Model name: model_name=EAM_Dynamo_MendelevHanSrolovitz_2003_Fe__MO_807997826449_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855324894189835
cohesive_energy=4.1227593179916635
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.3390607784579838e-19, 2.2042425695245197e-19, 2.91573716915124e-19, 3.54379040967924e-19, 4.05180857678796e-19, 4.455653219154e-19, 4.77759459198996e-19, 5.04128082241368e-19, 5.267876663760299e-19, 5.469991246139399e-19, 5.6516620546686595e-19, 5.81332167703926e-19, 5.955242483278979e-19, 6.0783377140692e-19, 6.184209546043919e-19, 6.275293287686819e-19, 6.35365574685576e-19, 6.420979209016439e-19, 6.478000675420499e-19, 6.524607993703559e-19, 6.560544815604179e-19, 6.585731032290661e-19, 6.600262774361039e-19, 6.604877043066959e-19, 6.60013460023032e-19, 6.585314466365819e-19, 6.5595514660911e-19, 6.52183622812674e-19, 6.47067872820312e-19, 6.403851940798979e-19, 6.31856807857116e-19, 6.211783005915059e-19, 6.080580761356799e-19, 5.919481900808099e-19, 5.71885734269862e-19, 5.4678283076835e-19, 5.15146250953386e-19, 4.758624820643399e-19, 4.2867838019304e-19, 3.7387913278033796e-19, 3.1210881483310196e-19, 2.4415409507862597e-19, 1.7058855275188197e-19, 7.56140853709764e-20, -6.34449129650928e-20, -2.67952826800062e-19, -5.565961626516e-19, -9.45904256417358e-19, -1.4631445522313819e-18, -2.2322165735541596e-18, -3.51796332233916e-18, -5.870647557003779e-18]
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: 0.015606668954780613
Energy: 0.015771760036921222
Energy: 1.5832882875799894
Energy: 0.01620352065255039
Energy: 0.01640035492739999
Energy: 1.5820392188522863
Energy: 0.015810335341471565
Energy: 0.016594290310868724
Energy: 0.20609610751622373
Energy: 0.3754412822899048
Energy: 0.16798665513580205
Energy: 0.3750871146527699
Energy: 0.3756432178085831
Energy: 0.1681869774573569
Energy: 0.16812687644592628
Energy: 0.3749510975905105
Energy: 0.3757766082668415
Energy: 0.1678506188108545
Energy: 0.3750887692695171
Energy: 0.20506837522823582
Energy: 0.1677893075277124
Energy: 0.16929704770070728
Energy: 0.37565106988630276
Energy: 0.20565908026523494
Energy: 0.16804432454641108
Energy: 0.16907085106585107
Energy: 0.20536245225628014
Energy: 0.1674241426732268
Energy: 0.1675306836350108
Energy: 0.20519802611618218
Energy: 0.37703279879593954
Energy: 0.16870734011766778
Energy: 0.37504129157159355
Energy: 0.2047179838467739
Energy: 0.16827042321636176
Energy: 0.015958664215767315
Energy: 0.2047207731546681
Energy: 0.3754574436761194
Energy: 0.016382076351291092
Energy: 0.01661417779997441
Energy: 0.3756354830354825
Energy: 0.16735982800042712

minimum gb energy = 0.015606668954780613 eV
minimum distance =  2.44044869483913 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 2.3610919412114346
Energy: 1.613079116092147
Energy: 1.7015513708108299
Energy: 1.2422650132047972
Energy: 1.2417457836123702
Energy: 2.097858413580753
Energy: 1.6128809972399505
Energy: 1.2564750022338143
Energy: 1.2961031917659531
Energy: 1.2683134760277253
Energy: 1.2695133214441126
Energy: 1.2896386541905198
Energy: 1.2595024970141002
Energy: 1.3098605025273475
Energy: 1.2275487150586057
Energy: 1.2674926476060944
Energy: 1.259480482435919
Energy: 1.2574478693324096
Energy: 1.2781870435700593
Energy: 1.2585976092893567
Energy: 1.263967371477784
Energy: 1.1936811963877405
Energy: 1.242062915017256
Energy: 1.2680913697874017
Energy: 1.2309954611743636
Energy: 1.263346494476297
Energy: 1.2876703138763115
Energy: 1.2361088865344383
Energy: 1.279430055630156
Energy: 1.239126803055767
Energy: 1.24643779413783
Energy: 1.23799070146932
Energy: 1.2532000911063204
Energy: 1.2492571749396129
Energy: 1.2317221474125726
Energy: 1.2571665170629327
Energy: 1.263165799381501
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Energy: 1.2492775585348628
Energy: 1.2432007985724618
Energy: 1.2285612236447998
Energy: 1.2520080838096956
Energy: 1.2543432943084514
Energy: 1.2385984231976284
Energy: 1.2339781227688993
Energy: 1.2619992153624024
Energy: 1.2620605970196404
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Energy: 1.255647783303015
Energy: 1.2735737138066618
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Energy: 1.2472481793735448
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Energy: 1.258996346288712
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Energy: 1.191810192965738
Energy: 1.2148764574991144
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Energy: 1.2138775213554205
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Energy: 1.2280395174333911
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Energy: 1.2447339455950224
Energy: 1.2455170188288542
Energy: 1.2400293041136652
Energy: 1.3087020445719864
Energy: 1.4230113417230077
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Energy: 1.1714825698239513
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Energy: 1.1763752098883806
Energy: 1.2729237711305808
Energy: 1.2599119420732643
Energy: 1.2898568604426897
Energy: 1.2018252779325143
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Energy: 1.2587656421688258
Energy: 1.1894220196877419
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Energy: 1.2447785629487842
