Model name: model_name=EAM_Dynamo_BonnyCastinBullens_2013_FeW__MO_737567242631_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855324625968933
cohesive_energy=4.122759316666129
mass=55.845
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: 0.014457439945989636
Energy: 0.015078823349556373
Energy: 0.01473495336893852
Energy: 2.0441791846583617
Energy: 0.014734953368727882
Energy: 0.015078823350030305
Energy: 0.014457439945989636
Energy: 0.015078823350477909
Energy: 0.01473495336893852
Energy: 1.4282928010910954
Energy: 0.67369370900901
Energy: 0.01553129465856346
Energy: 0.016817935655802696
Energy: 0.6633611607423938
Energy: 0.016817935656250296
Energy: 0.01553129465856346
Energy: 0.67369370900901
Energy: 0.01553129465856346
Energy: 0.016817935656487263
Energy: 0.6633611607423938
Energy: 0.014457439945989636
Energy: 0.015078823349793338
Energy: 0.01473495336893852
Energy: 2.044179184657914
Energy: 0.01473495336941245
Energy: 0.015078823350030305
Energy: 0.01445743994575267
Energy: 0.015078823350240942
Energy: 0.01473495336941245
Energy: 1.4282928010913059
Energy: 0.6736937090092208
Energy: 0.015531294658326492
Energy: 0.01681793565556573
Energy: 0.6633611607403139
Energy: 0.016817935656250296
Energy: 0.015531294658326492
Energy: 0.6736937090092208
Energy: 0.01553129465856346
Energy: 0.016817935656487263
Energy: 0.6633611607400769
Energy: 0.014457439946226601
Energy: 0.015078823349319405
Energy: 0.014734953368727882
Energy: 2.0441791846583617
Energy: 0.014734953368727882
Energy: 0.015078823350030305
Energy: 0.014457439945989636
Energy: 0.015078823350240942
Energy: 0.014734953368727882
Energy: 1.4282928010899367
Energy: 0.6736937090092208
Energy: 0.015531294658326492
Energy: 0.016817935655802696
Energy: 0.6633611607423938
Energy: 0.016817935656250296
Energy: 0.01553129465856346
Energy: 0.6736937090092208
Energy: 0.015531294658326492
Energy: 0.01681793565603966
Energy: 0.6633611607426309
Energy: 0.014457439945989636
Energy: 0.015078823349556373
Energy: 0.014734953368727882
Energy: 2.044179184657914
Energy: 0.014734953369175486
Energy: 0.015078823349793338
Energy: 0.01445743994575267
Energy: 0.015078823350240942
Energy: 0.01473495336941245
Energy: 1.737880485483267

minimum gb energy = 0.01445743994575267 eV
minimum distance =  2.2090983617944 Angstroms
sigma value = 3


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

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Energy: 1.4119352770308042
Energy: 1.4493835728602766
Energy: 1.4504229430609625
Energy: 1.4372917203752529
Energy: 1.3454446987875261
Energy: 1.4961809434415048
Energy: 1.4119352770381826
Energy: 1.4493835728659517
Energy: 1.391079299584458
Energy: 1.3956049705890863
Energy: 1.2890712222872664
Energy: 1.4336095568499754
Energy: 1.544257745926965
Energy: 1.345175950338453
Energy: 1.3051834551637904
Energy: 1.395604970594762
Energy: 1.2890712222889693
Energy: 1.4336095568488405
Energy: 1.5442577459309381
Energy: 1.36624759481594
Energy: 1.3052382377074354
Energy: 1.3050182987493195
Energy: 1.3118908691883038
Energy: 1.4121295814005954
Energy: 1.2692944814202396
Energy: 1.3662475948108324
Energy: 1.2980596138971237
Energy: 1.30501829875386
Energy: 1.3118908691854663
Energy: 1.3611889949514218
Energy: 1.2887857292120493
Energy: 1.2761837381309646
Energy: 1.3166024462923556
Energy: 1.2731406941971457
Energy: 1.3186670980024315
Energy: 1.3611889949576648
Energy: 1.2887857292069416
Energy: 1.2761837381343697
Energy: 1.3166024462968962
Energy: 1.291729526481216
Energy: 1.2886308627794596
Energy: 1.2750883031261677
Energy: 1.280974542106662
Energy: 1.289857622560807
Energy: 1.3616534923130907
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Energy: 1.2886308627851348
Energy: 1.2750883031261677
Energy: 1.2809745421077972
Energy: 1.432660957894098
Energy: 1.32318511323264
Energy: 1.2883482485823476
Energy: 1.2528653348769982
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Energy: 1.3102168627080706
Energy: 1.3848946985267865
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Energy: 1.3465416332556077
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Energy: 1.3465416332516351
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Energy: 1.4003806013854245
Energy: 1.4499744468731712
Energy: 1.3013939621784785
Energy: 1.311717667726787
Energy: 1.3203399787270034
Energy: 1.384115501962154
Energy: 1.400380601382587
Energy: 1.4499744468686309
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Energy: 1.3349120282490192
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Energy: 1.3508380223408105
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Energy: 1.3985227727231222
Energy: 1.4083751525531805
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Energy: 1.475740305061786
Energy: 1.4432215493470888
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Energy: 1.2989800098626971
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Energy: 1.3136748766689244
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Energy: 1.2989800098592916
Energy: 1.2520019301671375
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Energy: 1.3111308186272306
Energy: 1.3429213002840998
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Energy: 1.3982362347479627
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Energy: 1.3111308186277981
Energy: 1.3429213002818297
Energy: 1.3464870008018244
Energy: 1.3982362347468276
Energy: 1.5040326451465986
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Energy: 1.3279143964972075
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Energy: 1.2870360054433232
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Energy: 1.457330452027409
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Energy: 1.4290912965589597
Energy: 1.3534169045526145
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Energy: 1.4290912965589597
Energy: 1.3534169045514794
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Energy: 1.311641709979062
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Energy: 1.3844432804819802
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Energy: 1.3116074864198213
Energy: 1.3116417099739544
Energy: 1.4374241789656657
Energy: 1.2623109451918144
Energy: 1.3115601833878996
Energy: 1.4120760655630422
Energy: 1.2841474113088072
Energy: 1.2842237524862004
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Energy: 1.313235390877144
Energy: 1.3115601833833592
Energy: 1.4120760655573668
Energy: 1.2841474113099423
Energy: 1.2842237524833626
Energy: 1.258927676011439
Energy: 1.2883527295420312
Energy: 1.3811052572692395
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Energy: 1.307899310479074
Energy: 1.30275464850775
Energy: 1.258927676008653
Energy: 1.2883527295374906
Energy: 1.3811052572715097
Energy: 1.438854269674826
Energy: 1.2815371128838258
Energy: 1.2748617456305422
Energy: 1.2876096369585923
Energy: 1.2917599056367248
Energy: 1.365039097392204
Energy: 1.3739563300406656
Energy: 1.2815371128770154
Energy: 1.2748617456254345
Energy: 1.2876096369557544
Energy: 1.2917599056401299
Energy: 1.3031550938970604
Energy: 1.285328507645392
Energy: 1.2714732637233075
Energy: 1.4684961201606022
Energy: 1.3089300332189
Energy: 1.2741355288295546
Energy: 1.303155093895358
Energy: 1.2853285076459597
Energy: 1.2714732637204698
Energy: 1.4684961201611695
Energy: 1.3084884448194312
Energy: 1.3041851671862972
Energy: 1.3338408051081947
Energy: 1.3658313915187146
Energy: 1.4081002951217247
Energy: 1.4338206877671746
Energy: 1.3084884448182958
Energy: 1.3041851671936755
Energy: 1.3338408051116002
Energy: 1.3658313915192821
Energy: 1.3860360405394971
Energy: 1.4284245484699223
Energy: 1.327895505880526
Energy: 1.4398244875192119
Energy: 1.2994863545973896
Energy: 1.331797495196148
Energy: 1.3860360405377943
Energy: 1.4284245484648141
Energy: 1.3278955058810935
Energy: 1.4398244875186446
Energy: 1.389792394034265
Energy: 1.4386508903710828
Energy: 1.3474982703259328
Energy: 1.4662152977163483
Energy: 1.3453251325634747
Energy: 1.4493835728517632
Energy: 1.3897923940388055
Energy: 1.4386508903705155
Energy: 1.3474982703327436
Energy: 1.4662152977163483
Energy: 1.5442577459218574
Energy: 1.3451759503401557
Energy: 1.3051834551688983
Energy: 1.395604970594762
Energy: 1.2890712222866991
Energy: 1.4336095568477054
Energy: 1.5442577459281002
Energy: 1.3451759503395881
Energy: 1.3051834551677632
Energy: 1.3956049705941942
Energy: 1.3084884448086993
Energy: 1.4121295814040005
Energy: 1.2692944814213742
Energy: 1.3662475948085622
Energy: 1.299836151800999
Energy: 1.3050182987555627
Energy: 1.3084884448131882
Energy: 1.41212958139719
Energy: 1.2692944814185367
Energy: 1.3662475948096973
Energy: 1.3166024462997334
Energy: 1.2731406941909027
Energy: 1.3186395122968333
Energy: 1.3611889949593674
Energy: 1.2887857292058063
Energy: 1.2761837381281784
Energy: 1.3166024462912205
Energy: 1.273140694195443
Energy: 1.3186395122991035
Energy: 1.3611889949565295

