Model name: model_name=EAM_MagneticCubic_MendelevHanSrolovitz_2003_Fe__MO_856295952425_002
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=2.855324655771256
cohesive_energy=4.122759316663293
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, -1.028618227324242e-17, -1.86470929724724e-17]
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: 0.015606671580191342
Energy: 0.015767664449493287
Energy: 1.583289646441062
Energy: 0.016201155167938287
Energy: 0.016397836147575427
Energy: 1.5820386832598583
Energy: 0.01580487308012969
Energy: 0.016591811357591336
Energy: 0.20609603170632532
Energy: 0.3754413463368927
Energy: 0.16798653211569964
Energy: 0.37508707939206865
Energy: 0.37564309949388874
Energy: 0.16818705695834527
Energy: 0.16812663531465105
Energy: 0.374951091629526
Energy: 0.37577674855010096
Energy: 0.16785069515127904
Energy: 0.37508871388233794
Energy: 0.20506831394564864
Energy: 0.16778920418219062
Energy: 0.16929717630996705
Energy: 0.37565102078822166
Energy: 0.20565905592668737
Energy: 0.16804423965334692
Energy: 0.16907063593639504
Energy: 0.2053625134956984
Energy: 0.16742396677893157
Energy: 0.167530886671823
Energy: 0.20519805239737327
Energy: 0.3770327296642641
Energy: 0.1687072081345422
Energy: 0.37504132805933443
Energy: 0.2047178223441093
Energy: 0.16827055583044936
Energy: 0.015955402667276002
Energy: 0.20472067781751122
Energy: 0.3754575051465008
Energy: 0.01638185022079167
Energy: 0.016613904977151775
Energy: 0.37563550862885264
Energy: 0.16735978643158142

minimum gb energy = 0.015606671580191342 eV
minimum distance =  2.44044964948702 Angstroms
sigma value = 5


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

Energy: 2.361091950465363
Energy: 1.6134093473694373
Energy: 1.701391988477879
Energy: 1.2281609848778272
Energy: 1.2415869127801031
Energy: 2.0978592589258933
Energy: 1.6132216752330795
Energy: 1.2564750258591308
Energy: 1.2961030057814629
Energy: 1.2683094126722179
Energy: 1.2695166564946525
Energy: 1.2896296357808938
Energy: 1.2595598953712435
Energy: 1.3098606496153902
Energy: 1.2275488312422966
Energy: 1.267506684254469
Energy: 1.2594814990560428
Energy: 1.2574478367309785
Energy: 1.2781873327833952
Energy: 1.2585966144793668
Energy: 1.2639674158434864
Energy: 1.193681296095397
Energy: 1.2420630718188586
Energy: 1.268440274813104
Energy: 1.2309955807707251
Energy: 1.2633466782236888
Energy: 1.287670355836823
Energy: 1.2361091505739472
Energy: 1.2794301388711908
Energy: 1.2391264316685207
Energy: 1.2464378075171731
Energy: 1.2379908085673172
Energy: 1.253200264455165
Energy: 1.2492560023468149
Energy: 1.2317222284324476
Energy: 1.2571708907063517
Energy: 1.2631659048185546
Energy: 1.231160080963875
Energy: 1.2492779841498838
Energy: 1.2432009640957034
Energy: 1.2285612445708858
Energy: 1.2520081239846625
Energy: 1.2543442171804962
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Energy: 1.2619993941071337
Energy: 1.2620607708920792
Energy: 1.2223086833217358
Energy: 1.2556479597202495
Energy: 1.2736535114954501
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Energy: 1.2472485101266106
Energy: 1.3012530200145607
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Energy: 1.2493069701690573
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Energy: 1.216919726433955
Energy: 1.1904421531546618
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Energy: 1.2280396711099746
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Energy: 1.2770771599275066
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Energy: 1.183444428372342
Energy: 1.2447362473971972
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Energy: 1.2400295090459383
Energy: 1.3087006036427713
Energy: 1.4230153027693866
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Energy: 1.171467620403064
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Energy: 1.1763412000912359
Energy: 1.2730311548741655
Energy: 1.2599115617598198
Energy: 1.2898575141202213
Energy: 1.2018251026772024
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Energy: 1.2587658354049862
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Energy: 1.2656621974001825
Energy: 1.2447798291988619
Energy: 1.3760207906370696
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Energy: 1.1885259346451718
Energy: 1.2111592503228708
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Energy: 1.354131723170914
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Energy: 1.3519667970108944
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Energy: 1.2936316107092451
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Energy: 1.2779182188477527
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Energy: 1.2780628256858477
Energy: 1.3161926735084817
Energy: 1.2083767705729005
Energy: 1.270175871278739
Energy: 1.2301792981466095
Energy: 1.2566880731894912
Energy: 1.2170037039845591
Energy: 1.2555314294860966
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Energy: 1.16330830969138
Energy: 1.190022961905888
Energy: 1.2224380348781538
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Energy: 1.1902106363338014
Energy: 1.24175872849024
Energy: 1.2049482257059188
Energy: 1.182561772112281
Energy: 1.1957788450543871
Energy: 1.2174390080049977
Energy: 1.1907875545374944
Energy: 1.1904377844059992
Energy: 1.215717327916536
Energy: 1.2157162701789117
Energy: 1.3110272930321003
Energy: 1.2677887047404368
Energy: 1.2162204989565246
Energy: 1.2787727660386436
Energy: 1.262454549748439
Energy: 1.2548214136938596
Energy: 1.2641876511591843
Energy: 1.2093683165311107
Energy: 1.2482614991270742
Energy: 1.2616554764333896
Energy: 1.213744143681395
Energy: 1.254634853487456
Energy: 1.2807040658905593
Energy: 1.2188297102190588
Energy: 1.2198556079965517
Energy: 1.2581231694275647
Energy: 1.260557093895873
Energy: 1.2529440556331293
Energy: 1.301298738259612
Energy: 1.2595348733747305
Energy: 1.2576477066987235
Energy: 1.2888701217658973
Energy: 1.2710720342182409
Energy: 1.317198384742923
Energy: 1.2798527975752187
Energy: 1.278199865066827
Energy: 1.3146884361970284
Energy: 1.2798389217904447
Energy: 1.2585282041851098
Energy: 1.2612449408382858
Energy: 1.2324077695103932
Energy: 1.2494905235982228
Energy: 1.2488876726227298
Energy: 1.2227852859370825
Energy: 1.2785620280870367

minimum gb energy = 1.1460217411446538 eV
minimum distance =  2.25418870589429 Angstroms
sigma value = 401