Energy: 1.376020609595031
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Energy: 1.188526049534693
Energy: 1.2111576018477894
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Energy: 1.268580110014613
Energy: 1.2627616734522327
Energy: 1.3519667458289806
Energy: 1.2471499935731154
Energy: 1.2802358449712918
Energy: 1.3631660126591878
Energy: 1.2693983334853076
Energy: 1.2705558608432883
Energy: 1.2936336286815735
Energy: 1.3333609359936847
Energy: 1.2774061926893365
Energy: 1.2779198936427496
Energy: 1.2504828925984726
Energy: 1.2830803237392496
Energy: 1.2780610993876813
Energy: 1.3159469160723372
Energy: 1.2083886745950707
Energy: 1.2701757596620349
Energy: 1.2301862352007367
Energy: 1.256704462881313
Energy: 1.21700337219228
Energy: 1.255531293946317
Energy: 1.2647841700919997
Energy: 1.163310077732263
Energy: 1.1900228204824108
Energy: 1.2224379919712807
Energy: 1.2106061455123793
Energy: 1.1902104789899954
Energy: 1.241758623947995
Energy: 1.2049477814472327
Energy: 1.1824333892555827
Energy: 1.1957788555677615
Energy: 1.2174389128350018
Energy: 1.190787303991104
Energy: 1.1904378679544239
Energy: 1.2157172395000493
Energy: 1.2157162335618779
Energy: 1.311006102611357
Energy: 1.2677883255658842
Energy: 1.2162201325167785
Energy: 1.278772653645388
Energy: 1.2624545459464862
Energy: 1.2548213125623209
Energy: 1.2641875095260382
Energy: 1.209368263355729
Energy: 1.2482615715418814
Energy: 1.2616526874435887
Energy: 1.2137439530950096
Energy: 1.2546346718025763
Energy: 1.2806555517288296
Energy: 1.218829626016881
Energy: 1.2198555650563732
Energy: 1.2581205819417374
Energy: 1.2605566343609382
Energy: 1.2529439530709796
Energy: 1.30129866841064
Energy: 1.2595346599863884
Energy: 1.257638148052618
Energy: 1.2888694415161006
Energy: 1.2710717374327123
Energy: 1.3171973192393938
Energy: 1.2798542556437913
Energy: 1.2781990465636797
Energy: 1.3146883031661012
Energy: 1.2798391266642895
Energy: 1.2692198917103938
Energy: 1.3043737567267337
Energy: 1.2323960025035703
Energy: 1.2495017852249315
Energy: 1.2488881140561556
Energy: 1.2227732514442193
Energy: 1.2850973736335647

minimum gb energy = 1.1460215510079206 eV
minimum distance =  2.24753952362847 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.9883025272366075
Energy: 1.605607700075856
Energy: 1.3905987303315746
Energy: 1.5231991167270833
Energy: 1.523602926451967
Energy: 1.3570727055906138
Energy: 1.6635540385684295
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Energy: 1.248301759277232
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Energy: 1.2330973376353291
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Energy: 1.3589314559147567
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Energy: 1.3009320864224254
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Energy: 1.305000288193587
Energy: 1.173857029790342
Energy: 1.1616431903973672
Energy: 1.269774247564091
Energy: 1.2646854154105087
Energy: 1.3037477710307699
Energy: 1.2790033117979842
Energy: 1.3924556325588273
Energy: 1.2940960694553616
Energy: 1.2788932783294533
Energy: 1.356429293403615
Energy: 1.2962568232520992
Energy: 1.279189728323125
Energy: 1.2962181076735482
Energy: 1.3819913077896826
Energy: 1.314802921309119
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Energy: 1.3124721642613553
Energy: 1.304584293942441
Energy: 1.3702393781457194
Energy: 1.3488436259971994
Energy: 1.2991496571101866
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Energy: 1.3511627563339634
Energy: 1.3925403482487162
Energy: 1.393016747469192
Energy: 1.3537784414647036
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Energy: 1.3467905601621197
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Energy: 1.385870275981896
Energy: 1.3204230574665063
Energy: 1.290414187193708
Energy: 1.3841354856389672
Energy: 1.366261148913356
Energy: 1.2832534034889254
Energy: 1.366830653650211
Energy: 1.3871112079054573
Energy: 1.3279065083305142
Energy: 1.3246824877718302
Energy: 1.3620175741291647
Energy: 1.3867650131324547
Energy: 1.3146130564120826
Energy: 1.3575310436527004
Energy: 1.3464940745142775
Energy: 1.230556692736846
Energy: 1.2729328637695063
Energy: 1.295350388938846
Energy: 1.296680866137435
Energy: 1.2913773378674092
Energy: 1.3032495844052405
Energy: 1.4073774954896447
Energy: 1.6776271430947225
Energy: 1.65366502061229
Energy: 1.4185701735107257
Energy: 1.3042792261775458
Energy: 1.6524360184874223
Energy: 1.4539379762628029
Energy: 1.343937730965959
Energy: 1.2747571982960642
Energy: 1.2749631263121572
Energy: 1.2904465578242386
Energy: 1.2986089057666137
Energy: 1.2759616692591342
Energy: 1.3335650615402015
Energy: 1.4489846231284411
Energy: 1.3679514892318412
Energy: 1.3168507970983465
Energy: 1.384053728761758
Energy: 1.422046150580701
Energy: 1.3424297616993945
Energy: 1.3833666397476374
Energy: 1.5107543366182175
Energy: 1.3468936504402746
Energy: 1.3384691084281066
Energy: 1.4646155571436434
Energy: 1.410421072096124
Energy: 1.337692176726418
Energy: 1.3750264522709597
Energy: 1.4710742933712238
Energy: 1.3573775661003546
Energy: 1.3347462565280377
Energy: 1.3695956524754167
Energy: 1.2967306156913077
Energy: 1.340076709722283
Energy: 1.3920960890016287
Energy: 1.267112170697488
