 1.4712052992547138
Energy: 1.3443049125272375
Energy: 1.451357998827175
Energy: 1.471205299251978
Energy: 1.2560613369793674
Energy: 1.62328951121363
Energy: 1.373839480425993
Energy: 1.2560613369793674
Energy: 1.62328951121363
Energy: 1.373839480425993
Energy: 1.2560613369793674
Energy: 1.62328951121363
Energy: 1.373839480425993
Energy: 1.2560613369766316
Energy: 1.2865922968247172
Energy: 1.275081246762828
Energy: 1.27415511573618
Energy: 1.2865922968274535
Energy: 1.2750812467600925
Energy: 1.2741551157334436
Energy: 1.2865922968274535
Energy: 1.2750812467600925
Energy: 1.27415511573618
Energy: 1.2865922968274535
Energy: 1.275645221044964
Energy: 1.2830806840467444
Energy: 1.320125066142015
Energy: 1.2756452210477003
Energy: 1.2830806840467444
Energy: 1.320125066142015
Energy: 1.275645221044964
Energy: 1.2830806840467444
Energy: 1.320125066142015
Energy: 1.275645221044964
Energy: 1.6551093191485045
Energy: 1.2809788526238242
Energy: 1.3778432467892991
Energy: 1.6551093191485045
Energy: 1.2809788526238242
Energy: 1.377843246786563
Energy: 1.6551093191485045
Energy: 1.2809788526238242
Energy: 1.3778432467892991
Energy: 1.6551093191485045
Energy: 1.466145438501538
Energy: 1.4225374871701162
Energy: 1.2581338295447042
Energy: 1.466145438501538
Energy: 1.4225374871701162
Energy: 1.2581338295474405
Energy: 1.466145438501538
Energy: 1.4225374871701162
Energy: 1.2581338295474405
Energy: 1.4661454384988017

minimum gb energy = 1.2541692224385648 eV
minimum distance =  2.21108392993746 Angstroms
sigma value = 185


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

Energy: 1.1497127110164718
Energy: 0.6938492415788031
Energy: 0.6940644431921861
Energy: 0.8481733693790104
Energy: 0.6938492415768543
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Energy: 1.1497127110180663
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Energy: 0.6821191383178324
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Energy: 0.9138622991963536
Energy: 0.9660064369824148
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Energy: 0.9660100153852432
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Energy: 0.6822411019930967
Energy: 0.7439062406540663
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Energy: 0.8961796334422045
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Energy: 0.899303479445378
Energy: 0.6396600435810122
Energy: 0.6938492415785079
Energy: 0.6940644431934262
Energy: 0.7448224535120923
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Energy: 0.6396600435787092
Energy: 0.6938492415765591
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Energy: 0.7448224535120923
Energy: 0.8985309349507041
Energy: 0.6821191383171827
Energy: 1.1135236623297176
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Energy: 1.062951169332544
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Energy: 0.7439758340358764
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Energy: 0.7439758340358764
Energy: 1.0964693929302913
Energy: 0.6947089980421165
Energy: 0.9112592800743929
Energy: 1.0964693929312952
Energy: 0.694708998041467
Energy: 0.9109226271919849
Energy: 1.0964693929293465
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Energy: 1.0964693929312952
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Energy: 0.9005597595067073
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Energy: 0.9900139525740335
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Energy: 1.0312700460966733
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Energy: 0.6941267895325091
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Energy: 0.6941267895325091
Energy: 0.9110996178725793
Energy: 1.1164659188110364
Energy: 0.6941267895318595
Energy: 1.0161849479799216
Energy: 0.7903668101042446
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Energy: 1.0161849479802167
Energy: 0.7921494277500163
Energy: 0.7244878701601903
Energy: 1.0161849479795673
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Energy: 0.6822411019925061
Energy: 0.9434635454150925
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Energy: 0.6947089980424118
Energy: 0.9113365595463054
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Energy: 0.6947089980427661
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Energy: 0.9113365595443568
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Energy: 0.7904431321432245
Energy: 0.6943197960051797
Energy: 0.7241775844953301
Energy: 0.7921588201465551
Energy: 0.6943197960058293
Energy: 1.0193025092166337
Energy: 1.0106173480787548
Energy: 0.9589340362945223
Energy: 1.0193025092159842
Energy: 1.1286475053530292
Energy: 0.9247965124797364
Energy: 1.0193025092185823
Energy: 1.0106173480781053
Energy: 0.9589340362955262
Energy: 1.0193025092179329
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Energy: 0.9089597292718702
Energy: 1.1164659188106822
Energy: 0.6941267895331587
Energy: 0.9481227649256284
Energy: 1.1164659188129853
Energy: 0.6941267895331587
Energy: 0.908959729276122
Energy: 1.1164659188110364
Energy: 0.6941267895308556
Energy: 1.0161849479789176
Energy: 0.8993103874398184
Energy: 0.7244878701611942
Energy: 1.0161849479808664
Energy: 0.900520951723382
Energy: 0.7244878701618438
Energy: 1.016184947981516
Energy: 0.8993103874365704
Energy: 0.724487870166686
Energy: 1.0161849479779728
Energy: 0.7679964466558211
Energy: 0.9559110294898985
Energy: 0.6941414064226109
Energy: 0.9660100153855383
Energy: 0.888033755646451
Energy: 0.6941414064258586
Energy: 0.7679964466541678
Energy: 0.955911029488304
Energy: 0.6941414064223156
Energy: 0.9660100153848887
Energy: 0.845986363143418
Energy: 0.8406940984106344
Energy: 0.682241101993451
Energy: 0.7439062406534758
Energy: 0.7452061333117473
Energy: 0.6822411019930967
Energy: 0.8459863631431227
Energy: 0.8406940984099849
Energy: 0.6822411019943959
Energy: 0.743906240651527
Energy: 0.8961796334418503
Energy: 1.1164278094780018
Energy: 0.7244686778849645
Energy: 0.8993034794414806
Energy: 1.1164278094776476
Energy: 0.7244686778856141
Energy: 0.8961796334409055
Energy: 1.1164278094795963
Energy: 0.7244686778833701
Energy: 0.899303479443075