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

Energy: 2.065031558202109
Energy: 1.7277166280827085
Energy: 1.3714538906662657
Energy: 1.695557179894608
Energy: 1.6563077808284827
Energy: 1.5040620889433072
Energy: 1.7395129960916662
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Energy: 1.226239281578537
Energy: 1.2456274862445205
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Energy: 1.254695111486447
Energy: 1.2298446971070882
Energy: 1.274406624720084
Energy: 1.2690939572630253
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Energy: 1.21652182600086
Energy: 1.1946869596044933
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Energy: 1.2671045554577118
Energy: 1.3369951138131029
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Energy: 1.3465677796918742
Energy: 1.3855672772881162
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Energy: 1.3265296273903326
Energy: 1.318244495463252
Energy: 1.349987544504071
Energy: 1.332642105367664
Energy: 1.2827583037295291
Energy: 1.3653639175786754
Energy: 1.3586380366635042
Energy: 1.2821237778772057
Energy: 1.364196065924017
Energy: 1.3666680334472092
Energy: 1.3249604702094284
Energy: 1.3062175910001783
Energy: 1.3406132194506364
Energy: 1.3755120877216662
Energy: 1.2938275781412636
Energy: 1.3207761660063373
Energy: 1.3254126560598651
Energy: 1.267852969479272
Energy: 1.2803436099666285
Energy: 1.283285209965122
Energy: 1.2653294659619148
Energy: 1.246195110669477
Energy: 1.2705050306750736
Energy: 1.3795438233191015
Energy: 1.6384837331220692
Energy: 1.7268335269863202
Energy: 1.2760550458987003
Energy: 1.5691930412602773
Energy: 1.7252695162682652
Energy: 1.356138354253387
Energy: 1.3072013172128478
Energy: 1.2698908467142098
Energy: 1.2535138418922862
Energy: 1.2947726840823846
Energy: 1.2555089622515196
Energy: 1.2562164481387834
Energy: 1.351608257735142
Energy: 1.4177925331047507
Energy: 1.3231616630614378
Energy: 1.3052323827416956
Energy: 1.320146968474002
Energy: 1.4267191056764947
Energy: 1.3215695126393594
Energy: 1.316115170229487
Energy: 1.5113033262078988
Energy: 1.3918671736081474
Energy: 1.4966814256435335
Energy: 1.4068707814514705
Energy: 1.4023493391403659
Energy: 1.4964792462129066
Energy: 1.3612607336381297
Energy: 1.393051469257953
Energy: 1.347380489161761
Energy: 1.3052210243573685
Energy: 1.3330897872202168
Energy: 1.4161024247077987
Energy: 1.411331202388931
Energy: 1.3262593226376358
Energy: 1.281518721311844
Energy: 1.2540963519005115
Energy: 1.2583821099478065
Energy: 1.309008284278458
Energy: 1.2789852690379058
Energy: 1.2803773154429592
Energy: 1.296365265425797
Energy: 1.2647536494474496
Energy: 1.248519844364278
Energy: 1.2536944445149947
Energy: 1.270191220538509
Energy: 1.2599144705793077
Energy: 1.2524278336933607
Energy: 1.2339942826164667
Energy: 1.2862326489837763
Energy: 1.250193071735706
Energy: 1.2586312484070015
Energy: 1.2731561275136904
Energy: 1.2433964228398737
Energy: 1.2454358743495693
Energy: 1.2755422937685321
Energy: 1.3113173395154807
Energy: 1.2842503143468593
Energy: 1.344242145826169
Energy: 1.318029188280227
Energy: 1.3014793899428645
Energy: 1.3267898688152902
Energy: 1.3288493926829512
Energy: 1.2793659647323308
Energy: 1.225241176205966
Energy: 1.350259793355756
Energy: 1.289994257238653
Energy: 1.292896499807996
Energy: 1.3701026881376936
Energy: 1.3381204593882634
Energy: 1.2764117728626672
Energy: 1.2931265289541705
Energy: 1.365824698466806
Energy: 1.29934853327783
Energy: 1.3112523149071418
Energy: 1.3462237208757446
Energy: 1.3032477739259012
Energy: 1.2006673707377202
Energy: 1.2448767787167259
Energy: 1.3572758264451477
Energy: 1.2268031747905734
Energy: 1.1926165047941826
Energy: 1.271726191916307
Energy: 1.2914975868734948

minimum gb energy = 1.1926165047941826 eV
minimum distance =  2.21995262725323 Angstroms
sigma value = 311


