Model name: model_name=EAM_Dynamo_MendelevHanSrolovitz_2003Potential5_Fe__MO_942420706858_005
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=2.855258293449879
cohesive_energy=4.134425479783591
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: 0.014497285335710259
Energy: 0.015210744440039706
Energy: 0.014860056655366412
Energy: 1.9223522104648108
Energy: 0.014860056657209568
Energy: 0.015210744441672216
Energy: 0.014497285336157885
Energy: 0.01521074444211984
Energy: 0.014860056656761943
Energy: 1.5274495262795702
Energy: 0.8093442109705643
Energy: 0.015420502432482266
Energy: 0.016821761232734402
Energy: 0.7994496870095651
Energy: 0.016821761232023467
Energy: 0.015420502432719245
Energy: 0.8093442109708013
Energy: 0.0154205024331932
Energy: 0.016821761232734402
Energy: 0.7994496870093282
Energy: 0.014497285336157885
Energy: 0.015210744440724308
Energy: 0.014860056655603388
Energy: 1.922350818279843
Energy: 0.014860056656524966
Energy: 0.015210744440724308
Energy: 0.01449728533639486
Energy: 0.015210744440961285
Energy: 0.014860056655840365
Energy: 1.5274495262742516
Energy: 0.809344210971012
Energy: 0.015420502432482266
Energy: 0.016821761232734402
Energy: 0.7994496870093282
Energy: 0.016821761231812823
Energy: 0.015420502432719245
Energy: 0.8093442109705643
Energy: 0.015420502432719245
Energy: 0.01682176123297138
Energy: 0.7994496870095651
Energy: 0.01449728533639486
Energy: 0.015210744440724308
Energy: 0.014860056655840365
Energy: 1.9223523044257746
Energy: 0.014860056658157478
Energy: 0.015210744441882862
Energy: 0.014497285336631837
Energy: 0.015210744442356818
Energy: 0.014860056657209568
Energy: 1.5274495262793333
Energy: 0.8093442109708013
Energy: 0.01542050243224529
Energy: 0.016821761233182027
Energy: 0.7994496870095651
Energy: 0.016821761232260445
Energy: 0.015420502432719245
Energy: 0.8093442109708013
Energy: 0.015420502432719245
Energy: 0.016821761232497425
Energy: 0.7994496870090911
Energy: 0.014497285336157885
Energy: 0.015210744441435239
Energy: 0.014860056655603388
Energy: 1.9223522095527372
Energy: 0.014860056656761943
Energy: 0.015210744441435239
Energy: 0.014497285336631837
Energy: 0.015210744441435239
Energy: 0.014860056656051014
Energy: 1.5274495262784116

minimum gb energy = 0.014497285335710259 eV
minimum distance =  2.22126549030963 Angstroms
sigma value = 3


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

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Energy: 1.3804693645232162
Energy: 1.435457732645578
Energy: 1.456025679522758
Energy: 1.4346283171687173
Energy: 1.3878827182386173
Energy: 1.5482236936672145
Energy: 1.3804693645266217
Energy: 1.4354577326535243
Energy: 1.426207890064513
Energy: 1.4312592631690704
Energy: 1.2936318154498663
Energy: 1.4294730351437264
Energy: 1.5189858461922623
Energy: 1.3904028285420955
Energy: 1.3475733815719075
Energy: 1.4312592631741783
Energy: 1.2936318154481636
Energy: 1.4294730351499696
Energy: 1.5189858461916947
Energy: 1.4155555591811924
Energy: 1.3541116960614126
Energy: 1.3512080752831186
Energy: 1.3723719613167478
Energy: 1.4162602440459477
Energy: 1.3036621701194455
Energy: 1.4155555591324327
Energy: 1.354111696060845
Energy: 1.3512080752848212
Energy: 1.3723719613161802
Energy: 1.495729615027774
Energy: 1.3449268283786078
Energy: 1.355351107324069
Energy: 1.3717475679015954
Energy: 1.3520650826563205
Energy: 1.3814198737423153
Energy: 1.495729615030044
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Energy: 1.3553511073235012
Energy: 1.3717475679050006
Energy: 1.3635389754527991
Energy: 1.3564661422315498
Energy: 1.3564578824171876
Energy: 1.3478232467273077
Energy: 1.3273291366228361
Energy: 1.3145624084329353
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Energy: 1.3564661422287119
Energy: 1.3564578824171876
Energy: 1.3478232467227673
Energy: 1.309981228397125
Energy: 1.3472599746212721
Energy: 1.3584097247897495
Energy: 1.3152533147904084
Energy: 1.3483125450745612
Energy: 1.3858431081389044
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Energy: 1.3128694501624418
Energy: 1.4356794255031886
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Energy: 1.3938084406415148
Energy: 1.4168445761786905
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Energy: 1.4934932224376607
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Energy: 1.350126368057278
Energy: 1.4053747956296274
Energy: 1.3654335981346113
Energy: 1.3330475816631375
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Energy: 1.3666755888742141
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Energy: 1.3413935340382075
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Energy: 1.2977189282842438
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Energy: 1.4071656580637975
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Energy: 1.3734189611321472
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Energy: 1.3885476900689837
Energy: 1.313865810836595
Energy: 1.5548740561747525
Energy: 1.3761611505650213
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Energy: 1.3958987439232375
Energy: 1.5281890467994175
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Energy: 1.3761611505252913
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Energy: 1.3764427989679922
Energy: 1.5161880450934255
Energy: 1.3912520003664037
Energy: 1.4301124075480254
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Energy: 1.3431173645392716
Energy: 1.4357166914049282
Energy: 1.3129540117306189
Energy: 1.438255353506339
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Energy: 1.353984975307636
Energy: 1.3431173645381365
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Energy: 1.3129540117311869
Energy: 1.3724219612162698
Energy: 1.4525300039617188
Energy: 1.3805699889621035
Energy: 1.3384881997124307
Energy: 1.487351932655885
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Energy: 1.3724219612213264
Energy: 1.4525300039622868
Energy: 1.3805699889592655
Energy: 1.338488199712998
Energy: 1.3148502988530228
Energy: 1.3582794105861609
Energy: 1.3470810542497427
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Energy: 1.3673896462622008
Energy: 1.3764188608851082
Energy: 1.3148502988513202
Energy: 1.3582794105952418
Energy: 1.3470810542503102
Energy: 1.3043698387958307
Energy: 1.348553884095384
Energy: 1.3565570851746571
Energy: 1.3564039858896186
Energy: 1.3589074301883999
Energy: 1.3145624084244218
Energy: 1.3272912702467106
Energy: 1.3485538840993567
Energy: 1.3565570851763598
Energy: 1.3564039858913213
Energy: 1.3589074301804536
Energy: 1.371894966934376
Energy: 1.336129684729328
Energy: 1.3449494448564292
Energy: 1.4953728656970602
Energy: 1.3809031553284927
Energy: 1.375584824005955
Energy: 1.3718949669349438
Energy: 1.3361296847298958
Energy: 1.3449494448569967
Energy: 1.495372865700466
Energy: 1.3723719613105045
Energy: 1.349699089503584
Energy: 1.3500496815063385
Energy: 1.4377309782530663
Energy: 1.3103052043337595
Energy: 1.4182234064648243
Energy: 1.372371961312207
Energy: 1.3496990895030163
Energy: 1.3440127647084155
Energy: 1.4377309782496608
Energy: 1.519118803254441
Energy: 1.4303198344881776
Energy: 1.2952421226254585
Energy: 1.4312582964665799
Energy: 1.3478101147487849
Energy: 1.3894690451068918
Energy: 1.519118803254441
Energy: 1.4303198344893127
Energy: 1.2952421226368098
Energy: 1.4312583019707092
Energy: 1.4262078903657402
Energy: 1.434628317161339
Energy: 1.387882718245428
Energy: 1.548223693434612
Energy: 1.3804693645260542
Energy: 1.4354577326603353
Energy: 1.4262078903096018
Energy: 1.434628317162474
Energy: 1.3878827182511038
Energy: 1.5482236932774975
Energy: 1.5189858461865864
Energy: 1.3904028285585555
Energy: 1.347573381572475
Energy: 1.4312592631713406
Energy: 1.2936318154481636
Energy: 1.429473035164159
Energy: 1.5189858461894243
Energy: 1.3904028285619607
Energy: 1.3475733815707724
Energy: 1.431259263180422
Energy: 1.3723719613105045
Energy: 1.416260244051056
Energy: 1.3036621701200133
Energy: 1.4155555591851656
Energy: 1.354111696064818
Energy: 1.3512080752808482
Energy: 1.372371961312207
Energy: 1.4162602440493532
Energy: 1.3036621701444189
Energy: 1.4155555591868683
Energy: 1.3717475679055684
Energy: 1.3520650826585907
Energy: 1.3814198737457206
Energy: 1.495729615032882
Energy: 1.3449268283752023
Energy: 1.3553511073263391
Energy: 1.3717475679055684
Energy: 1.3520650826551852
Energy: 1.3814198737445855
Energy: 1.495729615032882

