Model name: model_name=EAM_Dynamo_MendelevHanSon_2007_VFe__MO_249706810527_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=2.855312779545784
cohesive_energy=4.013297914062382
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: 0.014074238326741654
Energy: 0.014545530000763219
Energy: 0.014318869392689637
Energy: 2.0855647620483606
Energy: 0.014318869392452667
Energy: 0.014545530000763219
Energy: 0.014074238326504684
Energy: 0.014545530000289282
Energy: 0.014318869392926606
Energy: 1.4458917772034225
Energy: 0.6817516275913603
Energy: 0.016036707896716604
Energy: 0.016397849872775774
Energy: 0.6713193964434256
Energy: 0.016397849871854234
Energy: 0.016036707896268997
Energy: 0.6817516275918079
Energy: 0.01603670789579506
Energy: 0.016397849871854234
Energy: 0.6713193964427148
Energy: 0.014074238326504684
Energy: 0.014545530000289282
Energy: 0.014318869391768093
Energy: 1.9102360497441895
Energy: 0.014318869392689637
Energy: 0.014545530000526248
Energy: 0.014074238326741654
Energy: 0.01454552999936774
Energy: 0.014318869392452667
Energy: 1.9756059014413005
Energy: 0.6817516275915709
Energy: 0.016036707896505967
Energy: 0.016397849872301837
Energy: 0.6713193964436364
Energy: 0.0163978498720912
Energy: 0.016036707896268997
Energy: 0.6817516275915709
Energy: 0.01603670789579506
Energy: 0.016397849871617264
Energy: 0.6713193964438733
Energy: 0.014074238326267715
Energy: 0.014545530000052313
Energy: 0.014318869392452667
Energy: 1.9102360497441895
Energy: 0.0143188693922157
Energy: 0.014545530000052313
Energy: 0.014074238326741654
Energy: 0.014545530000052313
Energy: 0.014318869392689637
Energy: 2.085564762049072
Energy: 0.6817516275913603
Energy: 0.016036707896505967
Energy: 0.016397849872301837
Energy: 0.6713193964434256
Energy: 0.016397849871854234
Energy: 0.016036707896032027
Energy: 0.6817516275915709
Energy: 0.01603670789555809
Energy: 0.016397849872301837
Energy: 0.6713193964436364
Energy: 0.014074238326267715
Energy: 0.014545530000052313
Energy: 0.014318869392452667
Energy: 1.9756059014436176
Energy: 0.014318869392689637
Energy: 0.014545530000763219
Energy: 0.014074238326741654
Energy: 0.014545530000052313
Energy: 0.014318869392452667
Energy: 1.9102360497453479

minimum gb energy = 0.014074238326267715 eV
minimum distance =  2.32644726110215 Angstroms
sigma value = 3


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

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Energy: 1.3817000510230455
Energy: 1.4389531826490796
Energy: 1.4652876097890235
Energy: 1.4433233514981316
Energy: 1.358649420545204
Energy: 1.4804652343470956
Energy: 1.3817000510264503
Energy: 1.4389531826485118
Energy: 1.3343074372677928
Energy: 1.3854260610437856
Energy: 1.3213283853625315
Energy: 1.415676188061706
Energy: 1.4555836051702595
Energy: 1.3323690019100793
Energy: 1.2958739114190578
Energy: 1.3854260610477585
Energy: 1.3213283853727478
Energy: 1.4156761880634086
Energy: 1.455583605940119
Energy: 1.3574689559769377
Energy: 1.3119542236161597
Energy: 1.3326513900626358
Energy: 1.3239746630693967
Energy: 1.4299973803911268
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Energy: 1.357468955972965
Energy: 1.293003262265758
Energy: 1.332651390060933
Energy: 1.3239746630705318
Energy: 1.422457348949184
Energy: 1.2940189534296733
Energy: 1.2777731476703502
Energy: 1.316872255692903
Energy: 1.3030670595084624
Energy: 1.3263255766956683
Energy: 1.422457348949184
Energy: 1.2940189534285382
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Energy: 1.3016701834539746
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Energy: 1.2918331998241086
Energy: 1.5003599604519535
Energy: 1.3204599815126163
Energy: 1.302471165876381
Energy: 1.2821241385737658
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Energy: 1.3204599815131841
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Energy: 1.2982492876310472
Energy: 1.4208141778255174
Energy: 1.441804263857102
Energy: 1.33152107758608
Energy: 1.2976922506844144
Energy: 1.29988713754221
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Energy: 1.4418042638644801
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Energy: 1.2976922506849822
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Energy: 1.4434135514049722
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Energy: 1.3975138246997167
Energy: 1.3300005537435504
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Energy: 1.3485995160664033
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Energy: 1.3167020588920613
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Energy: 1.2485852807582924
Energy: 1.2955654663717535
Energy: 1.2982265978480199
Energy: 1.3459817261915057
Energy: 1.3321566379474263
Energy: 1.377608836161165
Energy: 1.3719786080186407
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Energy: 1.2982265978457497
Energy: 1.3459817261898033
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Energy: 1.3776088361600298
Energy: 1.4950426054492292
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Energy: 1.3867707495346708
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Energy: 1.4228765108822512
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Energy: 1.310096433146771
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Energy: 1.3969419356314943
Energy: 1.3100964331456362
Energy: 1.292704529199385
Energy: 1.2827640860553626
Energy: 1.3013092620152096
Energy: 1.320252506386662
Energy: 1.476872824746376
Energy: 1.3123517349651292
Energy: 1.3137370991611534
Energy: 1.2827640860564977
Energy: 1.3013092620152096
Energy: 1.3202525063838244
Energy: 1.5003599604559263
Energy: 1.2922196302074047
Energy: 1.3037699564310654
Energy: 1.3020306728812514
Energy: 1.3035753805965642
Energy: 1.2839798741683397
Energy: 1.2772600547994675
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Energy: 1.303769956432768
Energy: 1.3020306728784137
Energy: 1.3035753805937262
Energy: 1.317235997937217
Energy: 1.2788538790372668
Energy: 1.2924687674568367
Energy: 1.4223950458854409
Energy: 1.3263290834398416
Energy: 1.2751511338770334
Energy: 1.3172359979389197
Energy: 1.2788538790401043
Energy: 1.2924687674545665
Energy: 1.4223950458848733
Energy: 1.323974663066559
Energy: 1.2940654585605398
Energy: 1.3038511329643345
Energy: 1.3576938349852008
Energy: 1.2735765167943816
Energy: 1.4315028120631927
Energy: 1.323974663066559
Energy: 1.2940654585605398
Energy: 1.3049226841135215
Energy: 1.3576938349914436
Energy: 1.455196386532887
Energy: 1.4222537955133567
Energy: 1.3215116923153445
Energy: 1.3859571346844848
Energy: 1.2954551246579054
Energy: 1.3316981913244479
Energy: 1.4551963865283464
Energy: 1.4222537955116539
Energy: 1.3215116923045611
Energy: 1.3859571346822148
Energy: 1.36296106421069
Energy: 1.443323351527593
Energy: 1.3586494205537174
Energy: 1.4804652343408526
Energy: 1.3817000510281532
Energy: 1.4389531826417012
Energy: 1.3343074345521564
Energy: 1.443323351517377
Energy: 1.3586494205662036
Energy: 1.4804652343419877
Energy: 1.4555836053523927
Energy: 1.3323690019095118
Energy: 1.2958739114184903
Energy: 1.385426061039245
Energy: 1.3213283853676399
Energy: 1.415676188061706
Energy: 1.455583606053578
Energy: 1.332369001910647
Energy: 1.2958739114167874
Energy: 1.3854260610415152
Energy: 1.3239746630671263
Energy: 1.4299973803916943
Energy: 1.2671569666975024
Energy: 1.3574689559826134
Energy: 1.3002302738865468
Energy: 1.3326513900586627
Energy: 1.3239746630648563
Energy: 1.4299973803939645
Energy: 1.2725169305166069
Energy: 1.3574689559831807
Energy: 1.3168722556900652
Energy: 1.3030670595107328
Energy: 1.3263255766956683
Energy: 1.4224573489497518
Energy: 1.2940189534280222
Energy: 1.2777731476692151
Energy: 1.3168722556912003
Energy: 1.3030670595078948
Energy: 1.3263255766962359
Energy: 1.4224573489503192