minimum gb energy = 0.6396600435787092 eV
minimum distance =  2.34852050063411 Angstroms
sigma value = 33


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

Energy: 1.244325122828571
Energy: 1.3581641697425522
Energy: 1.3581684687862279
Energy: 1.1955940665617588
Energy: 1.3581641697443352
Energy: 1.358168468784445
Energy: 1.244325122832137
Energy: 1.3581641697443352
Energy: 1.358168468782662
Energy: 1.1955940665617588
Energy: 1.378440003062606
Energy: 1.2075588206328256
Energy: 1.3156022971782715
Energy: 1.378440003060823
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Energy: 1.378440003060823
Energy: 1.2762769239036675
Energy: 1.137434334386526
Energy: 1.2366136052805123
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Energy: 1.2762769239018845
Energy: 1.137434334386526
Energy: 1.236613605276946
Energy: 1.2770443593479717
Energy: 1.475216529697577
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Energy: 1.475216529697577
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Energy: 1.475216529695794
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Energy: 1.305580418250006
Energy: 1.1845475212708014
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Energy: 1.305580418248223
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Energy: 1.4168597868146091
Energy: 1.3259062502708998
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Energy: 1.3453520005849067
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Energy: 1.4689188661095116
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Energy: 1.3980261012392805
Energy: 1.4665743569357415
Energy: 1.2080592804493582
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Energy: 1.4689188661077286
Energy: 1.2080592804475752
Energy: 1.200460811659072
Energy: 1.2366230557270455
Energy: 1.2366337147843427
Energy: 1.200460811660855
Energy: 1.236549909581074
Energy: 1.2358770199368592
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Energy: 1.200460811660855
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Energy: 1.3572601705300706
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Energy: 1.2076798047845916
Energy: 1.3417806625576227
Energy: 1.28989942994125
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Energy: 1.3572601705300706
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Energy: 1.2213042693673535
Energy: 1.3415733037675261
Energy: 1.3611738577669206
Energy: 1.1969763136891027
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Energy: 1.3611738577687034
Energy: 1.2213042693655705
Energy: 1.3415733037675261
Energy: 1.3611738577687034
Energy: 1.352947878892377
Energy: 1.3754222292602485
Energy: 1.2071195355454887
Energy: 1.352947878890594
Energy: 1.3754222292602485
Energy: 1.2071195355454887
Energy: 1.352947878892377
Energy: 1.3754222292602485
Energy: 1.2071195355454887
Energy: 1.352947878890594
Energy: 1.3235395043996747
Energy: 1.3847058845289606
Energy: 1.241306373967386
Energy: 1.3235395044014255
Energy: 1.3847058845253946
Energy: 1.241306373967386
Energy: 1.3235395044014255
Energy: 1.3847058845271776
Energy: 1.241306373967386
Energy: 1.3235395044014255
Energy: 1.2778919194475136
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Energy: 1.316212422084625
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Energy: 1.3188816542915298
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Energy: 1.3188816542933128
Energy: 1.3505269448386288
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Energy: 1.3530089878060683
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Energy: 1.3213809727072479
Energy: 1.3530089878042852
Energy: 1.3505269448421948
Energy: 1.3213809727090309
Energy: 1.3530089878060683
Energy: 1.3505269448368458
Energy: 1.32236525826549
Energy: 1.3719346629148748
Energy: 1.3262565984513115
Energy: 1.3223652582637069
Energy: 1.3719346629166576
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Energy: 1.2773008661553764
Energy: 1.3575759371716023
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Energy: 1.2773008661571594
Energy: 1.3575759371716023
Energy: 1.184601025286176
Energy: 1.2773008661589422
Energy: 1.3575759371716023
Energy: 1.184601025286176

minimum gb energy = 1.137434334384743 eV
minimum distance =  2.21515653865155 Angstroms
sigma value = 219


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

Energy: 1.4004017315042314
Energy: 1.7092028218092228
Energy: 1.7091626700240437
Energy: 1.4004017315030515
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Energy: 1.3982776159103545
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Energy: 1.420435434310976
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Energy: 1.695260762964568
Energy: 1.7090703750802674
Energy: 1.3987088999333768
Energy: 1.695260762963388
Energy: 1.7090703750802674
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Energy: 1.695260762964568
Energy: 1.7090703750802674
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Energy: 1.738414670038299
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Energy: 1.6070631988824917
Energy: 1.6810057876007936
Energy: 1.738414670038299
Energy: 1.6070631988836717
Energy: 1.6810057875996136
Energy: 1.738414670038299

minimum gb energy = 1.3882844070138458 eV
minimum distance =  2.26473201044606 Angstroms
sigma value = 15