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

Energy: 1.4544318759795267
Energy: 1.5157690220516011
Energy: 1.6031748840198716
Energy: 1.4811110978106168
Energy: 1.439830494939076
Energy: 1.479213661451788
Energy: 1.477151775105902
Energy: 1.2304628723547635
Energy: 1.3583559515910055
Energy: 1.3363392124926952
Energy: 1.2406460205455163
Energy: 1.3212208630316404
Energy: 1.3721155811188592
Energy: 1.3594229584140136
Energy: 1.397661037589149
Energy: 1.2762020283788746
Energy: 1.2542540103044304
Energy: 1.2364190940043032
Energy: 1.25286689520044
Energy: 1.3184000761772496
Energy: 1.2573290931595658
Energy: 1.4163477360259322
Energy: 1.337568598918287
Energy: 1.3020529083392924
Energy: 1.2377171474572568
Energy: 1.2956740462208785
Energy: 1.315627197124343
Energy: 1.2914317426760673
Energy: 1.2633465930978796
Energy: 1.3591767951737093
Energy: 1.2856371945229206
Energy: 1.3230870046240606
Energy: 1.3100256394851466
Energy: 1.3014888071450479
Energy: 1.2385229069033692
Energy: 1.433573750965867
Energy: 1.4332108256638614
Energy: 1.4351355333348557
Energy: 1.4369529289170968
Energy: 1.443223049817422
Energy: 1.4120536225429845
Energy: 1.3923335084556812
Energy: 1.429733387354149
Energy: 1.4314866095178358
Energy: 1.4295572236564884
Energy: 1.4451785039699887
Energy: 1.4202644439121426
Energy: 1.4234468905024695
Energy: 1.4385508243233214
Energy: 1.3607104629732865
Energy: 1.316614145830206
Energy: 1.44510102724035
Energy: 1.4399376090275293
Energy: 1.3922240578556673
Energy: 1.410263171153797
Energy: 1.4176406278096205
Energy: 1.3279521238299172
Energy: 1.3516023820734004
Energy: 1.3440226930741745
Energy: 1.356617798660641
Energy: 1.2877952442465237
Energy: 1.3400945446751547
Energy: 1.3969788400414223
Energy: 1.3593966776874626
Energy: 1.3773698843868631
Energy: 1.3852493838565731
Energy: 1.4219295791586584
Energy: 1.3976637744841054
Energy: 1.372911040867931
Energy: 1.3706489627984946
Energy: 1.4022723923294018
Energy: 1.3228947459296907
Energy: 1.3183779196004004
Energy: 1.3606791861674183
Energy: 1.3345978362788764
Energy: 1.3144112246773196
Energy: 1.3640646443564475
Energy: 1.4733498348712561
Energy: 1.330414598717658
Energy: 1.4541227614894863
Energy: 1.4841919107430785
Energy: 1.3451324044127957
Energy: 1.3242589397347972
Energy: 1.4063996621757715
Energy: 1.4891186862735626
Energy: 1.4958063741050043
Energy: 1.4655740753680027
Energy: 1.500318813466976
Energy: 1.4960591287590437
Energy: 1.4667018531887666
Energy: 1.4994462440855034
Energy: 1.378098134604536
Energy: 1.2912467387992503
Energy: 1.3321623222416392
Energy: 1.361608504940174
Energy: 1.3680825189666317
Energy: 1.2946065549391652
Energy: 1.2999221702445254
Energy: 1.3451440074718348
Energy: 1.337741863392172
Energy: 1.3441290359797642
Energy: 1.3199327379094379
Energy: 1.3574255841292824
Energy: 1.3315032088633159
Energy: 1.341917029474154
Energy: 1.3097832319063814
Energy: 1.4380828201437978
Energy: 1.2828194427305426
Energy: 1.4674919546841438
Energy: 1.3250899792320165
Energy: 1.3933303004305033
Energy: 1.3658050988869956
Energy: 1.3814064951617704
Energy: 1.3800961463848063
Energy: 1.3595662282623484
Energy: 1.3375534652211778
Energy: 1.3763981703784336
Energy: 1.3606680682182646
Energy: 1.348476076479231
Energy: 1.4094422938400955
Energy: 1.4324924409577668
Energy: 1.4304823414805485
Energy: 1.4148679431068947
Energy: 1.4653855985665138
Energy: 1.4306977535438201
Energy: 1.419956100965301
Energy: 1.425580753150632
Energy: 1.459242878124228
Energy: 1.418620517212717
Energy: 1.4121490271441723
Energy: 1.4723646070763177
Energy: 1.430881725200131
Energy: 1.4163234550912984
Energy: 1.3837460778185462
Energy: 1.3080356392076644
Energy: 1.346254604314165
Energy: 1.315334742120747
Energy: 1.2206912126058929
Energy: 1.228872200168422
Energy: 1.3182858708165448
Energy: 1.377930537278099
Energy: 1.3775002163412169
Energy: 1.3964594314429892
Energy: 1.2787877783481594
Energy: 1.3072668789994495
Energy: 1.3581966295461303
Energy: 1.256008459327225
Energy: 1.3882006609307538
Energy: 1.2651184158768523
Energy: 1.2125782302580383
Energy: 1.2214293346580436
Energy: 1.2690514732923035
Energy: 1.3069088509751663
Energy: 1.415193206354162
Energy: 1.3852754043209214
Energy: 1.2286728041098907
Energy: 1.3052363169606107
Energy: 1.3107005286319335
Energy: 1.3469319876896464
Energy: 1.3084662875338517
Energy: 1.2994172310663534
Energy: 1.4725506761803753
Energy: 1.4311131696310395
Energy: 1.371604892917828
Energy: 1.3774104577747028
Energy: 1.3904761229403517
Energy: 1.3804554425308062
Energy: 1.3738180704601484
Energy: 1.398870469152671
Energy: 1.43435744241177
Energy: 1.3740411403880055
Energy: 1.3756107462891096
Energy: 1.393348228441004
Energy: 1.3879547384078452
Energy: 1.3730169128102758
Energy: 1.384086840842978
Energy: 1.2129117873739346
Energy: 1.1919061034169856
Energy: 1.303592276776449
Energy: 1.2130326144165477
Energy: 1.2329435358813563
Energy: 1.3234722958030427
Energy: 1.3358938966148808
Energy: 1.2285818843777125
Energy: 1.2101953503066942
Energy: 1.231395203719337
Energy: 1.2267068364966534
Energy: 1.2158009520770066
Energy: 1.3747162624570726
Energy: 1.2884426420343127
Energy: 1.2874422815676259
Energy: 1.4598798484939832
Energy: 1.1459263676896159
Energy: 1.14482381069123
Energy: 1.306852071357889
Energy: 1.3157623377508618
Energy: 1.26540876818114
Energy: 1.2314578348771148
Energy: 1.2791260381430776
Energy: 1.2384722045304806
Energy: 1.2911176080441857
Energy: 1.2905116404444683
Energy: 1.39076589252753
Energy: 1.4135373182841175
Energy: 1.4342016461123368
Energy: 1.4878076160490163
Energy: 1.4421249857127518
Energy: 1.4013811708417196
Energy: 1.4203302728513494
Energy: 1.4391598907596563
Energy: 1.4205378949709295
Energy: 1.3971139445923975
Energy: 1.4408139185290032
Energy: 1.454966953846428
Energy: 1.4062298516052834
Energy: 1.4138114427707413
Energy: 1.4196332015389637
Energy: 1.3278656889526104
Energy: 1.3338064240721013
Energy: 1.3079710312949568
Energy: 1.333226948648952
Energy: 1.2757366944315869
Energy: 1.2857998381858633
Energy: 1.2671924015346026
Energy: 1.3351005965668414
Energy: 1.4673985973236205
Energy: 1.3668700831214105
Energy: 1.459999997839796
Energy: 1.4640916882628927
Energy: 1.3491933710789352
Energy: 1.328596975906676
Energy: 1.4504555565759791
Energy: 1.3573664451349785
Energy: 1.2664768775568604
Energy: 1.2399474457122952
Energy: 1.2838897307470742
Energy: 1.2925158125274883
Energy: 1.2769434484445532
Energy: 1.349536973335505
Energy: 1.414944875915886
Energy: 1.4152323972358494
Energy: 1.3381000390054065
Energy: 1.3343755877704973
Energy: 1.330296685079695
Energy: 1.3650876628198356
Energy: 1.4534532352721958
Energy: 1.4804496490111447
Energy: 1.413825780920548
Energy: 1.4626014698829548
Energy: 1.4132373066183357
Energy: 1.3758695187187895
Energy: 1.415443185897041