minimum gb energy = 1.2485852807582924 eV
minimum distance =  2.2161627538998 Angstroms
sigma value = 75


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

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Energy: 1.5066684994665471
Energy: 1.4610442065614617
Energy: 1.470317916821961
Energy: 1.518102108612511
Energy: 1.556684491746935
Energy: 1.6149778864301252
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Energy: 1.435029471160725
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Energy: 1.3364928115970154
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Energy: 1.4125802597775932
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minimum gb energy = 1.327515747966237 eV
minimum distance =  2.2079431049959 Angstroms
sigma value = 105


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

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Energy: 1.3522663975050027
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Energy: 1.4447665968091776
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Energy: 1.3683891722155046
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Energy: 1.3328824784085678
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Energy: 1.4911073168895168
Energy: 1.3315680111175423
Energy: 1.3619866748600749
Energy: 1.3337931753030754
Energy: 1.3328824784110673
Energy: 1.333264745345893
Energy: 1.4911073168867048
Energy: 1.331568011116605
Energy: 1.584157911541873
Energy: 1.4062085702421943
Energy: 1.3778829422916052
Energy: 1.3720311145977653
Energy: 1.4180773389126662
Energy: 1.3693607241782297
Energy: 1.5841579115415605
Energy: 1.4062085702390699
Energy: 1.377882942290668
Energy: 1.372031114595891
Energy: 1.468655318321237
Energy: 1.405492236255646
Energy: 1.5211939025751169
Energy: 1.4292096160075378
Energy: 1.3984760815846127
Energy: 1.4650082711453494
Energy: 1.4686553183231115
Energy: 1.405492236257833
Energy: 1.5211939025754295
Energy: 1.4292096159944159
Energy: 1.4278472246670046
Energy: 1.370540356936113
Energy: 1.4003999498780764
Energy: 1.374966726822058
Energy: 1.4274838387421032
Energy: 1.4037387262027328
Energy: 1.4278472246663798
Energy: 1.3705403569395496
Energy: 1.4003999498790136
Energy: 1.3749667268261196
Energy: 1.3442862001603724
Energy: 1.3688985127932192
Energy: 1.4174658025973663
Energy: 1.3320574228339765
Energy: 1.5057880256864664
Energy: 1.3322178927306658
Energy: 1.3442862001606848
Energy: 1.3688985127957183
Energy: 1.4174658025898683
Energy: 1.3320574228349138
Energy: 1.333754855986406
Energy: 1.4024544758567017
Energy: 1.3696628822446828
Energy: 1.403106279748913
Energy: 1.3357248618173447
Energy: 1.3339590684929896
Energy: 1.3337548559885928
Energy: 1.4024544758595134
Energy: 1.3696628822421837
Energy: 1.4031062797495377
Energy: 1.4336846653658541
Energy: 1.3965574486856729
Energy: 1.37106051814991
Energy: 1.4129563381004633
Energy: 1.3942388399757895
Energy: 1.5424392064012284
Energy: 1.4336846653315156
Energy: 1.3965574486862977
Energy: 1.3710605181474107
Energy: 1.4129563381001506

minimum gb energy = 1.299911721230045 eV
minimum distance =  2.22625029012069 Angstroms
sigma value = 165


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

Energy: 1.3820403143375262
Energy: 1.6162938963515032
Energy: 1.341485248507008
Energy: 1.5909424767529212
Energy: 1.3341389725813955
Energy: 1.616055022572297
Energy: 1.3820403143418163
Energy: 1.6162938963525757
Energy: 1.3414852485037905
Energy: 1.4132892208732926
Energy: 1.3378066393411103
Energy: 1.3407051715088891
Energy: 1.3516003980232973
Energy: 1.3870179195360255
Energy: 1.254929186443707
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Energy: 1.337806639342183
Energy: 1.340705171503526
Energy: 1.3516003980254425
Energy: 1.387017919537098
Energy: 1.2774870923024009
Energy: 1.465217155591497
Energy: 1.368784073869028
Energy: 1.2740285378713008
Energy: 1.3495292056141224
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Energy: 1.2774870923013282
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Energy: 1.3134163996275567
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Energy: 1.3291227429641672
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Energy: 1.276328182831155
Energy: 1.2586326721540135
Energy: 1.3197548451330965
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Energy: 1.3242103844743232
Energy: 1.3367459004659175
Energy: 1.3408963051910399
Energy: 1.357850194410915
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Energy: 1.3620192195970073
Energy: 1.3242103842459627
Energy: 1.3367459004659175
Energy: 1.3408963052767973
Energy: 1.3777379941717618
Energy: 1.304106623958331
Energy: 1.3591365957030652
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Energy: 1.346094524387817
Energy: 1.2739319571175942
Energy: 1.3777379941653263
Energy: 1.3041066239057992
Energy: 1.359136595706283
Energy: 1.4649852131692944
Energy: 1.2726599161031535
Energy: 1.4118944391115513
Energy: 1.3549584425586525
Energy: 1.313175476640089
Energy: 1.2547256190023763
Energy: 1.2733395529658436
Energy: 1.2726599160999357
Energy: 1.4118944391147688
Energy: 1.3549584425597252
Energy: 1.3131754766390162
Energy: 1.2739558527088553
Energy: 1.3687840738679555
Energy: 1.4652380308288895
Energy: 1.2774942439057857
Energy: 1.40499902844698
Energy: 1.352659288940037
Energy: 1.2739558527142183
Energy: 1.3687840738679555
Energy: 1.465238030827817
Energy: 1.2774942439047128
Energy: 1.3862939299498562
Energy: 1.3529386600471958
Energy: 1.3746642014073043
Energy: 1.3379892278206869
Energy: 1.2744017165814294
Energy: 1.2546499952045516
Energy: 1.3862939299391306
Energy: 1.352938660048268
Energy: 1.3746642014201507
Energy: 1.3379892278185417
Energy: 1.421116077689385
Energy: 1.3341389725803228
Energy: 1.6160550225701518
Energy: 1.3820403143375262
Energy: 1.6162938963536484
Energy: 1.3414852485059356
Energy: 1.4132892208443575
Energy: 1.3341389725835406
Energy: 1.6160550225701518
Energy: 1.3820403143385986