Energy: 1.250324434489252
Energy: 1.2773187472863872
Energy: 1.296942572522393
Energy: 1.2746461334450445
Energy: 1.2995744110807488
Energy: 1.292526262989697
Energy: 1.2637073167470476
Energy: 1.2590857591524582
Energy: 1.2842646527293875
Energy: 1.2763063362725784
Energy: 1.2675626738363475
Energy: 1.2640462695398322
Energy: 1.268576389759121
Energy: 1.2610065900063168
Energy: 1.2346747119223878
Energy: 1.3241369677662709
Energy: 1.2623512310816336
Energy: 1.2240703910296307
Energy: 1.2768917974619491
Energy: 1.275495086509771
Energy: 1.29680964418622
Energy: 1.2283720159435831
Energy: 1.3287047133822754
Energy: 1.2241898534806515
Energy: 1.2575477202882344
Energy: 1.3579318987075357
Energy: 1.2204293820439889
Energy: 1.3311535955031282
Energy: 1.246610390052447
Energy: 1.2871543639265786
Energy: 1.203620953816563
Energy: 1.2435909393451554
Energy: 1.4223063709015176
Energy: 1.3650970954317443
Energy: 1.2144830197377037
Energy: 1.1843795887956847
Energy: 1.2735174373011149
Energy: 1.2159442669675302
Energy: 1.2292174068016608
Energy: 1.260973748436933
Energy: 1.216299576181003
Energy: 1.2278750973766195
Energy: 1.221932829385732
Energy: 1.2678996234648996
Energy: 1.1616697960545055
Energy: 1.1821943112845354
Energy: 1.2281793818171822
Energy: 1.2049081860648478

minimum gb energy = 1.1612175240652378 eV
minimum distance =  2.25000307075021 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.5046847704232063
Energy: 1.406279316845904
Energy: 1.4513330940277325
Energy: 1.3727691739441792
Energy: 1.399449444663129
Energy: 1.429597428332907
Energy: 1.3859199312665769
Energy: 1.28524903480002
Energy: 1.2570595437541314
Energy: 1.229984785160111
Energy: 1.2798848605089799
Energy: 1.3247845353172807
Energy: 1.3077808784503244
Energy: 1.35638708537017
Energy: 1.280717035335392
Energy: 1.26222136742836
Energy: 1.2501490475318082
Energy: 1.2272306409532083
Energy: 1.2695117797779305
Energy: 1.2808130124052572
Energy: 1.2508538034883006
Energy: 1.2499371301838478
Energy: 1.2679616888934628
Energy: 1.337706151015623
Energy: 1.2343938979477922
Energy: 1.2839670617421386
Energy: 1.211516608820924
Energy: 1.3478219212081672
Energy: 1.294769824105681
Energy: 1.2894655666819788
Energy: 1.253619815133083
Energy: 1.2410678830342736
Energy: 1.329460112442235
Energy: 1.2789050217699844
Energy: 1.23375338643655
Energy: 1.3688484235820897
Energy: 1.3341032110193285
Energy: 1.3717047492864685
Energy: 1.4028189444182693
Energy: 1.3691583414213004
Energy: 1.356711005588694
Energy: 1.4089019568819432
Energy: 1.3466568269674855
Energy: 1.3573528773418602
Energy: 1.3503906652676338
Energy: 1.3722981455805585
Energy: 1.3423759628552154
Energy: 1.3510057100920139
Energy: 1.3636169831835185
Energy: 1.2979185016189132
Energy: 1.2392242652072014
Energy: 1.3558360626943973
Energy: 1.3588033366821304
Energy: 1.3220223092512915
Energy: 1.3229141836776706
Energy: 1.3509507688637967
Energy: 1.3162945393045271
Energy: 1.245905365290302
Energy: 1.2743756646477575
Energy: 1.2567178934905403
Energy: 1.2500886099442399
Energy: 1.2612618389927126
Energy: 1.3169584408608914
Energy: 1.310668757576516
Energy: 1.2477771975964849
Energy: 1.2895532143410944
Energy: 1.3245885222498759
Energy: 1.3255662159128894
Energy: 1.2499912394171622
Energy: 1.2615020781512551
Energy: 1.246966396660251
Energy: 1.2173503148615152
Energy: 1.2351375099709376
Energy: 1.2479387657185586
Energy: 1.222858159591929
Energy: 1.2357998253590932
Energy: 1.2540390876648115
Energy: 1.3017467154355147
Energy: 1.3395307382321264
Energy: 1.3501511085104685
Energy: 1.3289432752465136
Energy: 1.3069737542869173
Energy: 1.325150331509783
Energy: 1.2965356209136212
Energy: 1.3387549164039252
Energy: 1.4078108361182058
Energy: 1.3964379042968917
Energy: 1.3473852259243617
Energy: 1.3733017339957312
Energy: 1.4019395368723768
Energy: 1.3331993872397705
Energy: 1.2538938480808541
Energy: 1.281797401777422
Energy: 1.2441872115997834
Energy: 1.2292375404414233
Energy: 1.2965008247580871
Energy: 1.2613948439698741
Energy: 1.227533519349059
Energy: 1.2281819789820194
Energy: 1.229238028174934
Energy: 1.2679602180718792
Energy: 1.2484765992157276
Energy: 1.2438802974352232
Energy: 1.2917854112307838
Energy: 1.2606380498898893
Energy: 1.3923735033878615
Energy: 1.2289836062427386
Energy: 1.275238171051367
Energy: 1.3905285591862395
Energy: 1.437712923784424
Energy: 1.305684930955712
Energy: 1.2322334469734695
Energy: 1.2965065353526004
Energy: 1.2902857748507912
Energy: 1.287409412246363
Energy: 1.2564670982593984
Energy: 1.236909856250827
Energy: 1.334896922882568
Energy: 1.2633675688699737
Energy: 1.3554321194252252
Energy: 1.3926262994383136
Energy: 1.3660836888641856
Energy: 1.3600294224278482
Energy: 1.3980903662881323
Energy: 1.3686842880398202
Energy: 1.348181231010422
Energy: 1.3515288103367589
Energy: 1.3551109868380578
Energy: 1.3410732507757857
Energy: 1.3525123988603605
Energy: 1.3684858024778268
Energy: 1.3329665219385372
Energy: 1.2970671912023672
Energy: 1.2933459850623856
Energy: 1.272230634395065
Energy: 1.2390201602026831
Energy: 1.2581747931023992
Energy: 1.2836153710007763
Energy: 1.242934667279307
Energy: 1.2697393782432873
Energy: 1.298845474819038
Energy: 1.3205842063610822