minimum gb energy = 1.14482381069123 eV
minimum distance =  2.23274268592052 Angstroms
sigma value = 39


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

Energy: 1.433026498318645
Energy: 1.4357267525728412
Energy: 1.2331855071373399
Energy: 1.4377292763845508
Energy: 1.4380479067192866
Energy: 1.3983354341509202
Energy: 1.48665379214619
Energy: 1.2309210423021082
Energy: 1.2507887808691596
Energy: 1.3645739168575244
Energy: 1.2857825018587967
Energy: 1.2586611276478685
Energy: 1.207300787223625
Energy: 1.2957249333455947
Energy: 1.283236838782275
Energy: 1.2679184510505466
Energy: 1.2449607480613976
Energy: 1.286855202679549
Energy: 1.2516928226318849
Energy: 1.252817872360576
Energy: 1.3008606107045595
Energy: 1.3533429751070711
Energy: 1.1745724215272546
Energy: 1.3102551890826377
Energy: 1.321286670437428
Energy: 1.2373247375313337
Energy: 1.1351430044087392
Energy: 1.3207261060777729
Energy: 1.2450589018314466
Energy: 1.219760019713301
Energy: 1.2526329711106248
Energy: 1.3075791726747252
Energy: 1.2472206271851398
Energy: 1.2505452101978927
Energy: 1.2361515237511338
Energy: 1.2395131713532495
Energy: 1.237311525071216
Energy: 1.192296313545515
Energy: 1.2572091195190962
Energy: 1.2387713518280072
Energy: 1.198071264054154
Energy: 1.259694434669702
Energy: 1.235995086171353
Energy: 1.2394976499986938
Energy: 1.2025395181621619
Energy: 1.285843051173468
Energy: 1.2512913855806551
Energy: 1.2138645276595228
Energy: 1.2406540852733834
Energy: 1.2624624333289876
Energy: 1.2514543759574763
Energy: 1.242010121660201
Energy: 1.285191264153651
Energy: 1.2462433770195458
Energy: 1.240269238972883
Energy: 1.2897384616731995
Energy: 1.2530398708701522
Energy: 1.2940323598792671
Energy: 1.2758647661424911
Energy: 1.306949020419682
Energy: 1.2555748043402233
Energy: 1.430034108547184
Energy: 1.3272190475101506
Energy: 1.347609212203008
Energy: 1.2933783826236196
Energy: 1.4022412077688522
Energy: 1.3258952968807916
Energy: 1.3529775830791846
Energy: 1.4139192901787965
Energy: 1.332443261545528
Energy: 1.2518204355091647
Energy: 1.2427209511538637
Energy: 1.2334270364727777
Energy: 1.3156195488925206
Energy: 1.2575439523700584
Energy: 1.2422559448368502
Energy: 1.3091443462489438
Energy: 1.3240468458193861
Energy: 1.2346228408433029
Energy: 1.2398190904612847
Energy: 1.2851639551804943
Energy: 1.2499802212545479
Energy: 1.2499925833371517
Energy: 1.2852790104865266
Energy: 1.3457860748998005
Energy: 1.2706015528080226
Energy: 1.4668386752867668
Energy: 1.4293039891918293
Energy: 1.2718000382994257
Energy: 1.2153132485034799
Energy: 1.4324333627617054
Energy: 1.2938585806921064
Energy: 1.2535961728467333
Energy: 1.2996512482781806
Energy: 1.2863538727542227
Energy: 1.2505450515830416
Energy: 1.2660694156806682
Energy: 1.2869384619636495
Energy: 1.232992674476639
Energy: 1.2513646758168429
Energy: 1.4585123652339704
Energy: 1.2858478447159547
Energy: 1.2547691121530369
Energy: 1.4001419947437461
Energy: 1.3220350708883595
Energy: 1.4331914297644586
Energy: 1.3516035055353028
Energy: 1.3998623764170812
Energy: 1.436316476471128
Energy: 1.437139673857318
Energy: 1.4328451633566766
Energy: 1.490262515666124
Energy: 1.2846736095799378
Energy: 1.2507383985707266
Energy: 1.2107551857835066
Energy: 1.28607395823616
Energy: 1.2491316610380099
Energy: 1.2073355507275305
Energy: 1.2955378264063255
Energy: 1.2831188783054988
Energy: 1.2038824273965274
Energy: 1.2452168423691954
Energy: 1.2839281209602793
Energy: 1.2521992185161444
Energy: 1.2529966095415135
Energy: 1.3007242753967607
Energy: 1.3553425070583964
Energy: 1.1745677332595061
Energy: 1.3101400740185891
Energy: 1.321286252289753
Energy: 1.237834573531565
Energy: 1.1346156661743323
Energy: 1.3205883656863107
Energy: 1.2451090598492824
Energy: 1.2201451297479151
Energy: 1.2556160224946966
Energy: 1.290255274960312
Energy: 1.2476120434736686
Energy: 1.2506949963868317
Energy: 1.2416527878427692
Energy: 1.2394930036073313
Energy: 1.236779480788989
Energy: 1.1932714364209942
Energy: 1.2589437955999503
Energy: 1.2387007365841638
Energy: 1.197806302615609
Energy: 1.2591510754241768
Energy: 1.2529548492900358
Energy: 1.2391548430304398
Energy: 1.2015886018620892
Energy: 1.286384221039072
Energy: 1.2520179617404363
Energy: 1.2143997064487049
Energy: 1.2740005641416272
Energy: 1.2622278043002966
Energy: 1.2446550615614567
Energy: 1.2417906735788389
Energy: 1.2852820809796033
Energy: 1.2528576137753107
Energy: 1.2416754201771363
Energy: 1.2893404266747086
Energy: 1.2520467396314237
Energy: 1.294574234427527
Energy: 1.2763714568831264
Energy: 1.3236577191541392
Energy: 1.3522823525964103
Energy: 1.4301505720973102
Energy: 1.3311717471884075
Energy: 1.3506537201853543
Energy: 1.2940136822388235
Energy: 1.402207573226637
Energy: 1.3083661557686737
Energy: 1.353139231182439
Energy: 1.413694977677388
Energy: 1.332489951248279
Energy: 1.2604003793335015
Energy: 1.2474010869022452
Energy: 1.2335801866125775
Energy: 1.3156818187389991
Energy: 1.2577495977812363
Energy: 1.2368052647098802
Energy: 1.3090868714929171
Energy: 1.3242095927884843
Energy: 1.257508368019464
Energy: 1.289927746845578
Energy: 1.2852427930163768
Energy: 1.251537848612644
Energy: 1.2503079141594462
Energy: 1.4029564307069815
Energy: 1.3458670264864536
Energy: 1.2705115052486584
Energy: 1.4803485810933634
Energy: 1.4376760822689907
Energy: 1.2716219837948233
Energy: 1.2121494229942256
Energy: 1.4285974397528933
Energy: 1.293914323572394
Energy: 1.2539276087460751
Energy: 1.3008283646659942
Energy: 1.286594651920654
Energy: 1.250444537018023
Energy: 1.2660619779989986
Energy: 1.286709257211535
Energy: 1.231062562803638
Energy: 1.2509763295142162
Energy: 1.4626141912165629
Energy: 1.2859170131900772
Energy: 1.2550467846643925
Energy: 1.4000889924282984
Energy: 1.333372207161434