minimum gb energy = 1.2546499952045516 eV
minimum distance =  2.21033768917276 Angstroms
sigma value = 41


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

Energy: 1.3924782804862843
Energy: 1.2570470712395265
Energy: 1.1743540651947943
Energy: 1.433784773901552
Energy: 1.176536200977841
Energy: 1.2576814312730065
Energy: 1.3924782804762963
Energy: 1.2570470712428556
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Energy: 1.1474831963677317
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Energy: 1.2481250831286297
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Energy: 1.3435005209596036
Energy: 1.174865377617791
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Energy: 1.183897550098087
Energy: 1.3155913223537972
Energy: 1.174971651001221
Energy: 1.2742501473982886
Energy: 1.1489116052142865
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Energy: 1.1749716510028854
Energy: 1.274250147391668
Energy: 1.2330528360570618
Energy: 1.2420382851836083
Energy: 1.3228457776567337
Energy: 1.1467788061741508
Energy: 1.1468029235610187
Energy: 1.3087836920072071
Energy: 1.2330528360587263
Energy: 1.2420382851898504
Energy: 1.3228457776588145
Energy: 1.1467788061828899
Energy: 1.2587579922426924
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Energy: 1.1501668764879975
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Energy: 1.1749001550381135
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Energy: 1.32632842428766
Energy: 1.242323040849762
Energy: 1.2534667391187375
Energy: 1.3240433561111966
Energy: 1.1748819418548602
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Energy: 1.229632084681185
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Energy: 1.1498045480986445
Energy: 1.2955032583485901
Energy: 1.1748819418556926
Energy: 1.3316135639144995
Energy: 1.229632084681601
Energy: 1.1487776932712508
Energy: 1.175081982315347
Energy: 1.3719453302935252
Energy: 1.230097228409263
Energy: 1.2492365612941632
Energy: 1.1741904334846252
Energy: 1.376660192896786
Energy: 1.1750819823045648
Energy: 1.3719453302947735
Energy: 1.2300972221094737
Energy: 1.249236561287921
Energy: 1.149961317841917
Energy: 1.2757355573524902
Energy: 1.2292524378406764
Energy: 1.2652464440724616
Energy: 1.1762855051610868
Energy: 1.2744621007891397
Energy: 1.14996131784483
Energy: 1.275735557349161
Energy: 1.2292524378427572
Energy: 1.2652464440766233
Energy: 1.148268036342933
Energy: 1.3305178471891845
Energy: 1.2502699781695943
Energy: 1.2330997715244458
Energy: 1.3280932888486943
Energy: 1.1470215329584361
Energy: 1.148268036340436
Energy: 1.3305178471862713
Energy: 1.250269978172507
Energy: 1.2330997715261103
Energy: 1.3011459833980956
Energy: 1.17467259351769
Energy: 1.328315498252717
Energy: 1.2006802717845917
Energy: 1.145916887809468
Energy: 1.1500308482628918
Energy: 1.301145983393518
Energy: 1.1746725935185225
Energy: 1.3283154982585432
Energy: 1.2006802717858402
Energy: 1.3285294662468867
Energy: 1.1751048644620117
Energy: 1.3691471164612383
Energy: 1.2338139534749342
Energy: 1.2474249064654044
Energy: 1.2737228067438953
Energy: 1.3285294662448057
Energy: 1.175104864459931
Energy: 1.3691471164633193
Energy: 1.2338139536014059
Energy: 1.3066375173733988
Energy: 1.1487830902096707
Energy: 1.3422261289595214
Energy: 1.2285538225783526
Energy: 1.2656233870877989
Energy: 1.1812059202031
Energy: 1.306637517378809
Energy: 1.1487830902129998
Energy: 1.3422261289595214
Energy: 1.228553822582514

minimum gb energy = 1.1454366039858899 eV
minimum distance =  2.25813374118999 Angstroms
sigma value = 185


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

Energy: 1.2858404727341228
Energy: 1.2414556055114787
Energy: 1.4764736850784481
Energy: 1.483482638969609
Energy: 1.476005293091867
Energy: 1.18230858792301
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Energy: 1.5401350046997953
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Energy: 1.4758786356562708
Energy: 1.153563059354727
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Energy: 1.2879619321457545
Energy: 1.476582206033041
Energy: 1.228835770820682
Energy: 1.295026440051839
Energy: 1.2052025190847118
Energy: 1.2144432274640093
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Energy: 1.1856757124031814
Energy: 1.4926867741818561
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Energy: 1.4926867741863021
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Energy: 1.209992890655491
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Energy: 1.2913475088482205
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Energy: 1.2913475088462443
Energy: 1.2100027641833326
Energy: 1.5624357021434339
Energy: 1.2084446032153542
Energy: 1.2377481406595592
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Energy: 1.4622721034228354
Energy: 1.1850158847860122
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Energy: 1.2084446032207876
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Energy: 1.43689545234498
Energy: 1.287657277766258
Energy: 1.368612424255044
Energy: 1.2999297150305038
Energy: 1.2141765332135885
Energy: 1.1961227792708766
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Energy: 1.287657277764776
Energy: 1.368612424255044
Energy: 1.2999297150324798
Energy: 1.2141765332150705
Energy: 1.2145398641415932
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Energy: 1.4631518269873842
Energy: 1.2065861763150358
Energy: 1.2950264400790081
Energy: 1.2052025190901456
Energy: 1.214539864144557
Energy: 1.3252118394691628
Energy: 1.4631518269883719
Energy: 1.20658617631553
Energy: 1.4365510376452781
Energy: 1.2388564197922047
Energy: 1.2086250477706484
Energy: 1.3339647524020786
Energy: 1.1856757123903376
Energy: 1.4926867741818561
Energy: 1.4365510376491852
Energy: 1.238856419791711
Energy: 1.208625047775588
Energy: 1.3339647524050424
Energy: 1.2099928906545032
Energy: 1.29003536453521
Energy: 1.2050311051116913
Energy: 1.4968965432725068
Energy: 1.1858288098274634
Energy: 1.2283650616361999
Energy: 1.2099928906525272
Energy: 1.290035364539656
Energy: 1.2050311051087275
Energy: 1.4968965432715187
Energy: 1.4762840623850848
Energy: 1.520382915803886
Energy: 1.2130612417842563
Energy: 1.214951410389537
Energy: 1.2329045008355053
Energy: 1.2063906795392327
Energy: 1.476284062386073
Energy: 1.5203829158028979
Energy: 1.2130612417891962
Energy: 1.2149514103969465
Energy: 1.2898845693814933
Energy: 1.2094579213054855
Energy: 1.2097147660845378
Energy: 1.493523681700028
Energy: 1.2757065385308308
Energy: 1.2134084096319524
Energy: 1.2898845693775414
Energy: 1.2094579213079557
Energy: 1.2097147678892672
Energy: 1.493523681701016