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

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Energy: 1.864138750654944
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Energy: 1.7115789487361894
Energy: 1.5909309158753213
Energy: 1.7034582361754953
Energy: 1.7583111514415795
Energy: 1.5935928885744504
Energy: 1.5857613311083867
Energy: 1.758311151439443
Energy: 1.5935928885722348
Energy: 1.5857613311105234
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minimum gb energy = 1.5808495186956655 eV
minimum distance =  2.20646409358742 Angstroms
sigma value = 293


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

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Energy: 1.598595990153513
Energy: 1.57709590856834
Energy: 1.5880210428614105
Energy: 1.5985959901508475
Energy: 1.57709590856834
Energy: 1.5880210428614105
Energy: 1.598595990148182
Energy: 1.57709590856834
Energy: 1.678264728383133
Energy: 1.7202843725099977
Energy: 1.6366918948344051
Energy: 1.6623931261086586
Energy: 1.720284372512663
Energy: 1.6366918948290743
Energy: 1.678264728383133
Energy: 1.7202843725099977
Energy: 1.6366918948317397
Energy: 1.662393126103328
Energy: 1.631311586004759
Energy: 1.9402649104809018
Energy: 1.9087681196895478
Energy: 1.6209322304567506
Energy: 1.9402649104782363
Energy: 1.9087681196895478
Energy: 1.631311586004759
Energy: 1.9402649104809018
Energy: 1.9087681196895478
Energy: 1.6209322304567506
Energy: 1.6727033827706386
Energy: 1.6342436726596832
Energy: 1.6863611969203036
Energy: 1.6727033827706386
Energy: 1.6342436726596832
Energy: 1.686361196922969
Energy: 1.6727033827706386
Energy: 1.6342436726596832
Energy: 1.686361196922969
Energy: 1.6727033827706386
Energy: 1.5854340184321047
Energy: 1.6071847252397549
Energy: 1.589764146313115
Energy: 1.5854340184347702
Energy: 1.607080096744706
Energy: 1.589764146313115
Energy: 1.5854340184347702
Energy: 1.6071847252397549
Energy: 1.589764146313115
Energy: 1.5854340184347702
Energy: 1.681989830441777
Energy: 1.5996558287435785
Energy: 1.9283553596259755
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Energy: 1.599732054562761
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Energy: 1.681989830441777
Energy: 1.5996558287435785
Energy: 1.9283553596259755
Energy: 1.681989830441777
Energy: 1.773655926015893
Energy: 1.6057898806982884
Energy: 1.7006484113807514
Energy: 1.773655926015893
Energy: 1.6057898806982884
Energy: 1.7006484113807514
Energy: 1.773655926015893
Energy: 1.6057898806982884
Energy: 1.7006484113807514
Energy: 1.773655926015893
Energy: 1.700979043482862
Energy: 1.7094218723847814
Energy: 1.6584366887402815
Energy: 1.700979043482862
Energy: 1.7094218723821164
Energy: 1.6584115961938366
Energy: 1.700979043482862
Energy: 1.7094218723847814
Energy: 1.6584366887402815
Energy: 1.700979043482862
Energy: 1.6294906887004301
Energy: 1.6002405410356977
Energy: 1.6354934397652192
Energy: 1.6294906887004301
Energy: 1.6002405410356977
Energy: 1.6354934397625538
Energy: 1.6294906887004301
Energy: 1.6002405410356977
Energy: 1.6354934397625538
Energy: 1.6294906887004301
Energy: 1.7059867339483576
Energy: 1.575695199626907
Energy: 1.575390816808888
Energy: 1.7059867339483576
Energy: 1.5756951996242416
Energy: 1.5753908168115531
Energy: 1.7059867339483576
Energy: 1.575695199626907
Energy: 1.5753908168115531
Energy: 1.705986733945692
Energy: 1.6343735163201676
Energy: 1.6611802687903605
Energy: 1.6141357850637439
Energy: 1.6343735163175022
Energy: 1.6611802687930262
Energy: 1.6141357850610787
Energy: 1.6343735163201676
Energy: 1.6611802687903605
Energy: 1.6141357850637439
Energy: 1.6343735163228328
Energy: 1.5708892927116898
Energy: 1.6638173246343486
Energy: 1.7086004491428175
Energy: 1.5708892927196858
Energy: 1.6638173246343486
Energy: 1.7086004491428175
Energy: 1.570889292714355
Energy: 1.6638173246343486
Energy: 1.7086004491401525
Energy: 1.5708892927090246
Energy: 1.7863673878145645
Energy: 1.653881874866296
Energy: 1.5986383394968677
Energy: 1.7863673878172297
Energy: 1.653881874866296
Energy: 1.5985169221871713
Energy: 1.7863673878172297
Energy: 1.653881874866296
Energy: 1.5986383394968677
Energy: 1.7863673878172297
Energy: 1.6800719085392744
Energy: 1.8840359571337888
Energy: 1.6060594897677622
Energy: 1.6800719085418916
Energy: 1.8840359571364542
Energy: 1.6060594897677622
Energy: 1.6800719085392744
Energy: 1.8840359571364542
Energy: 1.6060594897677622
Energy: 1.6800719085392744

minimum gb energy = 1.5708892927090246 eV
minimum distance =  2.20762705676614 Angstroms
sigma value = 293