minimum gb energy = 1.1346156661743323 eV
minimum distance =  2.24606129133293 Angstroms
sigma value = 21


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

Energy: 1.6589900708485494
Energy: 1.1739488455728322
Energy: 1.1466469453690384
Energy: 1.2584766704489396
Energy: 1.1741617981710357
Energy: 1.1845325687540567
Energy: 1.1742549550820618
Energy: 1.2570349130887166
Energy: 1.2010443255446996
Energy: 1.1809459263959505
Energy: 1.2475661100064803
Energy: 1.2199889374425572
Energy: 1.1790582001063663
Energy: 1.2127360761016999
Energy: 1.199323947537572
Energy: 1.1547638616642804
Energy: 1.1570119913585386
Energy: 1.1927521697886436
Energy: 1.2040926813690522
Energy: 1.1562568222710519
Energy: 1.2162929928618762
Energy: 1.2043643958180685
Energy: 1.2141732277829966
Energy: 1.1011134876195179
Energy: 1.2178069101081972
Energy: 1.1997110862933502
Energy: 1.1007167960612931
Energy: 1.2265950835738035
Energy: 1.1130183498808597
Energy: 1.128293044856299
Energy: 1.1773378121418494
Energy: 1.1412032020659502
Energy: 1.1387621337250824
Energy: 1.10018124775628
Energy: 1.1775308114916878
Energy: 1.1123390722607136
Energy: 1.1607155007424508
Energy: 1.1630287911310722
Energy: 1.1267855380044973
Energy: 1.1606870029038194
Energy: 1.1268651668002012
Energy: 1.165200080639448
Energy: 1.1071457087007102
Energy: 1.1217270168443414
Energy: 1.086680067201602
Energy: 1.1641114028658786
Energy: 1.1210985169546555
Energy: 1.1614455339696406
Energy: 1.1219092477408148
Energy: 1.1016383650942976
Energy: 1.1214421581297058
Energy: 1.1651984896102945
Energy: 1.1136849301055551
Energy: 1.1208800364718463
Energy: 1.173281599861264
Energy: 1.1314561022514062
Energy: 1.0707146956614302
Energy: 1.0836104695651652
Energy: 1.1472414082903117
Energy: 1.0933763781037664
Energy: 1.0731918492682415
Energy: 1.1664233218791593
Energy: 1.0930827517258812
Energy: 1.078070783856658
Energy: 1.0714783472620002
Energy: 1.1499552260432984
Energy: 1.110479331801552
Energy: 1.0681282093190798
Energy: 1.148270281551873
Energy: 1.0997056338616855
Energy: 1.1098381072440717
Energy: 1.1072008756772351
Energy: 1.1433516707040354
Energy: 1.128393184691049
Energy: 1.1081169996121043
Energy: 1.1437747392779796
Energy: 1.1173456571048659
Energy: 1.1210315727386435
Energy: 1.1513962133555546
Energy: 1.1363183351198336
Energy: 1.1257299226906934
Energy: 1.143318162967094
Energy: 1.1285964442134757
Energy: 1.1277528768844651
Energy: 1.1023858685025605
Energy: 1.1469382154058452
Energy: 1.0605586288760476
Energy: 1.0943997377127654
Energy: 1.1506278780584815
Energy: 1.063990432468892
Energy: 1.091977312916272
Energy: 1.1222972100303354
Energy: 1.1653664920436355
Energy: 1.061469379377072
Energy: 1.1036639093723815
Energy: 1.1448276927940928
Energy: 1.061025411865774
Energy: 1.0891911443991538
Energy: 1.1224755360205474
Energy: 1.1581619624585813
Energy: 1.101033868984256
Energy: 1.0981485672497548
Energy: 1.1462892934803581
Energy: 1.1216292655292985
Energy: 1.109733455608936
Energy: 1.1705210712421406
Energy: 1.1532208855379409
Energy: 1.1212079781818416
Energy: 1.1359619167090105
Energy: 1.1445589074874218
Energy: 1.121349513263674
Energy: 1.1354043562911973
Energy: 1.1543286879354606
Energy: 1.1409562881674709
Energy: 1.1009766426389918
Energy: 1.145962213249503
Energy: 1.1806707355212809
Energy: 1.1220623772325349
Energy: 1.1596242352855677
Energy: 1.1765357421724765
Energy: 1.158999914196086
Energy: 1.138023613672408
Energy: 1.158933489482988
Energy: 1.1555347399063969
Energy: 1.1388134675504487
Energy: 1.1411810659138075
Energy: 1.1801993815016416
Energy: 1.1013905553161452
Energy: 1.1976878675792486
Energy: 1.1633438200634025
Energy: 1.1011577154606926
Energy: 1.1235831995322498
Energy: 1.2013600856132987
Energy: 1.1785982554129497
Energy: 1.1551376702234941
Energy: 1.2183571449750945
Energy: 1.2263927506280885
Energy: 1.1546244115900695
Energy: 1.159097724039743
Energy: 1.2182558088701245
Energy: 1.176155814704683
Energy: 1.184956101344451
Energy: 1.1978932003984855
Energy: 1.2311523606551968
Energy: 1.2042923099055667
Energy: 1.1581191984380959
Energy: 1.2317840911897524
Energy: 1.2539312451775884
Energy: 1.1583691756959058
Energy: 1.2464366871013322
Energy: 1.2289861593581426
Energy: 1.1613714368632697
Energy: 1.1742055268630327
Energy: 1.2448804969883762
Energy: 1.2433175912018342
Energy: 1.2039607407079251
Energy: 1.2498014463503115
Energy: 1.2287203271495006
Energy: 1.1997951152615496
Energy: 1.1011462014494597
Energy: 1.2451658323183359
Energy: 1.237263834554743
Energy: 1.1792763778157718
Energy: 1.1991474294443565
Energy: 1.2299357531593607
Energy: 1.201506566424149
Energy: 1.1810279637019085
Energy: 1.2319632810371486
Energy: 1.2574595618945519
Energy: 1.2016843556958638
Energy: 1.2233978702723483
Energy: 1.2234516674999631
Energy: 1.2464150174055781
Energy: 1.1822908508954604
Energy: 1.2126949585775393