minimum gb energy = 1.2936318154481636 eV
minimum distance =  2.18868664820867 Angstroms
sigma value = 75


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

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Energy: 1.4721300160649617
Energy: 1.5244647608729465
Energy: 1.4626095069333194
Energy: 1.495950930864394
Energy: 1.6078479277772841
Energy: 1.696538173024263
Energy: 1.472130016062469
Energy: 1.5244647598448149
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Energy: 1.4936470215538116
Energy: 1.4236818261624145
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Energy: 1.3976468667023785
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minimum gb energy = 1.3735718170452003 eV
minimum distance =  2.18265611557063 Angstroms
sigma value = 105


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

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Energy: 1.5668209334051666
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Energy: 1.3860258205963212
Energy: 1.5668209334020422
Energy: 1.3810269712887595
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Energy: 1.4249355581943215
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Energy: 1.4278981389695333
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Energy: 1.5766924713074495
Energy: 1.4249355563358184
Energy: 1.409075093436993
Energy: 1.427898138969221
Energy: 1.392463695877231
Energy: 1.4288496100520385
Energy: 1.5866430840175405
Energy: 1.4739608728741878
Energy: 1.4566662698015478
Energy: 1.4961405287053355
Energy: 1.392463696358501
Energy: 1.4288453594166861
Energy: 1.5866430840169155
Energy: 1.473960874886354
Energy: 1.4812427655924214
Energy: 1.3990338708773113
Energy: 1.4736518498029183
Energy: 1.4127878896075803
Energy: 1.3900963756119393
Energy: 1.4356900154539405
Energy: 1.4812427655946088
Energy: 1.3990338708744996
Energy: 1.4736518498051052
Energy: 1.4127878896135164
Energy: 1.382990743116086
Energy: 1.4017534190538663
Energy: 1.4598507335380837
Energy: 1.379346564980984
Energy: 1.5782851717153092
Energy: 1.379625688318628
Energy: 1.3829907431201476
Energy: 1.4017534190579277
Energy: 1.459850733539021
Energy: 1.37934656497661
Energy: 1.3848549093847577
Energy: 1.4578662657171972
Energy: 1.4058814323471636
Energy: 1.4093332784696249
Energy: 1.4476650245018872
Energy: 1.3852507643545502
Energy: 1.3848549093850704
Energy: 1.4578662657200092
Energy: 1.4058814322924866
Energy: 1.409333278469
Energy: 1.4717068887240439
Energy: 1.464462882450827
Energy: 1.4028886025628253
Energy: 1.4446885489864971
Energy: 1.4282665064794058
Energy: 1.4575762655110667
Energy: 1.4717068887196698
Energy: 1.464462882450202
Energy: 1.40288860256345
Energy: 1.444688548982123

minimum gb energy = 1.3455846342284066 eV
minimum distance =  2.20364780960382 Angstroms
sigma value = 165


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

Energy: 1.4314830219569168
Energy: 1.6546367227139793
Energy: 1.344332634973572
Energy: 1.3841786503999294
Energy: 1.3495913532313233
Energy: 1.6550600443751216
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Energy: 1.6546367227139793
Energy: 1.344332635795926
Energy: 1.3873656697161116
Energy: 1.419568678962594
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Energy: 1.3461113698803369
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Energy: 1.5105679329617516
Energy: 1.4075031803282017
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Energy: 1.3644923346909779
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Energy: 1.3605732204251864
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Energy: 1.323290980000593
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Energy: 1.4222361551893052
Energy: 1.3774074419112952
Energy: 1.366766873461249
Energy: 1.382800905333321
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Energy: 1.3774074419102227
Energy: 1.3667668734623217
Energy: 1.3828009053343935
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Energy: 1.4158749977448732
Energy: 1.3512803096027284
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Energy: 1.3195863114127682
Energy: 1.4158749959597499
Energy: 1.3512803094676276
Energy: 1.3892108344239722
Energy: 1.5103528306965759
Energy: 1.3186746137720902
Energy: 1.4027625316470682
Energy: 1.4067235127406628
Energy: 1.3606213641131584
Energy: 1.3026978106720704
Energy: 1.3197233693624666
Energy: 1.3186746137710172
Energy: 1.4027625316492134
Energy: 1.4067235127406628
Energy: 1.3606213641131584
Energy: 1.319524303977773
Energy: 1.4075031803314193
Energy: 1.5105521058944942
Energy: 1.3231563936398176
Energy: 1.4508331975277977
Energy: 1.3664871797449294
Energy: 1.319524303977773
Energy: 1.4075031803303468
Energy: 1.5105521058944942
Energy: 1.3231563936387454
Energy: 1.4336733781067335
Energy: 1.3552281322087387
Energy: 1.3859416449407318
Energy: 1.4194320652459533
Energy: 1.319531690441168
Energy: 1.3027057289172321
Energy: 1.4336733781088788
Energy: 1.3552170866226214
Energy: 1.3859416449385864
Energy: 1.4194320652459533
Energy: 1.384901783175396
Energy: 1.3495913533428265
Energy: 1.6550600443740486
Energy: 1.4314830219601347
Energy: 1.6546367227150522
Energy: 1.344332635281315
Energy: 1.384119437760734
Energy: 1.349591353156289
Energy: 1.655060044372976
Energy: 1.4314830219601347

minimum gb energy = 1.3026978106720704 eV
minimum distance =  2.19141627478568 Angstroms
sigma value = 41