minimum gb energy = 1.2520019301671375 eV
minimum distance =  2.21926536470483 Angstroms
sigma value = 75


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

Energy: 1.6220963444537857
Energy: 1.423756073472843
Energy: 1.4388254906627311
Energy: 1.5019061600893728
Energy: 1.4361300098184906
Energy: 1.559026028766512
Energy: 1.6220963444548933
Energy: 1.4237560734736738
Energy: 1.4388254906688236
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Energy: 1.4082236648607955
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Energy: 1.3844038885546022
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minimum gb energy = 1.3229219319400503 eV
minimum distance =  2.20984796882873 Angstroms
sigma value = 105


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

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Energy: 1.4475694211817667
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Energy: 1.4365951667319754
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Energy: 1.3885211643431639
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Energy: 1.3017434937955028
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Energy: 1.3428672996546867
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Energy: 1.3428672996537496
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Energy: 1.4751523908051447
Energy: 1.2934081531514792
Energy: 1.3885998833807534
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Energy: 1.3901156232341343
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Energy: 1.3802426076894627
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Energy: 1.4031500230693785
Energy: 1.3340283018094532
Energy: 1.3195193335593678
Energy: 1.4168442868623896
Energy: 1.4163127032758045
Energy: 1.3151596414123334
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Energy: 1.3340283018097656
Energy: 1.3195193335606177
Energy: 1.41684428686114
Energy: 1.4236137469906105
Energy: 1.3200249947854437
Energy: 1.3338221117629967
Energy: 1.4790958713344389
Energy: 1.3158863602015054
Energy: 1.3682461159401236
Energy: 1.4540169680611432
Energy: 1.320024994784819
Energy: 1.3338221117642466
Energy: 1.4790958713344389
Energy: 1.3158863602027553
Energy: 1.4987353360526587
Energy: 1.3792495242840044
Energy: 1.3401618996175337
Energy: 1.3505647189203764
Energy: 1.4148326957757524
Energy: 1.3536467068443478
Energy: 1.4987353360532836
Energy: 1.3792495242967857
Energy: 1.3401618996159717
Energy: 1.3505647189197516
Energy: 1.4475745821708739
Energy: 1.3793568044516762
Energy: 1.4976497267165365
Energy: 1.4467935894298092
Energy: 1.3385110524684283
Energy: 1.4519708514997676
Energy: 1.4475745821705617
Energy: 1.3793568044501139
Energy: 1.4976497267168487
Energy: 1.4467935894291843
Energy: 1.4080353417764109
Energy: 1.3536195377570472
Energy: 1.417925550570277
Energy: 1.3968207868680202
Energy: 1.4269510870831381
Energy: 1.3870276181718673
Energy: 1.4080353417760985
Energy: 1.35361953775611
Energy: 1.4179255505674653
Energy: 1.3968207868680202
Energy: 1.3273975192093386
Energy: 1.3533192320845087
Energy: 1.4057434533187216
Energy: 1.3162124208503194
Energy: 1.490773325311927
Energy: 1.3173976372722696
Energy: 1.3273975192087137
Energy: 1.3533192320845087
Energy: 1.4057434533187216
Energy: 1.3162124208506318
Energy: 1.3203325959747472
Energy: 1.4001244877816956
Energy: 1.3585687031896774
Energy: 1.3680150386832466
Energy: 1.3305009106111998
Energy: 1.3204604047000665
Energy: 1.320332595974435
Energy: 1.4001244877820083
Energy: 1.3585687031884277
Energy: 1.368015038682622
Energy: 1.5349242268591266
Energy: 1.3797023952852836
Energy: 1.3585480123035119
Energy: 1.3998316995480056
Energy: 1.38023060367602
Energy: 1.476806736912835
Energy: 1.5349242268600638
Energy: 1.3797023952849712
Energy: 1.358548012304137
Energy: 1.399831699548943

minimum gb energy = 1.2934081531514792 eV
minimum distance =  2.23065140866345 Angstroms
sigma value = 165


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

Energy: 1.3635536868300833
Energy: 1.600584447730894
Energy: 1.3205748745473487
Energy: 1.5728344818212263
Energy: 1.3204411930997264
Energy: 1.6005656239485275
Energy: 1.3635536868300833
Energy: 1.600584447730894
Energy: 1.3205748745484212
Energy: 1.3954125703388691
Energy: 1.3172665583574845
Energy: 1.324728258946777
Energy: 1.3245414362711214
Energy: 1.3695681557782389
Energy: 1.2385697471016712
Energy: 1.2588113520890452
Energy: 1.3172665583585568
Energy: 1.3247282589457046
Energy: 1.3245414362711214
Energy: 1.3695681557793113
Energy: 1.2619898944281198
Energy: 1.4532047183124075
Energy: 1.3532013760691295
Energy: 1.2596496226097862
Energy: 1.3369908932370271
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Energy: 1.261989894429192
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Energy: 1.2596496226108589
Energy: 1.2963347473713043
Energy: 1.336529305267848
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Energy: 1.288958754444809
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Energy: 1.2590371435783894
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Energy: 1.3683645490215044
Energy: 1.3251199832683414
Energy: 1.318862601632663
Energy: 1.309085889686463
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Energy: 1.2578051262365517
Energy: 1.562587042488224
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Energy: 1.562587042488224
Energy: 1.3466376639890716
Energy: 1.2579138826208331
Energy: 1.2823979140384636
Energy: 1.2614194378366508
Energy: 1.2423956872271869
Energy: 1.303340732405588
Energy: 1.319424786203809
Energy: 1.3202236506471525
Energy: 1.2823979140395363
Energy: 1.2614194378366508
Energy: 1.2423956872271869
Energy: 1.303340732405588
Energy: 1.3602979018032604
Energy: 1.3094018832000547
Energy: 1.3185122183722002
Energy: 1.3244125038689254
Energy: 1.3392350027893396
Energy: 1.5996632589795532
Energy: 1.3602979018022123
Energy: 1.309401883215071
Energy: 1.3185122183722002
Energy: 1.3244125038689254
Energy: 1.358079996609775
Energy: 1.2900101216102686
Energy: 1.3437785740329444
Energy: 1.4528965339780735
Energy: 1.3352228627504505
Energy: 1.2602510311372643
Energy: 1.3580799966087023
Energy: 1.2900101215577615
Energy: 1.3437785740318717
Energy: 1.452896533977001
Energy: 1.257645446928373
Energy: 1.3945057044854219
Energy: 1.336664103032052
Energy: 1.2967229189831118
Energy: 1.2385647835039393
Energy: 1.2581564828783929
Energy: 1.2576454469273004
Energy: 1.3945057044843494
Energy: 1.3366641030309792
Energy: 1.2967229189841842
Energy: 1.259161113147787
Energy: 1.3532013760659118
Energy: 1.4532750144083544
Energy: 1.2619965585427435
Energy: 1.38695681344383
Energy: 1.3338400094517036
Energy: 1.2591611131510048
Energy: 1.3532013760669843
Energy: 1.4532750144083544
Energy: 1.2619965585427435
Energy: 1.3686587252778262
Energy: 1.3245312871298214
Energy: 1.3266036715404415
Energy: 1.317368688959633
Energy: 1.2587430446584755
Energy: 1.2385091379470603
Energy: 1.3686587252778262
Energy: 1.324531287128749
Energy: 1.3266036711802545
Energy: 1.3173686889607052
Energy: 1.5728344818255167
Energy: 1.320441193098654
Energy: 1.6005656239496004
Energy: 1.3635536868333007
Energy: 1.600584447731942
Energy: 1.3205748745516388
Energy: 1.5728344818255167
Energy: 1.320441193098654
Energy: 1.6005656239496004
Energy: 1.3635536868343734