minimum gb energy = 1.0605586288760476 eV
minimum distance =  2.24531960077266 Angstroms
sigma value = 113


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

Energy: 1.653224416847425
Energy: 1.215728622285584
Energy: 1.057578761164919
Energy: 1.1734407842684054
Energy: 1.1739132095692593
Energy: 1.1011541082715859
Energy: 1.2152060885469251
Energy: 1.142954658534825
Energy: 1.0427073401651292
Energy: 1.0637114599708803
Energy: 1.0601461614889136
Energy: 1.0474738968721609
Energy: 1.0557744191465201
Energy: 1.0408247751996123
Energy: 1.0889534630432618
Energy: 1.0151550057615575
Energy: 1.0613523687957256
Energy: 1.0614862022605662
Energy: 1.0280909185770137
Energy: 1.0512948028441482
Energy: 1.0634694138729515
Energy: 0.9977591553657552
Energy: 1.0137544646298158
Energy: 1.0091742214867183
Energy: 0.992680943230046
Energy: 0.983867568826078
Energy: 1.009534059402434
Energy: 1.084392521661505
Energy: 0.9492300335311173
Energy: 1.000385401033197
Energy: 1.0501028059024016
Energy: 1.0208553471463364
Energy: 0.9936487043930557
Energy: 1.008257639232508
Energy: 1.0281484334443052
Energy: 1.008433508848116
Energy: 0.9970103460197925
Energy: 1.0300290112228236
Energy: 1.0193590572669133
Energy: 0.9923695265074197
Energy: 1.020400646604347
Energy: 1.0315605211974985
Energy: 1.0135308871256117
Energy: 1.1101213487448696
Energy: 0.9926057051768755
Energy: 1.0008756114657658
Energy: 0.9934918946517324
Energy: 1.0251297235496246
Energy: 1.0043133834018825
Energy: 1.0120997405602576
Energy: 1.1311804173260398
Energy: 1.0094613559598495
Energy: 0.9884421099582241
Energy: 1.0145466227886928
Energy: 1.0134155494428883
Energy: 0.9954582727295449
Energy: 0.9975860865412419
Energy: 0.9870746299965448
Energy: 0.9961645595032629
Energy: 0.9741702874930445
Energy: 0.983043170331857
Energy: 0.993996000825872
Energy: 0.9751788911287217
Energy: 0.9525963484868367
Energy: 0.9747211909675703
Energy: 0.9648508354724585
Energy: 0.9681754506751709
Energy: 0.9754518331225469
Energy: 1.003833229192277
Energy: 0.9726111056174701
Energy: 0.9785059236827736
Energy: 1.0096189414194185
Energy: 1.0131354639712944
Energy: 0.9751947312643283
Energy: 0.9750828312904797
Energy: 1.017921118012353
Energy: 0.9556665708150464
Energy: 0.9852672342408912
Energy: 0.9738039907430602
Energy: 0.9606506880642904
Energy: 0.9587736273554304
Energy: 0.9721048576487513
Energy: 0.9603962379897669
Energy: 0.9588150541472381
Energy: 0.9699452150701269
Energy: 0.989796650159738
Energy: 0.9299987055677864
Energy: 0.9517392610412068
Energy: 1.0015529422019194
Energy: 0.9328217179564166
Energy: 0.951441614230765
Energy: 0.9704422478059163
Energy: 0.9473561742898011
Energy: 0.9299116675790355
Energy: 0.9490096180151144
Energy: 0.9980503488658752
Energy: 0.9199687988178937
Energy: 0.9523591218785573
Energy: 0.9895570751206881
Energy: 0.9455837248137412
Energy: 0.9388274948330825
Energy: 0.9504797046242773
Energy: 0.9479782423959232
Energy: 0.9391047663570549
Energy: 0.954298076053131
Energy: 0.9291132903594076
Energy: 0.9273424126687766
Energy: 0.9408626241243622
Energy: 0.95292599527866
Energy: 0.9348471611796434
Energy: 0.9417704987883141
Energy: 0.9546288406163549
Energy: 0.9275668630938595
Energy: 0.9328617937979887
Energy: 0.9454362242336912
Energy: 0.9492806742093296
Energy: 0.9342405390626184
Energy: 0.9469247755128041
Energy: 0.945589296488237
Energy: 0.9611180586742566
Energy: 0.940291444396276
Energy: 0.9640998937477802
Energy: 0.9535308914029056
Energy: 0.9376700625411301
Energy: 0.9563602084460138
Energy: 0.9625569714544215
Energy: 0.9952925717950241
Energy: 0.9370509137393839
Energy: 0.9571294792333731
Energy: 0.9459381178199923
Energy: 0.9363790489918844
Energy: 0.9562646946828723
Energy: 0.9519662460818272
Energy: 0.914004721570448
Energy: 0.9105764872168994
Energy: 0.9645315895514275
Energy: 0.9278214554520343
Energy: 0.9057022228137419
Energy: 0.9628487348193512
Energy: 0.9265126315494965
Energy: 0.943597159509626
Energy: 0.948196617617826
Energy: 0.9547604766626635
Energy: 0.9364612070410127
Energy: 0.9540447063803735
Energy: 0.9543290886520251
Energy: 0.9393751955645888
Energy: 0.9509465455655743
Energy: 0.9577349824774781
Energy: 0.9569064038291618
Energy: 0.9379664199374135
Energy: 0.9547489778142814
Energy: 0.9556033240555482
Energy: 0.939171348519818