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

Energy: 1.4839702849988097
Energy: 1.4845962269894575
Energy: 1.4845693641700775
Energy: 1.4839702849988097
Energy: 1.4845962269909028
Energy: 1.4845693641695958
Energy: 1.4839702849988097
Energy: 1.4845962269894575
Energy: 1.4845693641695958
Energy: 1.4839702849988097
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944231353
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944226537
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944226537
Energy: 1.4821839104394192
Energy: 1.4814119313558922
Energy: 1.4816215487204156
Energy: 1.733024745266471
Energy: 1.4814119313558922
Energy: 1.4816215487208975
Energy: 1.7330247449087164
Energy: 1.481411931356374
Energy: 1.4816215487208975
Energy: 1.7330247462117248
Energy: 1.481411931356374
Energy: 1.7329918327612415
Energy: 1.4815231096411445
Energy: 1.4814025527390164
Energy: 1.7329918326004292
Energy: 1.4815231096411445
Energy: 1.4814025527404617
Energy: 1.7329918329625196
Energy: 1.4815231096416264
Energy: 1.4814025527390164
Energy: 1.7329918327116665
Energy: 1.4846648939736549
Energy: 1.4844560197414818
Energy: 1.4819948869929924
Energy: 1.484664893973173
Energy: 1.4844560197419636
Energy: 1.4819948869925108
Energy: 1.484664893973173
Energy: 1.4844560197419636
Energy: 1.4819948869939559
Energy: 1.4846648939726912
Energy: 1.484596226990421
Energy: 1.4845693641700775
Energy: 1.4839702849988097
Energy: 1.4845962269899393
Energy: 1.4845693641695958
Energy: 1.4839702849988097
Energy: 1.484596226990421
Energy: 1.4845693641700775
Energy: 1.4839702849983278
Energy: 1.4845962269889756
Energy: 1.484430192637556
Energy: 1.4847112944231353
Energy: 1.4821839104389374
Energy: 1.4844301926380377
Energy: 1.4847112944231353
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944221719
Energy: 1.4821839104384555
Energy: 1.484430192637556
Energy: 1.4816215487204156
Energy: 1.7330247449558827
Energy: 1.4814119313558922
Energy: 1.481621548719934
Energy: 1.7330247446790155
Energy: 1.4814119313549288
Energy: 1.4816215487204156
Energy: 1.7330247446366664
Energy: 1.4814119313554106
Energy: 1.4816215487204156
Energy: 1.4815231096411445
Energy: 1.4814025527404617
Energy: 1.7329918341441746
Energy: 1.4815231096416264
Energy: 1.4814025527390164
Energy: 1.732991834680128
Energy: 1.4815231096411445
Energy: 1.48140255273998
Energy: 1.732991834616057
Energy: 1.4815231096421082
Energy: 1.4844560197419636
Energy: 1.481994886992029
Energy: 1.4846648939736549
Energy: 1.4844560197414818
Energy: 1.4819948869934743
Energy: 1.4846648939736549
Energy: 1.4844560197419636
Energy: 1.4819948869934743
Energy: 1.484664893973173
Energy: 1.4844560197419636
Energy: 1.484569364169114
Energy: 1.4839702849988097
Energy: 1.4845962269909028
Energy: 1.484569364169114
Energy: 1.4839702849988097
Energy: 1.4845962269889756
Energy: 1.4845693641695958
Energy: 1.4839702849983278
Energy: 1.484596226990421
Energy: 1.4845693641686324
Energy: 1.4847112944226537
Energy: 1.4821839104389374
Energy: 1.484430192637556
Energy: 1.4847112944221719
Energy: 1.4821839104389374
Energy: 1.484430192637556
Energy: 1.4847112944236172
Energy: 1.4821839104389374
Energy: 1.484430192637556
Energy: 1.4847112944226537
Energy: 1.7330247460065928
Energy: 1.4814119313558922
Energy: 1.4816215487204156
Energy: 1.7330247439967021
Energy: 1.4814119313554106
Energy: 1.4816215487204156
Energy: 1.7330247438180655
Energy: 1.481411931356374
Energy: 1.4816215487208975
Energy: 1.733024744357829
Energy: 1.481402552739498
Energy: 1.732991835993691
Energy: 1.4815231096416264
Energy: 1.481402552739498
Energy: 1.7329918365127837
Energy: 1.4815231096421082
Energy: 1.481402552739498
Energy: 1.7329918363659418
Energy: 1.4815231096416264
Energy: 1.4814025527404617
Energy: 1.4819948869934743
Energy: 1.4846648939741365
Energy: 1.4844560197419636
Energy: 1.4819948869929924
Energy: 1.484664893973173
Energy: 1.4844560197414818
Energy: 1.4819948869934743
Energy: 1.4846648939736549
Energy: 1.4844560197419636
Energy: 1.4819948869929924
Energy: 1.4839702849988097
Energy: 1.4845962269894575
Energy: 1.484569364169114
Energy: 1.4839702849983278
Energy: 1.4845962269894575
Energy: 1.484569364169114
Energy: 1.4839702849988097
Energy: 1.4845962269894575
Energy: 1.484569364169114
Energy: 1.4839702849988097
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944236172
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944221719
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.4847112944231353
Energy: 1.4821839104384555
Energy: 1.4814119313554106
Energy: 1.481621548719934
Energy: 1.7330247437087551
Energy: 1.4814119313558922
Energy: 1.4816215487208975
Energy: 1.7330247450030927
Energy: 1.481411931356374
Energy: 1.4816215487204156
Energy: 1.7330247437920518
Energy: 1.4814119313558922
Energy: 1.7329918361174534
Energy: 1.4815231096411445
Energy: 1.4814025527390164
Energy: 1.7329918358502212
Energy: 1.4815231096411445
Energy: 1.4814025527404617
Energy: 1.732991836083294
Energy: 1.4815231096416264
Energy: 1.4814025527390164
Energy: 1.732991836242661
Energy: 1.484664893973173
Energy: 1.4844560197414818
Energy: 1.4819948869929924
Energy: 1.484664893973173
Energy: 1.4844560197419636
Energy: 1.4819948869939559
Energy: 1.4846648939741365
Energy: 1.4844560197414818
Energy: 1.4819948869934743
Energy: 1.484664893973173
Energy: 1.4845962269894575
Energy: 1.484569364169114
Energy: 1.4839702849988097
Energy: 1.4845962269889756
Energy: 1.4845693641695958
Energy: 1.4839702849983278
Energy: 1.484596226990421
Energy: 1.484569364169114
Energy: 1.4839702849988097
Energy: 1.484596226988494
Energy: 1.484430192637556
Energy: 1.4847112944221719
Energy: 1.4821839104389374
Energy: 1.484430192637556
Energy: 1.4847112944221719
Energy: 1.4821839104394192
Energy: 1.484430192637556
Energy: 1.48471129442169
Energy: 1.4821839104389374
Energy: 1.484430192637556