minimum gb energy = 1.2385091379470603 eV
minimum distance =  2.21336720603771 Angstroms
sigma value = 41


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

Energy: 1.504904818947253
Energy: 1.2390171900433766
Energy: 1.2144797156671399
Energy: 1.6231980154139316
Energy: 1.2153742293764538
Energy: 1.3518509053448444
Energy: 1.5049048189493337
Energy: 1.2390171900471219
Energy: 1.214479715665059
Energy: 1.238998614052758
Energy: 1.3525447447557148
Energy: 1.2928093866117336
Energy: 1.2149719367772638
Energy: 1.3736742763468266
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Energy: 1.1993696721132598
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Energy: 1.2015496024184489
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Energy: 1.3158973880429814
Energy: 1.1993696721120113
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Energy: 1.201549602416368
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Energy: 1.4171971507888703
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Energy: 1.3996972612971006
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Energy: 1.2215043828822636
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Energy: 1.2162852406078015
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Energy: 1.2090632266244938
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Energy: 1.316840830366551
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Energy: 1.4616982040369049
Energy: 1.2151186358049795
Energy: 1.280673271178272
Energy: 1.3385550910631447
Energy: 1.3054805974443053
Energy: 1.354087247226479
Energy: 1.461698204036489
Energy: 1.2151186358049795
Energy: 1.280673271178272
Energy: 1.1474722182369599
Energy: 1.2885368883312693
Energy: 1.2217298619274015
Energy: 1.3721147756548009
Energy: 1.2090430987019856
Energy: 1.1987464919382866
Energy: 1.1474722182382084
Energy: 1.2885368883321016
Energy: 1.2217298619274015
Energy: 1.3721147756556331
Energy: 1.1966515895054433
Energy: 1.197506284534128
Energy: 1.2515307850609219
Energy: 1.2021883841995824
Energy: 1.2010710444144925
Energy: 1.3132882686325547
Energy: 1.1966515895062757
Energy: 1.197506284534128
Energy: 1.2515307850621702
Energy: 1.2021883841991663
Energy: 1.2950453047974066
Energy: 1.2950750410357035
Energy: 1.2409460816901459
Energy: 1.1920338020872987
Energy: 1.357357911709
Energy: 1.216653241018641
Energy: 1.295045304739146
Energy: 1.2950750410373681
Energy: 1.2409460816843196
Energy: 1.1920338018527057
Energy: 1.386801587964098
Energy: 1.3109082159841383
Energy: 1.2435413369417714
Energy: 1.221335726679808
Energy: 1.2809686374582725
Energy: 1.21375172056865
Energy: 1.3868015879607691
Energy: 1.310908216013269
Energy: 1.2435413407852611
Energy: 1.2213357266806404
Energy: 1.1985915569501024
Energy: 1.3225270104214688
Energy: 1.2968675678385804
Energy: 1.2862657800691037
Energy: 1.3728705320980084
Energy: 1.209371637029855
Energy: 1.1985915569501024
Energy: 1.3225270104227171
Energy: 1.2968675678181893
Energy: 1.286265780070352
Energy: 1.3614145535493323
Energy: 1.1983411480902895
Energy: 1.1977023371781548
Energy: 1.361414553550959
Energy: 1.2032361979312833
Energy: 1.2009870297771283
Energy: 1.3614145535489162
Energy: 1.1983411480915378
Energy: 1.1977023371777387
Energy: 1.3614145535517914
Energy: 1.2158713328440456
Energy: 1.2857461261604421
Energy: 1.2949062784964311
Energy: 1.199707135053021
Energy: 1.2119736915502144
Energy: 1.436262416768731
Energy: 1.2158713328432136
Energy: 1.2857461266841432
Energy: 1.2949062784947667
Energy: 1.199707135053021
Energy: 1.2248349034366457
Energy: 1.4377478868241875
Energy: 1.3143664579917436
Energy: 1.2470198309125509
Energy: 1.2249496958877253
Energy: 1.2916345538815048
Energy: 1.2248349034374781
Energy: 1.437747886823355
Energy: 1.314366457973433
Energy: 1.2470198309129672
Energy: 1.2143470393703
Energy: 1.240946081695972
Energy: 1.2954185175446478
Energy: 1.2461320114973902
Energy: 1.2159105296088257
Energy: 1.3578064107782486
Energy: 1.2143470393715485
Energy: 1.2409460816943074
Energy: 1.2954185175442314
Energy: 1.2461320115044645
Energy: 1.2023856235948969
Energy: 1.2515307850571764
Energy: 1.2120082412312363
Energy: 1.1967725077338183
Energy: 1.3132882686300575
Energy: 1.2023607934063005
Energy: 1.2023856235957289
Energy: 1.2515307850613382
Energy: 1.2120082412316524
Energy: 1.1967725077346505
Energy: 1.3682047308735417
Energy: 1.225062367731657
Energy: 1.1975619341446428
Energy: 1.171607928350724
Energy: 1.1990171490088064
Energy: 1.209502505000382
Energy: 1.3682047308747902
Energy: 1.225062367731241
Energy: 1.1975619341483879
Energy: 1.171607928350724
Energy: 1.1975513956916393
Energy: 1.2164711306837703
Energy: 1.2083869104027842
Energy: 1.3539368457741383
Energy: 1.2408432675309302
Energy: 1.36627564411232
Energy: 1.1975513956845647
Energy: 1.2164711306816895
Energy: 1.208386910241395
Energy: 1.3539368457782999
Energy: 1.1975074455856545
Energy: 1.2172896818287973
Energy: 1.367139335099826
Energy: 1.3749605158970737
Energy: 1.2956889854197162
Energy: 1.2156703033967753
Energy: 1.1975074455852384
Energy: 1.2172896818283812
Energy: 1.3671393351010743
Energy: 1.3749605158970737

minimum gb energy = 1.1474722182369599 eV
minimum distance =  2.24525619169007 Angstroms
sigma value = 185