Energy: 0.9440591449511495
Energy: 0.9668866367797271
Energy: 0.901957881165725
Energy: 0.9300785691012258
Energy: 0.960812874131071
Energy: 0.905523669756393
Energy: 0.9257112681656308
Energy: 0.9667137828307298
Energy: 0.9940760157543096
Energy: 0.9362232283478514
Energy: 0.9467146850563736
Energy: 0.9546683259172409
Energy: 0.9350571562672201
Energy: 0.9735504610945143
Energy: 0.9769357864422338
Energy: 0.9618826028352729
Energy: 0.940191165259382
Energy: 0.9584081044899588
Energy: 0.9695129057578448
Energy: 0.9389335725226308
Energy: 0.947706596810001
Energy: 0.955496903679054
Energy: 0.9354835752332024
Energy: 0.9376718526858209
Energy: 0.9468875935564854
Energy: 0.9428149327371932
Energy: 0.9356849733478122
Energy: 0.9441447542508677
Energy: 0.947909084075144
Energy: 0.9344637306197453
Energy: 0.9249555560687186
Energy: 0.953069290498406
Energy: 0.9434008780539752
Energy: 0.9217818472974711
Energy: 0.9428552944110801
Energy: 0.9660417828302729
Energy: 0.9428880568022254
Energy: 0.9364357603128619
Energy: 0.9725992474778378
Energy: 0.9369417183876438
Energy: 0.9488439565824047
Energy: 0.9708951415289824
Energy: 0.942410740053835
Energy: 0.9337773351189383
Energy: 0.9992618314315747
Energy: 0.9507325627170424
Energy: 0.9299542449856103
Energy: 0.998745450982665
Energy: 0.9490469791376512
Energy: 0.9422530425869612
Energy: 0.9367534566271641
Energy: 0.9928974653639301
Energy: 0.950606721967644
Energy: 0.9312621442470052
Energy: 0.9895536926835097
Energy: 0.9555872680208691
Energy: 0.9754054575304328
Energy: 0.9545941979386152
Energy: 0.975376750341811
Energy: 0.957990197609738
Energy: 0.9604592386104686
Energy: 0.9721065476342097
Energy: 0.9567019371510447
Energy: 0.9840620743274447
Energy: 1.0066885400261318
Energy: 0.9754206759592334
Energy: 0.962781059442377
Energy: 1.0116601110908974
Energy: 0.9920516220350905
Energy: 0.9891516134002302
Energy: 0.9708425796294227
Energy: 1.0077494363783892
Energy: 0.990154179924065
Energy: 0.967182433377751
Energy: 1.0070322338369497
Energy: 0.9741772978339633
Energy: 0.9890929504901431
Energy: 0.9983986784027603
Energy: 0.9973954254931084
Energy: 0.9907055490401165
Energy: 0.9742178085099713
Energy: 0.9947018376881507
Energy: 1.0061807826329514
Energy: 0.9758063468615608
Energy: 1.0103838477744722
Energy: 1.0281083284766739
Energy: 1.015426102701108
Energy: 0.9969599733071008
Energy: 0.9903934302830528
Energy: 1.0156232976546693
Energy: 0.9785979602889016
Energy: 1.0088565912001943
Energy: 1.0093161018218557
Energy: 0.9931622708312211
Energy: 0.9601219777868665
Energy: 1.057040015007911
Energy: 0.9929082684585117
Energy: 1.007185333624857
Energy: 1.0473192333826442
Energy: 1.0128009720759559
Energy: 0.9932411353816756
Energy: 1.0174758567288797
Energy: 1.0212803760417704
Energy: 1.0018524292259012
Energy: 1.019388898144945
Energy: 1.0920750727193653
Energy: 1.0099888317865113
Energy: 1.021095730697857
Energy: 1.0349908018678393
Energy: 1.0093159701093999
Energy: 1.0022518016419923
Energy: 1.0463008895435375
Energy: 1.0905036301210593
Energy: 1.1268356046352828
Energy: 1.1418229613345297
Energy: 1.0272065606670806
Energy: 1.0094928270046817
Energy: 1.0040773520335244
Energy: 0.9701369953747339
Energy: 1.089752653016591
Energy: 1.0508490568561037
Energy: 1.0311192902688098
Energy: 1.086947723708938
Energy: 1.061739230976736
Energy: 1.0152057215888446
Energy: 1.0494109414409725
Energy: 1.0493229853369548
Energy: 1.0481207775784913
Energy: 1.0895066103171502
Energy: 1.04709098736109
Energy: 1.039601442537367
Energy: 1.0316237712836498
Energy: 1.1188286043047082
Energy: 0.9856024183367765
Energy: 1.0902402366549286
Energy: 1.0407002623070787
Energy: 0.9863664837707902
Energy: 0.9848087480396951
Energy: 1.0412737861168933
Energy: 1.0981986314854755
Energy: 1.0918981843519058
Energy: 1.0521820870264638
Energy: 1.0641941085939035
Energy: 1.045801969718789
Energy: 1.0570669604562917
Energy: 1.050961146316008
Energy: 1.0997908683927138
Energy: 1.1063299201545882
Energy: 1.0495594318361388
Energy: 1.0585393419699287
Energy: 1.0981797091295478
Energy: 1.0502939163189922
Energy: 1.0541625811001276
Energy: 1.0608304943916382
Energy: 1.1445850101104516
Energy: 1.0431238862060104
Energy: 0.9837382278795004
Energy: 1.065335165977483
Energy: 1.0674335640896666
Energy: 1.0023848493840106
Energy: 0.9850359043102779

