Model name: model_name=EAM_Dynamo_BonnyCastinBullens_2013_FeW__MO_737567242631_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=2.855324625968933
cohesive_energy=4.122759316666129
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]
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: 0.015606671879619984
Energy: 1.4103981832248629
Energy: 1.583289369996623
Energy: 0.01620067085073017
Energy: 0.016397431633828327
Energy: 1.5820308488238968
Energy: 0.015803849219713124
Energy: 0.16801783435043136
Energy: 0.2060960481249375
Energy: 0.3754413825198557
Energy: 0.16798650612824867
Energy: 0.37508708898214055
Energy: 0.37564310883685487
Energy: 0.16818705655128657
Energy: 0.16812664419791423
Energy: 0.37495110395453923
Energy: 0.37577676003271043
Energy: 0.1678507093374535
Energy: 0.3750887198329092
Energy: 0.20506831612886595
Energy: 0.16778925292560604
Energy: 0.1692971833973049
Energy: 0.3756510300310467
Energy: 0.205659119967809
Energy: 0.16804424091285405
Energy: 0.16907062899598446
Energy: 0.20536252621734827
Energy: 0.16742397424957528
Energy: 0.16753085907834853
Energy: 0.20519810708673608
Energy: 0.37703273846219576
Energy: 0.16870720910662743
Energy: 0.37504134327363875
Energy: 0.20471783403379976
Energy: 0.1682705596406952
Energy: 0.015954594617878886
Energy: 0.20472069036208934
Energy: 0.37545751179193465
Energy: 0.016381803047192823
Energy: 0.01661385712444799
Energy: 0.3756355189423915
Energy: 0.16735979896965594

minimum gb energy = 0.015606671879619984 eV
minimum distance =  2.44044961358047 Angstroms
sigma value = 5


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

Energy: 2.3610920777792748
Energy: 1.8376449491886135
Energy: 1.7013623729158562
Energy: 1.243161111382344
Energy: 1.2410466307682926
Energy: 2.097858948441632
Energy: 1.6133673322350592
Energy: 1.2802668698794406
Energy: 1.2961030984433919
Energy: 1.2683142108181715
Energy: 1.2695172175290503
Energy: 1.2896286394163334
Energy: 1.2598586885281458
Energy: 1.3098606452499866
Energy: 1.2275488627896207
Energy: 1.267501129300465
Energy: 1.2594838667377206
Energy: 1.257447873488495
Energy: 1.2781873299836968
Energy: 1.2585994600770427
Energy: 1.263967444187344
Energy: 1.1936813226622662
Energy: 1.2420630910312227
Energy: 1.2681289488180691
Energy: 1.2309956091162662
Energy: 1.263346656451383
Energy: 1.2876704825657743
Energy: 1.2361091716825847
Energy: 1.2794301683341462
Energy: 1.2391265751035754
Energy: 1.2464378373999998
Energy: 1.2379908387472076
Energy: 1.253200306525057
Energy: 1.2492636472582304
Energy: 1.2317222722911214
Energy: 1.2571707758674393
Energy: 1.2631659477835486
Energy: 1.2311603923175074
Energy: 1.2492780919992326
Energy: 1.243200994398083
Energy: 1.2285602883418605
Energy: 1.2520081497490734
Energy: 1.2543496242079746
Energy: 1.2385996675890774
Energy: 1.2339783398641555
Energy: 1.2620020994122714
Energy: 1.262060773960007
Energy: 1.2223096827567914
Energy: 1.2556479925147348
Energy: 1.2736123717453227
Energy: 1.240423718101368
Energy: 1.2472486455456084
Energy: 1.301252602027591
Energy: 1.2649888477057707
Energy: 1.2533098443810475
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Energy: 1.258796264959315
Energy: 1.2429016185766597
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Energy: 1.3308978482254785
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Energy: 1.2589360138663268
Energy: 1.254548449704502
Energy: 1.2184326274115442
Energy: 1.301129739545066
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Energy: 1.254516555562344
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Energy: 1.1954719279623367
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Energy: 1.214876586171834
Energy: 1.1980811495296293
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Energy: 1.225755444820921
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Energy: 1.1927479434945432
Energy: 1.2154887583801266
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Energy: 1.2046719831885144
Energy: 1.2123456396096826
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Energy: 1.284122413481179
Energy: 1.2138783960347985
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Energy: 1.272217501153998
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Energy: 1.2775927221725605
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Energy: 1.1904276168072454
Energy: 1.2132890291347433
Energy: 1.2280396767129673
Energy: 1.1955511303908717
Energy: 1.2770780897006861
Energy: 1.287800772507711
Energy: 1.1834446201454158
Energy: 1.2447352245555183
Energy: 1.2455172158242171
Energy: 1.2400300788403253
Energy: 1.3091449407332985
Energy: 1.4230151728310072
Energy: 1.2929529107033215
Energy: 1.1716164710974886
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Energy: 1.1980978457781688
Energy: 1.1763353391517188
Energy: 1.2732375219209695
Energy: 1.2599115978620845
Energy: 1.2898575797665455
Energy: 1.2018251423509574
Energy: 1.2734800276298495
Energy: 1.258765917192055
Energy: 1.189426853418899
Energy: 1.2656613550099518
Energy: 1.2447798773251468
Energy: 1.3760210000624473
Energy: 1.3278626301397
Energy: 1.1885259801421688
Energy: 1.2111597268048007
Energy: 1.2427776032593103
Energy: 1.263080761711514
Energy: 1.2902285249150494
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Energy: 1.2540883733808517
Energy: 1.1854971157784495
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Energy: 1.1735932976520311
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Energy: 1.2127345256074078
Energy: 1.1762942699744925
Energy: 1.2111811327614537
Energy: 1.1460217679771167
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Energy: 1.2685802733445084
Energy: 1.2627590832874822
Energy: 1.3519668613308438
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Energy: 1.2802357417896109
Energy: 1.363165780703663
Energy: 1.269168579590959
Energy: 1.2705542516380992
Energy: 1.2936305061976028
Energy: 1.3333312041794594
Energy: 1.2774062274018163
Energy: 1.277918876098557
Energy: 1.2503869588232452
Energy: 1.2830606471517267
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Energy: 1.3158565532992097
Energy: 1.2083754167460403
Energy: 1.2701759010729412
Energy: 1.2301738848887696
Energy: 1.2570323391710287
Energy: 1.2170036308936907
Energy: 1.255531479302644
Energy: 1.2647848706771256
Energy: 1.1633084706681758
Energy: 1.1900229891638667
Energy: 1.2224380179925622
Energy: 1.2106062401310793
Energy: 1.1902106040136002
Energy: 1.241758763983711
Energy: 1.2049472267561552
Energy: 1.1825182035023203
Energy: 1.1957789152620986
Energy: 1.2174390298216495
Energy: 1.1907875701953372
Energy: 1.1904377156941024
Energy: 1.2157173535854897
Energy: 1.2157162865012392
Energy: 1.311058541179912
Energy: 1.2677887185741994
Energy: 1.2162205543561844
Energy: 1.2787729608019176
Energy: 1.2624545835283938
Energy: 1.2548214447920818
Energy: 1.2641876821986007
Energy: 1.2093683832460447
Energy: 1.2482616504796977
Energy: 1.2616592983282315
Energy: 1.2137441371718867
Energy: 1.25463490245804
Energy: 1.280935869788556
Energy: 1.218825869707325
Energy: 1.2198556302713903
Energy: 1.258123214713632
Energy: 1.2605569632205165
Energy: 1.2529440808834225
Energy: 1.301298762857411
Energy: 1.2595348981151606
Energy: 1.2579060711891685
Energy: 1.288863994745954
Energy: 1.2710726284074094
Energy: 1.3171987582308509
Energy: 1.2798539905817952
Energy: 1.2782002510729873
Energy: 1.3146448948236575
Energy: 1.2798389447117025
Energy: 1.2571524629884951
Energy: 1.261019425303628
Energy: 1.232411196772354
Energy: 1.2495390565425264
Energy: 1.249211681759366
Energy: 1.2227650243095374
Energy: 1.2961095520240262