minimum gb energy = 1.131084199464154 eV
minimum distance =  2.18507415581338 Angstroms
sigma value = 33


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

Energy: 1.4329038640514742
Energy: 1.466178123292564
Energy: 1.4086891814308027
Energy: 1.4428681477482745
Energy: 1.408096636645587
Energy: 1.485109993351989
Energy: 1.4329038640501184
Energy: 1.4661781232988016
Energy: 1.408689181426464
Energy: 1.4248079288958442
Energy: 1.5119005554805023
Energy: 1.4076054223119414
Energy: 1.2214823883212738
Energy: 1.3179012826685057
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Energy: 1.2757781995353836
Energy: 1.5119005554894513
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Energy: 1.317901282658743
Energy: 1.3943631101268377
Energy: 1.2330915956806707
Energy: 1.447560861064638
Energy: 1.5392479101920884
Energy: 1.250835556678521
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Energy: 1.3943631101273801
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Energy: 1.5392479101918173
Energy: 1.3238023762349151
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Energy: 1.4740266590514708
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Energy: 1.3811564689873503
Energy: 1.4061865077963558
Energy: 1.3270208129311551
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Energy: 1.230068390061818
Energy: 1.2506694786717896
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Energy: 1.2545031741201014
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Energy: 1.3272253744001614
Energy: 1.4093871606309525
Energy: 1.4472370160231023
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Energy: 1.501959737686036
Energy: 1.286610581879392
Energy: 1.3272253744042293
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Energy: 1.447237016028797
Energy: 1.2205757416272398
Energy: 1.3120049194888685
Energy: 1.2531463363336992
Energy: 1.2781245277561288
Energy: 1.391165866654463
Energy: 1.440334037311484
Energy: 1.2205757416215448
Energy: 1.3120049194858856
Energy: 1.2531463363426483
Energy: 1.2781245277599256
Energy: 1.2599764989683697
Energy: 1.4723465178918598
Energy: 1.2506716094429284
Energy: 1.2792114004435746
Energy: 1.2761322758005131
Energy: 1.2301358601766863
Energy: 1.2599764989662003
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Energy: 1.2506716094418437
Energy: 1.279211400443032
Energy: 1.3209581930733054
Energy: 1.4092979747117194
Energy: 1.487721926605346
Energy: 1.2941003944349976
Energy: 1.4035810603220285
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Energy: 1.3247334876399637
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Energy: 1.5457401244354547
Energy: 1.322116590956685
Energy: 1.4091351826495926
Energy: 1.488182479906272
Energy: 1.2254045472174047

minimum gb energy = 1.2199824753021866 eV
minimum distance =  2.24687065849965 Angstroms
sigma value = 219


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

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Energy: 1.8424731998264725
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Energy: 1.2346362269471296
Energy: 1.1978764267433686
Energy: 1.2226374366112718
Energy: 1.1976627325369473
Energy: 1.3168709568288692

minimum gb energy = 1.195291659164623 eV
minimum distance =  2.2282497712713 Angstroms
sigma value = 15


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

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minimum gb energy = 1.3375190950042068 eV
minimum distance =  2.21294112095693 Angstroms
sigma value = 293


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

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Energy: 1.331854223388345
Energy: 1.437506511885875
Energy: 1.4038524431581643
Energy: 1.3739659351613571
Energy: 1.3923928121075568
Energy: 1.5240442509788195
Energy: 1.3318542233871289
Energy: 1.4375065118862804
Energy: 1.403852443158975
Energy: 1.3739659351617626
Energy: 1.5359203368634373
Energy: 1.4611479932901699
Energy: 1.3923668483624774
Energy: 1.6030003411516573
Energy: 1.3932124412051219
Energy: 1.4718334626996614
Energy: 1.5359203368654644
Energy: 1.461147993286116
Energy: 1.3923668483616665
Energy: 1.6030003411540898
Energy: 1.331768625643625
Energy: 1.5238079381225746
Energy: 1.3922784500544385
Energy: 1.3739381318032344
Energy: 1.4036513031078872
Energy: 1.437253918323923
Energy: 1.331768625642814
Energy: 1.5238079381193315
Energy: 1.3922784500544385
Energy: 1.3739381318044503
Energy: 1.4776164730864167
Energy: 1.4117341854549843
Energy: 1.440404457279392
Energy: 1.395599901602724
Energy: 1.374231712985238
Energy: 1.3172415765940326
Energy: 1.5057608109595049
Energy: 1.4117341854549843
Energy: 1.440404457281419
Energy: 1.3955999015978593
Energy: 1.4162742182952268
Energy: 1.4144120360777046
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Energy: 1.4067726570934023
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Energy: 1.4144120360756773
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Energy: 1.43425068482869
Energy: 1.3568517130467375
Energy: 1.495513998835859
Energy: 1.4319362892811687
Energy: 1.4060443348325904
Energy: 1.5958631770707534
Energy: 1.3303223073416415
Energy: 1.3568517130463318
Energy: 1.4955139988374806
Energy: 1.431936289280763
Energy: 1.406044334833401
Energy: 1.3639206565708473
Energy: 1.381726978961138
Energy: 1.3754907647947476
Energy: 1.5407062304740375
Energy: 1.4039430677660314
Energy: 1.4313673407639103
Energy: 1.3639206565700364
Energy: 1.381726978962354
Energy: 1.3754907647935313
Energy: 1.540706230474443
Energy: 1.3976756530767567
Energy: 1.3845483414512803
Energy: 1.4418258057409636
Energy: 1.4819494268239515
Energy: 1.4237605447085284
Energy: 1.4974765314128649
Energy: 1.3976756530767567
Energy: 1.3845483414529018
Energy: 1.4418258057405584
Energy: 1.4819494268365188
Energy: 1.4067625307158715
Energy: 1.4192473876013518
Energy: 1.4192402619737248
Energy: 1.406667581106938
Energy: 1.3617605922630127
Energy: 1.3612621635156823
Energy: 1.4067625307150609
Energy: 1.419247387601757
Energy: 1.4192402619741302
Energy: 1.406667581106938
Energy: 1.4820029730616404
Energy: 1.4416953722885202
Energy: 1.3846051839847342
Energy: 1.3976871351622775
Energy: 1.5006434562305662
Energy: 1.4242832561852887
Energy: 1.4820029730608295
Energy: 1.4416953722881147
Energy: 1.384605183983518
Energy: 1.397687135161872
Energy: 1.5406774679830606
Energy: 1.3766044451773738
Energy: 1.3816516733725792
Energy: 1.363981205459148
Energy: 1.4317962239607116
Energy: 1.4038561047186224
Energy: 1.5406774679818447
Energy: 1.3766044451773738
Energy: 1.3816516733733901
Energy: 1.3639812054579317
Energy: 1.4062177738585064
Energy: 1.4311300793440795
Energy: 1.495513998835859
Energy: 1.3561287210665205
Energy: 1.33033627322718
Energy: 1.5958631770739966
Energy: 1.4062177738597228
Energy: 1.4311300793457011
Energy: 1.495513998835859
Energy: 1.356128721068142
Energy: 1.4559389189873213
Energy: 1.5268129779802997
Energy: 1.415708031038708
Energy: 1.4157897842462406
Energy: 1.4062008291057946
Energy: 1.3969512589212816
Energy: 1.4559389189865104
Energy: 1.5268129779802997
Energy: 1.4157080310399242
Energy: 1.4157897841899274