minimum gb energy = 1.4814025527390164 eV
minimum distance =  2.29087561323711 Angstroms
sigma value = 15


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

Energy: 1.5974574526180723
Energy: 1.701433933103098
Energy: 1.653870952878304
Energy: 1.5567266597309728
Energy: 1.7014339413865558
Energy: 1.6538709546659622
Energy: 1.597457452620256
Energy: 1.7014339361894633
Energy: 1.6538709518939307
Energy: 1.5567266597309728
Energy: 1.565983182738938
Energy: 1.6265796721001877
Energy: 1.730434188757481
Energy: 1.5659831827411217
Energy: 1.626579672098004
Energy: 1.7304341887552974
Energy: 1.5659831827411217
Energy: 1.626579672098004
Energy: 1.7304341887552974
Energy: 1.5659831827367543
Energy: 1.7197477131473493
Energy: 1.5814509289978527
Energy: 1.7922657567957447
Energy: 1.719747713149533
Energy: 1.5814509290022203
Energy: 1.7922657567608453
Energy: 1.7197477131517165
Energy: 1.5814509290000367
Energy: 1.792265756765213
Energy: 1.719747713149533
Energy: 1.5391030828266383
Energy: 1.582425464068128
Energy: 1.5399194064613302
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Energy: 1.582425464068128
Energy: 1.5399194064613302
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Energy: 1.7518371909973276
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Energy: 1.6901758148411645
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Energy: 1.6901758148389807
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Energy: 1.5763035307845463
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Energy: 1.7518371910016952
Energy: 1.6257474259737015
Energy: 1.7767272679234312
Energy: 1.5429027872609689
Energy: 1.6257474259758853
Energy: 1.7767272679168802
Energy: 1.5429027872631524
Energy: 1.6257474259737015
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Energy: 1.5824413258213943
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Energy: 1.6157350195919082
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Energy: 1.5828473443337823
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Energy: 1.7836926144301988
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Energy: 1.7836926144323824
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Energy: 1.5828473443337823
Energy: 1.8061404022934098
Energy: 1.5775946547805864
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Energy: 1.557611898685487
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Energy: 1.8061404022955934
Energy: 1.57759465478277
Energy: 1.5769706422764016
Energy: 1.8061404022977774
Energy: 1.5778735975187694
Energy: 1.7206577866645298
Energy: 1.7490357736527213
Energy: 1.5779904828946085
Energy: 1.7206577866645298
Energy: 1.7798228637490923
Energy: 1.5778735975187694
Energy: 1.720657786671081
Energy: 1.7490357736483537
Energy: 1.5779904828924247
Energy: 1.6127853274073796
Energy: 1.5714392994703363
Energy: 1.6528753289763185
Energy: 1.612785327405196
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Energy: 1.6528753289785023
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Energy: 1.5714392994681528
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Energy: 1.6127853274073796
Energy: 1.6674816149848517
Energy: 1.5430128957295348
Energy: 1.7331231705096655
Energy: 1.6674816149870355
Energy: 1.5430065597931883
Energy: 1.7331231705075216
Energy: 1.667481614991403
Energy: 1.5430128957273512
Energy: 1.733123170505338
Energy: 1.667481614989219
Energy: 1.8654894807673783
Energy: 1.5389120505701468
Energy: 1.6936379937226254
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Energy: 1.5389120505679632
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Energy: 1.8654894807695617
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Energy: 1.5478624993813253
Energy: 1.5448622535460523
Energy: 1.9767246816399078
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Energy: 1.9767246816399078
Energy: 1.547862499383509
Energy: 1.5448622535460523
Energy: 1.9767246816420914
Energy: 1.547862499383509
Energy: 1.6734354051450402
Energy: 1.8298936487343205
Energy: 1.5620525626962898
Energy: 1.6734354051450402
Energy: 1.829893648736504
Energy: 1.5620505422671487
Energy: 1.6734354051471843
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Energy: 1.5620525626984734
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Energy: 1.5577787522729976
Energy: 1.7817296012381492
Energy: 1.7220636514536276
Energy: 1.557778752277365