minimum gb energy = 1.1460217679771167 eV
minimum distance =  2.24188786570996 Angstroms
sigma value = 401


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

Energy: 1.9883029445526013
Energy: 1.8314316480891681
Energy: 1.3905905846885664
Energy: 1.5231974535035813
Energy: 1.5236032650715012
Energy: 1.3502874988206583
Energy: 1.6635534738084679
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Energy: 1.21307199204785
Energy: 1.2483176480276632
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Energy: 1.2768020104440083
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Energy: 1.3733559770144939
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Energy: 1.3451034439339797
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Energy: 1.177651767565075
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Energy: 1.2655581626350552
Energy: 1.303747269372603
Energy: 1.2789991594178345
Energy: 1.3924357994445802
Energy: 1.2940965123348793
Energy: 1.2788935453632087
Energy: 1.3564265461355387
Energy: 1.2962563345697522
Energy: 1.2791908120914623
Energy: 1.296389128386355
Energy: 1.3818919793192064
Energy: 1.3148031238839222
Energy: 1.303711026866269
Energy: 1.3794729037236313
Energy: 1.3185791236578381
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Energy: 1.3699145554118548
Energy: 1.3487858350765
Energy: 1.2991367261305222
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Energy: 1.3925404743120275
Energy: 1.3930165666786907
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Energy: 1.3606342444192143
Energy: 1.3467910772669351
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Energy: 1.3859001213405617
Energy: 1.320423209992923
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Energy: 1.3841434795373893
Energy: 1.36626139877809
Energy: 1.2832536072639755
Energy: 1.3668306383746056
Energy: 1.3871109282448901
Energy: 1.327905994635159
Energy: 1.3246805735561988
Energy: 1.3620181430390275
Energy: 1.3864054039655929
Energy: 1.3146132193641156
Energy: 1.3575310322733707
Energy: 1.3464504635575019
Energy: 1.2304857383757069
Energy: 1.2728068803262282
Energy: 1.2955840742523594
Energy: 1.2966970722810243
Energy: 1.2913769967776962
Energy: 1.3029649858010866
Energy: 1.4069348774412043
Energy: 1.6774260692866032
Energy: 1.6536652744766263
Energy: 1.418599334431201
Energy: 1.3038358613514176
Energy: 1.6524360892267573
Energy: 1.4537167419355832
Energy: 1.3439379439391956
Energy: 1.2747562943081996
Energy: 1.2749634524370772
Energy: 1.2904623277081004
Energy: 1.298602392615133
Energy: 1.2760003893759513
Energy: 1.3335652277252352
Energy: 1.448984871211729
Energy: 1.3679517531453766
Energy: 1.316852950106697
Energy: 1.3840497938090544
Energy: 1.4220462666204836
Energy: 1.3425475325529272
Energy: 1.3833669043499965
Energy: 1.5108574689924184
Energy: 1.3471955052365854
Energy: 1.3384701124183713
Energy: 1.4646179810755677
Energy: 1.4104099453655456
Energy: 1.3376923953588535
Energy: 1.375032336372886
Energy: 1.4709442027241473
Energy: 1.3573765313882495
Energy: 1.334746112919291
Energy: 1.3694218533418452
Energy: 1.296528140245953
Energy: 1.3400768631152238
Energy: 1.392096325313826
Energy: 1.2671125632240252
Energy: 1.2503232706450202
Energy: 1.2773193276118129
Energy: 1.2969445615313953
Energy: 1.2746654854870134
Energy: 1.2995745624638195
Energy: 1.2925391408992035
Energy: 1.2637068776470195
Energy: 1.2590871347334467
Energy: 1.284264215168459
Energy: 1.2763058057802878
Energy: 1.267570011998926
Energy: 1.2640464578186974
Energy: 1.2685766117290531
Energy: 1.2610067444869395
Energy: 1.2346748023490666
Energy: 1.3238157482251443
Energy: 1.2623644955202051
Energy: 1.2241018582909957
Energy: 1.2765232869013237
Energy: 1.2758135909688044
Energy: 1.2968098796443777
Energy: 1.228466363726014
Energy: 1.328758701913646
Energy: 1.2241848918171274
Energy: 1.257546744388336
Energy: 1.3570864275280867
Energy: 1.2204310550795503
Energy: 1.3313931409621818
Energy: 1.2510167924233078
Energy: 1.2878932786241872
Energy: 1.203238533331487
Energy: 1.2435906010040305
Energy: 1.4223118229997143
Energy: 1.362386088074677
Energy: 1.2144865982021815
Energy: 1.184369633577041
Energy: 1.2734894313659415
Energy: 1.2159419278831585
Energy: 1.2292175923181226
Energy: 1.2609981956068728
Energy: 1.216077293513842
Energy: 1.2278236377465632
Energy: 1.221830012003235
Energy: 1.267901352297099
Energy: 1.1616667574235502
Energy: 1.1831934337746206
Energy: 1.2282004709117087
Energy: 1.2049076724064112

minimum gb energy = 1.161279580693837 eV
minimum distance =  2.24999256183892 Angstroms
sigma value = 311