minimum gb energy = 1.3172415765940326 eV
minimum distance =  2.21310142040906 Angstroms
sigma value = 293


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

Energy: 1.139245285208721
Energy: 1.4039093134412521
Energy: 1.169823120954129
Energy: 1.632506901248639
Energy: 1.1698331360059144
Energy: 1.3491523978862852
Energy: 1.139245285208721
Energy: 1.4039093134353904
Energy: 1.1698231209533965
Energy: 1.4821115723081488
Energy: 1.2463689337727573
Energy: 1.798244629836884
Energy: 1.169892639735915
Energy: 1.4737018918789453
Energy: 1.5872906414725068
Energy: 1.1708945227253025
Energy: 1.2463689337734898
Energy: 1.8226647577245843
Energy: 1.1698926397351823
Energy: 1.2815767081452394
Energy: 1.2141356877839573
Energy: 1.136228096607456
Energy: 1.5284742708263899
Energy: 1.1360581860147352
Energy: 1.2916052228555748
Energy: 1.1725996417397024
Energy: 1.214135687786155
Energy: 1.1362280966059906
Energy: 1.5284742708263899
Energy: 1.1360581860147352
Energy: 1.5286241935175504
Energy: 1.1362094435753962
Energy: 1.2141342727047186
Energy: 1.1726112598322052
Energy: 1.2916660606451005
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Energy: 1.1362094435775942
Energy: 1.214134272706184
Energy: 1.1726112598322052
Energy: 1.1698736102778269
Energy: 1.7488538545067895
Energy: 1.2459134711287532
Energy: 1.1709050248082187
Energy: 1.5873943517752367
Energy: 1.565222595085888
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Energy: 1.2459134711294857
Energy: 1.170905024811882
Energy: 1.1698331360066474
Energy: 1.3491523978862852
Energy: 1.139245285208721
Energy: 1.4039093134471137
Energy: 1.169823120954129
Energy: 1.6059642483374594
Energy: 1.1698331360066474
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Energy: 1.139245285208721
Energy: 1.4039093134353904
Energy: 1.5872906414725068
Energy: 1.1708945227275003
Energy: 1.2463689337712918
Energy: 1.7982446298332206
Energy: 1.1698926397373803
Energy: 1.423619312632306
Energy: 1.5872906414725068
Energy: 1.1708945227275003
Energy: 1.246368933770559
Energy: 1.8226647577253172
Energy: 1.2916052228570403
Energy: 1.1725996417397024
Energy: 1.2141356877883533
Energy: 1.136228096607456
Energy: 1.5284742708256571
Energy: 1.1360581860162007
Energy: 1.2916052228555748
Energy: 1.1725996417397024
Energy: 1.2141356877832246
Energy: 1.1362280966081888
Energy: 1.291666060644368
Energy: 1.1361128725202392
Energy: 1.5286241935175504
Energy: 1.1362094435739307
Energy: 1.2141342727098476
Energy: 1.1726112598322052
Energy: 1.2916660606458332
Energy: 1.1361128725239027
Energy: 1.5286241935182834
Energy: 1.1362094435761287
Energy: 1.5873943517737716
Energy: 1.5652225950851553
Energy: 1.1698736102726979
Energy: 1.7986449982429369
Energy: 1.2459134711287532
Energy: 1.1709050248111494
Energy: 1.5873943517745044
Energy: 1.5652225950844227
Energy: 1.1698736102785596
Energy: 1.5065908340955532
Energy: 1.1698231209533965
Energy: 1.6717029886374712
Energy: 1.16983313600738
Energy: 1.2678273129503297
Energy: 1.139245285208721
Energy: 1.4039093134375884
Energy: 1.1698231209533965
Energy: 1.6305323845838933
Energy: 1.1698331360066474
Energy: 1.214252016975611
Energy: 1.1698926397351823
Energy: 1.2815767081481704
Energy: 1.5872906414725068
Energy: 1.1708945227275003
Energy: 1.2463689337720243
Energy: 1.7348848731390936
Energy: 1.1698926397344496
Energy: 1.2815767081474374
Energy: 1.5872906414717738
Energy: 1.1708945227282332
Energy: 1.5284742708256571
Energy: 1.1360581860140027
Energy: 1.2916052228555748
Energy: 1.1725996417397024
Energy: 1.214135687786155
Energy: 1.1362280966045253
Energy: 1.5284742708278551
Energy: 1.1360581860125372
Energy: 1.291605222854842
Energy: 1.1725996417397024
Energy: 1.2141342727069169
Energy: 1.1726112598322052
Energy: 1.2916660606451005
Energy: 1.136112872518774
Energy: 1.5286241935182834
Energy: 1.1362094435775942
Energy: 1.2141342727069169
Energy: 1.1726112598322052
Energy: 1.2916660606458332
Energy: 1.13611287252317
Energy: 1.2459134711302187
Energy: 1.170905024811882
Energy: 1.5873943517737716
Energy: 1.5652225950851553
Energy: 1.1698736102778269
Energy: 1.8226647577231188
Energy: 1.2459134711280204
Energy: 1.1709050248089512
Energy: 1.5873943517745044
Energy: 1.5652225950851553
Energy: 1.139245285208721
Energy: 1.4039093134353904
Energy: 1.1698231209533965
Energy: 1.503868248258255
Energy: 1.1698331360081127
Energy: 1.2142520169800073
Energy: 1.139245285208721
Energy: 1.4039093134471137
Energy: 1.1698231209533965
Energy: 1.6325069012501046
Energy: 1.2463689337712918
Energy: 1.5458140565110552
Energy: 1.1698926397344496
Energy: 1.2815767081496359
Energy: 1.5872906414725068
Energy: 1.1708945227267678
Energy: 1.2463689337742225
Energy: 1.625567288636865
Energy: 1.1698926397351823
Energy: 1.281576708148903
Energy: 1.2141356877839573
Energy: 1.1362280966052578
Energy: 1.5284742708263899
Energy: 1.1360581860118044
Energy: 1.2916052228563075
Energy: 1.1725996417397024
Energy: 1.2141356877839573
Energy: 1.1362280966037925
Energy: 1.5284742708263899
Energy: 1.13605818601327
Energy: 1.5286241935175504
Energy: 1.1362094435768615
Energy: 1.214134272706184
Energy: 1.1726112598322052
Energy: 1.2916660606451005
Energy: 1.1361128725195064
Energy: 1.5286241935182834
Energy: 1.1362094435753962
Energy: 1.214134272706184
Energy: 1.1726112598322052
Energy: 1.1698736102770944
Energy: 1.8226647577253172
Energy: 1.245913471131684
Energy: 1.1709050248089512
Energy: 1.5873943517752367
Energy: 1.565222595085888
Energy: 1.1698736102741634
Energy: 1.8226647577231188
Energy: 1.2459134711272877
Energy: 1.1709050248038222
Energy: 1.1698331360059144
Energy: 1.2142520169792745
Energy: 1.139245285208721
Energy: 1.4039093134368559
Energy: 1.1698231209533965
Energy: 1.6560542520142882
Energy: 1.1698331360066474
Energy: 1.2142520169741455
Energy: 1.139245285208721
Energy: 1.4039093134353904
Energy: 1.5872906414717738
Energy: 1.1708945227304313
Energy: 1.2463689337734898
Energy: 1.4966046466328784
Energy: 1.1698926397337168
Energy: 1.2815767081518339
Energy: 1.5872906414725068
Energy: 1.1708945227296985
Energy: 1.2463689337720243
Energy: 1.6788416286341836