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

Energy: 1.3745330614174818
Energy: 1.137115466983949
Energy: 1.3935924103129262
Energy: 1.5420179929511946
Energy: 1.3937025155773404
Energy: 1.2142227435481832
Energy: 1.374533061416988
Energy: 1.137115466979503
Energy: 1.393592410312432
Energy: 1.3134149486112197
Energy: 1.419991962407304
Energy: 1.1385920777238863
Energy: 1.1144045517467227
Energy: 1.1361855377579033
Energy: 1.135892358034991
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Energy: 1.1361855377579033
Energy: 1.7094380238770082
Energy: 1.1359194318104806
Energy: 1.4537379112808617
Energy: 1.392991107109551
Energy: 1.1373756961321544
Energy: 1.1364783456016356
Energy: 1.7094380238765141
Energy: 1.1359194318099866
Energy: 1.4537379112808617
Energy: 1.392991107109057
Energy: 1.4725545533081905
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Energy: 1.1363337714813995
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Energy: 1.1150532088614722
Energy: 1.6871896731640577
Energy: 1.1144803802364447
Energy: 1.1378378352307112
Energy: 1.4214927712498497
Energy: 1.4250326407376108
Energy: 1.3706555245103935
Energy: 1.6871896731660336
Energy: 1.1144803802378818
Energy: 1.1378378352312053
Energy: 1.4214927712468857
Energy: 1.13863967087114
Energy: 1.3045252349561558
Energy: 1.2692540184895158
Energy: 1.1364680122845985
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Energy: 1.281194416595544
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Energy: 1.1364680122850923
Energy: 1.1364600418354147
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Energy: 1.2803750717994986
Energy: 1.1361332597080056
Energy: 1.1364600418349207
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Energy: 1.3156019926169034
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Energy: 1.1145025516860396
Energy: 1.6874162587314734
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Energy: 1.4706025740560615
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Energy: 1.136055156768954
Energy: 1.1374510600480854
Energy: 1.4706025740570496
Energy: 1.3926215030234241
Energy: 1.4537379112848137
Energy: 1.13590327812291
Energy: 1.7091656333126841
Energy: 1.1361319908986762
Energy: 1.1373279417800748
Energy: 1.3926215030229299
Energy: 1.4537379112858013
Energy: 1.13590327812291
Energy: 1.70916563331219
Energy: 1.136183758544278
Energy: 1.1143797189748077
Energy: 1.138319406018085
Energy: 1.419735280252704
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Energy: 1.135918779815789
Energy: 1.136183758542796
Energy: 1.1143797189748077
Energy: 1.1383194060175912
Energy: 1.4197352802541858
Energy: 1.5977342608775393
Energy: 1.3937025155753644
Energy: 1.1842682185970907
Energy: 1.3745330614164937
Energy: 1.137115466982961
Energy: 1.393592410312432
Energy: 1.4913400914010253
Energy: 1.3937025155753644
Energy: 1.1152355722962028
Energy: 1.3745330614174818
Energy: 1.1361855377583974
Energy: 1.135892358035485
Energy: 1.235534614644783
Energy: 1.4199919624092803
Energy: 1.1385920777248741
Energy: 1.1144045517467227
Energy: 1.1361855377574095
Energy: 1.1358923580340028
Energy: 1.235534614645277
Energy: 1.419991962408786
Energy: 1.392991107110539
Energy: 1.1373756961326484
Energy: 1.1364783456016356
Energy: 1.7094380238779963
Energy: 1.1359194318104806
Energy: 1.4537379112798736
Energy: 1.392991107108563
Energy: 1.1373756961316606
Energy: 1.1364783455991656
Energy: 1.7094380238779963
Energy: 1.1150532088604843
Energy: 1.1151042090733043
Energy: 1.1149176696796408
Energy: 1.4725545533076967
Energy: 1.1371489930791168
Energy: 1.1363337714813995
Energy: 1.1150532088604843
Energy: 1.1151042090708345
Energy: 1.1149176696910024
Energy: 1.4725545533067086
Energy: 1.4214927712454037
Energy: 1.4250326407351408
Energy: 1.3706555245113816
Energy: 1.6871896731665275
Energy: 1.1144803802369387
Energy: 1.1378378352312053
Energy: 1.4214927712503438
Energy: 1.425032640736129
Energy: 1.3706555245133576
Energy: 1.6871896731625757
Energy: 1.1364680122831163
Energy: 1.1360002523831019
Energy: 1.281194416593568
Energy: 1.138639670872128
Energy: 1.3045252349556617
Energy: 1.2473432267759663
Energy: 1.1364680122831163
Energy: 1.1360002523821138
Energy: 1.281194416596532
Energy: 1.1386396708726219
Energy: 1.139155050362166
Energy: 1.2803750717985107
Energy: 1.1361332597084997
Energy: 1.1364600418344266
Energy: 1.2352869281868815
Energy: 1.3048845551148383
Energy: 1.259253238769384
Energy: 1.2803750717975226
Energy: 1.1361332597109695
Energy: 1.1364600418349207
Energy: 1.6874162587324615
Energy: 1.370875906237856
Energy: 1.4275906827968903
Energy: 1.4219138071725714
Energy: 1.1378826574949679
Energy: 1.1145025516865337
Energy: 1.6874162587319674
Energy: 1.3708759062368683
Energy: 1.42759068279936
Energy: 1.4219138071710893
Energy: 1.4706025740560615
Energy: 1.114062960868299
Energy: 1.1152195142731829
Energy: 1.115042088953128
Energy: 1.1360551567694481
Energy: 1.1374510600485794
Energy: 1.4706025740560615
Energy: 1.114062960873239
Energy: 1.1152195142751589
Energy: 1.1150420889526338
Energy: 1.7091656333116962
Energy: 1.1361319908981824
Energy: 1.1373279417805688
Energy: 1.3926215030244118
Energy: 1.4537379112862956
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Energy: 1.7091656333116962
Energy: 1.1361319908991703
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Energy: 1.392621503023918
Energy: 1.4197352802536916
Energy: 1.235534614642313
Energy: 1.135918779815295
Energy: 1.136183758543784
Energy: 1.1143797189733258
Energy: 1.138319406018579
Energy: 1.4197352802556678
Energy: 1.2355346146418187
Energy: 1.1359187798143071
Energy: 1.1361837585447723
Energy: 1.3745330614164937
Energy: 1.137115466979997
Energy: 1.393592410312432
Energy: 1.5977342608765512
Energy: 1.3937025155758584
Energy: 1.2142227435462074
Energy: 1.3745330614174818
Energy: 1.137115466980985
Energy: 1.3935924103129262
Energy: 1.5420179929452669
Energy: 1.419991962407304
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Energy: 1.1144045517457346
Energy: 1.1361855377583974
Energy: 1.1358923580340028
Energy: 1.2355346146433008
Energy: 1.419991962408786
Energy: 1.1385920777248741
Energy: 1.1144045517467227
Energy: 1.1361855377579033
Energy: 1.7094380238765141
Energy: 1.1359194318099866
Energy: 1.4537379112803674
Energy: 1.392991107109057
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Energy: 1.1364783456006475
Energy: 1.7094380238770082
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Energy: 1.392991107111527
Energy: 1.4725545533076967
Energy: 1.1371489930805987
Energy: 1.1363337714813995
Energy: 1.1150532088614722
Energy: 1.1151042090718224
Energy: 1.1149176696860625
Energy: 1.4725545533081905
Energy: 1.1371489930801046
Energy: 1.1363337714813995
Energy: 1.1150532088624603
Energy: 1.6871896731660336
Energy: 1.1144803802378818
Energy: 1.1378378352312053
Energy: 1.4214927712498497
Energy: 1.4250326407376108
Energy: 1.3706555245133576
Energy: 1.6871896731630698
Energy: 1.1144803802378818
Energy: 1.1378378352312053
Energy: 1.4214927712473797
Energy: 1.138639670872128
Energy: 1.3045252349551677
Energy: 1.2692540184905037
Energy: 1.1364680122850923
Energy: 1.1360002523850776
Energy: 1.2811944166054237
Energy: 1.138639670870646
Energy: 1.3045252349596137
Energy: 1.1767480356160558
Energy: 1.1364680122850923
Energy: 1.1364600418349207
Energy: 1.2352869281893513
Energy: 1.304884555119284
Energy: 1.13915505036019
Energy: 1.2803750717970288
Energy: 1.1361332597134393
Energy: 1.1364600418354147
Energy: 1.2352869281908332
Energy: 1.304884555112862
Energy: 1.250467096037216
Energy: 1.4219138071720774
Energy: 1.137882657495462
Energy: 1.1145025516850517
Energy: 1.6874162587324615
Energy: 1.370875906236374
Energy: 1.4275906827978782
Energy: 1.4219138071735595
Energy: 1.137882657497932
Energy: 1.1145025516855458
Energy: 1.6874162587319674
Energy: 1.115042088953622
Energy: 1.136055156768954
Energy: 1.1374510600480854
Energy: 1.4706025740570496
Energy: 1.114062960870769
Energy: 1.115219514275653
Energy: 1.115042088953622
Energy: 1.1360551567694481
Energy: 1.1374510600490735
Energy: 1.4706025740595194
Energy: 1.3926215030234241
Energy: 1.4537379112848137
Energy: 1.13590327812291
Energy: 1.70916563331219
Energy: 1.1361319908981824
Energy: 1.1373279417805688
Energy: 1.3926215030234241
Energy: 1.4537379112848137
Energy: 1.135903278122416
Energy: 1.7091656333126841
Energy: 1.13618375854329
Energy: 1.1143797189733258
Energy: 1.1383194060175912
Energy: 1.4197352802546797
Energy: 1.235534614644289
Energy: 1.135918779816283
Energy: 1.136183758543784
Energy: 1.1143797189743136
Energy: 1.138319406018579
Energy: 1.4197352802546797