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

Energy: 1.4445001599369605
Energy: 1.3180587134458903
Energy: 1.20049715232434
Energy: 1.3638516564741645
Energy: 1.1898874639774508
Energy: 1.3183053447863389
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Energy: 1.3275289061365358
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Energy: 1.1988195018501162
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Energy: 1.3863992854541614
Energy: 1.1896505881736423
Energy: 1.3216036720032691
Energy: 1.2881723624436048
Energy: 1.2964348073292769
Energy: 1.3368093559126464
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Energy: 1.1972589306507633
Energy: 1.3668980115914775
Energy: 1.2881723624498473
Energy: 1.2964348073330225
Energy: 1.3368093559197212
Energy: 1.1974014639390456
Energy: 1.3169294743991522
Energy: 1.2843299005640114
Energy: 1.3304618097619432
Energy: 1.1993265488856522
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Energy: 1.3169294744045623
Energy: 1.2843299005694215
Energy: 1.3304618097552845
Energy: 1.1993265488906464
Energy: 1.457552232086718
Energy: 1.285141808137145
Energy: 1.5148071382588015
Energy: 1.1896634269757866
Energy: 1.4607384836142556
Energy: 1.2007743832825626
Energy: 1.4575522320879666
Energy: 1.285141807396711
Energy: 1.5148071382563044
Energy: 1.1896634269757866
Energy: 1.1979265011217544
Energy: 1.2837849493868498
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Energy: 1.1897655886834062
Energy: 1.3215238004521257
Energy: 1.2764180035834443
Energy: 1.19792650112009
Energy: 1.2837849493872657
Energy: 1.3167043207882227
Energy: 1.1897655886842387
Energy: 1.3811239973971075
Energy: 1.2969887371982871
Energy: 1.3072753559225256
Energy: 1.3785781781669015
Energy: 1.1978445107697597
Energy: 1.2121235845861908
Energy: 1.3811239973933622
Energy: 1.2969887371982871
Energy: 1.3072753559250225
Energy: 1.3785781781698148
Energy: 1.1899763676286497
Energy: 1.422268567103149
Energy: 1.2836496916172975
Energy: 1.1980564213715335
Energy: 1.2778648036501845
Energy: 1.3474998370682543
Energy: 1.1899763676194939
Energy: 1.4222685671077266
Energy: 1.2836496916180917
Energy: 1.198056421373614
Energy: 1.190036507551375
Energy: 1.4618579264565672
Energy: 1.2858383977792573
Energy: 1.309442845279047
Energy: 1.1897369815413954
Energy: 1.4775789017925123
Energy: 1.1900365075484618
Energy: 1.461857926461145
Energy: 1.2858383977846675
Energy: 1.3094428452798792
Energy: 1.2023827282081159
Energy: 1.3360251344198486
Energy: 1.2843329392717155
Energy: 1.3167868647089038
Energy: 1.2008098791143114
Energy: 1.3259055600229543
Energy: 1.202382728213526
Energy: 1.3360251344202647
Energy: 1.2843329392742127
Energy: 1.3167868647051584
Energy: 1.1988046313064844
Energy: 1.3781973960919345
Energy: 1.3030645541218777
Energy: 1.2877453625455673
Energy: 1.3824716135992852
Energy: 1.197117565963515
Energy: 1.198804633301545
Energy: 1.3781973960952643
Energy: 1.3030645541218777
Energy: 1.287745362539325
Energy: 1.3461537704428077
Energy: 1.1898146769939961
Energy: 1.3968181062536513
Energy: 1.258365985474057
Energy: 1.1976708232987163
Energy: 1.2771761817448315
Energy: 1.3461537704365651
Energy: 1.1898146769840083
Energy: 1.3968181062499059
Energy: 1.25836598547697
Energy: 1.3943097103610247
Energy: 1.1898222832400112
Energy: 1.4561936790789731
Energy: 1.2824643665988742
Energy: 1.3095914708952778
Energy: 1.3691913980366421
Energy: 1.3943097103601922
Energy: 1.1898222832341847
Energy: 1.4561936790710657
Energy: 1.2824643665976254
Energy: 1.3546840105466045
Energy: 1.201271064796369
Energy: 1.483793890836565
Energy: 1.283562057050677
Energy: 1.3167775702164228
Energy: 1.2235405170833675
Energy: 1.3546840105499336
Energy: 1.2012710647913747
Energy: 1.48379389073381
Energy: 1.2835620570594168

minimum gb energy = 1.1893905463992216 eV
minimum distance =  2.22865345627055 Angstroms
sigma value = 185