minimum gb energy = 1.1360581860118044 eV
minimum distance =  2.20885684441262 Angstroms
sigma value = 15


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

Energy: 1.6048109222279139
Energy: 1.369712826683426
Energy: 1.402182172295968
Energy: 1.759848202224121
Energy: 1.4003404775356554
Energy: 1.3828227110909967
Energy: 1.6048109222299067
Energy: 1.3697128266788061
Energy: 1.4021821722969643
Energy: 1.7341102096912004
Energy: 1.4564755138706518
Energy: 1.4492363684468121
Energy: 1.3979648655143944
Energy: 1.381525989512755
Energy: 1.3746818411444903
Energy: 1.3399082692035487
Energy: 1.456475513874305
Energy: 1.449236368456414
Energy: 1.397964865523694
Energy: 1.3815259895144154
Energy: 1.4459631295344004
Energy: 1.3670088557954534
Energy: 1.457142325239975
Energy: 1.388778907130591
Energy: 1.3884004778488577
Energy: 1.43715550970722
Energy: 1.4459631295433684
Energy: 1.3670088557984423
Energy: 1.457142325247282
Energy: 1.3887789071325838
Energy: 1.4672860792821383
Energy: 1.3535890601205518
Energy: 1.4106005692900614
Energy: 1.3473968444519893
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Energy: 1.3535890601102558
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Energy: 1.3473968444546467
Energy: 1.4021655662968815
Energy: 1.4914442181495842
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Energy: 1.4070664095526149
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Energy: 1.402165566299871
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Energy: 1.42570668851213
Energy: 1.3727836339591537
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Energy: 1.3897384172861358
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Energy: 1.3727836339591537
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Energy: 1.3170477710389459
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Energy: 1.4034693970710843
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Energy: 1.3678431067014254
Energy: 1.5568562843644926
Energy: 1.403729574439146
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Energy: 1.3360043719396353
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Energy: 1.3678431068342192
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Energy: 1.341020945629098
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Energy: 1.4128000576473123
Energy: 1.356440958203664
Energy: 1.4930889839203862
Energy: 1.3913353106452757
Energy: 1.3792842013910787
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Energy: 1.4128000576473123
Energy: 1.3564409582029997
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Energy: 1.3340560581832948
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Energy: 1.3416731266842494
Energy: 1.4869404671476807
Energy: 1.3790456754043083
Energy: 1.4625721135996368
Energy: 1.4698752134220336
Energy: 1.3356189318136882
Energy: 1.3823000701146078
Energy: 1.337074515237434
Energy: 1.3790456754059692
Energy: 1.4625721136019618
Energy: 1.4698752134207052
Energy: 1.3356189318193346
Energy: 1.445439758034862
Energy: 1.373275685343559
Energy: 1.5255165248736495
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Energy: 1.3705841752128316
Energy: 1.3290107250058618
Energy: 1.4454397580365226
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Energy: 1.3986256367814283
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Energy: 1.4303096552741061
Energy: 1.3873676348812676
Energy: 1.392155954506736
Energy: 1.4652781315999526
Energy: 1.4059129438231512
Energy: 1.4253019597803394
Energy: 1.346269291458298
Energy: 1.387367634872964
Energy: 1.39215595438756
Energy: 1.4652781315992882
Energy: 1.4059129438224869
Energy: 1.3287730970040506
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Energy: 1.4766136222192798
Energy: 1.3669729981384067
Energy: 1.3839053350839576
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Energy: 1.3897526820322166
Energy: 1.4517658484444946
Energy: 1.476613622215626
Energy: 1.3954582926441277
Energy: 1.3798254979026674
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Energy: 1.3647294730911586
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Energy: 1.4010196827049104
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Energy: 1.5051004108465191
Energy: 1.3872382247818438
Energy: 1.3289049058227913
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Energy: 1.3360817801046032
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Energy: 1.318111755847626
Energy: 1.3872382247738726
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Energy: 1.4155753216155722
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Energy: 1.3962625117970262
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Energy: 1.402700170159952
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Energy: 1.426347457102602
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Energy: 1.3955330305892852
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Energy: 1.4027001701589554
Energy: 1.4152749384710095
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Energy: 1.433506580638322
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Energy: 1.4152749384786485
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Energy: 1.3914382070697546
Energy: 1.43350658063334
Energy: 1.3878995838835098
Energy: 1.4370757594604795
Energy: 1.3400104078215818
Energy: 1.37046698290174
Energy: 1.5551313621610956
Energy: 1.473007109774902
Energy: 1.3878995838835098
Energy: 1.4370757594641332
Energy: 1.3400104078199209
Energy: 1.3704669829140288
Energy: 1.3935205175178946
Energy: 1.3906884138750941
Energy: 1.3287589413211631
Energy: 1.3574582813370086
Energy: 1.3301338647252523
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Energy: 1.3935205175202197
Energy: 1.390688413874762
Energy: 1.3287589413214953
Energy: 1.3574582813250518
Energy: 1.4183044285980952
Energy: 1.3471580810310655
Energy: 1.381592242923771
Energy: 1.3792573557904884
Energy: 1.4591784076967607
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Energy: 1.3471580810260835
Energy: 1.38159224292048
Energy: 1.3792573557855061
Energy: 1.4079604808173138
Energy: 1.3495164690462207