minimum gb energy = 1.114062960868299 eV
minimum distance =  2.18334469374211 Angstroms
sigma value = 33


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

Energy: 1.3870479856829325
Energy: 1.4421644583091453
Energy: 1.384886564437168
Energy: 1.4294640568131656
Energy: 1.3844705328458433
Energy: 1.4587241935463053
Energy: 1.3870479856804918
Energy: 1.4421644583064335
Energy: 1.3848865644398798
Energy: 1.590128436403986
Energy: 1.494661170323581
Energy: 1.3700001828781039
Energy: 1.2011783208938938
Energy: 1.2989678226032522
Energy: 1.22813544053559
Energy: 1.2684967443502089
Energy: 1.4946611703262926
Energy: 1.3700001828764767
Energy: 1.2011783210294125
Energy: 1.2989678226027097
Energy: 1.3938951225655682
Energy: 1.2074313136605284
Energy: 1.4301194516254756
Energy: 1.5245214740078665
Energy: 1.2325780506674475
Energy: 1.2705696758083103
Energy: 1.393895122560687
Energy: 1.2074313136578412
Energy: 1.430119451627916
Energy: 1.524521474009469
Energy: 1.3145021667222534
Energy: 1.2045440719716756
Energy: 1.28596872428314
Energy: 1.3659062173754402
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Energy: 1.4568270874114972
Energy: 1.314502166727677
Energy: 1.204544071970862
Energy: 1.2859687242809708
Energy: 1.3659062173724572
Energy: 1.2866880526905926
Energy: 1.2074656727913482
Energy: 1.331173403448252
Energy: 1.4566793111266383
Energy: 1.3830918904699845
Energy: 1.3628431129753278
Energy: 1.2866880526862534
Energy: 1.207465672799755
Energy: 1.331173403441201
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Energy: 1.5348995275188473
Energy: 1.2040130534630238
Energy: 1.334833828423984
Energy: 1.2712897570323438
Energy: 1.2324840616671076
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Energy: 1.2712897570318014
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Energy: 1.3842242963297544
Energy: 1.4349530348928807
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Energy: 1.2698438530581042
Energy: 1.4937008042525604
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Energy: 1.1989876224663583
Energy: 1.2994692780798
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Energy: 1.4937008042482212
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Energy: 1.232641644135067
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Energy: 1.395965221632951
Energy: 1.2035254277867864
Energy: 1.4224928494728268
Energy: 1.5257879450491503
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Energy: 1.4700430435171423
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Energy: 1.3996293984123864
Energy: 1.2044806719131764
Energy: 1.3827673384874453
Energy: 1.3627812368235637
Energy: 1.2868955245488323
Energy: 1.2037571531589089
Energy: 1.3184058299321562
Energy: 1.458119113794857
Energy: 1.3827673384860892
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Energy: 1.2868955245450358
Energy: 1.2037571531613493
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Energy: 1.3720800439079195
Energy: 1.5238588005197786
Energy: 1.2043482052407477
Energy: 1.2946959623930048
Energy: 1.271223271966798
Energy: 1.2335888353525655
Energy: 1.3720800439092757
Energy: 1.5238588005216769
Energy: 1.2043482052391208
Energy: 1.2323151412598414
Energy: 1.3001636999198958
Energy: 1.3755612459976014
Energy: 1.3006244466160393
Energy: 1.4938954087366538
Energy: 1.2713961900373514
Energy: 1.23231514125957
Energy: 1.3001636999196244
Energy: 1.3755612460024826
Energy: 1.3006244466122427
Energy: 1.2311534619851574
Energy: 1.2987452337409673
Energy: 1.3847643622829378
Energy: 1.4337089361875779
Energy: 1.3552549972646166
Energy: 1.4740914931564897
Energy: 1.2311534619783777
Energy: 1.2987452337436791
Energy: 1.3847643622826664
Energy: 1.4337089361894761
Energy: 1.199480513546159
Energy: 1.299450695249127
Energy: 1.228001102230278
Energy: 1.270163563714006
Energy: 1.377454050094666
Energy: 1.4046312929868132
Energy: 1.1994805135439894
Energy: 1.299450695250483
Energy: 1.2280011022278372
Energy: 1.2701635637159043
Energy: 1.2832097228404755
Energy: 1.4580888110481
Energy: 1.23198446178971
Energy: 1.2712740730757837
Energy: 1.2599072833008078
Energy: 1.2033259036109907
Energy: 1.2832097228421027
Energy: 1.4580888110459307
Energy: 1.2319844617899813
Energy: 1.2712740730763257
Energy: 1.2864128571321154
Energy: 1.3637968282000772
Energy: 1.4697611742601355
Energy: 1.2321220167885196
Energy: 1.3908271043767586
Energy: 1.2077113320121515
Energy: 1.2864128571307598
Energy: 1.3637968281954669
Energy: 1.4697611742595933
Energy: 1.232122016793401
Energy: 1.2243644294000093
Energy: 1.4721570975786782
Energy: 1.3646095149880424
Energy: 1.3637050784286353
Energy: 1.3626703194902485
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Energy: 1.2199554305619866
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Energy: 1.2312528944892507
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Energy: 1.276617982896653
Energy: 1.334473054031493
Energy: 1.2705567792600425
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Energy: 1.2766179829012385
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Energy: 1.5280447567039734
Energy: 1.2862337194738092
Energy: 1.3626266700351926
Energy: 1.4690068072003235
Energy: 1.362404809250819

minimum gb energy = 1.1989876224663583 eV
minimum distance =  2.19394937541214 Angstroms
sigma value = 219


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

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Energy: 1.1865509102238072
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Energy: 1.221333153055609
Energy: 1.1865509102234402
Energy: 1.2104190956801304
Energy: 1.1868009946790765
Energy: 1.3029035209168962

minimum gb energy = 1.1827355679139382 eV
minimum distance =  2.22745363247453 Angstroms
sigma value = 15


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

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minimum gb energy = 1.3041867430478749 eV
minimum distance =  2.22386337108479 Angstroms
sigma value = 293