Energy: 1.26019833908316
Energy: 1.2895113163321836
Energy: 1.3538158130240765
Energy: 1.281621121700332
Energy: 1.2562548385449028
Energy: 1.278319395682068
Energy: 1.261145790605808
Energy: 1.2555527985385642
Energy: 1.2583296163831195
Energy: 1.2553909199815785
Energy: 1.2381640531613556
Energy: 1.32098471882351
Energy: 1.241123797511475
Energy: 1.226113878177617
Energy: 1.330830336158456
Energy: 1.3180703983889783
Energy: 1.3098540634257654
Energy: 1.2978644438289018
Energy: 1.303085867858315
Energy: 1.3527906483552636
Energy: 1.354228432805105
Energy: 1.3970990442042213
Energy: 1.360657015311774
Energy: 1.3381306902376446
Energy: 1.3781551796336788
Energy: 1.3820222628781709
Energy: 1.38054999014394
Energy: 1.346972479925482
Energy: 1.37328918056796
Energy: 1.397683224081639
Energy: 1.3459565837635596
Energy: 1.3747104390337375
Energy: 1.401026703715935
Energy: 1.2153684395852495
Energy: 1.2253752803952462
Energy: 1.2879054502610965
Energy: 1.2429899746005462
Energy: 1.2321069307927932
Energy: 1.293088429567736
Energy: 1.2581460241937985
Energy: 1.2910337616571215
Energy: 1.2467343158619506
Energy: 1.2398195190421744
Energy: 1.319795466707965
Energy: 1.2755432526190944
Energy: 1.2542756438324933
Energy: 1.3558435362053127
Energy: 1.2698587740424396
Energy: 1.3650058366217332
Energy: 1.2325418374595176
Energy: 1.261157550791317
Energy: 1.2100400966850233
Energy: 1.381144796996274
Energy: 1.3122099099989766
Energy: 1.2987896241911208
Energy: 1.2549389669508861
Energy: 1.2908315487260904
Energy: 1.3419834415953762
Energy: 1.3225888106465014
Energy: 1.3177312065331306
Energy: 1.3120795728776296
Energy: 1.3344524889532443
Energy: 1.3862280174699657
Energy: 1.4058543845601277
Energy: 1.3641846072916335
Energy: 1.3649146576638798
Energy: 1.3696021870587836
Energy: 1.3492760539781434
Energy: 1.3161574758882884
Energy: 1.3186599349947519
Energy: 1.3720046880498853
Energy: 1.3273536292646984
Energy: 1.3380876502747807
Energy: 1.3519215770762747
Energy: 1.3078918995810642
Energy: 1.247746990544591
Energy: 1.2662227325350632
Energy: 1.2650436073533806
Energy: 1.237688303438377
Energy: 1.233824335683255
Energy: 1.2822473524378089
Energy: 1.2869530016107105
Energy: 1.2932048825464095
Energy: 1.3848781242112478
Energy: 1.3713355523209507
Energy: 1.2452463346576115
Energy: 1.2489136970159853
Energy: 1.2627618328849797
Energy: 1.2952090563612295
Energy: 1.287952630513695
Energy: 1.2350776144860962
Energy: 1.2530564733081204
Energy: 1.2523137987059478
Energy: 1.2757311997269174
Energy: 1.2636146920770563
Energy: 1.2885441381406
Energy: 1.2513522122672678
Energy: 1.2979016360971627
Energy: 1.3039466390779355
Energy: 1.2953544497553606
Energy: 1.3142335688695623
Energy: 1.2985869664160359
Energy: 1.2970418802310215
Energy: 1.3725661909223146
Energy: 1.3456658589272705
Energy: 1.3351731781845806
Energy: 1.3730729151682575
Energy: 1.4225029914461442
Energy: 1.3353767583414573
Energy: 1.3741414358685913

minimum gb energy = 1.2100400966850233 eV
minimum distance =  2.24103536442224 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.4330264360392813
Energy: 1.434149659946699
Energy: 1.5352993312761978
Energy: 1.4367407810550257
Energy: 1.4383836535059196
Energy: 1.318020751082067
Energy: 1.4353244407595231
Energy: 1.2317633004309032
Energy: 1.1889293058970538
Energy: 1.338394073720171
Energy: 1.2532273476059783
Energy: 1.1886684352571224
Energy: 1.1837043921133876
Energy: 1.2531472620206243
Energy: 1.252632293331675
Energy: 1.1519919042783713
Energy: 1.1961947717912698
Energy: 1.2666938533197605
Energy: 1.1845223249118992
Energy: 1.1798963924781214
Energy: 1.2670031102785646
Energy: 1.2724389011697517
Energy: 1.1747069163837716
Energy: 1.279301527626162
Energy: 1.2516339580032423
Energy: 1.23754027676458
Energy: 1.1349160497440318
Energy: 1.3478925287200794
Energy: 1.3667045994626197
Energy: 1.1509903918901376
Energy: 1.198515826656138
Energy: 1.2667707858242059
Energy: 1.2027293457828216
Energy: 1.1885465552279344
Energy: 1.195794389968609
Energy: 1.1968573955162733
Energy: 1.1939295305248296
Energy: 1.171173293566841
Energy: 1.218252161216575
Energy: 1.1957202118309556
Energy: 1.1708885662788584
Energy: 1.2199411389828252
Energy: 1.183855836888784
Energy: 1.1996219395801766
Energy: 1.186716151632491
Energy: 1.2226353579238958
Energy: 1.204447996481774
Energy: 1.2033124911915294
Energy: 1.2346618487245438
Energy: 1.196101201470359
Energy: 1.1828870404620286
Energy: 1.195448987871967
Energy: 1.2200982043647262
Energy: 1.2152332222262479
Energy: 1.1944599662666888
Energy: 1.2208938354954628
Energy: 1.1963644227837469
Energy: 1.2331868600148346
Energy: 1.3599514055972544
Energy: 1.254371767928634
Energy: 1.1994322126040395
Energy: 1.3598006913268987
Energy: 1.2546437134465402
Energy: 1.2789514221024052
Energy: 1.2333495580006844
Energy: 1.319853136721178
Energy: 1.273214380152454
Energy: 1.2886024136485452
Energy: 1.339770605924457
Energy: 1.2765667283723787
Energy: 1.1934430400640208
Energy: 1.1812772932780327
Energy: 1.1823294184492867
Energy: 1.2523348006898427
Energy: 1.1903481362354016
Energy: 1.1825408488884734
Energy: 1.265838030214278
Energy: 1.347800388985186
Energy: 1.1799824514644552
Energy: 1.2060028408615089