Energy: 1.7817296012359656
Energy: 1.7220636514558114
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Energy: 1.7817296012359656
Energy: 1.722063651457995
Energy: 1.557778752277365
Energy: 1.566980086566173
Energy: 1.7892320585502859
Energy: 1.7436552905173215
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Energy: 1.6262456116262345
Energy: 1.5444988263704627
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Energy: 1.6262456116240507
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Energy: 1.5692243098084173
Energy: 1.7327090184235008
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Energy: 1.7327090184235008
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Energy: 1.6923177484462473
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Energy: 1.6181901494062154
Energy: 1.6923177484462473
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Energy: 1.6181901494040316
Energy: 1.6923177484462473
Energy: 1.6271909296621359
Energy: 1.5780549375045216
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Energy: 1.5780549375067054
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Energy: 1.6271909296643194
Energy: 1.5780549375045216
Energy: 1.7224326027157113
Energy: 1.627190929666503
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Energy: 1.9921492670991563
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Energy: 1.7416496966819446
Energy: 1.9921492670969723
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Energy: 1.7416496966797608
Energy: 1.9921492670969723
Energy: 1.545016728928848
Energy: 1.7416496966841282
Energy: 1.580640086082915
Energy: 1.5823097294027915
Energy: 1.6171176920034422
Energy: 1.5801651154651675
Energy: 1.5827506657136823
Energy: 1.6171176920034422
Energy: 1.5806400860850989
Energy: 1.5823097294049753
Energy: 1.6171176920034422
Energy: 1.5801651154651675
Energy: 1.5459996538599434
Energy: 1.6203320631294829
Energy: 1.5650826108356328
Energy: 1.5459996538599434
Energy: 1.6203320631316667
Energy: 1.5650826108378164
Energy: 1.5459996538577596
Energy: 1.6203320631294829
Energy: 1.5650826108378164
Energy: 1.5459996538577596
Energy: 1.6971051926182006
Energy: 1.6000677233347793
Energy: 1.5990749765134182
Energy: 1.6971051926182006
Energy: 1.6000677233325955
Energy: 1.5990749765112346
Energy: 1.6971051926138332
Energy: 1.600067723330412
Energy: 1.5990749765090508
Energy: 1.6971051926138332
Energy: 1.5781099034403854
Energy: 1.7663386154696428
Energy: 1.6720598999268634
Energy: 1.5780582430925716
Energy: 1.7663386154696428
Energy: 1.6509335046126308
Energy: 1.578109903442569
Energy: 1.7663386154696428
Energy: 1.6720598999312308
Energy: 1.5780582430903878
Energy: 1.6539639340778511
Energy: 1.5708058581018414
Energy: 1.6509755526319494
Energy: 1.6539639340778511
Energy: 1.5708058581018414
Energy: 1.6509755526319494
Energy: 1.6539639340756676
Energy: 1.5708058581018414
Energy: 1.6509755526319494
Energy: 1.6539639340756676
Energy: 1.7326497456050636
Energy: 1.7703556412649986
Energy: 1.7338852308113337
Energy: 1.7326497456072472
Energy: 1.7703556412649986
Energy: 1.73388523080915
Energy: 1.7326497456050636
Energy: 1.7703556412671821
Energy: 1.73388523080915
Energy: 1.7326497456028798
Energy: 1.791590065295405
Energy: 1.5446982352860634
Energy: 1.702853848802271
Energy: 1.848160167846843
Energy: 1.5447156000735227
Energy: 1.702853848804455
Energy: 1.7915900648479446
Energy: 1.5446982352860634
Energy: 1.702853848802271
Energy: 1.8481601678512103
Energy: 1.620243456518636
Energy: 1.5434421622603405
Energy: 1.7049266957732276
Energy: 1.6202434565164525
Energy: 1.543442162262524
Energy: 1.7049266957732276
Energy: 1.6202434565164525
Energy: 1.5434421622647077
Energy: 1.7049266957732276
Energy: 1.6202434565164525
Energy: 1.8085232471876294
Energy: 1.680116445242021
Energy: 1.5598988048893825
Energy: 1.808523247189813
Energy: 1.6801164452398374
Energy: 1.559915379741474
Energy: 1.808523247189813
Energy: 1.680116445242021
Energy: 1.5598988048893825
Energy: 1.808523247189813
Energy: 1.5620414395528721
Energy: 1.7810783268008554
Energy: 1.7056945946618072
Energy: 1.562041439555056
Energy: 1.7810783267964878
Energy: 1.7056945946618072
Energy: 1.562041439555056
Energy: 1.7810783267964878
Energy: 1.7056945946618072
Energy: 1.5620414395528721
Energy: 1.5972952787803822
Energy: 1.6940265822258853
Energy: 1.679160481791095
Energy: 1.556728297904694
Energy: 1.6940265822280691