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

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Energy: 1.313573747613407
Energy: 1.4202634569152368
Energy: 1.3884176205118768
Energy: 1.3568896131490216
Energy: 1.517940246311344
Energy: 1.4327297812177024
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Energy: 1.432945362857252
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Energy: 1.3748096372331553
Energy: 1.5815829925889462
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Energy: 1.5062301693382707
Energy: 1.3757840456038994
Energy: 1.357081822299375
Energy: 1.3884189402886917
Energy: 1.4207932147668318
Energy: 1.313804050384486
Energy: 1.506230169338676
Energy: 1.3757840456038994
Energy: 1.3570818223005912
Energy: 1.439765901039286
Energy: 1.3957293075747677
Energy: 1.4230099949076584
Energy: 1.3776753868176452
Energy: 1.3560661163659078
Energy: 1.2992618187960652
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Energy: 1.5074971303898772
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Energy: 1.5074971303894718
Energy: 1.4341052945066048
Energy: 1.3397238622329826
Energy: 1.4803728131505416
Energy: 1.4160796232130448
Energy: 1.3882797235973012
Energy: 1.570179918454817
Energy: 1.3125727123877455
Energy: 1.3397238622329826
Energy: 1.480372813152974
Energy: 1.4160796232134503
Energy: 1.3882797235960849
Energy: 1.347161407433552
Energy: 1.363974016512599
Energy: 1.3528448590149131
Energy: 1.5228091786970261
Energy: 1.3825438707896986
Energy: 1.4125619621042116
Energy: 1.347161407433552
Energy: 1.363974016512599
Energy: 1.3528448590161293
Energy: 1.522809178696621
Energy: 1.3799922879066988
Energy: 1.42677073640506
Energy: 1.4241274050737427
Energy: 1.4757224001073774
Energy: 1.4065074494642673
Energy: 1.4828743572478311
Energy: 1.3799922879062931
Energy: 1.4267707364038438
Energy: 1.4241274050737427
Energy: 1.4757224001081883
Energy: 1.3879819769717752
Energy: 1.4030751970967863
Energy: 1.403081908191136
Energy: 1.3882301319660733
Energy: 1.344920541758765
Energy: 1.3448713109380757
Energy: 1.3879819769713697
Energy: 1.4030751970967863
Energy: 1.4030819081907306
Energy: 1.3882301319672896
Energy: 1.4760576076442082
Energy: 1.4250448105972857
Energy: 1.380332010135123
Energy: 1.3801342528111704
Energy: 1.4828403767769764
Energy: 1.4073540880948932
Energy: 1.476057607645019
Energy: 1.4250448105968803
Energy: 1.3803320101355285
Energy: 1.380134252811981
Energy: 1.5224971579750475
Energy: 1.35274747697106
Energy: 1.363950475246399
Energy: 1.347087886490065
Energy: 1.412857675513602
Energy: 1.3827002188291517
Energy: 1.5224971579750475
Energy: 1.3527474769722756
Energy: 1.3639504752451828
Energy: 1.347087886490065
Energy: 1.3909370001318446
Energy: 1.4162558697001257
Energy: 1.4803728131533793
Energy: 1.3394876092443748
Energy: 1.3123252570201254
Energy: 1.5701799184515741
Energy: 1.3909370001314394
Energy: 1.4162558696993148
Energy: 1.4803728131525686
Energy: 1.3394876092455912
Energy: 1.4373871086328338
Energy: 1.5077984384802883
Energy: 1.3977378673866425
Energy: 1.3961356080539586
Energy: 1.3883879506449526
Energy: 1.378153470955998
Energy: 1.437387108633239
Energy: 1.5077984384819099
Energy: 1.3977378673874534
Energy: 1.396135608065715

minimum gb energy = 1.2992618187960652 eV
minimum distance =  2.21124063193181 Angstroms
sigma value = 293


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

Energy: 1.1247726530720983
Energy: 1.3832744779517185
Energy: 1.1549287126158079
Energy: 1.7363112989704033
Energy: 1.1549343532955936
Energy: 1.4055722623764877
Energy: 1.1247726530713658
Energy: 1.3832744779495205
Energy: 1.1549287126143424
Energy: 1.462013442316472
Energy: 1.2305986087964798
Energy: 1.812403321255113
Energy: 1.1549441099889828
Energy: 1.5015657741706316
Energy: 1.569885590532453
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Energy: 1.2305986087964798
Energy: 1.8124033212565782
Energy: 1.1549441099867845
Energy: 1.2625522753712748
Energy: 1.1982466028381145
Energy: 1.1207597476825393
Energy: 1.5041582072857795
Energy: 1.120861331513375
Energy: 1.2776528298155942
Energy: 1.1574428672401926
Energy: 1.1982466028381145
Energy: 1.120759747681074
Energy: 1.5041582072865123
Energy: 1.120861331515573
Energy: 1.5041485971796338
Energy: 1.1207548704336643
Energy: 1.1981766146191797
Energy: 1.1574377566687981
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Energy: 1.1247726530720983
Energy: 1.383274477950253
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Energy: 1.154934353297059
Energy: 1.2622430145170271
Energy: 1.124772653070633
Energy: 1.3832744779136517
Energy: 1.5698855905331857
Energy: 1.1554741829978872
Energy: 1.230598608795747
Energy: 1.7356175540562413
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Energy: 1.4032151153628174
Energy: 1.569885590532453
Energy: 1.1554741829978872
Energy: 1.2305986087972123
Energy: 1.7356175540599046
Energy: 1.277652829810499
Energy: 1.1574428672409252
Energy: 1.1982466028410452
Energy: 1.1207597476818065
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Energy: 1.1208613315141076
Energy: 1.2776528298126637
Energy: 1.1574428672401926
Energy: 1.1982466028417782
Energy: 1.1207597476796085
Energy: 1.2303575232113786
Energy: 1.120863531596362
Energy: 1.5041485971796338
Energy: 1.1207548704329315
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Energy: 1.1574377566687981
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Energy: 1.1208635315956295
Energy: 1.5041485971789013
Energy: 1.1207548704321988
Energy: 1.5697875785277084
Energy: 1.5478000703258588
Energy: 1.1550454188324089
Energy: 1.8124033212609745
Energy: 1.2305961622301602
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Energy: 1.5478000703309875
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Energy: 1.1549287126143424
Energy: 1.58269072298432
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Energy: 1.405572262380118
Energy: 1.1247726530728313
Energy: 1.383274477936332
Energy: 1.1549287126143424
Energy: 1.5800446848887357
Energy: 1.1549343532963263
Energy: 1.2622430145170271
Energy: 1.154944109986052
Energy: 1.4032151153591537
Energy: 1.5698855905331857
Energy: 1.1554741829942234
Energy: 1.230598608795747
Energy: 1.6137748079353778
Energy: 1.1549441099875175
Energy: 1.26255227537274
Energy: 1.569885590532453
Energy: 1.1554741829971544
Energy: 1.504158207287245
Energy: 1.1208613315141076
Energy: 1.2776528298119312
Energy: 1.1574428672409252
Energy: 1.19824660283958
Energy: 1.120759747681074
Energy: 1.504158207287245
Energy: 1.1208613315148406
Energy: 1.2776528298119312
Energy: 1.1574428672401926
Energy: 1.1981766146169814
Energy: 1.1574377566702634
Energy: 1.2303575232113786
Energy: 1.120863531596362
Energy: 1.5041485971796338
Energy: 1.1207548704336643
Energy: 1.1981766146206452
Energy: 1.1574377566680654
Energy: 1.2303575232113786
Energy: 1.1208635315978273
Energy: 1.2305961622272295
Energy: 1.1555626555876024
Energy: 1.569787578526976
Energy: 1.5478000703280568
Energy: 1.1550454188331416
Energy: 1.812403321259509
Energy: 1.230596162227962
Energy: 1.1555626555876024
Energy: 1.569787578526976
Energy: 1.547800070322195
Energy: 1.1247726530713658
Energy: 1.3832744778967996
Energy: 1.1549287126143424
Energy: 1.4398562674939273
Energy: 1.154934353297059
Energy: 1.2622430145170271
Energy: 1.1247726530728313
Energy: 1.3832744778967996
Energy: 1.1549287126143424
Energy: 1.4847122190677955
Energy: 1.2305986087964798
Energy: 1.4849011607728457
Energy: 1.1549441099875175
Energy: 1.2625522753712748
Energy: 1.5698855905331857
Energy: 1.1554741829949564
Energy: 1.230598608795747
Energy: 1.6137748079353778
Energy: 1.1549441099867845
Energy: 1.2625522753720075
Energy: 1.1982466028425107
Energy: 1.1207597476796085
Energy: 1.5041582072857795
Energy: 1.1208613315126423
Energy: 1.2776528298177925
Energy: 1.157442867241658
Energy: 1.1982466028417782
Energy: 1.120759747681074
Energy: 1.5041582072865123
Energy: 1.1208613315126423
Energy: 1.5041485971789013
Energy: 1.120754870434397
Energy: 1.1981766146221104
Energy: 1.1574377566702634
Energy: 1.2303575232106458
Energy: 1.120863531594164
Energy: 1.5041485971796338
Energy: 1.1207548704329315
Energy: 1.1981766146191797
Energy: 1.1574377566680654
Energy: 1.1550454188316763
Energy: 1.8124033212602417
Energy: 1.2305961622272295
Energy: 1.155562655588335
Energy: 1.5697875785277084
Energy: 1.5478000703295223
Energy: 1.1550454188309434
Energy: 1.812403321259509
Energy: 1.230596162227962
Energy: 1.155562655589068
Energy: 1.1549343532977916
Energy: 1.2622430145170271
Energy: 1.1247726530713658
Energy: 1.38327447788068
Energy: 1.1549287126143424
Energy: 1.4398562674939273
Energy: 1.1549343532963263
Energy: 1.2622430145170271
Energy: 1.1247726530728313
Energy: 1.383274477882878
Energy: 1.569885590532453
Energy: 1.155474182995689
Energy: 1.2305986087972123
Energy: 1.4849011607728457
Energy: 1.1549441099889828
Energy: 1.2625522753720075
Energy: 1.5698855905331857
Energy: 1.155474182992758
Energy: 1.230598608795747
Energy: 1.613774807936843