Energy: 1.2538165868313345
Energy: 1.3392357412142348
Energy: 1.1882247141451563
Energy: 1.2526464892169356
Energy: 1.2744557354695056
Energy: 1.2193686450337258
Energy: 1.4360120136576253
Energy: 1.4612004341480755
Energy: 1.2196919750595574
Energy: 1.1450935372616013
Energy: 1.4606656387825354
Energy: 1.2521677777867817
Energy: 1.1826180408407911
Energy: 1.1958127477215468
Energy: 1.2659064685121657
Energy: 1.1825203083398732
Energy: 1.180134819500407
Energy: 1.2537421731540996
Energy: 1.2325876215294205
Energy: 1.1889304054154357
Energy: 1.377230154331921
Energy: 1.2536857736485163
Energy: 1.1955100046092855
Energy: 1.3193083121343916
Energy: 1.253592376555933
Energy: 1.4328724737542526
Energy: 1.2895472382300113
Energy: 1.1836790461394195
Energy: 1.4359674469631996
Energy: 1.437288116791905
Energy: 1.4240847357374822
Energy: 1.433837709858162
Energy: 1.2701739268653107
Energy: 1.1813617191234227
Energy: 1.1843722210665497
Energy: 1.2525071541819246
Energy: 1.18833755189723
Energy: 1.183733126969396
Energy: 1.253091379040351
Energy: 1.2529588009085904
Energy: 1.1520604979290603
Energy: 1.1964140848680036
Energy: 1.266836098053818
Energy: 1.1829605488381771
Energy: 1.1800427257097343
Energy: 1.2671079786762307
Energy: 1.2673108536256066
Energy: 1.1747434069631906
Energy: 1.279777789591265
Energy: 1.2514663360630236
Energy: 1.2375662899620081
Energy: 1.1347567192714587
Energy: 1.3485859988590962
Energy: 1.3673410900503988
Energy: 1.1510207109860395
Energy: 1.1989206901247187
Energy: 1.254246062828974
Energy: 1.2032705287570011
Energy: 1.1890554219971627
Energy: 1.1961341769662035
Energy: 1.195925754740249
Energy: 1.1936912910608983
Energy: 1.171212154034057
Energy: 1.218237175526145
Energy: 1.1955762108840309
Energy: 1.1720655871603616
Energy: 1.2196415346131377
Energy: 1.1852828786914307
Energy: 1.199060351817614
Energy: 1.1865675634745547
Energy: 1.2225662705775455
Energy: 1.2078007915480022
Energy: 1.2032917460914678
Energy: 1.2377917181928177
Energy: 1.1959428328251576
Energy: 1.183170462074529
Energy: 1.1956769245475245
Energy: 1.2199166898270069
Energy: 1.1854465657894873
Energy: 1.1945053168433866
Energy: 1.220326413977477
Energy: 1.1968505395803901
Energy: 1.2329067391096982
Energy: 1.359680674919314
Energy: 1.254374391655287
Energy: 1.2941137559062368
Energy: 1.359287724247725
Energy: 1.2794213466218918
Energy: 1.2897048800840056
Energy: 1.2329133993227228
Energy: 1.3199548998598611
Energy: 1.2623731201897703
Energy: 1.288985480960505
Energy: 1.346617506647225
Energy: 1.2761918584623095
Energy: 1.1956273553205878
Energy: 1.180554629472699
Energy: 1.1822207574179497
Energy: 1.2523442982393158
Energy: 1.1904110029139845
Energy: 1.182370589686087
Energy: 1.2661488278293986
Energy: 1.347488076942556
Energy: 1.1828507087546407
Energy: 1.1958746021004736
Energy: 1.2539323500209667
Energy: 1.181669437240769
Energy: 1.188309280235563
Energy: 1.372344103952521
Energy: 1.2744931438636617
Energy: 1.2193703928561488
Energy: 1.4349329492005234
Energy: 1.351247817294605
Energy: 1.219836949697851
Energy: 1.1410746223714032
Energy: 1.4614683105002528
Energy: 1.2522547448773482
Energy: 1.1824251010833104
Energy: 1.1957970043382835
Energy: 1.2656146358425093
Energy: 1.1820833421161794
Energy: 1.1800891004622203
Energy: 1.253822563664637
Energy: 1.23168012687618
Energy: 1.1899325117677368
Energy: 1.3768651369192235
Energy: 1.2531524616185308
Energy: 1.1956534416008013
Energy: 1.3192926816513602
Energy: 1.2539576322645776

minimum gb energy = 1.1347567192714587 eV
minimum distance =  2.24515585491858 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.658988776533968
Energy: 1.1739657739650495
Energy: 1.146686588251322
Energy: 1.2588723116574376
Energy: 1.174165335260499
Energy: 1.18450472503866
Energy: 1.1742546673072793
Energy: 1.2570366281533953
Energy: 1.201066550084608
Energy: 1.1809651631606506
Energy: 1.247563428095478
Energy: 1.2200320209949262
Energy: 1.1790588417174697
Energy: 1.2127336773037396
Energy: 1.1993239562674076
Energy: 1.154763831545772
Energy: 1.1570248406159982
Energy: 1.1927518369744097
Energy: 1.2040927055628419
Energy: 1.1562041947102268
Energy: 1.2162926981158828
Energy: 1.204225664759403
Energy: 1.2141753587099524
Energy: 1.101131218058307
Energy: 1.2178424973233672
Energy: 1.1997110246065243
Energy: 1.1007185549683594
Energy: 1.2265955527590235
Energy: 1.1130153555785927
Energy: 1.1285069913726555
Energy: 1.1773378460566248
Energy: 1.1412031752537954
Energy: 1.1386088089210054
Energy: 1.1001816896996905
Energy: 1.1774709937541272
Energy: 1.1123381690710763
Energy: 1.1607153512218562
Energy: 1.1630275490376116
Energy: 1.1267852849098108
Energy: 1.1606868998057416
Energy: 1.1268649791817797
Energy: 1.1651999874969416
Energy: 1.107098893058321
Energy: 1.1217264093027555
Energy: 1.0866800028923105
Energy: 1.1641113575377178
Energy: 1.1210999221760356
Energy: 1.1614443694188576
Energy: 1.1219102445036426
Energy: 1.101681288408035
Energy: 1.1214349760832076
Energy: 1.1651984134142923
Energy: 1.1136950873700615
Energy: 1.120879826773331
Energy: 1.1732885480077855
Energy: 1.1314558982449072
Energy: 1.070714228780312
Energy: 1.0836099848185894
Energy: 1.1472413123491536
Energy: 1.0933764297533464
Energy: 1.0731915239608734