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

Energy: 1.6034045143297821
Energy: 1.4807746000207567
Energy: 1.4514102286416368
Energy: 1.4424033300286807
Energy: 1.3671938130686747
Energy: 1.479219347320839
Energy: 1.6666209309021658
Energy: 1.253729754130934
Energy: 1.2227670508492827
Energy: 1.2698911513844762
Energy: 1.2024591462730974
Energy: 1.2925563493534225
Energy: 1.2967423307106072
Energy: 1.299227556488501
Energy: 1.2057553942172146
Energy: 1.1923646007001696
Energy: 1.2106918645248472
Energy: 1.2262660927792544
Energy: 1.2064139775753087
Energy: 1.249732493817029
Energy: 1.2541778487593145
Energy: 1.269685211595187
Energy: 1.183260693833097
Energy: 1.2033874770305912
Energy: 1.2827028181901832
Energy: 1.3127400048790407
Energy: 1.3820096425279034
Energy: 1.3149925229902106
Energy: 1.2024554641610892
Energy: 1.3071512018232678
Energy: 1.2709013365250192
Energy: 1.2554754946483764
Energy: 1.2225502213009491
Energy: 1.2622673335648313
Energy: 1.2953231627975748
Energy: 1.3678964217206635
Energy: 1.371780835409136
Energy: 1.3681031462503936
Energy: 1.3509945251742876
Energy: 1.371587023935576
Energy: 1.3694282871838777
Energy: 1.3814371702409673
Energy: 1.353283538704686
Energy: 1.3610120242893549
Energy: 1.3466255146548978
Energy: 1.3820894881978008
Energy: 1.3506070013069025
Energy: 1.3435363990115796
Energy: 1.3621008480612717
Energy: 1.2925088402903115
Energy: 1.2385938990214282
Energy: 1.3436193241766246
Energy: 1.3327727054916194
Energy: 1.311881700801397
Energy: 1.316650792046425
Energy: 1.334219617221385
Energy: 1.385899705599722
Energy: 1.2703387227054215
Energy: 1.2340231526398207
Energy: 1.3599675786983476
Energy: 1.2618891924456048
Energy: 1.2805768729763174
Energy: 1.327902275089586
Energy: 1.3719205677046433
Energy: 1.3172937439161139
Energy: 1.364121034001179
Energy: 1.3962387745787428
Energy: 1.26796254519037
Energy: 1.2927078995614394
Energy: 1.3877169364394482
Energy: 1.2808811604230892
Energy: 1.2828320099240493
Energy: 1.2658486942687834
Energy: 1.2464500434035348
Energy: 1.2606587492185235
Energy: 1.232112811674506
Energy: 1.3026277679216225
Energy: 1.339283525628993
Energy: 1.3215085027748605
Energy: 1.3994769612025424
Energy: 1.3477024618535638
Energy: 1.3293840806909425
Energy: 1.2916512462663519
Energy: 1.3419289931047726
Energy: 1.3229245088258723
Energy: 1.3572138762490655
Energy: 1.3964591877750685
Energy: 1.3920374444615262
Energy: 1.3465927070666583
Energy: 1.4019788683208
Energy: 1.3915670473844906
Energy: 1.269762106258486
Energy: 1.2577867338978082
Energy: 1.2452107084166293
Energy: 1.2583257454166354
Energy: 1.2562667966153176
Energy: 1.2894151808820966
Energy: 1.2644975216445116
Energy: 1.278010260262876
Energy: 1.2903310643056
Energy: 1.332102462871998
Energy: 1.3037081662980197
Energy: 1.3093015527326253
Energy: 1.3236363571502252
Energy: 1.3215684860234924
Energy: 1.3540924573076982
Energy: 1.3104390756327315
Energy: 1.3303711369232254
Energy: 1.35477707961242
Energy: 1.3836065911183184
Energy: 1.3367370559136638
Energy: 1.289132537090082
Energy: 1.2858738062580912
Energy: 1.2971287701622556
Energy: 1.3272086976874755
Energy: 1.2568619304368847
Energy: 1.2876123871465495
Energy: 1.327108401377445
Energy: 1.2786346456544062
Energy: 1.3288389471577364
Energy: 1.393877842015754
Energy: 1.3969945002023085
Energy: 1.3457493816793258
Energy: 1.3884878355786991
Energy: 1.3982999461424048
Energy: 1.3440996051962097
Energy: 1.3324143511299416
Energy: 1.3572425931997907
Energy: 1.3757775382099144
Energy: 1.3257554804894074
Energy: 1.3382282725108343
Energy: 1.3721678731365616
Energy: 1.2950095574098848
Energy: 1.2844829856918767
Energy: 1.2848852300236278
Energy: 1.2978867894338748
Energy: 1.2315341685785013
Energy: 1.274118656558448
Energy: 1.2577346079333969
Energy: 1.2854444715717332
Energy: 1.3362235135293505
Energy: 1.3728358602045145
Energy: 1.3533162132123784
Energy: 1.3538723674199797
Energy: 1.2696906606839238
Energy: 1.3570669970921199
Energy: 1.333351188712798
Energy: 1.3394240435958662
Energy: 1.2901854908497354
Energy: 1.335910364626507
Energy: 1.3026596449206562
Energy: 1.2881402643036712
Energy: 1.3309838292237335
Energy: 1.400477358965635
Energy: 1.2695974681016413
Energy: 1.2584424481713072
Energy: 1.3247581023245223
Energy: 1.3396558238054344
Energy: 1.3277059769367097
Energy: 1.3568329914836776
Energy: 1.257411063057788
Energy: 1.3531881098111442
Energy: 1.362446773745664
Energy: 1.4077277222273208
Energy: 1.3605252424999104
Energy: 1.3377141466873848
Energy: 1.3916660329535346
Energy: 1.3953622921338509
Energy: 1.3806039175711595
Energy: 1.3589219114277953
Energy: 1.4037887160467093
Energy: 1.3978224519473337
Energy: 1.3459801578816413
Energy: 1.394846926833804
Energy: 1.4142302426722222
Energy: 1.2491165818060923
Energy: 1.2627939193987985
Energy: 1.2859923505913062
Energy: 1.2446021139491563
Energy: 1.2514559416081827
Energy: 1.230932038918532
Energy: 1.2692509807805372
Energy: 1.3455564374033389
Energy: 1.2781583465777855
Energy: 1.2796396678006081
Energy: 1.359723083409896
Energy: 1.3019978076184
Energy: 1.308973596638823
Energy: 1.3925693787373459
Energy: 1.3043823680665283
Energy: 1.29999183111744
Energy: 1.32046287078788
Energy: 1.2954058151205112
Energy: 1.2762963899503517
Energy: 1.2850351835407365
Energy: 1.383641183810763
Energy: 1.3452006740081368
Energy: 1.2540755302451991
Energy: 1.2572168817508167
Energy: 1.3621292293331009
Energy: 1.3270751206342022
Energy: 1.3200656607566332
Energy: 1.333297635355239
Energy: 1.3523862329943515
Energy: 1.3644037187272486
Energy: 1.3766718400876503
Energy: 1.401500192558385
Energy: 1.347602754150661
Energy: 1.3456232146768692
Energy: 1.3632579078830769
Energy: 1.3495058803649052
Energy: 1.3285575481969922
Energy: 1.3350875412135492
Energy: 1.359834019651709
Energy: 1.3408278147573371
Energy: 1.3170878008229618
Energy: 1.3316688282174989
Energy: 1.3048100118851822
Energy: 1.25922202020112
Energy: 1.2538952130650027
Energy: 1.2430404129874568
Energy: 1.1933376267478977
Energy: 1.2284689655941599
Energy: 1.3216461247769817
Energy: 1.3868708941385122
Energy: 1.481476240873359
Energy: 1.4013956207497507
Energy: 1.3877204152992986
Energy: 1.349844484058133
Energy: 1.2489661738167692
Energy: 1.3496357174230305
Energy: 1.2426715189267108
Energy: 1.2065531198615465
Energy: 1.210571773941313
Energy: 1.2235560897090207
Energy: 1.3472752607451057
Energy: 1.243602429895592
Energy: 1.264256882899586
Energy: 1.3036282538220956
Energy: 1.2727721313027756
Energy: 1.2755071335244124
Energy: 1.275354786368657
Energy: 1.2688388114070277
Energy: 1.3743190994563705
Energy: 1.3070756643454606
Energy: 1.3865027561168906
Energy: 1.3468717842485924
Energy: 1.3351762419970783
Energy: 1.3358272181514645
Energy: 1.376908890907996
Energy: 1.375997362248123
Energy: 1.3801459820623265