minimum gb energy = 1.1207548704321988 eV
minimum distance =  2.22457207885486 Angstroms
sigma value = 15


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

Energy: 1.5635707013650573
Energy: 1.3310512416439781
Energy: 1.3838131381942023
Energy: 1.7421226090477586
Energy: 1.383815905538988
Energy: 1.3807707489770549
Energy: 1.5635707013657216
Energy: 1.3310512416446425
Energy: 1.3838131381948666
Energy: 1.3543561664868802
Energy: 1.391856091485508
Energy: 1.5162125600960188
Energy: 1.3824781536801838
Energy: 1.3626082300545077
Energy: 1.3775759694394185
Energy: 1.321896638407003
Energy: 1.3918560914861722
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Energy: 1.3824781536801838
Energy: 1.3626082300531792
Energy: 1.4259160927239787
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Energy: 1.447994213414816
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Energy: 1.4266301182457155
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Energy: 1.3675181925492383
Energy: 1.4697332602913984
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Energy: 1.4657399977580783
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Energy: 1.3505978948497803
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Energy: 1.3364837149668987
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Energy: 1.3665826813791875
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Energy: 1.3883774491937981
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Energy: 1.4979604238835915
Energy: 1.3290252614194809
Energy: 1.3751401373520589
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Energy: 1.3670254223877678
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Energy: 1.3290252614194809
Energy: 1.4060707601039444
Energy: 1.3504650526284283
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Energy: 1.4373850713452234
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Energy: 1.3146609151076296
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Energy: 1.309626533577628
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Energy: 1.3259043169009284
Energy: 1.3832251179108677
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Energy: 1.3259043168995999
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Energy: 1.3613114950102678
Energy: 1.299009024001008
Energy: 1.4183972706841002
Energy: 1.3192783112909592
Energy: 1.3321492046669947
Energy: 1.37960837221352
Energy: 1.4652706267024669
Energy: 1.299009024001008
Energy: 1.4183972706857608
Energy: 1.3192783112896307
Energy: 1.332149204668323
Energy: 1.4746690071995243
Energy: 1.3553077812359418
Energy: 1.3789997125569113
Energy: 1.5566491423149913
Energy: 1.380157603260672
Energy: 1.4257691223203313
Energy: 1.4746690071991921
Energy: 1.355307781236274
Energy: 1.3789997125579077
Energy: 1.5566491423146591
Energy: 1.2828433551714034
Energy: 1.4742839965459102
Energy: 1.3780282538502882
Energy: 1.3659891311819214
Energy: 1.4696807624505128
Energy: 1.3765781051851684
Energy: 1.2828433551710712
Energy: 1.4742839965452461
Energy: 1.3780282538512845
Energy: 1.3659891311825858
Energy: 1.3313622022426408
Energy: 1.3791033509212756
Energy: 1.3398766030543185
Energy: 1.3688220787139966
Energy: 1.3555382268088112
Energy: 1.478405376920292
Energy: 1.3313622022396516
Energy: 1.3791033509222719
Energy: 1.692301050723068
Energy: 1.3688220787136642
Energy: 1.464652717751898
Energy: 1.3795510589635112
Energy: 1.3575402279600217
Energy: 1.3068494215285895
Energy: 1.3933321853865666
Energy: 1.3696501986398528
Energy: 1.4646527177489088
Energy: 1.3795510589638431
Energy: 1.357540227961018
Energy: 1.3068494215285895
Energy: 1.2890748656990947
Energy: 1.4345581086083745
Energy: 1.3668765227326003
Energy: 1.372699757820804
Energy: 1.361287715847392
Energy: 1.4029407892554182
Energy: 1.2890748656984303
Energy: 1.4345581086063814
Energy: 1.3668765227332649
Energy: 1.3726997578201396
Energy: 1.289852185699841
Energy: 1.438961433695289
Energy: 1.3504978898544369
Energy: 1.376035078338522
Energy: 1.325991711626356
Energy: 1.3622443622501041
Energy: 1.289852185701834
Energy: 1.4389614336959533
Energy: 1.3504978898557654
Energy: 1.3760350783401825
Energy: 1.4708234532363096
Energy: 1.297744440764788
Energy: 1.3852304357766019
Energy: 1.2955303553680046
Energy: 1.3824002968693139
Energy: 1.3789290864814534
Energy: 1.5065092390651684
Energy: 1.2977444407651204
Energy: 1.3852304357805876
Energy: 1.295530355369001
Energy: 1.4276821078599142
Energy: 1.453294466467873
Energy: 1.3514968668308727
Energy: 1.3220934418558938
Energy: 1.385890241507043
Energy: 1.3791470427947328
Energy: 1.427682107858586
Energy: 1.453294466460898
Energy: 1.3514968668305407
Energy: 1.3220934418558938
Energy: 1.3492348731146704
Energy: 1.384936060404335
Energy: 1.4572555604170792
Energy: 1.3733558369878587
Energy: 1.3789945263198224
Energy: 1.4730662222010935
Energy: 1.3492348731150026
Energy: 1.3849360604046672
Energy: 1.457255560416747
Energy: 1.3733558369881909
Energy: 1.4471105989497401
Energy: 1.3852831304878916
Energy: 1.4400832525138594
Energy: 1.5442534251677753
Energy: 1.3807396795722804
Energy: 1.3549992555028214
Energy: 1.4471105989497401
Energy: 1.3852831304878916
Energy: 1.440083252513527
Energy: 1.5442534251664466
Energy: 1.3469993116355228
Energy: 1.4574028533796006
Energy: 1.3514536163523867
Energy: 1.3325681833255991
Energy: 1.3215927001281271
Energy: 1.3916382966753114
Energy: 1.3469993116348584
Energy: 1.4574028533796006
Energy: 1.3514536163523867
Energy: 1.3325681833255991
Energy: 1.369862817409393
Energy: 1.3361020189375488
Energy: 1.4998924837480325
Energy: 1.365591711787193
Energy: 1.383351481957971
Energy: 1.3241259984420108
Energy: 1.369862817409393
Energy: 1.3361020189382131
Energy: 1.4998924837470364
Energy: 1.3655917117888536
Energy: 1.380490422132575
Energy: 1.281998651787152
Energy: 1.4889832414794555
Energy: 1.3487896306343103
Energy: 1.3731947357921108
Energy: 1.3299472042156215
Energy: 1.3804904221319105
Energy: 1.2819986517858233
Energy: 1.4889832414791233
Energy: 1.3487896306343103
Energy: 1.347714484941748
Energy: 1.421572778862281
Energy: 1.2848227206242115
Energy: 1.3104699494240835
Energy: 1.311008359853702
Energy: 1.3743097168541953
Energy: 1.3477144849351055
Energy: 1.4215727788486634
Energy: 1.2848227206235474
Energy: 1.310469949422755
Energy: 1.3721767670041092
Energy: 1.498326117577221
Energy: 1.4554994155886807
Energy: 1.3681340626208605
Energy: 1.3181658480460936
Energy: 1.4054769313732713
Energy: 1.372176767004773
Energy: 1.4983261175778853
Energy: 1.4554994155836989
Energy: 1.3681340626261749
Energy: 1.4076693605697392
Energy: 1.360645816972381
Energy: 1.4441945866962314
Energy: 1.430027085974853
Energy: 1.3611967757221124
Energy: 1.3199238791489656
Energy: 1.407669360571068
Energy: 1.3606458169710527
Energy: 1.4441945866972274
Energy: 1.43002708597286
Energy: 1.2902280074940797
Energy: 1.4003725110387992
Energy: 1.385635759286777
Energy: 1.4372750595382857
Energy: 1.4392382563392403
Energy: 1.3669909076811186
Energy: 1.290228007492751
Energy: 1.4003725110387992
Energy: 1.3856357592864448
Energy: 1.437275059538618
Energy: 1.3667723258853008
Energy: 1.3623752027795235
Energy: 1.3882888160571107
Energy: 1.3279087714451991
Energy: 1.47196378011461
Energy: 1.3123078368018146
Energy: 1.3667723258846365
Energy: 1.362375202781184
Energy: 1.388288816056114
Energy: 1.327908771447524
Energy: 1.322441631574819
Energy: 1.35228851770068
Energy: 1.4601319353109854
Energy: 1.544712762517831
Energy: 1.362082845586177
Energy: 1.4433743651841355
Energy: 1.3224416315764798
Energy: 1.3522885176973585
Energy: 1.4601319353119822
Energy: 1.5447127625181631
Energy: 1.2971615014628828
Energy: 1.3282204376714375
Energy: 1.3327485017652163
Energy: 1.5152425639120384
Energy: 1.403704867776119
Energy: 1.3621816364741641
Energy: 1.2971615014642113
Energy: 1.3282204376724338
Energy: 1.3327485017652163
Energy: 1.5152425639100455
Energy: 1.3748980026093198
Energy: 1.3487635991238016
Energy: 1.4613796140193687
Energy: 1.289309663484015
Energy: 1.379123583345293
Energy: 1.2957630444837092
Energy: 1.3748980026086555
Energy: 1.3487635991224731
Energy: 1.4613796140206972
Energy: 1.2893096634863397