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

Energy: 1.4800129777163258
Energy: 1.300495503012216
Energy: 1.5128562597041197
Energy: 1.6919683016770937
Energy: 1.5167739378911775
Energy: 1.3003587932112206
Energy: 1.48001297771929
Energy: 1.3004955030181442
Energy: 1.5128562597070838
Energy: 1.624501517957409
Energy: 1.5508089482978442
Energy: 1.3993378877871265
Energy: 1.2508382226310544
Energy: 1.300904662838319
Energy: 1.2635229317084005
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Energy: 1.3009046628417318
Energy: 1.253278485323992
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Energy: 1.361071580144002
Energy: 1.253278485316582
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Energy: 1.5165796829510356
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Energy: 1.2646288926884968
Energy: 1.3004818453680385
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Energy: 1.2523021422425624
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Energy: 1.250762056357287
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Energy: 1.4977873689796122
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Energy: 1.6180334766963307
Energy: 1.2507620563612392
Energy: 1.301276196015806
Energy: 1.4977873689801064
Energy: 1.3599531851449107
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Energy: 1.3355598091270655
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Energy: 1.4399297766499224
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Energy: 1.2639867565198648
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Energy: 1.2622793469488753
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Energy: 1.2196288218274793
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Energy: 1.2522867405696467
Energy: 1.3003487374651364
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Energy: 1.2843885093424927
Energy: 1.252286740573105
Energy: 1.3003487374616782
Energy: 1.2639425694899036
Energy: 1.6009962940013107
Energy: 1.5198206594401185
Energy: 1.58726468903383
Energy: 1.263568979134892
Energy: 1.2847946098177443
Energy: 1.2938915690549142
Energy: 1.2635512174218535
Energy: 1.5198206594336963
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Energy: 1.26356897913588
Energy: 1.28479460981231
Energy: 1.300740522526427
Energy: 1.2508319019084833
Energy: 1.3005574048016277
Energy: 1.505039938037118
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Energy: 1.263449496082478
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Energy: 1.2508319018986032
Energy: 1.300557404803604
Energy: 1.505039938037118
Energy: 1.618269554983436
Energy: 1.5153515593598066
Energy: 1.4286301357131024
Energy: 1.455576463049704
Energy: 1.2601947216901128
Energy: 1.512856259713012
Energy: 1.635965296058109
Energy: 1.5153515593657347
Energy: 1.3003181013034841
Energy: 1.455576463050692
Energy: 1.3009046628407437
Energy: 1.2635229317079062
Energy: 1.3964289731016861
Energy: 1.5136913165693882
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Energy: 1.2508382226355002
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Energy: 1.2635229317024723
Energy: 1.396428973096746
Energy: 1.513691316515047
Energy: 1.5129669768638743
Energy: 1.2620718438805087
Energy: 1.2962614824959386
Energy: 1.253278485313124
Energy: 1.2635586193070367
Energy: 1.587264689025926
Energy: 1.512966976858934
Energy: 1.2620718438810026
Energy: 1.2962614819769582
Energy: 1.2532784853309085
Energy: 1.2522966158223827
Energy: 1.2457391052593934
Energy: 1.2418040351765127
Energy: 1.5623357016137427
Energy: 1.2641067704175453
Energy: 1.3005046473134647
Energy: 1.252296615829299
Energy: 1.2457391052584053
Energy: 1.2418040351972615
Energy: 1.562335701625599
Energy: 1.4977873689781303
Energy: 1.5400467547864642
Energy: 1.2420663653714312
Energy: 1.6180334766997886
Energy: 1.2507620563528412
Energy: 1.301276196018276
Energy: 1.4977873689815884
Energy: 1.5400467547005516
Energy: 1.242066365402015
Energy: 1.6180334767027527
Energy: 1.263986756522335
Energy: 1.2833205834969532
Energy: 1.4340483197949514
Energy: 1.353974063625495
Energy: 1.4476234416744218
Energy: 1.3361076298709667
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Energy: 1.283320581831421
Energy: 1.4340483197767178
Energy: 1.353974063629447
Energy: 1.2622793469167648
Energy: 1.379152473122678
Energy: 1.247827671713884
Energy: 1.2638729475518566
Energy: 1.3543585352541894
Energy: 1.5154288895258916
Energy: 1.2622793469177527
Energy: 1.3791524595745428
Energy: 1.247827671721788
Energy: 1.2638729475567967
Energy: 1.455367958012261
Energy: 1.1927650887312706
Energy: 1.5117652905342365
Energy: 1.4983915979909395
Energy: 1.3010609250551592
Energy: 1.2508402085851753
Energy: 1.4553679580221413
Energy: 1.192765088734235
Energy: 1.5117652905436227
Energy: 1.498391597979622
Energy: 1.5931386546159594
Energy: 1.1926281229003226
Energy: 1.2843885093405167
Energy: 1.252286740571623
Energy: 1.3003487374616782
Energy: 1.2639425694918793
Energy: 1.5931386546213935
Energy: 1.1926281229022984
Energy: 1.2843885093464447
Energy: 1.252286740572117
Energy: 1.3012404458104243
Energy: 1.2938915690208277
Energy: 1.2625182065158576
Energy: 1.5198206594356722
Energy: 1.5780923497389687
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Energy: 1.3012404458128943
Energy: 1.2938915690173696
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Energy: 1.5198206594351784
Energy: 1.5543287460627158
Energy: 1.394150071030622
Energy: 1.263510379988056
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Energy: 1.3007802983674603
Energy: 1.5543287460617277
Energy: 1.3941500709906522
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Energy: 1.624501517961855
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Energy: 1.1944435143540333
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Energy: 1.300495503010734
Energy: 1.5128562597095538
Energy: 1.624501517954939
Energy: 1.5508089482983383
Energy: 1.3993378877891023
Energy: 1.2508382226295722
Energy: 1.3009046628422258
Energy: 1.2635229317059304
Energy: 1.394150070802524
Energy: 1.5508089482963623
Energy: 1.3993378877841622
Energy: 1.2508382226251262
Energy: 1.30090466284519
Energy: 1.253278485311642
Energy: 1.2635686615183244
Energy: 1.5780923496308255
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Energy: 1.2620718438800145
Energy: 1.3610715800605595
Energy: 1.25327848531016
Energy: 1.2635686615119022
Energy: 1.578092349627367
Energy: 1.5165796829520237
Energy: 1.5419263207469687
Energy: 1.2646288926884968
Energy: 1.3004818453705087
Energy: 1.2523021422376226
Energy: 1.3288389969588474
Energy: 1.1927207089204492
Energy: 1.5419263207509206
Energy: 1.2646288926860267
Energy: 1.3004818453749547
Energy: 1.2523021422435505
Energy: 1.6180334766983067
Energy: 1.250762056358769
Energy: 1.301276196017782
Energy: 1.4977873689751662
Energy: 1.5317475674711178
Energy: 1.1935552301440628
Energy: 1.6180334766948488
Energy: 1.2507620563592634
Energy: 1.301276196015312
Energy: 1.4977873689835643
Energy: 1.3539740637721713
Energy: 1.4476234416033291
Energy: 1.3361076298764005
Energy: 1.2639867565144307
Energy: 1.3149899716314262
Energy: 1.4399297766099073
Energy: 1.353974063682306
Energy: 1.4476234415717129
Energy: 1.3361076298709667
Energy: 1.2639867565198648
Energy: 1.2638629153941228
Energy: 1.458349655409779
Energy: 1.5133905315482967
Energy: 1.2622793469562854
Energy: 1.362579688313939
Energy: 1.247827671717836
Energy: 1.2638629153960987
Energy: 1.45834965539698
Energy: 1.5133905315413805
Energy: 1.262279346971106
Energy: 1.498391596242458
Energy: 1.3004583115349313
Energy: 1.2508748134316547
Energy: 1.2196284302272498
Energy: 1.2414615848827326
Energy: 1.5394649347609084
Energy: 1.4983915980596068
Energy: 1.3004583115388835
Energy: 1.2508748134311607
Energy: 1.2196287325753146
Energy: 1.252286740573105
Energy: 1.3003487374631602
Energy: 1.2639425694903974
Energy: 1.6009962940047684
Energy: 1.2425998389407025
Energy: 1.2843885093479266
Energy: 1.252286740573105
Energy: 1.3003487374611842
Energy: 1.2639425694889155
Energy: 1.6009962940052627
Energy: 1.5198206594366603
Energy: 1.5872646890511206
Energy: 1.263568979136374
Energy: 1.284794609815768
Energy: 1.2938915690524442
Energy: 1.2635512174208654
Energy: 1.5198206594312262
Energy: 1.5872646890471684
Energy: 1.263568979136374
Energy: 1.284794609815768
Energy: 1.3007405225259332
Energy: 1.2508319019119412
Energy: 1.300557404801134
Energy: 1.505039938037118
Energy: 1.396428973095758
Energy: 1.2634494960834661
Energy: 1.300740522525439
Energy: 1.2508319019030494
Energy: 1.3005574048055797
Energy: 1.5050399380386

minimum gb energy = 1.1926281229003226 eV
minimum distance =  2.15645711559274 Angstroms
sigma value = 33