Energy: 1.166423435883318
Energy: 1.093084579373848
Energy: 1.07807054410697
Energy: 1.0714783037190063
Energy: 1.1499547930039036
Energy: 1.1104792449583358
Energy: 1.0681280870731444
Energy: 1.1482699672103158
Energy: 1.0997051629470862
Energy: 1.1097784401067878
Energy: 1.1072006536473307
Energy: 1.1433512012119058
Energy: 1.1283962822071052
Energy: 1.1081167456705003
Energy: 1.1437745749650448
Energy: 1.117315133871266
Energy: 1.1210474526086804
Energy: 1.151395927972067
Energy: 1.1363187436627769
Energy: 1.12572961725402
Energy: 1.1433178995265407
Energy: 1.1285963803397097
Energy: 1.1277525327418283
Energy: 1.1023856930171858
Energy: 1.1469378303261386
Energy: 1.0605631822445634
Energy: 1.0941633926291074
Energy: 1.1506282028363801
Energy: 1.063993081796067
Energy: 1.0920553528569292
Energy: 1.1222884614043631
Energy: 1.1656671424070355
Energy: 1.0614692203968425
Energy: 1.1036635481755077
Energy: 1.1448275866102777
Energy: 1.061025284764387
Energy: 1.0891908635039758
Energy: 1.1224801730615537
Energy: 1.1581600884544574
Energy: 1.101033817277175
Energy: 1.0981482210633573
Energy: 1.146288033300406
Energy: 1.1216291310219386
Energy: 1.1098751348897362
Energy: 1.1704435750580098
Energy: 1.1530094848184986
Energy: 1.1212081534681204
Energy: 1.1359619273153565
Energy: 1.1445582374267353
Energy: 1.121317151015578
Energy: 1.1354032701576444
Energy: 1.1543286244734983
Energy: 1.1409568690829472
Energy: 1.1009760613266613
Energy: 1.1459614441187258
Energy: 1.1806705403143405
Energy: 1.1220626092105082
Energy: 1.1596240894295344
Energy: 1.1765348023286923
Energy: 1.1590870939823998
Energy: 1.1380235374570984
Energy: 1.158932151536544
Energy: 1.1555336720679206
Energy: 1.138812498502038
Energy: 1.1411801747881976
Energy: 1.180336492039988
Energy: 1.10139101578798
Energy: 1.201046095163077
Energy: 1.1633121734522383
Energy: 1.1011657611740466
Energy: 1.1239384472231244
Energy: 1.2013600060968448
Energy: 1.1800119884775646
Energy: 1.1551386756984092
Energy: 1.2183563415159608
Energy: 1.2263873643370722
Energy: 1.1546234251354148
Energy: 1.1590970587439513
Energy: 1.2182148440105054
Energy: 1.176179224517392
Energy: 1.18495595296603
Energy: 1.1979516696045467
Energy: 1.231152178393094
Energy: 1.2042920929400667
Energy: 1.1581190733656639
Energy: 1.2317839728493956
Energy: 1.2539164082872032
Energy: 1.158337412831929
Energy: 1.246438643501989
Energy: 1.2289975876518169
Energy: 1.1619952294912566
Energy: 1.174007117935435
Energy: 1.2453279671230064
Energy: 1.2433182638235418
Energy: 1.2039587827704359
Energy: 1.2498030184001618
Energy: 1.2289664338340653
Energy: 1.1996523112391702
Energy: 1.1010519530616973
Energy: 1.2451280878530595
Energy: 1.237265796087093
Energy: 1.1792779446868689
Energy: 1.1991514734135027
Energy: 1.2299355105058105
Energy: 1.2015062928971694
Energy: 1.1810275946781226
Energy: 1.2319632634729125
Energy: 1.2574620422528413
Energy: 1.2016955307905357
Energy: 1.2233974022078318
Energy: 1.2234480837331094
Energy: 1.2463017543778403
Energy: 1.1822895659223014
Energy: 1.2126952611104427

minimum gb energy = 1.0605631822445634 eV
minimum distance =  2.24535229708179 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.6532227245614153
Energy: 1.2158691513246545
Energy: 1.0575981474694582
Energy: 1.1734456716527075
Energy: 1.1739129841743896
Energy: 1.101044131276636
Energy: 1.21520720855981
Energy: 1.1429515306235274
Energy: 1.0427198196576142
Energy: 1.0642366446237579
Energy: 1.0601384728034777
Energy: 1.0474668145327075
Energy: 1.0557739005760725
Energy: 1.040971275654651
Energy: 1.0889353536424986
Energy: 1.015155604563275
Energy: 1.0613672728374752
Energy: 1.0470318562502974
Energy: 1.0280906408959258
Energy: 1.0512900836580426
Energy: 1.063326829801613
Energy: 0.9982245236097705
Energy: 1.014053361977067
Energy: 1.009174749233681
Energy: 0.9927536520721484
Energy: 0.9838673012549297
Energy: 1.0095416256804217
Energy: 1.0844667932411252
Energy: 0.9492730422271204
Energy: 1.0003923505370107
Energy: 1.0501280856579178
Energy: 1.020887431675467
Energy: 0.9936472181987714
Energy: 1.0082561721391505
Energy: 1.028240722860496
Energy: 1.0084320250952084
Energy: 0.9970016876951793
Energy: 1.0300289838205976
Energy: 1.0193590002586113
Energy: 0.9923693721377957
Energy: 1.0204007434200146
Energy: 1.032113058216656
Energy: 1.0126111548688999
Energy: 1.110121455917188
Energy: 0.9929661185017463
Energy: 1.000894524377199
Energy: 0.9960429637382604
Energy: 1.025342714941578
Energy: 1.002932875404744
Energy: 1.0125460466706395
Energy: 1.1311716149807365
Energy: 1.0094735954523384
Energy: 0.988444598349671
Energy: 1.0145438964022493
Energy: 1.0137951322320782
Energy: 0.9954564518605179
Energy: 0.9975843688091398
Energy: 0.9870476178604712
Energy: 0.9961641292093695
Energy: 0.9740217324797427
Energy: 0.9830427927171212
Energy: 0.9939959358370664
Energy: 0.9751785465383731
Energy: 0.9525963428982639
Energy: 0.9746955999634986
Energy: 0.9648505584193118
Energy: 0.9681769009822594
Energy: 0.975451789718853
Energy: 1.003831521109692
Energy: 0.9726032974998063
Energy: 0.9785050503933376
Energy: 1.009732056461859
Energy: 1.012792772528271
Energy: 0.9751403910313373
Energy: 0.9753437693852551
Energy: 1.0179210503018177