minimum gb energy = 0.901957881165725 eV
minimum distance =  2.24567462502044 Angstroms
sigma value = 365


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

Energy: 1.203169549593691
Energy: 1.1585798493905255
Energy: 1.218947351577945
Energy: 1.207056401379965
Energy: 1.2063816104504026
Energy: 1.2079625337170876
Energy: 1.2212374119945324
Energy: 1.1460441744672962
Energy: 0.37012444749583384
Energy: 0.36942735291891715
Energy: 0.36917681265688146
Energy: 0.36939650549803543
Energy: 0.36956404176957447
Energy: 0.36958835611378904
Energy: 0.38484509176973547
Energy: 0.369976526529491
Energy: 0.36964884096806405
Energy: 0.36950752342615467
Energy: 0.3695484945122535
Energy: 0.3693613117196191
Energy: 0.36967530415359656
Energy: 1.1455409937362577
Energy: 1.1768415162197237
Energy: 1.1601349889026227
Energy: 1.1449133735356787
Energy: 1.1447867934075586
Energy: 1.1547384408664039
Energy: 1.1869375864622764
Energy: 1.1850600841425183
Energy: 1.17568540248414
Energy: 1.1758211998345682
Energy: 1.1755839756335769
Energy: 1.21941083973434
Energy: 1.1758863904627102
Energy: 1.1754684679334115
Energy: 0.38509482163236936
Energy: 0.36973719215125045
Energy: 0.36962220554453373
Energy: 0.3693473051433427
Energy: 0.3693293190624483
Energy: 0.3695717560241455
Energy: 0.3695681499185619
Energy: 1.146278098341008
Energy: 1.1760252465678693
Energy: 1.1573173914487465
Energy: 1.1531792156135725
Energy: 1.1552786075626877
Energy: 1.1933514689092963
Energy: 1.1758285190670001
Energy: 1.1454081395501963
Energy: 1.1762514020429797
Energy: 1.1917531134227994
Energy: 1.153246586120601
Energy: 1.1460577230079878
Energy: 1.1566989112701151
Energy: 1.1759747108931875
Energy: 0.38516768298514503
Energy: 0.3696265555590128
Energy: 0.36941463818366704
Energy: 0.36928129621254857
Energy: 0.3694430436312707
Energy: 0.3695620417331741
Energy: 0.36971101922116933
Energy: 1.1848930474709962
Energy: 1.1756678324857206
Energy: 1.1759070330190744
Energy: 1.1760252756484382
Energy: 1.1762486503333744
Energy: 1.1755618507228394
Energy: 1.175480065820473
Energy: 1.175881676504182
Energy: 1.1436511663010025
Energy: 1.1590875754573848
Energy: 1.1453125595001332
Energy: 1.1457385635665396
Energy: 1.1449242198977705
Energy: 1.1597335200180248
Energy: 0.3849422008418858
Energy: 0.3701145056000085
Energy: 0.36960523273213153
Energy: 0.36961184903108085
Energy: 0.3694425810474845
Energy: 0.36970208997893467
Energy: 0.3699240651623762
Energy: 0.38475565348014423
Energy: 0.3702977721292217
Energy: 0.36946564311911095
Energy: 0.3695622214309267
Energy: 0.3694516012751785
Energy: 0.3692687612723126
Energy: 0.369870847017695
Energy: 1.1765012205692764
Energy: 1.176895615494879
Energy: 1.1581624194091507
Energy: 1.1463453757164779
Energy: 1.1465826056506607
Energy: 1.1472713148309353
Energy: 1.1587668112876934
Energy: 1.1458024057318772
Energy: 1.1764869251722745
Energy: 1.1753632242188257
Energy: 0.36910265821476684
Energy: 0.36892479397185074
Energy: 0.36971716514192854
Energy: 1.1760098954737006
Energy: 0.3848552145236325
Energy: 0.370149243132305
Energy: 0.3698343281570276
Energy: 0.3693045089835862
Energy: 0.3692698994251759
Energy: 0.36946838071052157
Energy: 0.3698329772238755
Energy: 1.14569079309583
Energy: 1.176470199103949
Energy: 1.1584655642211907
Energy: 1.1451475354129879
Energy: 1.1452587708425301
Energy: 1.154429265428709
Energy: 1.18600813309615
Energy: 1.1854691795756584
Energy: 1.1759130816931431
Energy: 1.1758958930190462
Energy: 1.158150040623608
Energy: 1.2189115184870734
Energy: 1.1756918392937885
Energy: 1.1755310621717563
Energy: 0.38542303870104894
Energy: 0.3694138506788525
Energy: 0.3692125895563854
Energy: 0.3691923728744212
Energy: 0.36891571344655666
Energy: 0.36912868005170385
Energy: 0.36904551913300254
Energy: 1.1444513190939074
Energy: 1.1752948915233334
Energy: 1.1758708691686124
Energy: 1.1458512041103361
Energy: 1.1461293368648913
Energy: 1.1941351657485
Energy: 1.1757123384796646

minimum gb energy = 0.36891571344655666 eV
minimum distance =  2.29789196714617 Angstroms
sigma value = 23