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

Energy: 1.4746470071295605
Energy: 1.4872978419002685
Energy: 1.450480482388546
Energy: 1.6636418503809824
Energy: 1.4572852650715593
Energy: 1.4972360431657157
Energy: 1.4746470071227806
Energy: 1.487297841911659
Energy: 1.4504804020586384
Energy: 1.6450410535632498
Energy: 1.577765332705882
Energy: 1.4660163416555103
Energy: 1.2820505667631792
Energy: 1.3707114092785562
Energy: 1.3241681592344428
Energy: 1.36545923128518
Energy: 1.5777653327061534
Energy: 1.4660163416574088
Energy: 1.282050556837967
Energy: 1.3707114092801835
Energy: 1.497952010615159
Energy: 1.300098066310219
Energy: 1.5129101668263008
Energy: 1.4994412484750954
Energy: 1.3299679968435814
Energy: 1.3457627054163614
Energy: 1.4979520106124469
Energy: 1.3000980663023542
Energy: 1.5129101668157485
Energy: 1.4994412484707562
Energy: 1.3893115648476533
Energy: 1.2968458442643414
Energy: 1.3554207264552722
Energy: 1.4438548847028148
Energy: 1.4475462978621851
Energy: 1.537485962121544
Energy: 1.3893115648417116
Energy: 1.2968458442472561
Energy: 1.3554207264528313
Energy: 1.4438548846984756
Energy: 1.3577798909209993
Energy: 1.2963840984031814
Energy: 1.4078320059332272
Energy: 1.5377713854085016
Energy: 1.4434988277806053
Energy: 1.4533875377595173
Energy: 1.3577798909180159
Energy: 1.296384095003326
Energy: 1.4078319467353986
Energy: 1.5377713854079593
Energy: 1.517679982780363
Energy: 1.294456598750315
Energy: 1.4466443133181528
Energy: 1.3450753950794012
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Energy: 1.5300013902979948
Energy: 1.517679982783346
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Energy: 1.5704292906528046
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Energy: 1.3300083880373252
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Energy: 1.3750313328045694
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Energy: 1.4771421308175472
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Energy: 1.3765344950822684
Energy: 1.3996025167624118
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Energy: 1.477142130811063
Energy: 1.443482408208732
Energy: 1.526113745380081
Energy: 1.322307927900511
Energy: 1.3453252543839664
Energy: 1.5700901971016576
Energy: 1.4827884845252954
Energy: 1.2823577868679474
Energy: 1.3718558774583163
Energy: 1.3223079278991552
Energy: 1.3453252543788135
Energy: 1.5700901971057257
Energy: 1.4827884841745385
Energy: 1.327098325633814
Energy: 1.3460491132154826
Energy: 1.4944592327751105
Energy: 1.2918809017891437
Energy: 1.4908548362616942
Energy: 1.5002602415741029
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Energy: 1.4944592327740256
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Energy: 1.5166982655933985
Energy: 1.408196477685076
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Energy: 1.2925973360404412
Energy: 1.355970582949511
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Energy: 1.5166982655866184
Energy: 1.408196477313979
Energy: 1.4594399834832605
Energy: 1.2925973360540008
Energy: 1.4265356116213908
Energy: 1.4459537974143806
Energy: 1.3568914465807735
Energy: 1.2988487439984353
Energy: 1.39136633270807
Energy: 1.537535227509239
Energy: 1.4265356116235355
Energy: 1.445953797420347
Energy: 1.356891446578604
Energy: 1.2988487440006047
Energy: 1.3299063358942615
Energy: 1.4549865946328624
Energy: 1.5185368193596214
Energy: 1.299412025008484
Energy: 1.3666542924435674
Energy: 1.3448136202701397
Energy: 1.3299063360953913
Energy: 1.45498659463232
Energy: 1.5185368194002764
Energy: 1.2994120250193317
Energy: 1.3229163275717533
Energy: 1.3710453641808373
Energy: 1.2820694180651406
Energy: 1.359338129940636
Energy: 1.5707851722988362
Energy: 1.3805938565771834
Energy: 1.3229163356235578
Energy: 1.3710453641792348
Energy: 1.2820722262547113
Energy: 1.3593381299441616
Energy: 1.3415953628928883
Energy: 1.3966172253804416
Energy: 1.4600592060191375
Energy: 1.477318240917753
Energy: 1.4389878525596336
Energy: 1.5265223362609819
Energy: 1.3415953622824224
Energy: 1.3972527644564159
Energy: 1.4600592060093744
Energy: 1.477318240908261
Energy: 1.281884041611335
Energy: 1.3737706623744579
Energy: 1.3208217903521853
Energy: 1.345627547525642
Energy: 1.4304916845429336
Energy: 1.455094369943965
Energy: 1.2818840416886017
Energy: 1.373770662372831
Energy: 1.3208217903456765
Energy: 1.3456275475237436
Energy: 1.3272112371985167
Energy: 1.5322380612756188
Energy: 1.3147728578140865
Energy: 1.3458314714861168
Energy: 1.3320960251826754
Energy: 1.3023223453133976
Energy: 1.327211237193093
Energy: 1.532238061268025
Energy: 1.314772854545713
Energy: 1.3458314714847606
Energy: 1.3554628434212161
Energy: 1.4513837371489176
Energy: 1.5167386803247678
Energy: 1.3233188943587653
Energy: 1.4578975200639648
Energy: 1.2891294434890594
Energy: 1.3554628434244704
Energy: 1.4513837371535279
Energy: 1.5167386803261238
Energy: 1.3233188927450414
Energy: 1.3086879536232
Energy: 1.5385409549360067
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Energy: 1.4656395738945718
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Energy: 1.5823706171972727
Energy: 1.5973409930205271
Energy: 1.3126438889520249
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Energy: 1.303518825791499
Energy: 1.4782232633431884
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Energy: 1.3453249813353452
Energy: 1.4151495656768214
Energy: 1.428874546716406
Energy: 1.408738226798417
Energy: 1.3454216575205122
Energy: 1.3124010612459327
Energy: 1.2895589078975804
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Energy: 1.4087382267992306
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Energy: 1.5899846032918825
Energy: 1.3444096618383543
Energy: 1.445991878063774
Energy: 1.5169461871207164
Energy: 1.2826260398371725

minimum gb energy = 1.2816784624497728 eV
minimum distance =  2.22449566913676 Angstroms
sigma value = 219


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

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Energy: 1.3008985079027215
Energy: 1.2434388624097255
Energy: 1.3642267912982189
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Energy: 1.3310604540480753
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Energy: 1.2530210229249472
Energy: 1.3310604540473614
Energy: 1.2433730150220552
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Energy: 1.2435845839356863
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Energy: 1.3012510607719479
Energy: 1.2435845839358493
Energy: 1.3085596877218457
Energy: 1.243337131835722
Energy: 1.4473439156183565

minimum gb energy = 1.239156083045211 eV
minimum distance =  2.30796587852092 Angstroms
sigma value = 15


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

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Energy: 1.4996999537976865
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minimum gb energy = 1.391720358667821 eV
minimum distance =  2.18230284663419 Angstroms
sigma value = 293


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

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Energy: 1.3892915136202793
Energy: 1.4943412072559623
Energy: 1.4622005118970554
Energy: 1.4368135258219075
Energy: 1.5939968888559772
Energy: 1.5031655855911064
Energy: 1.459513208058961
Energy: 1.6041307524318003
Energy: 1.4592274798955263
Energy: 1.502617882747236
Energy: 1.593996888833274
Energy: 1.5031655855963768
Energy: 1.459513208058961
Energy: 1.6041307521850159
Energy: 1.3888432553468761
Energy: 1.560197747926526
Energy: 1.4471146314881527
Energy: 1.4357988432046185
Energy: 1.4621611287438274
Energy: 1.5021156357762486
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Energy: 1.5601977479257152
Energy: 1.447114631483288
Energy: 1.4357988432070508
Energy: 1.5601689166213242
Energy: 1.4753332132193573
Energy: 1.4983993886756495
Energy: 1.453143468258287
Energy: 1.521075190391902
Energy: 1.378127278627783
Energy: 1.5162654132758195
Energy: 1.4753332132205736
Energy: 1.4983993886687574
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Energy: 1.5299869207050114
Energy: 1.5034144954532334
Energy: 1.4161718781200896
Energy: 1.554173395234305
Energy: 1.4980018454024986
Energy: 1.4697031233691649
Energy: 1.6110197467907859
Energy: 1.3921394917076715
Energy: 1.4161718781277923
Energy: 1.5541733952359267
Energy: 1.4980018454020931
Energy: 1.46970312336957
Energy: 1.4239399993111108
Energy: 1.4165487199532896
Energy: 1.4356321923347695
Energy: 1.5588886128809354
Energy: 1.4669674091903793
Energy: 1.493709877237023
Energy: 1.4239399993079045
Energy: 1.4165487199524784
Energy: 1.4356321923311206
Energy: 1.5588886128910708
Energy: 1.4544882781150807
Energy: 1.410480658256859
Energy: 1.5037446889575188
Energy: 1.5607164984100685
Energy: 1.4896210340462133
Energy: 1.5253454348899436
Energy: 1.4544882781146753
Energy: 1.4104806582556426
Energy: 1.5037446889579242
Energy: 1.560716498436015
Energy: 1.458097440659403
Energy: 1.4781710643557329
Energy: 1.4781583028799528
Energy: 1.4690984057073286
Energy: 1.4203035007440603
Energy: 1.4204070372464237
Energy: 1.4580974406602136
Energy: 1.47817106435776
Energy: 1.4781583028799528
Energy: 1.4690984057048961
Energy: 1.5609085169286963
Energy: 1.5040064444157266
Energy: 1.4136497313529885
Energy: 1.4540584503576168
Energy: 1.525421190421274
Energy: 1.493022330072054
Energy: 1.560908516929102
Energy: 1.504006444415321
Energy: 1.413649731341637
Energy: 1.4540584503576168
Energy: 1.4442980042199713
Energy: 1.4340476209419535
Energy: 1.4321934223190447
Energy: 1.423959223727381
Energy: 1.4913318325130345
Energy: 1.4669167415651867
Energy: 1.444298004218755
Energy: 1.4340476209407373
Energy: 1.432193422315396
Energy: 1.423959223727381
Energy: 1.4698600898969372
Energy: 1.4982848646637985
Energy: 1.554173395235116
Energy: 1.4156437331628946
Energy: 1.392279094125867
Energy: 1.6110197467940295
Energy: 1.4698600898953154
Energy: 1.4982848646633928
Energy: 1.554173395235116
Energy: 1.4156437331637053
Energy: 1.501981597983038
Energy: 1.5306482308359548
Energy: 1.476691902518956
Energy: 1.4689571871225438
Energy: 1.469389309410947
Energy: 1.4180380694570145
Energy: 1.501981597981011
Energy: 1.530648230836766
Energy: 1.476691902519767
Energy: 1.468957187145652