Energy: 0.9557239395177061
Energy: 0.9852655313994914
Energy: 0.9738047599181888
Energy: 0.9606505357457082
Energy: 0.9587744932404849
Energy: 0.9723628567554394
Energy: 0.9603956586460506
Energy: 0.9588148881029684
Energy: 0.9699451783142986
Energy: 0.9897965403071788
Energy: 0.9299992796813753
Energy: 0.9517391203637593
Energy: 1.001552731642324
Energy: 0.9328216650742518
Energy: 0.951441540532523
Energy: 0.9704432715804677
Energy: 0.9473381158550489
Energy: 0.929912014040678
Energy: 0.9489974861420684
Energy: 0.9969202859444639
Energy: 0.9199697827524989
Energy: 0.9520551393972929
Energy: 0.9895566747990036
Energy: 0.9455828246105006
Energy: 0.9388276552976453
Energy: 0.9504803958021623
Energy: 0.9479786010349903
Energy: 0.939104618962223
Energy: 0.9542968203477832
Energy: 0.929112648294012
Energy: 0.9273424618002489
Energy: 0.9408977403154131
Energy: 0.9529259358418825
Energy: 0.9348273640909593
Energy: 0.9417703859890543
Energy: 0.9546288027255205
Energy: 0.9275676923012511
Energy: 0.9328502541339303
Energy: 0.9454365963767695
Energy: 0.9492973993484968
Energy: 0.934238865012116
Energy: 0.9472231281507634
Energy: 0.9455919453769798
Energy: 0.9611180300550175
Energy: 0.9402913402199263
Energy: 0.9640996590321774
Energy: 0.9535308726602816
Energy: 0.9376700274761863
Energy: 0.9563601529390106
Energy: 0.9625567959389071
Energy: 0.9952925164139117
Energy: 0.9370503908813657
Energy: 0.9571293719769565
Energy: 0.9459382227164802
Energy: 0.9363778302704999
Energy: 0.9562645239880206
Energy: 0.9519664393174422
Energy: 0.9140045530871085
Energy: 0.9105763271031718
Energy: 0.9645317214760816
Energy: 0.9278213762212864
Energy: 0.9057021816386289
Energy: 0.9628487356729911
Energy: 0.9265121279837891
Energy: 0.9435977545260887
Energy: 0.9481966073524958
Energy: 0.9547604257042164
Energy: 0.9364610697480534
Energy: 0.9540447402643176
Energy: 0.9543290097232869
Energy: 0.9393750427394784
Energy: 0.9509456264792514
Energy: 0.9577349265359621
Energy: 0.9569063627434288
Energy: 0.9379662015064154
Energy: 0.9547489777755885
Energy: 0.9556036981139131
Energy: 0.9391709765932619
Energy: 0.9440610039323248
Energy: 0.9668863846580178
Energy: 0.9019578053913078
Energy: 0.9300784991801472
Energy: 0.9608130707156516
Energy: 0.9055236330024609
Energy: 0.9257023946813528
Energy: 0.9667203720212645
Energy: 0.9940759282670136
Energy: 0.9362180675111006
Energy: 0.9467143641099672
Energy: 0.9546682422683425
Energy: 0.9350564946798471
Energy: 0.9735503405114393
Energy: 0.9769362665846875
Energy: 0.9621093969083458
Energy: 0.9401910887517381
Energy: 0.9584080681672452
Energy: 0.9695128570589121
Energy: 0.9389335833448964
Energy: 0.9477068525529475
Energy: 0.9554972138616553
Energy: 0.9354851864702315
Energy: 0.9376744681831954
Energy: 0.9468875667292145
Energy: 0.9424787239939943
Energy: 0.9356848230957848
Energy: 0.9441425313427936
Energy: 0.9479077597626352
Energy: 0.9344634031959533
Energy: 0.9249551957497804
Energy: 0.9530689391165958
Energy: 0.9434009499662097
Energy: 0.9217531155370962
Energy: 0.9428552506158885
Energy: 0.9660414213346008
Energy: 0.9428721685827617
Energy: 0.9364357362598279
Energy: 0.9725991373441618
Energy: 0.9369417654348107
Energy: 0.9488556632586848
Energy: 0.970894907387402
Energy: 0.9424108346828344
Energy: 0.9337779293921904
Energy: 0.9990287981217805
Energy: 0.9510737957082265
Energy: 0.9299545582807272
Energy: 0.9987445541345273
Energy: 0.9493733750466704
Energy: 0.9422530044434309
Energy: 0.9367534800896946
Energy: 1.0037282158117553
Energy: 0.9506066678359455
Energy: 0.9312621054053263
Energy: 0.989553674837709
Energy: 0.9555827831885674
Energy: 0.9754053184508057
Energy: 0.9545940182902184
Energy: 0.9753768260809379
Energy: 0.9579908772833754
Energy: 0.9604589896643168
Energy: 0.9721065565960356
Energy: 0.9567017330363494
Energy: 0.9840618241355353
Energy: 1.0066893329955156
Energy: 0.9753712549346593
Energy: 0.9628040222512456
Energy: 1.0116822842450757
Energy: 0.9920777333394185
Energy: 0.9891506652140196
Energy: 0.9708427332215441
Energy: 1.0077465120011537
Energy: 0.9901557896329859
Energy: 0.9671823601678591
Energy: 1.007032958423305
Energy: 0.9741771246788375
Energy: 0.9890950527617048
Energy: 0.9983983123221878
Energy: 0.9973958523548564
Energy: 0.9907060351355728
Energy: 0.9742182139935582
Energy: 0.994701615540914
Energy: 1.006180722337995
Energy: 0.9758252464793412
Energy: 1.0103839756045223
Energy: 1.027277118498349
Energy: 1.015424396973687
Energy: 0.9969594595204361
Energy: 0.9900843483934844
Energy: 1.015623873875117
Energy: 0.9783399585369534
Energy: 1.0088438137785092
Energy: 1.0091412554235213
Energy: 0.9934106768711299
Energy: 0.9601210887943421
Energy: 1.0570473642511418
Energy: 0.9929967971015643
Energy: 1.007186638179329
Energy: 1.0475150133890268
Energy: 1.01280091648535
Energy: 0.9932410476670667
Energy: 1.0174756259807805
Energy: 1.021279029866733
Energy: 1.001851689534276
Energy: 1.0193889010391075
Energy: 1.092602103310894
Energy: 1.009965280355836
Energy: 1.0212383113950712
Energy: 1.0349475830017538
Energy: 1.0092818089578397
Energy: 1.0022500968945016
Energy: 1.054882282607693
Energy: 1.090642728754254
Energy: 1.126549932834471
Energy: 1.1418223411953903
Energy: 1.027031458319193