Energy: 1.397146037172262
Energy: 1.3734921086803158
Energy: 1.479824341024263
Energy: 1.3497191286411239
Energy: 1.4079604808119996
Energy: 1.3495164690326331
Energy: 1.3971460371739226
Energy: 1.3734921086670606
Energy: 1.3137313665255603
Energy: 1.4296158123764282
Energy: 1.3360916228892097
Energy: 1.357964629020569
Energy: 1.3876948406238625
Energy: 1.4699593369905164
Energy: 1.3137313665258925
Energy: 1.42961581237045
Energy: 1.3360916228955204
Energy: 1.3579646290066494
Energy: 1.5061851445278522
Energy: 1.3756328255511014
Energy: 1.396635823878806
Energy: 1.529859505391883
Energy: 1.3966908984321942
Energy: 1.445684428778143
Energy: 1.5061851445288486
Energy: 1.3756328255421342
Energy: 1.396635823874156
Energy: 1.5298595054008508
Energy: 1.3267083028551923
Energy: 1.4801605465879415
Energy: 1.3934722420567296
Energy: 1.3850008181373965
Energy: 1.4790554550969452
Energy: 1.4170959543963841
Energy: 1.3267083029225857
Energy: 1.4801605465935879
Energy: 1.3934722420511134
Energy: 1.3850008181387248
Energy: 1.353349668620521
Energy: 1.395957062727462
Energy: 1.4703707000528288
Energy: 1.3917180598821035
Energy: 1.3661335458324357
Energy: 1.5162386363583604
Energy: 1.3533496686092286
Energy: 1.3959570627281264
Energy: 1.4703707142595743
Energy: 1.3917180598784802
Energy: 1.4811514937040402
Energy: 1.3914963987708207
Energy: 1.364516861619348
Energy: 1.3227651175095683
Energy: 1.4039483366641057
Energy: 1.410726053547256
Energy: 1.48115149372427
Energy: 1.3914963987651745
Energy: 1.36451686161503
Energy: 1.3227651175195323
Energy: 1.3501549106051076
Energy: 1.4397696041328794
Energy: 1.3812924030674618
Energy: 1.3917436963220768
Energy: 1.3875425288182228
Energy: 1.420671832750741
Energy: 1.3501549105997932
Energy: 1.4397696041352044
Energy: 1.3812924030704512
Energy: 1.3917436963237375
Energy: 1.349247615807162
Energy: 1.4650913349742276
Energy: 1.3762006709603478
Energy: 1.389929933628351
Energy: 1.341946435417593
Energy: 1.3664188055497355
Energy: 1.3492476158051692
Energy: 1.465091334974892
Energy: 1.3762006709653298
Energy: 1.3899299336220403
Energy: 1.4734306697390511
Energy: 1.329673274266486
Energy: 1.3918563639770087
Energy: 1.3168060871690068
Energy: 1.3727861310955878
Energy: 1.3961196346228717
Energy: 1.4734306697350652
Energy: 1.3296732742628325
Energy: 1.3918563639723591
Energy: 1.3168060871673464
Energy: 1.44653517229422
Energy: 1.489158237937225
Energy: 1.3682321423588266
Energy: 1.3452325485926362
Energy: 1.4636197735797463
Energy: 1.3909132757079647
Energy: 1.4465351723001982
Energy: 1.4891582379365607
Energy: 1.3682321423638084
Energy: 1.345232548591972
Energy: 1.357929543137214
Energy: 1.4106575176643188
Energy: 1.4685275884609124
Energy: 1.3993039539271797
Energy: 1.3956126310140613
Energy: 1.478677590647407
Energy: 1.3579295431332585
Energy: 1.4106575176679725
Energy: 1.4685275884625733
Energy: 1.399303953926848
Energy: 1.4798384236488484
Energy: 1.405055939385869
Energy: 1.4031274684351382
Energy: 1.5594088527117254
Energy: 1.3933970055613694
Energy: 1.3742194255204687
Energy: 1.4798384236538302
Energy: 1.4050559393868653
Energy: 1.4031274684424453
Energy: 1.5594088527020935
Energy: 1.410025570021866
Energy: 1.4727879275769495
Energy: 1.3683388407457047
Energy: 1.357965131283981
Energy: 1.333309193661223
Energy: 1.3968110496193926
Energy: 1.4100255700401334
Energy: 1.4727879275746245
Energy: 1.3683388407423833
Energy: 1.3579651312793313
Energy: 1.3805452103207854
Energy: 1.3564837242885086
Energy: 1.489974568453924
Energy: 1.3898466905783569
Energy: 1.393738089598842
Energy: 1.3406712056519636
Energy: 1.380545210322114
Energy: 1.356483724281866
Energy: 1.4899745684572454
Energy: 1.3898466905830071
Energy: 1.3730146657724123
Energy: 1.3410349813483602
Energy: 1.5239183806171348
Energy: 1.374271317828611
Energy: 1.3861522094723686
Energy: 1.3400254392559745
Energy: 1.3730146657734088
Energy: 1.3410349813513496
Energy: 1.5239183806224488
Energy: 1.3742713178173183
Energy: 1.3754745994426218
Energy: 1.4754288545284913
Energy: 1.3173026733060251
Energy: 1.3615878869622424
Energy: 1.3289498586791233
Energy: 1.3916501143461584
Energy: 1.3754745994489326
Energy: 1.4754288544889669
Energy: 1.3173026733017072
Energy: 1.3615878869688853
Energy: 1.3915226967754568
Energy: 1.5069990894911593
Energy: 1.3484588035566967
Energy: 1.4040403939891024
Energy: 1.343272832585645
Energy: 1.4341579895992111
Energy: 1.391522696773464
Energy: 1.5069990894914913
Energy: 1.3484588035769567
Energy: 1.4040403939980703
Energy: 1.4115297813815288
Energy: 1.3726048815887752
Energy: 1.454821554462915
Energy: 1.4442313876898252
Energy: 1.3802432920484327
Energy: 1.3457685817380574
Energy: 1.4115297813821932
Energy: 1.372604881598075
Energy: 1.4548215544672332
Energy: 1.4442313876808572
Energy: 1.3588374650212125
Energy: 1.4442568428138507
Energy: 1.4058048272227155
Energy: 1.4714997521363566
Energy: 1.3929850955294185
Energy: 1.3851994717503464
Energy: 1.3588374650228734
Energy: 1.4442568428181684
Energy: 1.4058048272237118
Energy: 1.471499752137685
Energy: 1.3892904748628094
Energy: 1.4045389592348343
Energy: 1.4099655880846205
Energy: 1.3510550244126847
Energy: 1.461930237297122
Energy: 1.3280802504287967
Energy: 1.3892904748661308
Energy: 1.4045389592308488
Energy: 1.4099655880729958
Energy: 1.3510550244130168
Energy: 1.3449485843308047
Energy: 1.3662429554376359
Energy: 1.4795186236379014
Energy: 1.5507243191710247
Energy: 1.3759388120734568
Energy: 1.437360359072579
Energy: 1.3449485843278157
Energy: 1.3662429554392965
Energy: 1.4795186236452085
Energy: 1.5507243191710247
Energy: 1.3160922301514755
Energy: 1.3819256499904014
Energy: 1.3440030080330139
Energy: 1.5370111849153045
Energy: 1.434596872113751
Energy: 1.3927158466756095
Energy: 1.3160922301494826
Energy: 1.381925649993391
Energy: 1.3440030080399885
Energy: 1.5370111849136436
Energy: 1.4011742790820785
Energy: 1.3779317319539923
Energy: 1.4719618740963905
Energy: 1.308935340511865
Energy: 1.4055840975444471
Energy: 1.311977668226594
Energy: 1.4011742790817463
Energy: 1.377931731948014
Energy: 1.4719618741040295
Energy: 1.3089353405141901