minimum gb energy = 1.378121369309237 eV
minimum distance =  2.19021696292467 Angstroms
sigma value = 293


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

Energy: 1.2059613104696014
Energy: 1.4659666259144657
Energy: 1.2346573252913375
Energy: 1.55630307337891
Energy: 1.234654278810779
Energy: 1.4699404302807313
Energy: 1.2059613104696014
Energy: 1.465966625963559
Energy: 1.2346573252942683
Energy: 1.502341549434678
Energy: 1.2351806590237144
Energy: 1.7652182653141375
Energy: 1.2346837850374588
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Energy: 1.2346837850396568
Energy: 1.673863155656884
Energy: 1.2752575371913113
Energy: 1.2036856539496046
Energy: 1.577058949129679
Energy: 1.2035361135483074
Energy: 1.2581045417262366
Energy: 1.236127399239078
Energy: 1.2752575372865336
Energy: 1.2036856539525356
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Energy: 1.2035361135424454
Energy: 1.5771221124030692
Energy: 1.2036808952116698
Energy: 1.2752599290994777
Energy: 1.236456182457562
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Energy: 1.2059613104710667
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Energy: 1.6748782510403772
Energy: 1.235388426608184
Energy: 1.2351806590215162
Energy: 1.7652182653148702
Energy: 1.2346837850367258
Energy: 1.673863155637833
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Energy: 1.235388426613313
Energy: 1.2351806590215162
Energy: 1.7070655012511917
Energy: 1.258104541725504
Energy: 1.236127399237646
Energy: 1.2752575372074315
Energy: 1.203685653948872
Energy: 1.5770589491304117
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Energy: 1.2036856539503373
Energy: 1.258082908290899
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Energy: 1.5771221124030692
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Energy: 1.275259929208622
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Energy: 1.2035520607876393
Energy: 1.5771221124030692
Energy: 1.2036808952131355
Energy: 1.67483960715983
Energy: 1.6011110420807007
Energy: 1.2346879657376364
Energy: 1.7080540109682358
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Energy: 1.2354105217913909
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Energy: 1.2346879657391014
Energy: 1.708054010964572
Energy: 1.2346573252942683
Energy: 1.5433981832040191
Energy: 1.2346542788144426
Energy: 1.469940480681529
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Energy: 1.4659666259086037
Energy: 1.234657325295001
Energy: 1.5025369515516862
Energy: 1.234654278810779
Energy: 1.4660721837025874
Energy: 1.2346837850374588
Energy: 1.6738631556371
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Energy: 1.235388426601589
Energy: 1.2351806590237144
Energy: 1.8339235054895349
Energy: 1.2346837850389243
Energy: 1.6738631556312382
Energy: 1.6748782510396445
Energy: 1.235388426635262
Energy: 1.5770589491304117
Energy: 1.2035361135409801
Energy: 1.2581045417262366
Energy: 1.2361273992398107
Energy: 1.2752575372023025
Energy: 1.2036856539496046
Energy: 1.5770589491318772
Energy: 1.2035361135439109
Energy: 1.2581045417277021
Energy: 1.236127399239078
Energy: 1.2752599291309854
Energy: 1.2364561824568294
Energy: 1.2580829082923646
Energy: 1.2035520607854409
Energy: 1.5771221124045347
Energy: 1.2036808952138685
Energy: 1.2752599291031417
Energy: 1.236456182457562
Energy: 1.2580829082901996
Energy: 1.2035520607832428
Energy: 1.235133008534311
Energy: 1.235410521793589
Energy: 1.674839607159097
Energy: 1.48434443682795
Energy: 1.2346879657427654
Energy: 1.5910717404553163
Energy: 1.2351330085357763
Energy: 1.2354105217921234
Energy: 1.67483960715983
Energy: 1.484344436718106
Energy: 1.2059613104688687
Energy: 1.4659666258873876
Energy: 1.2346573252971993
Energy: 1.5337994688068375
Energy: 1.23465427881371
Energy: 1.4660721825702785
Energy: 1.2059613104688687
Energy: 1.465966625927655
Energy: 1.2346573252971993
Energy: 1.533799468802441
Energy: 1.2351806590237144
Energy: 1.9219690741905984
Energy: 1.2346837850381913
Energy: 1.67386315556386
Energy: 1.6748782510403772
Energy: 1.2353884266037876
Energy: 1.2351806590229817
Energy: 1.9219690741891329
Energy: 1.2346837850352603
Energy: 1.6738631556158843
Energy: 1.2752575372323114
Energy: 1.2036856539518028
Energy: 1.577058949129679
Energy: 1.2035361135380491
Energy: 1.2581045417218404
Energy: 1.236127399237646
Energy: 1.275257537178122
Energy: 1.2036856539518028
Energy: 1.5770589491282134
Energy: 1.2035361135475744
Energy: 1.5771221124030692
Energy: 1.203680895214601
Energy: 1.2752599291068052
Energy: 1.2364561824590274
Energy: 1.2580829082916318
Energy: 1.2035520607847083
Energy: 1.5771221124038022
Energy: 1.2036808952094717
Energy: 1.2752599291566311
Energy: 1.2364561824597602
Energy: 1.234687965738369
Energy: 1.5910717405695896
Energy: 1.2351330085394403
Energy: 1.2354105217913909
Energy: 1.674839607159097
Energy: 1.484344436721037
Energy: 1.2346879657427654
Energy: 1.5910717397609828
Energy: 1.2351330085350438
Energy: 1.2354105217913909
Energy: 1.2346542788144426
Energy: 1.4660721825438998
Energy: 1.2059613104696014
Energy: 1.4659666259210604
Energy: 1.2346573252928028
Energy: 1.5337994688061047
Energy: 1.2346542788115118
Energy: 1.466072182466996
Energy: 1.2059613104696014
Energy: 1.4659666259298532
Energy: 1.6748782510418094
Energy: 1.235388426621373
Energy: 1.2351806590207834
Energy: 1.9219690741905984
Energy: 1.2346837850315968
Energy: 1.673863155646626
Energy: 1.674878251043275
Energy: 1.2353884266191748
Energy: 1.2351806590266452
Energy: 1.921969074191331

minimum gb energy = 1.2035361135380491 eV
minimum distance =  2.25616276010226 Angstroms
sigma value = 15