minimum gb energy = 1.183260693833097 eV
minimum distance =  2.23852858087967 Angstroms
sigma value = 39


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

Energy: 1.4330265423147301
Energy: 1.2907329455040135
Energy: 1.535795562965483
Energy: 1.436772317473148
Energy: 1.4376543374246602
Energy: 1.3178476832057024
Energy: 1.4356708759457741
Energy: 1.2848282346454647
Energy: 1.188931036100158
Energy: 1.3383946683455175
Energy: 1.252774681754127
Energy: 1.188667059712008
Energy: 1.1837041270220379
Energy: 1.2531445466373772
Energy: 1.252632893515869
Energy: 1.1519940005314793
Energy: 1.196194893072246
Energy: 1.2666941579681958
Energy: 1.184522380404484
Energy: 1.1799290241675944
Energy: 1.2670013217843765
Energy: 1.2723055800523366
Energy: 1.1747071238403308
Energy: 1.2792972080316423
Energy: 1.2516592790506036
Energy: 1.237541610493842
Energy: 1.1349162383172753
Energy: 1.3478928401286128
Energy: 1.3667044305017721
Energy: 1.1510486434358094
Energy: 1.1985021484856186
Energy: 1.2667717876670135
Energy: 1.2027301241650623
Energy: 1.188546237925268
Energy: 1.1957808279615627
Energy: 1.1972208038766028
Energy: 1.1939299694869756
Energy: 1.1711736555036856
Energy: 1.2180356321459933
Energy: 1.1957203611725902
Energy: 1.1708886557517906
Energy: 1.219937127250941
Energy: 1.1838060677186668
Energy: 1.1996223035701854
Energy: 1.1867163782806085
Energy: 1.2226358133099686
Energy: 1.2044454651696523
Energy: 1.2033127340550644
Energy: 1.2346638262348375
Energy: 1.196101446162986
Energy: 1.1828876396577868
Energy: 1.1954496103546077
Energy: 1.2200974018275068
Energy: 1.2152340641385917
Energy: 1.1944603727120406
Energy: 1.220358598635401
Energy: 1.1968245805252753
Energy: 1.2332980873447104
Energy: 1.359494471924685
Energy: 1.2543700012297065
Energy: 1.1996842580403118
Energy: 1.3597954450987269
Energy: 1.254577685222373
Energy: 1.279002261245566
Energy: 1.233667174120617
Energy: 1.3198522581371706
Energy: 1.2732147953033228
Energy: 1.2885238280703766
Energy: 1.339771060632426
Energy: 1.2764538395981526
Energy: 1.1934635761249768
Energy: 1.181253372711061
Energy: 1.1823302528676198
Energy: 1.2523345568320077
Energy: 1.1903486941961379
Energy: 1.1825414163230479
Energy: 1.2658374704310411
Energy: 1.3477807167785432
Energy: 1.1799826303151364
Energy: 1.2060013163329368
Energy: 1.25373371127438
Energy: 1.338909331477446
Energy: 1.1883675952035768
Energy: 1.2526392220165858
Energy: 1.274449423552156
Energy: 1.2193706846658172
Energy: 1.4360137671356614
Energy: 1.461011342545774
Energy: 1.2196915237637824
Energy: 1.1450936396003
Energy: 1.460667857428871
Energy: 1.252177193625864
Energy: 1.182618150152638
Energy: 1.1958178965248092
Energy: 1.2659067986494361
Energy: 1.1825205134722436
Energy: 1.18013491639078
Energy: 1.2537338594314793
Energy: 1.2325868230050911
Energy: 1.1889102787213437
Energy: 1.3772293488160883
Energy: 1.253692170059724
Energy: 1.1954244856089846
Energy: 1.3193087282361826
Energy: 1.2538656352002298
Energy: 1.4328728324304014
Energy: 1.2895018749746332
Energy: 1.1834339028824363
Energy: 1.4359754167565129
Energy: 1.4373141205350137
Energy: 1.424349603292315
Energy: 1.4357580887164594
Energy: 1.270248086159883
Energy: 1.1813276960382373
Energy: 1.1843703786308382
Energy: 1.2525552735273162
Energy: 1.1883249619836678
Energy: 1.1837338875869132
Energy: 1.2530970977533151
Energy: 1.2530856828587482
Energy: 1.153112744115242
Energy: 1.1964146726579779
Energy: 1.2668363941080765
Energy: 1.1829634293572298
Energy: 1.1800430470961039
Energy: 1.2671153624830647
Energy: 1.2673104801347395
Energy: 1.174744884198867
Energy: 1.2797785068970575
Energy: 1.2514828797320519
Energy: 1.2375700301397952
Energy: 1.134756862755957
Energy: 1.3480123926252383
Energy: 1.3673410337682694
Energy: 1.1510178815920364
Energy: 1.1989180622105102
Energy: 1.2542459299009194
Energy: 1.2032696561318503
Energy: 1.189055076321851
Energy: 1.1961413077905372
Energy: 1.195999922879478
Energy: 1.1936917506875395
Energy: 1.1712111833284131
Energy: 1.218238401474398
Energy: 1.1955764179492008
Energy: 1.172066195479719
Energy: 1.2196327013190644
Energy: 1.185283217567979
Energy: 1.1990607175760617
Energy: 1.1865673919217652
Energy: 1.2225665128813137
Energy: 1.2078010069146288
Energy: 1.2032920067228008
Energy: 1.2377920005333536
Energy: 1.1959425615387806
Energy: 1.1831710375880207
Energy: 1.195676692475999
Energy: 1.219917276079279
Energy: 1.1854467839936218
Energy: 1.194505548802927
Energy: 1.2203134790147563
Energy: 1.1963292298013082
Energy: 1.2332185532096482
Energy: 1.3596770333209125
Energy: 1.2543740841167377
Energy: 1.2938995329280694
Energy: 1.3592877030178308
Energy: 1.2792002499634771
Energy: 1.2894438547909366
Energy: 1.2338693661573494
Energy: 1.3199546137800984
Energy: 1.2623564824232452
Energy: 1.2889850697138934
Energy: 1.346617923018906
Energy: 1.2761908994682345
Energy: 1.1956255443508517
Energy: 1.180572586651468
Energy: 1.1822204276776653
Energy: 1.2523497974550724
Energy: 1.1904112676933603
Energy: 1.1823710672500116
Energy: 1.2661483826324396
Energy: 1.3474565865456547
Energy: 1.1828511861898259
Energy: 1.1953929012199258
Energy: 1.2538827890661488
Energy: 1.1815161777198417
Energy: 1.1884576708684076
Energy: 1.37234286471672
Energy: 1.2744931587991897
Energy: 1.2193705517089972
Energy: 1.4349155181706776
Energy: 1.3507889055482483
Energy: 1.2198370622096673
Energy: 1.141075655533694
Energy: 1.4614660523105536
Energy: 1.252255757915139
Energy: 1.1824252546960505
Energy: 1.1958083591978108
Energy: 1.2656149854402496
Energy: 1.1820833440264746
Energy: 1.1800882899367935
Energy: 1.2538233845308007
Energy: 1.231680678805993
Energy: 1.1898767361797862
Energy: 1.3768648219565618
Energy: 1.2531517190226384
Energy: 1.195560253784758
Energy: 1.3192930633288
Energy: 1.2539466272041428