minimum gb energy = 1.3069129554253547 eV
minimum distance =  2.24689215974745 Angstroms
sigma value = 437


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

Energy: 1.4109125864297796
Energy: 1.4884350472239463
Energy: 1.3952101197556401
Energy: 1.8183191077363225
Energy: 1.394772683047025
Energy: 1.3766261703432643
Energy: 1.4109125864382497
Energy: 1.4884350471404544
Energy: 1.39521011975806
Energy: 1.4788917277115152
Energy: 1.4195963700242247
Energy: 1.7552028457657396
Energy: 1.3498761751054111
Energy: 1.359722701794281
Energy: 1.5433481636105997
Energy: 1.3555468158766446
Energy: 1.4195963700278547
Energy: 1.7552028457596893
Energy: 1.3498761751078312
Energy: 1.3597227017918612
Energy: 1.3634400822920305
Energy: 1.354647820060227
Energy: 1.5054744480078557
Energy: 1.3602497235547801
Energy: 1.351541260562209
Energy: 1.3773582858969147
Energy: 1.3634400822799302
Energy: 1.354647820060227
Energy: 1.5054744281927945
Energy: 1.360249723551205
Energy: 1.7125477043485386
Energy: 1.3480714786635122
Energy: 1.368516019338069
Energy: 1.321758820994286
Energy: 1.3713844708259877
Energy: 1.3406218713210447
Energy: 1.7125477043424888
Energy: 1.3480714786623023
Energy: 1.368516019338069
Energy: 1.3217588209954962
Energy: 1.3490232023781419
Energy: 1.3795775216574544
Energy: 1.377361927081987
Energy: 1.4364012433371374
Energy: 1.2996219607808062
Energy: 1.3335082955843933
Energy: 1.349023202375722
Energy: 1.4422857130125115
Energy: 1.3773619270710966
Energy: 1.4364012433468174
Energy: 1.345251385061325
Energy: 1.4619900994336166
Energy: 1.3604194235454954
Energy: 1.3398120481955957
Energy: 1.3340734304235646
Energy: 1.4631294938552797
Energy: 1.345251385061325
Energy: 1.4619900994167314
Energy: 1.3604194235503355
Energy: 1.3398120482028557
Energy: 1.6583684967076304
Energy: 1.3612378030282084
Energy: 1.4202580762858672
Energy: 1.3197666653081812
Energy: 1.3508655813823431
Energy: 1.3553733254831042
Energy: 1.6583684967136805
Energy: 1.3612378030282084
Energy: 1.4202580762931274
Energy: 1.3197666653130216
Energy: 1.36354946769304
Energy: 1.3615384418915166
Energy: 1.3502462912035653
Energy: 1.321614621856951
Energy: 1.5033038865353543
Energy: 1.3479456149276023
Energy: 1.3635494676990898
Energy: 1.3615384418854666
Energy: 1.3502462911999353
Energy: 1.3216146218533211
Energy: 1.3237541786360232
Energy: 1.4340149953723935
Energy: 1.695284133262087
Energy: 1.3564624516170243
Energy: 1.3947027815693553
Energy: 1.6414795128316042
Energy: 1.323754178632393
Energy: 1.4340149953723935
Energy: 1.695284133263297
Energy: 1.3564624516085542
Energy: 1.4989848935360268
Energy: 1.3499559415942235
Energy: 1.3373839208435634
Energy: 1.4403927194350659
Energy: 1.3502417998334182
Energy: 1.5627763724227541
Energy: 1.4989848935360268
Energy: 1.3499559415942235
Energy: 1.3373839208423535
Energy: 1.4403927194350659
Energy: 1.5867671197806614
Energy: 1.3379177038930306
Energy: 1.3515174827077356
Energy: 1.3607017282670708
Energy: 1.4292623835491196
Energy: 1.349042184706288
Energy: 1.5867671197746114
Energy: 1.3379177038869803
Energy: 1.3515174827077356
Energy: 1.3607017282646507
Energy: 1.3236562108049885
Energy: 1.3614415882044417
Energy: 1.576952821193184
Energy: 1.3271747823130084
Energy: 1.581272255321693
Energy: 1.3595408894480185
Energy: 1.3236562108061982
Energy: 1.3614415882020219
Energy: 1.5769528211943942
Energy: 1.3271747823130084
Energy: 1.5869504338262592
Energy: 1.3489373945535463
Energy: 1.4292623835479095
Energy: 1.3606494360426364
Energy: 1.3516147879612392
Energy: 1.3392340593282142
Energy: 1.5869504338214193
Energy: 1.3489373945499166
Energy: 1.4292623835491196
Energy: 1.3606494360402162
Energy: 1.5175270623630646
Energy: 1.5646067380287922
Energy: 1.3502701829810284
Energy: 1.4442512604802284
Energy: 1.3568061472630126
Energy: 1.3499356189392646
Energy: 1.5175270623679047
Energy: 1.564606738021532
Energy: 1.3502701829858685
Energy: 1.4442512604850688

minimum gb energy = 1.2996219607808062 eV
minimum distance =  2.23722600092846 Angstroms
sigma value = 33