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

Energy: 1.6550384990171023
Energy: 1.435243411298126
Energy: 1.451773109732629
Energy: 1.7668052422106006
Energy: 1.4483820406366519
Energy: 1.4318774617031473
Energy: 1.6550384990190952
Energy: 1.4352434112994543
Energy: 1.4517731097389397
Energy: 1.7668052422052862
Energy: 1.5258031466531758
Energy: 1.537552352407651
Energy: 1.4482607781690184
Energy: 1.4303413554555984
Energy: 1.4391013110348847
Energy: 1.396467623064767
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Energy: 1.537552352414626
Energy: 1.4482607781710113
Energy: 1.4303413554492874
Energy: 1.4977835027464088
Energy: 1.408217317565112
Energy: 1.5210143790421669
Energy: 1.4318681816462466
Energy: 1.4358563095462429
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Energy: 1.4977835027437516
Energy: 1.408217317562787
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Energy: 1.431868181657872
Energy: 1.4936142938659196
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Energy: 1.4658264302392994
Energy: 1.4145305970258772
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Energy: 1.44308362803883
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Energy: 1.461998233340755
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Energy: 1.4289927474372475
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Energy: 1.535962071987593
Energy: 1.399721436191731
Energy: 1.4408580981703443
Energy: 1.4009784729809158
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Energy: 1.4203193611260772
Energy: 1.5359620719809501
Energy: 1.3997214361840915
Energy: 1.4323081855345858
Energy: 1.419740860856195
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Energy: 1.5496044049797428
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Energy: 1.419740860862838
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Energy: 1.3866786764772803
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Energy: 1.4420105707007358
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Energy: 1.4507504508214115
Energy: 1.4288105815991603
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Energy: 1.4610214769705
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Energy: 1.450750450819419
Energy: 1.428810581607796
Energy: 1.3976524113318518
Energy: 1.4389626734326944
Energy: 1.4015710929822947
Energy: 1.419280604918456
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Energy: 1.3976524113258733
Energy: 1.4389626734274104
Energy: 1.4015710929796377
Energy: 1.4192806049377207
Energy: 1.5605405473240463
Energy: 1.4196379601375981
Energy: 1.4487726460393278
Energy: 1.615580945728208
Energy: 1.4333838402690988
Energy: 1.4971021179451804
Energy: 1.5605405473174032
Energy: 1.419637960110694
Energy: 1.4487726460370027
Energy: 1.615580945741826
Energy: 1.405707927648702
Energy: 1.5348872327765037
Energy: 1.4400122279580712
Energy: 1.432199872952822
Energy: 1.5488957041418505
Energy: 1.4900437284755965
Energy: 1.4057079276387374
Energy: 1.5348872327765037
Energy: 1.4400122279544174
Energy: 1.4321998729551473
Energy: 1.4325584859115548
Energy: 1.4424110560547159
Energy: 1.6424416636923567
Energy: 1.4383405133738212
Energy: 1.4135944963237959
Energy: 1.5795776080711788
Energy: 1.432558485912551
Energy: 1.442411056059366
Energy: 1.6424416637086319
Energy: 1.4383405133721603
Energy: 1.5538397782946982
Energy: 1.4387377814814217
Energy: 1.4212185077234667
Energy: 1.3875229552028623
Energy: 1.4171315674093876
Energy: 1.4856955979506972
Energy: 1.553839778269787
Energy: 1.4387377814943754
Energy: 1.4212185077174884
Energy: 1.3875229552071804
Energy: 1.423339684991141
Energy: 1.5032210661951022
Energy: 1.431559519528723
Energy: 1.4380855259792336
Energy: 1.4517817358958134
Energy: 1.4711580203904207
Energy: 1.4233396849894804
Energy: 1.5032210661914482
Energy: 1.431559519524073
Energy: 1.4380855259808942
Energy: 1.422439466788219
Energy: 1.520660766661209
Energy: 1.4468383163966962
Energy: 1.4358728536892253
Energy: 1.398977634987743
Energy: 1.436033407803416
Energy: 1.422439466783569
Energy: 1.5206607666552305
Energy: 1.4468383162223792
Energy: 1.435872853675607
Energy: 1.5557931692206857
Energy: 1.3857809754131005
Energy: 1.4528715331100182
Energy: 1.3811565172838043
Energy: 1.4295632238478992
Energy: 1.4423598687258161
Energy: 1.555793162344291
Energy: 1.385780975413765
Energy: 1.4528715331060325
Energy: 1.3811565172841362
Energy: 1.5016054819602778
Energy: 1.5407888193774129
Energy: 1.4135853456858498
Energy: 1.401446629532802
Energy: 1.493296268674034
Energy: 1.4386740671756146
Energy: 1.5016054819589493
Energy: 1.540788819633408
Energy: 1.4135853456851852
Energy: 1.4014466295218415
Energy: 1.4030811264811738
Energy: 1.471845263538599
Energy: 1.5404020715081586
Energy: 1.4466950047185414
Energy: 1.4466833867653734
Energy: 1.534903734275218
Energy: 1.4030811264931309
Energy: 1.4718452635359418
Energy: 1.5404020715041729
Energy: 1.4466950047138913
Energy: 1.5627589065581216
Energy: 1.4313466735663716
Energy: 1.4232904100311954
Energy: 1.5745699079425979
Energy: 1.4476869010689597
Energy: 1.420488945088941
Energy: 1.5627589065641
Energy: 1.431346673561752
Energy: 1.4232904117436584
Energy: 1.5745699079708002
Energy: 1.458323114490154
Energy: 1.532993227933972
Energy: 1.4159059615362193
Energy: 1.417485539904662
Energy: 1.3922231644872685
Energy: 1.4440942209614833
Energy: 1.4583231144848396
Energy: 1.5329932279186933
Energy: 1.4159059615392087
Energy: 1.4174855399043298
Energy: 1.4268130375256554
Energy: 1.416885292122513
Energy: 1.5399730001966168
Energy: 1.4422899635155615
Energy: 1.4398269869298448
Energy: 1.4040949605797608
Energy: 1.4268130375276482
Energy: 1.4168852921218484
Energy: 1.5399730001956202
Energy: 1.4422899635089181
Energy: 1.4518837984533666
Energy: 1.414153467619479
Energy: 1.5668288777949397
Energy: 1.4499262076015347
Energy: 1.432304946834149
Energy: 1.40630877192998
Energy: 1.4518837982292576
Energy: 1.414153467614165
Energy: 1.5668288775817913
Energy: 1.4499262076025312
Energy: 1.460648165983986
Energy: 1.5297284648125944
Energy: 1.388509331015477
Energy: 1.4284152682269255
Energy: 1.3958250060175588
Energy: 1.437197802037903
Energy: 1.4606481659756825
Energy: 1.529728465983234
Energy: 1.3885093310207914
Energy: 1.428415268222275
Energy: 1.4285097205138733
Energy: 1.554122461538198
Energy: 1.4096433233858552
Energy: 1.4545764033542299
Energy: 1.4093762715380111
Energy: 1.4490978797348457
Energy: 1.4285097205148696
Energy: 1.5541224615455054
Energy: 1.4096433232600316
Energy: 1.4545764033568869
Energy: 1.471997641092497
Energy: 1.4264798890677037
Energy: 1.5990562898331548
Energy: 1.5135467673660334
Energy: 1.4407431893073472
Energy: 1.4130493912756503
Energy: 1.4719976410905045
Energy: 1.4264798890696964
Energy: 1.5990562898368084
Energy: 1.5135467673617153
Energy: 1.4062290087690725
Energy: 1.4837663958084637
Energy: 1.440416233019538
Energy: 1.5603751879065126
Energy: 1.4492593285224227
Energy: 1.4335787835516671
Energy: 1.4062290087710658
Energy: 1.4837664021841908
Energy: 1.4404162330145558
Energy: 1.5603751878952195
Energy: 1.432314246817771
Energy: 1.4590598622278388
Energy: 1.470082569216581
Energy: 1.40984235310974
Energy: 1.5230213530426189
Energy: 1.3855997868415273
Energy: 1.4323142468094672
Energy: 1.459059862223853
Energy: 1.4700825692155843
Energy: 1.4098423531090756
Energy: 1.4028874080017912
Energy: 1.4277152388739591
Energy: 1.5662480918330857
Energy: 1.618128602982908
Energy: 1.417973441931051
Energy: 1.4608381519514162
Energy: 1.4028874079944837
Energy: 1.4277152387913148
Energy: 1.566248093441285
Energy: 1.618128602982908
Energy: 1.3820487886974293
Energy: 1.4431909398947564
Energy: 1.3989147080227136
Energy: 1.5623452474643982
Energy: 1.5008525316081776
Energy: 1.4236696212724052
Energy: 1.382048788696433
Energy: 1.4431909398947564
Energy: 1.3989147080907738
Energy: 1.5623452479524138
Energy: 1.448218671627031
Energy: 1.430169654157579
Energy: 1.524610292832747
Energy: 1.3724819338802023
Energy: 1.460517897065888
Energy: 1.3816309548271224
Energy: 1.448218671629024
Energy: 1.4301696541479467
Energy: 1.5246102928284286
Energy: 1.372481933886513