Energy: 1.679160481788951
Energy: 1.597295278782566
Energy: 1.6940265822258853
Energy: 1.6791604817932786
Energy: 1.5567282979025103
Energy: 1.5968289032470429
Energy: 1.7763387899832024
Energy: 1.7062807078524145
Energy: 1.557420443118543
Energy: 1.776338789985386
Energy: 1.6854621685643796
Energy: 1.5968289032448593
Energy: 1.776338789985386
Energy: 1.706280707848047
Energy: 1.5574204431163594
Energy: 1.5699880095881518
Energy: 1.8720363925304873
Energy: 1.770778857374007
Energy: 1.5699880095925194
Energy: 1.8720363925283035
Energy: 1.770778857374007
Energy: 1.569988009594703
Energy: 1.8720363925261196
Energy: 1.7707788573761907
Energy: 1.5699880095903356
Energy: 1.8311174729926676
Energy: 1.560371164303894
Energy: 1.8219879317351582
Energy: 1.8311174729926676
Energy: 1.560371164303894
Energy: 1.8219879317329746
Energy: 1.8311174729948514
Energy: 1.5603711643017104
Energy: 1.8219879317329746
Energy: 1.8311174729948514
Energy: 1.7371622519076373
Energy: 1.7028882987913523
Energy: 1.5450394179691065
Energy: 1.7371622519076373
Energy: 1.7028882987913523
Energy: 1.5450082090374093
Energy: 1.737162251909821
Energy: 1.7028882987913523
Energy: 1.54503941797129
Energy: 1.7371622519076373
Energy: 1.9330056390927843
Energy: 1.7207094836416865
Energy: 1.5429346529966381
Energy: 1.9330056390949677
Energy: 1.7207094836373191
Energy: 1.5429346529944543
Energy: 1.9330056390949677
Energy: 1.7207094836395027
Energy: 1.5429346529944543
Energy: 1.9330056390971517
Energy: 1.6937938942604518
Energy: 1.6930027254490148
Energy: 1.7116342079789209
Energy: 1.6937938942626358
Energy: 1.6930027254490148
Energy: 1.711634207976737
Energy: 1.6937938942626358
Energy: 1.6930027254446474
Energy: 1.7116342079811044
Energy: 1.6937938942626358
Energy: 1.8089442626894658
Energy: 1.7489245365286887
Energy: 1.5658355570710278
Energy: 1.8089442626894658
Energy: 1.7489245365265051
Energy: 1.5658355570732114
Energy: 1.8089442626850982
Energy: 1.7489245365286887
Energy: 1.5658355570710278
Energy: 1.808944262687282
Energy: 1.5799756800872766
Energy: 1.7326766932845123
Energy: 1.614046984872006
Energy: 1.5799756800872766
Energy: 1.7326766932845123
Energy: 1.6140469848741898
Energy: 1.5799756800894602
Energy: 1.7326766932823288
Energy: 1.6140469848741898
Energy: 1.5799756800894602
Energy: 1.7118787392758477
Energy: 1.5798897081887697
Energy: 1.5808881709062848
Energy: 1.711878739280215
Energy: 1.5595023071750918
Energy: 1.5594842552240444
Energy: 1.7118787392780312
Energy: 1.5798897081844026
Energy: 1.5808881708997338
Energy: 1.7118787392758477
Energy: 1.781457280402332
Energy: 1.556867662645667
Energy: 1.8613455111251591
Energy: 1.781457280402332
Energy: 1.556867662645667
Energy: 1.8613455111251591
Energy: 1.78145728040666
Energy: 1.556867662645667
Energy: 1.8613455111273431
Energy: 1.781457280402332
Energy: 1.5822955243480692
Energy: 1.9740485952145823
Energy: 1.5816160368867764
Energy: 1.582295524350253
Energy: 1.9740485952145823
Energy: 1.5816160368867764
Energy: 1.582295524350253
Energy: 1.974048595212399
Energy: 1.581616036882409
Energy: 1.582295524350253
Energy: 1.6154695743242649
Energy: 1.5443739669661076
Energy: 1.839984529162083
Energy: 1.6154695743220813
Energy: 1.5443673496667871
Energy: 1.839984529162083
Energy: 1.6154695743264487
Energy: 1.54437396696174
Energy: 1.839984529162083
Energy: 1.6154695743242649
Energy: 1.591606289696612
Energy: 1.5546798846842
Energy: 1.711750636493508
Energy: 1.591606289687877
Energy: 1.5546798846842
Energy: 1.711750636500059
Energy: 1.591606289700979
Energy: 1.5546798846820162
Energy: 1.7117506364956916
Energy: 1.5916062897118977
Energy: 1.6623089355425784
Energy: 1.6317617745456343
Energy: 1.562223964602178
Energy: 1.6623089355425784
Energy: 1.6317617745434507
Energy: 1.5622224976595023
Energy: 1.6623089355447624
Energy: 1.6317617745434507
Energy: 1.562223964604362
Energy: 1.6623089355425784
Energy: 1.5654255500947207
Energy: 1.695656403156819
Energy: 1.6922548664006802
Energy: 1.5654255500925371
Energy: 1.695656403156819
Energy: 1.6922548663984962
Energy: 1.5654255500903533
Energy: 1.695656403156819
Energy: 1.6922548664006802
Energy: 1.5654255500903533
Energy: 1.557047618270607
Energy: 1.6966180887112912
Energy: 1.7638004790700637
Energy: 1.557047618270607
Energy: 1.6966180887396394
Energy: 1.7638004790722475
Energy: 1.5570476182684234
Energy: 1.6966180887854971
Energy: 1.7638004790700637
Energy: 1.5570476182727908