minimum gb energy = 1.134756862755957 eV
minimum distance =  2.24514465385378 Angstroms
sigma value = 21


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

Energy: 1.6589901084396936
Energy: 1.1394555678240355
Energy: 1.1464991810557255
Energy: 1.2585166098148195
Energy: 1.1743134764281424
Energy: 1.1845677285174605
Energy: 1.174254937521137
Energy: 1.2575216682461132
Energy: 1.201045389208959
Energy: 1.1810904721629476
Energy: 1.2475610919294153
Energy: 1.219988334057677
Energy: 1.17905801742139
Energy: 1.2127359006398863
Energy: 1.1993238876833465
Energy: 1.15476403334055
Energy: 1.1569445173032713
Energy: 1.1927523896677614
Energy: 1.2040924397191186
Energy: 1.156294454909017
Energy: 1.2162930074146128
Energy: 1.2043795466490663
Energy: 1.2141781021503837
Energy: 1.1011107467270416
Energy: 1.2180319982753502
Energy: 1.1997111223844825
Energy: 1.1007175557692503
Energy: 1.2265953143523693
Energy: 1.113018642625881
Energy: 1.1282292809804026
Energy: 1.1773378147525024
Energy: 1.1412039642677938
Energy: 1.1388050422948564
Energy: 1.1001618225727523
Energy: 1.1775723558259894
Energy: 1.1123391188923768
Energy: 1.1607155296168006
Energy: 1.1630288516173242
Energy: 1.12678577735264
Energy: 1.1606870327079677
Energy: 1.1268651950627169
Energy: 1.1652001553248525
Energy: 1.1070229065246369
Energy: 1.1217272430456657
Energy: 1.0866800724056078
Energy: 1.1641113343750924
Energy: 1.1210985922084622
Energy: 1.1614453019077182
Energy: 1.1219090558347853
Energy: 1.1017084768834673
Energy: 1.1216215990797695
Energy: 1.1651985207789968
Energy: 1.1136847442448063
Energy: 1.1208800970049575
Energy: 1.1732849192389956
Energy: 1.131455880889695
Energy: 1.0707172491595536
Energy: 1.0836105651392511
Energy: 1.1472413009329216
Energy: 1.0933765683802124
Energy: 1.0731918899236552
Energy: 1.1664234002767282
Energy: 1.0930825000099156
Energy: 1.0780708054528667
Energy: 1.0714785673850873
Energy: 1.149955353176311
Energy: 1.1104794446873913
Energy: 1.0681282375159475
Energy: 1.1482703401692733
Energy: 1.099705776089231
Energy: 1.109849780686588
Energy: 1.1072003342486159
Energy: 1.1433517111712124
Energy: 1.1283939140348278
Energy: 1.108117067955136
Energy: 1.1437747825387445
Energy: 1.1172700027771523
Energy: 1.1210340929911957
Energy: 1.151396243449829
Energy: 1.1363090855829656
Energy: 1.1257299670113348
Energy: 1.1433181894306534
Energy: 1.1285965066856332
Energy: 1.127752919670894
Energy: 1.102385571090331
Energy: 1.1469382586590344
Energy: 1.0605579085789987
Energy: 1.0943993288200753
Energy: 1.1506279587518624
Energy: 1.0639905718195224
Energy: 1.0920148030218848
Energy: 1.1222976906426894
Energy: 1.1653587323316332
Energy: 1.061469416635838
Energy: 1.1036639309387157
Energy: 1.1448277155537792
Energy: 1.0610254522064704
Energy: 1.0891911656201192
Energy: 1.1224752823284985
Energy: 1.1581617848995243
Energy: 1.101033888745321
Energy: 1.0981487672785883
Energy: 1.1460965098680858
Energy: 1.1216292960273728
Energy: 1.1097339016907326
Energy: 1.1711935433696217
Energy: 1.1530074898610303
Energy: 1.121207611506871
Energy: 1.13596210122359
Energy: 1.1445589893875994
Energy: 1.121352879234967
Energy: 1.1352294522109991
Energy: 1.154328620469052
Energy: 1.1409562081481877
Energy: 1.100977010721331
Energy: 1.1459608566446828
Energy: 1.1806707662524378
Energy: 1.1220623205932359
Energy: 1.159624263171779
Energy: 1.176534964364408
Energy: 1.1590164176085518
Energy: 1.1380236672877024
Energy: 1.1589326879563868
Energy: 1.1555358427381923
Energy: 1.1388133128244786
Energy: 1.1411884841096325
Energy: 1.18023438128185
Energy: 1.1013905370611037
Energy: 1.197679068443188
Energy: 1.1633507543734598
Energy: 1.1011575596665353
Energy: 1.1240657730002785
Energy: 1.2013601029127836
Energy: 1.1786087468964788
Energy: 1.155135005248259
Energy: 1.2183594364136947
Energy: 1.2263966856598272
Energy: 1.154623210842643
Energy: 1.159097642638666
Energy: 1.218244990752608
Energy: 1.1761742397557815
Energy: 1.1849561509165796
Energy: 1.1978526308838346
Energy: 1.2311523920241711
Energy: 1.2042923903700715
Energy: 1.158119590158791
Energy: 1.2317849467210464
Energy: 1.2539281912919917
Energy: 1.158483040197426
Energy: 1.2464377589248108
Energy: 1.2288845952884837
Energy: 1.1617813072916614
Energy: 1.1742213511707795
Energy: 1.2451228241439873
Energy: 1.2433176452997499
Energy: 1.2039617113015526
Energy: 1.247646745110124
Energy: 1.2289282671985418
Energy: 1.1996264163769879
Energy: 1.1011315632127352
Energy: 1.2451231016052315
Energy: 1.2372639067247224
Energy: 1.1792753295894665
Energy: 1.199147589830464
Energy: 1.2299357836498408
Energy: 1.2015065988261662
Energy: 1.1810277540737344
Energy: 1.2317657402805005
Energy: 1.2575956005079247
Energy: 1.2012838246025304
Energy: 1.2233973718829352
Energy: 1.2234494232342596
Energy: 1.2462755318050336
Energy: 1.182290700979042
Energy: 1.2126946314258435

minimum gb energy = 1.0605579085789987 eV
minimum distance =  2.24535333041583 Angstroms
sigma value = 113