minimum gb energy = 1.3724819338802023 eV
minimum distance =  2.23919609673615 Angstroms
sigma value = 437


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

Energy: 1.5332184544766312
Energy: 1.585205630927925
Energy: 1.4129135789120406
Energy: 1.4540508603885005
Energy: 1.4443205584897831
Energy: 1.4995476865866022
Energy: 1.5332184544778413
Energy: 1.5852056309230846
Energy: 1.4129135789084104
Energy: 1.454050851816512
Energy: 1.4623603324475007
Energy: 1.5999374443265162
Energy: 1.4099163788643898
Energy: 1.4167679085245308
Energy: 1.4988339029242703
Energy: 1.451394395070803
Energy: 1.462360332453551
Energy: 1.5999374443277259
Energy: 1.4099163788450284
Energy: 1.4167679085209008
Energy: 1.3767004276966774
Energy: 1.457552402323476
Energy: 1.5800569328912832
Energy: 1.3836222837426193
Energy: 1.413772558112712
Energy: 1.486704669721026
Energy: 1.3767004276942572
Energy: 1.457552402324686
Energy: 1.5800569328960685
Energy: 1.3836222837450391
Energy: 1.4795708287643692
Energy: 1.404202201718161
Energy: 1.4203647247878188
Energy: 1.4071027291248346
Energy: 1.4094635352502944
Energy: 1.4929436910453273
Energy: 1.4795712120709552
Energy: 1.404202201718161
Energy: 1.4203647247841886
Energy: 1.407102729116364
Energy: 1.391770175805694
Energy: 1.4641578863244074
Energy: 1.4058774070854145
Energy: 1.5032728534072404
Energy: 1.401985690830102
Energy: 1.5891558679365372
Energy: 1.3917701758093242
Energy: 1.3990619059158675
Energy: 1.4058774070842044
Energy: 1.5032728534060855
Energy: 1.3918003923446582
Energy: 1.548770389145939
Energy: 1.4164030693440601
Energy: 1.387250663430224
Energy: 1.3837085413502082
Energy: 1.4130051893792612
Energy: 1.3918003923530737
Energy: 1.5487703891398885
Energy: 1.41640306933922
Energy: 1.387250663433854
Energy: 1.5540108844345053
Energy: 1.3991945049740266
Energy: 1.4903068935377937
Energy: 1.4062079476158686
Energy: 1.3957099398382455
Energy: 1.4590575818285412
Energy: 1.554010884427245
Energy: 1.3991945049728167
Energy: 1.4903068935365835
Energy: 1.4062079476207092
Energy: 1.4029102840747827
Energy: 1.469085706271964
Energy: 1.4110033189040794
Energy: 1.4160426959873171
Energy: 1.4972935166646568
Energy: 1.4042753780593318
Energy: 1.4029102840735725
Energy: 1.469085706271964
Energy: 1.4110033189064994
Energy: 1.416042695984897
Energy: 1.494942404995302
Energy: 1.4514454341502232
Energy: 1.662288470228188
Energy: 1.3767219094589547
Energy: 1.4131455502205372
Energy: 1.4908414758149966
Energy: 1.494942404997722
Energy: 1.4514454341478031
Energy: 1.662288470228188
Energy: 1.3767219094637948
Energy: 1.5796759910740013
Energy: 1.4371016283162277
Energy: 1.4212243746966502
Energy: 1.391278942331885
Energy: 1.412696549666568
Energy: 1.5844845642882057
Energy: 1.5796759910764213
Energy: 1.4371016283077571
Energy: 1.4212243747014908
Energy: 1.3912789423355152
Energy: 1.6050336416032607
Energy: 1.4915812733143639
Energy: 1.3971428335333937
Energy: 1.4140992815639024
Energy: 1.4954411015274554
Energy: 1.4037370223005676
Energy: 1.6050336415996305
Energy: 1.491581273316784
Energy: 1.3971428335333937
Energy: 1.4140992815602722
Energy: 1.3586856797514455
Energy: 1.4735218413133075
Energy: 1.6149292111259197
Energy: 1.3514879995283902
Energy: 1.6085157040973659
Energy: 1.4691258501140276
Energy: 1.3586856797502356
Energy: 1.4735218413108875
Energy: 1.61492921121662
Energy: 1.35148799952476
Energy: 1.378451284873829
Energy: 1.4174867648081655
Energy: 1.5119884751272252
Energy: 1.4176338220380695
Energy: 1.4104418720307006
Energy: 1.493525025627483
Energy: 1.3784512846621761
Energy: 1.4174867648057452
Energy: 1.5119884751284354
Energy: 1.4176338220368596
Energy: 1.4286652530874175
Energy: 1.5136843864640286
Energy: 1.3950450891977646
Energy: 1.5161257367302792
Energy: 1.4156845176523447
Energy: 1.3989796391032983
Energy: 1.4286652530922581
Energy: 1.5136843864603982
Energy: 1.3950450891953443
Energy: 1.5161257367302792

minimum gb energy = 1.35148799952476 eV
minimum distance =  2.19243324375131 Angstroms
sigma value = 33