minimum gb energy = 1.5389120505679632 eV
minimum distance =  2.21669144901151 Angstroms
sigma value = 437


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

Energy: 1.5310733358616675
Energy: 1.529674558882597
Energy: 1.5294789135615976
Energy: 1.5310733358616675
Energy: 1.5296745588833929
Energy: 1.5294789135608022
Energy: 1.5310733358616675
Energy: 1.5296745588818015
Energy: 1.5294789135615976
Energy: 1.5310733358616675
Energy: 1.6875282233341158
Energy: 1.5010619065047557
Energy: 1.7189055233961859
Energy: 1.6875282233182047
Energy: 1.5010619065055508
Energy: 1.7189055233953907
Energy: 1.6875282233372981
Energy: 1.50106190650396
Energy: 1.7189055233953907
Energy: 1.6875282233325248
Energy: 1.6904999165677328
Energy: 1.485834183760506
Energy: 1.8559170931304942
Energy: 1.6601289802959562
Energy: 1.4858341837613016
Energy: 1.8559051026175697
Energy: 1.6904999165677328
Energy: 1.4858341837597104
Energy: 1.8558863028281196
Energy: 1.6601289802967516
Energy: 1.6185718883315459
Energy: 1.7628236545697566
Energy: 1.624390566815138
Energy: 1.6185718883307503
Energy: 1.76282365456737
Energy: 1.6243905668135468
Energy: 1.6185718883323412
Energy: 1.7628236545681655
Energy: 1.6243905668199112
Energy: 1.6185718883307503
Energy: 1.681011558020962
Energy: 1.5356429246706471
Energy: 1.8709688885971973
Energy: 1.6810115580217573
Energy: 1.5356429246714427
Energy: 1.8709688885430995
Energy: 1.6810115580201663
Energy: 1.5356429246706471
Energy: 1.8709688886202687
Energy: 1.6810115580225529
Energy: 1.700673526556942
Energy: 1.7244431901965451
Energy: 1.5016641630449281
Energy: 1.700673526556942
Energy: 1.7244431901981359
Energy: 1.501664163046519
Energy: 1.700673526556942
Energy: 1.7244431901973405
Energy: 1.5016641630449281
Energy: 1.700673526556942
Energy: 1.6228337583198296
Energy: 1.5613995362539665
Energy: 1.4857969977700054
Energy: 1.6228337583206252
Energy: 1.5613995362539665
Energy: 1.4857969977700054
Energy: 1.622833758319034
Energy: 1.5613995362547624
Energy: 1.485796997770801
Energy: 1.6228337583198296
Energy: 1.617200583057311
Energy: 1.7760199248392445
Energy: 1.6168379245179132
Energy: 1.6172005830565157
Energy: 1.7760199248376531
Energy: 1.6168379245195044
Energy: 1.617200583057311
Energy: 1.7760199248392445
Energy: 1.6168379245171176
Energy: 1.6172005830565157
Energy: 1.8989975037006646
Energy: 1.718592147378922
Energy: 1.5339548087846127
Energy: 1.8989975037014601
Energy: 1.7185921473781265
Energy: 1.533954808785408
Energy: 1.8989975037022555
Energy: 1.718592147378922
Energy: 1.5339548087846127
Energy: 1.8989975037014601
Energy: 1.6190946764011704
Energy: 1.6814325543687723
Energy: 1.7318773837205501
Energy: 1.6190946764019656
Energy: 1.6814325543679767
Energy: 1.731877383721346
Energy: 1.6190946764011704
Energy: 1.6814325543687723
Energy: 1.7318773837221413
Energy: 1.6190946764011704
Energy: 1.6069406607583123
Energy: 1.499995043029988
Energy: 1.5858688497262143
Energy: 1.606940660760699
Energy: 1.4999950430307838
Energy: 1.5858688497262143
Energy: 1.6069406607583123
Energy: 1.499995043029988
Energy: 1.5858688497262143
Energy: 1.6069406607599033
Energy: 1.6809680187093605
Energy: 1.5068837915376208
Energy: 1.6875679794260559
Energy: 1.6809680187117473
Energy: 1.5068837915368252
Energy: 1.6875679794276468
Energy: 1.6809680187133382
Energy: 1.5068837915376208
Energy: 1.6875679794260559
Energy: 1.6809680187117473
Energy: 1.498846311824402
Energy: 1.6290283940300607
Energy: 1.4991262975356776
Energy: 1.4988463118251976
Energy: 1.6290283940300607
Energy: 1.4991262975372688
Energy: 1.4988463118236064
Energy: 1.6290283940300607
Energy: 1.4991262975364732
Energy: 1.4988463118251976
Energy: 1.5223869551467217
Energy: 1.5889939255934746
Energy: 1.6202055528757306
Energy: 1.5223869551475173
Energy: 1.5889939255934746
Energy: 1.6202055528757306
Energy: 1.5223869551467217
Energy: 1.5889939255934746
Energy: 1.620205552874935
Energy: 1.5223869551475173

minimum gb energy = 1.4857969977700054 eV
minimum distance =  2.22417210801531 Angstroms
sigma value = 33