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

Energy: 1.6532055749135284
Energy: 1.038501531675978
Energy: 1.0576222619604383
Energy: 1.1734423310958744
Energy: 1.1739129867028697
Energy: 1.1009076113608438
Energy: 1.215205782853854
Energy: 1.1047013337058893
Energy: 1.0430963843473198
Energy: 1.0637125555302736
Energy: 1.0601327949509096
Energy: 1.0474592211646965
Energy: 1.0558248893801927
Energy: 1.0408398922432915
Energy: 1.0889530124400864
Energy: 1.0151551212856076
Energy: 1.0613670131883104
Energy: 1.0615153599628904
Energy: 1.0280909327999435
Energy: 1.051294170675425
Energy: 1.063867598865759
Energy: 0.9971883453757373
Energy: 1.0135637108390447
Energy: 1.0091740899789365
Energy: 0.9927009126708526
Energy: 0.9838675725940459
Energy: 1.0102798971762326
Energy: 1.0844399856494575
Energy: 0.9492084450187666
Energy: 1.0005221699901015
Energy: 1.049998948619727
Energy: 1.020579860163121
Energy: 0.9936503063243769
Energy: 1.0082563451387012
Energy: 1.0405296151715442
Energy: 1.008433288585453
Energy: 0.9969900555554007
Energy: 1.0300291057869377
Energy: 1.019358937769596
Energy: 0.9923695788620324
Energy: 1.0204006976704818
Energy: 1.0318706093195238
Energy: 1.0127349722567776
Energy: 1.1101210325249478
Energy: 0.9924440731919043
Energy: 1.0008783821692497
Energy: 0.9936608503437294
Energy: 1.02491580423782
Energy: 1.0033972258528572
Energy: 1.0131811290328367
Energy: 1.1311733726836863
Energy: 1.0094649493552894
Energy: 0.9884400272587262
Energy: 1.0145538418713411
Energy: 1.0134655609211223
Energy: 0.9954581528035094
Energy: 0.9975862042608913
Energy: 0.9874143919135692
Energy: 0.9961597079318272
Energy: 0.9741741354423414
Energy: 0.9830444092110102
Energy: 0.9939960031764168
Energy: 0.975178923637289
Energy: 0.9525964109368351
Energy: 0.9747226830783018
Energy: 0.9648510149062598
Energy: 0.9681752628640216
Energy: 0.9754517423956033
Energy: 1.0038172506908485
Energy: 0.9726071295616676
Energy: 0.9785041167736812
Energy: 1.0110279028916254
Energy: 1.013124192669748
Energy: 0.975178132295678
Energy: 0.9752308141895064
Energy: 1.0179207891449835
Energy: 0.9553709169987579
Energy: 0.9852675624393675
Energy: 0.9738056423184647
Energy: 0.9606507022101473
Energy: 0.9587736657592474
Energy: 0.9721104001905753
Energy: 0.9603963707932615
Energy: 0.958815069103256
Energy: 0.9699452438973157
Energy: 0.9897966624240692
Energy: 0.9299989150328427
Energy: 0.9517393250251852
Energy: 1.0015529505622676
Energy: 0.932821745428257
Energy: 0.9514416509587104
Energy: 0.9704418197208635
Energy: 0.9473551744903684
Energy: 0.9299112921368382
Energy: 0.9491273095077315
Energy: 0.9970408236544211
Energy: 0.9199685304981121
Energy: 0.9520809612313418
Energy: 0.9895570376254942
Energy: 0.9455837501379966
Energy: 0.9388275333670114
Energy: 0.9504796453967621
Energy: 0.9479799192542799
Energy: 0.9391048068525633
Energy: 0.9542981384890913
Energy: 0.9291131002253911
Energy: 0.9273424336837066
Energy: 0.9409387162085425
Energy: 0.9529264661843401
Energy: 0.9348246451687723
Energy: 0.9417704672210312
Energy: 0.9546288767585448
Energy: 0.9275670889933401
Energy: 0.9328467203269767
Energy: 0.9454335762057002
Energy: 0.9492806466601416
Energy: 0.9342405555493023
Energy: 0.9469314736198069
Energy: 0.9455893166863694
Energy: 0.9611180827661068
Energy: 0.9402910240274226
Energy: 0.9640997951531541
Energy: 0.9535308976914163
Energy: 0.937670126735813
Energy: 0.9563602225115564
Energy: 0.9625624145590501
Energy: 0.9952926004373881
Energy: 0.93704681517107
Energy: 0.9571295192068708
Energy: 0.9459382831646682
Energy: 0.9363790306273101
Energy: 0.9562647098264996
Energy: 0.9519663086355462
Energy: 0.9140047512621898
Energy: 0.9105764999636172
Energy: 0.9645317546792712
Energy: 0.9278214703008691
Energy: 0.9057022419814558
Energy: 0.9628487530393153
Energy: 0.9265125728545233
Energy: 0.9436225453848033
Energy: 0.948196632629515
Energy: 0.9547605003433953
Energy: 0.9364612338035024
Energy: 0.9540446898288149
Energy: 0.9543290768310579
Energy: 0.9393754664543714
Energy: 0.9509466749792181
Energy: 0.9577350018325824
Energy: 0.956906426160285
Energy: 0.9376823387237694
Energy: 0.9547489911594739
Energy: 0.9556033966784168
Energy: 0.9391713017124814
Energy: 0.9440588126164424
Energy: 0.9668867110197397