minimum gb energy = 1.2819986517858233 eV
minimum distance =  2.25466300748608 Angstroms
sigma value = 437


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

Energy: 1.3972685528664286
Energy: 1.4710047902231438
Energy: 1.3804073357716522
Energy: 1.7973637093903163
Energy: 1.3802287698272468
Energy: 1.361639792625949
Energy: 1.3972685528640083
Energy: 1.4710047902255639
Energy: 1.3804073357692324
Energy: 1.5768072273646965
Energy: 1.4057350761342227
Energy: 1.7443547391100744
Energy: 1.331796977644244
Energy: 1.3471405318701641
Energy: 1.5326278800026032
Energy: 1.345366474667422
Energy: 1.4057350761330125
Energy: 1.7443547391100744
Energy: 1.3317969776430338
Energy: 1.3471405318677439
Energy: 1.3495043074359867
Energy: 1.3635251229891834
Energy: 1.4855797912961428
Energy: 1.3556305007303566
Energy: 1.4134372723922175
Energy: 1.3607329796871965
Energy: 1.3495043074069462
Energy: 1.3635251229855532
Energy: 1.485579791987997
Energy: 1.3556305007267815
Energy: 1.7095364212102113
Energy: 1.3292861241189233
Energy: 1.351872704124886
Energy: 1.307885699212164
Energy: 1.3567906141286075
Energy: 1.3283734413837474
Energy: 1.7095364212065816
Energy: 1.329286124116503
Energy: 1.3518727041273058
Energy: 1.307885699212164
Energy: 1.3364233120259104
Energy: 1.3666920258531488
Energy: 1.3616040300466665
Energy: 1.4177879590926101
Energy: 1.2861872701043149
Energy: 1.3141137855321454
Energy: 1.33642331202349
Energy: 1.517520783442724
Energy: 1.3616040300490868
Energy: 1.4177879590901903
Energy: 1.3371697844575907
Energy: 1.4405358064373723
Energy: 1.3443100857962391
Energy: 1.322909090080407
Energy: 1.3209265410497455
Energy: 1.4496944618199161
Energy: 1.3371697844575907
Energy: 1.440535806430112
Energy: 1.3443100857974493
Energy: 1.322909090076777
Energy: 1.6396070734118564
Energy: 1.3559462681697798
Energy: 1.4113041565648201
Energy: 1.3059392550118039
Energy: 1.586232940296883
Energy: 1.3401829076752505
Energy: 1.6396070734082262
Energy: 1.3559462681649397
Energy: 1.4113041565672404
Energy: 1.3059392550130138
Energy: 1.3521191619308979
Energy: 1.3458341223667554
Energy: 1.3325372641093371
Energy: 1.3095847652661365
Energy: 1.4849974005857203
Energy: 1.329081603303785
Energy: 1.3521191619272679
Energy: 1.3458341223619152
Energy: 1.3325372641105473
Energy: 1.3095847652685568
Energy: 1.3117376808406103
Energy: 1.4194504401545347
Energy: 1.68086238820743
Energy: 1.3385261251096128
Energy: 1.3799063034666181
Energy: 1.4822775965651882
Energy: 1.3117376808394001
Energy: 1.4194504401496946
Energy: 1.68086238820743
Energy: 1.3385261251096128
Energy: 1.4825638545790059
Energy: 1.3291395949649567
Energy: 1.3266483464749048
Energy: 1.4216327193041993
Energy: 1.33304983558617
Energy: 1.5446971754358576
Energy: 1.4825638545826358
Energy: 1.3291395949625366
Energy: 1.326648346473695
Energy: 1.4216327193017793
Energy: 1.574132088986357
Energy: 1.3065730211255553
Energy: 1.3341014062129413
Energy: 1.348861874411
Energy: 1.4176695974675064
Energy: 1.3324376397451498
Energy: 1.574132088986357
Energy: 1.306573021123135
Energy: 1.334101406211731
Energy: 1.3488618744085799
Energy: 1.3001195236165106
Energy: 1.3431627946762927
Energy: 1.5570090473873064
Energy: 1.3091309689446626
Energy: 1.5562596932761859
Energy: 1.34338526434357
Energy: 1.3001195236201406
Energy: 1.343162794678713
Energy: 1.5570090473848865
Energy: 1.3091309689482928
Energy: 1.5741947888704937
Energy: 1.332529493475378
Energy: 1.4176695974590363
Energy: 1.3488933735277824
Energy: 1.3340398264757605
Energy: 1.3065215955107294
Energy: 1.5741947888692835
Energy: 1.332529493472958
Energy: 1.4176695974626663
Energy: 1.3488933735277824
Energy: 1.4929531256639244
Energy: 1.5438199391055107
Energy: 1.3330982927994677
Energy: 1.4216509256472007
Energy: 1.3447152335799941
Energy: 1.32914559763261
Energy: 1.4929531256602944
Energy: 1.5438199391030907
Energy: 1.3330982927994677
Energy: 1.4216509256435708

minimum gb energy = 1.2861872701043149 eV
minimum distance =  2.24117335960167 Angstroms
sigma value = 33