Energy: 1.009282319098592
Energy: 1.0039985302213348
Energy: 0.9702657616623899
Energy: 1.0897484284754833
Energy: 1.0508480868718197
Energy: 1.0311192603311499
Energy: 1.0869476714655897
Energy: 1.061739300885486
Energy: 1.0152054733053253
Energy: 1.0493881640500535
Energy: 1.0493287583284467
Energy: 1.048686557150219
Energy: 1.0902192321449153
Energy: 1.0475971443117205
Energy: 1.0392532594772443
Energy: 1.0316169697213828
Energy: 1.1186381653685613
Energy: 0.9854923455227063
Energy: 1.0915597524306961
Energy: 1.0653012323575186
Energy: 0.9861882644159569
Energy: 0.9849399631045151
Energy: 1.0412863479561318
Energy: 1.0985461028968933
Energy: 1.0918951671969206
Energy: 1.0521820295788031
Energy: 1.064180075377079
Energy: 1.0456232300967527
Energy: 1.0570654580269763
Energy: 1.050844310741637
Energy: 1.0997902719550268
Energy: 1.106330329586045
Energy: 1.0507047005588126
Energy: 1.0585400972027932
Energy: 1.0982387852443523
Energy: 1.049998025362105
Energy: 1.0541626065720306
Energy: 1.0608273262282324
Energy: 1.1446502981521518
Energy: 0.9865161055692236
Energy: 0.9839202048551953
Energy: 1.0653342548767226
Energy: 1.0676801378311032
Energy: 1.0109661950973632
Energy: 0.9855884087855834

minimum gb energy = 0.9019578053913078 eV
minimum distance =  2.23951772261918 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 1.2031658105261882
Energy: 1.1585676521785464
Energy: 1.2189458098054133
Energy: 1.207056251032725
Energy: 1.2063820387048871
Energy: 1.2079622897793199
Energy: 1.22122267316118
Energy: 1.146059469611076
Energy: 0.3701247277462082
Energy: 0.3694269612845068
Energy: 0.36917697032112406
Energy: 0.3693947170540557
Energy: 0.36957232834304515
Energy: 0.3695878965851426
Energy: 0.3848443748988636
Energy: 0.369976602368769
Energy: 0.3696489702163568
Energy: 0.3695047480650334
Energy: 0.3695484246543171
Energy: 0.36936109462701416
Energy: 0.3696752043115881
Energy: 1.1455424964974488
Energy: 1.1768445011764017
Energy: 1.1600665698741464
Energy: 1.144905089034831
Energy: 1.1448048757354041
Energy: 1.1563859003763433
Energy: 1.1869405964820494
Energy: 1.1848416336385545
Energy: 1.1757174286441858
Energy: 1.1757611483720098
Energy: 1.1754141469796446
Energy: 1.2194131856201367
Energy: 1.175885998547077
Energy: 1.1754690113839315
Energy: 0.38509968726220367
Energy: 0.3697371067667823
Energy: 0.36962218017114534
Energy: 0.3693473864144406
Energy: 0.3693291533007034
Energy: 0.3695713869417733
Energy: 0.36956814963853774
Energy: 1.1462759970488408
Energy: 1.1760219288141378
Energy: 1.1570749937951623
Energy: 1.1529799997465897
Energy: 1.1552692621841856
Energy: 1.1933170420796864
Energy: 1.1759647448837895
Energy: 1.1454069723066258
Energy: 1.1762525188724378
Energy: 1.1917509582824017
Energy: 1.1535351334300492
Energy: 1.146117351650997
Energy: 1.1566511471822043
Energy: 1.1759817099857897
Energy: 0.38514739330757997
Energy: 0.369626515696143
Energy: 0.36941453777376376
Energy: 0.3692810158098927
Energy: 0.3694429837566172
Energy: 0.3695622025326034
Energy: 0.3697107607670856
Energy: 1.1846889125211766
Energy: 1.1756676970186652
Energy: 1.1759202337442338
Energy: 1.1760224690108316
Energy: 1.1762468012715788
Energy: 1.1754950819342256
Energy: 1.1754565830443668
Energy: 1.175881938232936
Energy: 1.1436511336763535
Energy: 1.1590873820397245
Energy: 1.145646709834648
Energy: 1.1459109744387124
Energy: 1.1451096419634925
Energy: 1.1591091753743314
Energy: 0.3849421064658882
Energy: 0.3701142612823852
Energy: 0.36960540765757444
Energy: 0.3696117275777005
Energy: 0.3694421509780901
Energy: 0.36970178809830795
Energy: 0.3699239026872687
Energy: 0.38475563239076327
Energy: 0.3702976350234088
Energy: 0.3694657317086099
Energy: 0.3695622793940365
Energy: 0.3694514334722951
Energy: 0.3692677052480336
Energy: 0.369870881375783
Energy: 1.1765015489456196
Energy: 1.1769012231900486
Energy: 1.158157728742403
Energy: 1.1463444576481239
Energy: 1.146582566506407
Energy: 1.147277728922099
Energy: 1.158762727615969
Energy: 1.1458018309902767
Energy: 1.1764858488770056
Energy: 1.1753624896643824
Energy: 0.3691021835883253
Energy: 0.3689248327018752
Energy: 0.36971741448876333
Energy: 1.176023887661739
Energy: 0.38485442700105194
Energy: 0.3701490421153248
Energy: 0.3698344938312758
Energy: 0.36930467382222393
Energy: 0.36927048351331426
Energy: 0.3694685241661742
Energy: 0.36983282315474775
Energy: 1.1457043170068661
Energy: 1.176449833280499
Energy: 1.158157602961767
Energy: 1.1451473824303902
Energy: 1.1452412145578899
Energy: 1.1539674174955707
Energy: 1.1860690070978541
Energy: 1.1855578652319387
Energy: 1.175914410075154
Energy: 1.175889784826847
Energy: 1.1582035481337951
Energy: 1.2191696337002358
Energy: 1.1756812821417773
Energy: 1.1755266000391509
Energy: 0.3854158564524736
Energy: 0.3694138746693877
Energy: 0.36921319449670725
Energy: 0.3691923832735865
Energy: 0.368915155956791
Energy: 0.3691287505772901
Energy: 0.36904526861107884
Energy: 1.1448233252292033
Energy: 1.175296979425116
Energy: 1.1758699239226473
Energy: 1.151901082328583
Energy: 1.1455236429446538
Energy: 1.1941297241291737
Energy: 1.1756858193129798

minimum gb energy = 0.368915155956791 eV
minimum distance =  2.29540639517817 Angstroms
sigma value = 23