Energy: 0.9019577294336677
Energy: 0.9300785939862931
Energy: 0.960812920108485
Energy: 0.9055236951565933
Energy: 0.9263108788952618
Energy: 0.9667156645840214
Energy: 0.9940759407744957
Energy: 0.9362234474234977
Energy: 0.9467147569205344
Energy: 0.9546683410871956
Energy: 0.9350577458438705
Energy: 0.9735504952916924
Energy: 0.976935454673119
Energy: 0.961882759316192
Energy: 0.940191156539728
Energy: 0.9584083186651288
Energy: 0.9695131809968125
Energy: 0.9389335894205799
Energy: 0.947706512610106
Energy: 0.9552888756920217
Energy: 0.9354833876055633
Energy: 0.9369162852221238
Energy: 0.9468837615200947
Energy: 0.9425101037652203
Energy: 0.9356851459031658
Energy: 0.9441451042199217
Energy: 0.9479090245448514
Energy: 0.9344637641258063
Energy: 0.9249564489148605
Energy: 0.9530701171267234
Energy: 0.9434008820601792
Energy: 0.9217811598755838
Energy: 0.9430756871693061
Energy: 0.9660417353774192
Energy: 0.9428763499717444
Energy: 0.9364357958888448
Energy: 0.9725992536173991
Energy: 0.9369422574792469
Energy: 0.9488292092019432
Energy: 0.9708951038136939
Energy: 0.9424107561681826
Energy: 0.9337773388636661
Energy: 0.9992572499355189
Energy: 0.9513266058778086
Energy: 0.9299544197612878
Energy: 0.9987464887488728
Energy: 0.9490421759360004
Energy: 0.9422530594031837
Energy: 0.9367534770784486
Energy: 1.0037282648123218
Energy: 0.9506067997455312
Energy: 0.9312621542853557
Energy: 0.9895534091593102
Energy: 0.9555871881744418
Energy: 0.9754054864623547
Energy: 0.9545944110536817
Energy: 0.975376766362593
Energy: 0.9579902716321803
Energy: 0.960459386216867
Energy: 0.9721065695209461
Energy: 0.9567018430963723
Energy: 0.9840630315079456
Energy: 1.0066931310786003
Energy: 0.9753211421971257
Energy: 0.9627833068706818
Energy: 1.0119077509954144
Energy: 0.9920493477369308
Energy: 0.9890494128183874
Energy: 0.9708426075950065
Energy: 1.0077478256897765
Energy: 0.9901557885365964
Energy: 0.9671824177085402
Energy: 1.0070328054304223
Energy: 0.9741772634341986
Energy: 0.9890242822428431
Energy: 0.9983986577966364
Energy: 0.997395965208776
Energy: 0.9907083801765787
Energy: 0.9745225133270451
Energy: 0.994701891072966
Energy: 1.0061807959758107
Energy: 0.9758083338119151
Energy: 1.0103840147442997
Energy: 1.0281947922807981
Energy: 1.0154251538164993
Energy: 0.9969595524087302
Energy: 0.9903824403323066
Energy: 1.0156223490510399
Energy: 0.9785381605218015
Energy: 1.0088528309106441
Energy: 1.0090631721437349
Energy: 0.9930074184598231
Energy: 0.9601219855385164
Energy: 1.0570794088318003
Energy: 0.9931986403380016
Energy: 1.0071849775295454
Energy: 1.047362002096309
Energy: 1.0128011364003884
Energy: 0.9932411602442431
Energy: 1.017474058411557
Energy: 1.0215101267875326
Energy: 1.0018576654456153
Energy: 1.0193887607722072
Energy: 1.0919193603971005
Energy: 1.0100624014742732
Energy: 1.021387402067977
Energy: 1.0212668067638084
Energy: 1.009303004673065
Energy: 1.001978115962311
Energy: 1.0462568640829508
Energy: 1.0904510211926288
Energy: 1.1268350199668933
Energy: 1.1418228713968148
Energy: 1.0272539883961438
Energy: 1.009080034095255
Energy: 1.0039782854802481
Energy: 0.9700391179772198
Energy: 1.0897499460146218
Energy: 1.0508422698416984
Energy: 1.0311190806023292
Energy: 1.0869477437310961
Energy: 1.0617392531777705
Energy: 1.0152060012130277
Energy: 1.04941252823579
Energy: 1.049275827759338
Energy: 1.049162018183938
Energy: 1.0901431221842606
Energy: 1.0469114189045527
Energy: 1.0393830732467177
Energy: 1.0316229366087089
Energy: 1.128361283818693
Energy: 0.9857161538163565
Energy: 1.1039034454899135
Energy: 1.0646758091783837
Energy: 0.985845061400567
Energy: 0.9856627379070619
Energy: 1.0412852752377753
Energy: 1.0988584189095683
Energy: 1.0918541610637473
Energy: 1.0521824308194292
Energy: 1.0641929927166653
Energy: 1.0458646896122563
Energy: 1.0570669859197988
Energy: 1.0508743376153322
Energy: 1.0997907272885312
Energy: 1.1063300635369584
Energy: 1.04839337925681
Energy: 1.0585460196156387
Energy: 1.0982863708361226
Energy: 1.04999584621156
Energy: 1.0541623335925305
Energy: 1.0610344031549974
Energy: 1.1446530625917495
Energy: 0.9865600448961426
Energy: 0.9839495622931397
Energy: 1.0653351027612654
Energy: 1.0645781278952182
Energy: 1.0034631761062005
Energy: 0.9931495410332227

minimum gb energy = 0.9019577294336677 eV
minimum distance =  2.24020674006374 Angstroms
sigma value = 365


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

Energy: 1.2031689058236092
Energy: 1.1305393480011752
Energy: 1.2189478159819234
Energy: 1.2070564388356684
Energy: 1.2063816005198822
Energy: 1.2079638137082296
Energy: 1.2211042674808958
Energy: 0.38492901013347075
Energy: 0.37012616117862723
Energy: 0.3694268684455682
Energy: 0.36917683885914226
Energy: 0.3693861000146232
Energy: 0.3695177746223935
Energy: 0.36958834109332955
Energy: 0.3848450810408167
Energy: 0.36995594688247463
Energy: 0.36964937622131594
Energy: 0.3695114068634352
Energy: 0.3695485298831046
Energy: 0.36936286633795157
Energy: 0.3696752710772962
Energy: 1.145540988253984
Energy: 1.1768424547898155
Energy: 1.1585541063718054
Energy: 1.144912670418355
Energy: 1.144919918938402
Energy: 1.1548718845560766
Energy: 1.1844343430805513
Energy: 1.1848198769617861
Energy: 1.1756420012099937
Energy: 1.1757967265241995
Energy: 1.175419088938577
Energy: 1.219404699989248
Energy: 1.1758862462975024
Energy: 1.1754602011866002
Energy: 0.3850951178496099
Energy: 0.36973721960657074
Energy: 0.36962202976709063
Energy: 0.3693477563863693
Energy: 0.3693288138996229
Energy: 0.3695710005324949
Energy: 0.36956816223199196
Energy: 1.1462779769641387
Energy: 1.175721833371011
Energy: 1.1576436028413093
Energy: 1.1548452890651995
Energy: 1.1552792848236701
Energy: 1.1933508203473042
Energy: 1.1759896352949346
Energy: 1.1455926313901141
Energy: 1.176252382744569
Energy: 1.1917542198753022
Energy: 1.1532429388941388
Energy: 1.1457993011195053
Energy: 1.1564395398347183
Energy: 1.176114337016209
Energy: 0.3851107215371966
Energy: 0.369626540692194
Energy: 0.3694146561298224
Energy: 0.3692801232022327
Energy: 0.3694430490786996
Energy: 0.369562055355005
Energy: 0.3697111714028659
Energy: 1.1848748519885577
Energy: 1.175667910632299
Energy: 1.1759231469220985
Energy: 1.1760466281112496
Energy: 1.17624813562189
Energy: 1.1755609405104954
Energy: 1.1752434162202539
Energy: 1.175753950513698
Energy: 1.1436511495375397
Energy: 1.15908760437321
Energy: 1.1452406325709088
Energy: 1.1457546877675575
Energy: 1.144895764973856
Energy: 1.159467936028446
Energy: 0.3849421875836401
Energy: 0.37011454191603294
Energy: 0.3696059031042945
Energy: 0.3696118531723203
Energy: 0.3694425644537374
Energy: 0.3697020289701998
Energy: 0.3699239854718155
Energy: 0.38475545619745427
Energy: 0.37028538859291277
Energy: 0.3694655423204403
Energy: 0.3695622337222214
Energy: 0.3694516162495199
Energy: 0.3693576135883198
Energy: 0.36987084640847806
Energy: 1.1765012921790237
Energy: 1.1763615972950312
Energy: 1.1581630577628927
Energy: 1.146458417537964
Energy: 1.146582630976226
Energy: 1.1471572038481008
Energy: 1.1587590890277546
Energy: 1.1458051358848678
Energy: 1.176488339111049
Energy: 1.1753645970835054
Energy: 0.3691018984426627
Energy: 0.3689257721079845
Energy: 0.36971706199429993
Energy: 1.1760100402128975
Energy: 0.3848567420581283
Energy: 0.3701498399731701
Energy: 0.36983481858727024
Energy: 0.3693042606550123
Energy: 0.369286805038828
Energy: 0.36946852535441255
Energy: 0.36983295029050806
Energy: 1.1457761583488848
Energy: 1.1764493965412655
Energy: 1.1584655374919828
Energy: 1.145147477147029
Energy: 1.1454177767597162
Energy: 1.1548862631849286
Energy: 1.185648943223816
Energy: 1.1854802932785768
Energy: 1.1759098647967612
Energy: 1.175894748687001
Energy: 1.1581355159665212
Energy: 1.218524543006424
Energy: 1.17568626823897
Energy: 1.1755318197985445
Energy: 0.3854228157597193
Energy: 0.3694138626381933
Energy: 0.3692124603145685
Energy: 0.369188937025066
Energy: 0.36891540422635266
Energy: 0.36912843610823526
Energy: 0.36904627267524426
Energy: 1.1442495011696028
Energy: 1.1752958879755966
Energy: 1.1758719960327706
Energy: 1.1538943066992113
Energy: 1.1523976969766674
Energy: 1.19413576948475
Energy: 1.1759936167334657

minimum gb energy = 0.36891540422635266 eV
minimum distance =  2.29580699790046 Angstroms
sigma value = 23