Model name: model_name=MEAM_LAMMPS_LeeBaskesKim_2001_Fe__MO_196726067688_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=2.863657340407371
cohesive_energy=4.290337440834254
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=[0.0, 2.4558483881278797e-19, 2.90855941783092e-19, 3.2776528490055e-19, 3.5962136291437197e-19, 4.79688479866332e-19, 5.086766617052939e-19, 5.34122431006482e-19, 5.56616990947842e-19, 5.765528748047039e-19, 5.94229689607626e-19, 6.09886159675074e-19, 6.23712944026494e-19, 6.35868658148652e-19, 6.4648628270216995e-19, 6.55679572228062e-19, 6.63543055147734e-19, 6.70161646822788e-19, 6.756106495550219e-19, 6.799525482331619e-19, 6.83246623392666e-19, 6.85544144685822e-19, 6.8689317741165e-19, 6.87333775986e-19, 6.868579295257019e-19, 6.85311829073892e-19, 6.82496804727954e-19, 6.78172529992788e-19, 6.7204901089764e-19, 6.63780177289566e-19, 6.52939850183922e-19, 6.39015333057828e-19, 6.213721639642199e-19, 5.992284807057059e-19, 5.716085577121799e-19, 5.37293138565168e-19, 4.94750542402566e-19, 4.4202451155426e-19, 3.7653714381614393e-19, 2.95007181441786e-19, 1.9309593010631396e-19, 6.49823616630792e-20, -9.72234427220514e-20, -3.0442157134317e-19, -5.71948219158588e-19, -9.21913263499842e-19, -1.3869658598145839e-18, -2.01685199041188e-18, -2.8901183647735795e-18, -4.13624328539976e-18, -5.9802043952366996e-18, -8.83983333866526e-18, -1.3560662812512598e-17, -2.2064695950457802e-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: 0.016148349649810063
Energy: 0.016719433063624056
Energy: 1.2911562260434564
Energy: 0.016814574101238596
Energy: 0.016616402244482707
Energy: 1.3808200686554746
Energy: 0.01646069609375737
Energy: 0.016804558440691127
Energy: 0.2166748272462549
Energy: 0.1750241162226008
Energy: 0.1752410882565985
Energy: 0.35537218877028215
Energy: 0.21630711597354793
Energy: 0.17544461347406032
Energy: 0.17560582415515202
Energy: 0.21607057229302257
Energy: 0.17507318621567716
Energy: 0.1757223410542518
Energy: 0.1754750322772893
Energy: 0.21635948559461549
Energy: 0.17532935625824791
Energy: 0.17604841259322696
Energy: 0.2160376234211748
Energy: 0.21728077193715734
Energy: 0.17527607252957378
Energy: 0.17629848490807848
Energy: 0.21666272385068464
Energy: 0.1754457140562304
Energy: 0.17542671240091587
Energy: 0.21654348037202847
Energy: 0.17513826332871077
Energy: 0.1757794345192142
Energy: 0.17536815306190182
Energy: 0.2160033645236683
Energy: 0.17534588637276197
Energy: 0.016656996349774227
Energy: 0.21590204653312992
Energy: 0.17514972988691346
Energy: 0.017034252873727708
Energy: 0.017134298914052434
Energy: 0.2165342505832598
Energy: 0.17531841329035897

minimum gb energy = 0.016148349649810063 eV
minimum distance =  2.44980378737891 Angstroms
sigma value = 5


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

Energy: 2.523006265132592
Energy: 1.366843427702203
Energy: 1.5956321603508163
Energy: 1.355207840724144
Energy: 2.3186765628802646
Energy: 1.6946794008640225
Energy: 1.3618335038213922
Energy: 1.3224515921329871
Energy: 1.3035533410118654
Energy: 1.3471060805036814
Energy: 1.3352082554561666
Energy: 1.277787147089544
Energy: 1.3411797602139321
Energy: 1.2810897690392893
Energy: 1.228521626110772
Energy: 1.2608291107238918
Energy: 1.2697200803274538
Energy: 1.2358922766068332
Energy: 1.2633849480199648
Energy: 1.279123314108289
Energy: 1.2411087887461765
Energy: 1.2306666470838625
Energy: 1.285945351188537
Energy: 1.2686187261022897
Energy: 1.2811063235851912
Energy: 1.2574217529168497
Energy: 1.2726126031087315
Energy: 1.2621779087171285
Energy: 1.252863599076784
Energy: 1.262138813711247
Energy: 1.2506772914852706
Energy: 1.2431813243219965
Energy: 1.2773510364480416
Energy: 1.2796524833714735
Energy: 1.2447681030020956
Energy: 1.2715220898015014
Energy: 1.238670830538416
Energy: 1.2349171243668051
Energy: 1.2914769011090168
Energy: 1.2849119006074907
Energy: 1.2344175770290406
Energy: 1.249901815820257
Energy: 1.2699416464036892
Energy: 1.2354393763902587
Energy: 1.2367381529475237
Energy: 1.276236899003449
Energy: 1.246420222817037
Energy: 1.2276093460243342
Energy: 1.2379279965237864
Energy: 1.2997334343354328
Energy: 1.2341876568007282
Energy: 1.2438830399522447
Energy: 1.2975367544260887
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Energy: 1.245829801402021
Energy: 1.2789890892156894
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Energy: 1.3159418074885931
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Energy: 1.270374578264548
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Energy: 1.3178263755896968
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Energy: 1.3679702220983891
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Energy: 1.293752475745896
Energy: 1.291834571531222
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Energy: 1.345583012851242
Energy: 1.293582233089796
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Energy: 1.446973033957283
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Energy: 1.3296266679205526
Energy: 1.2261840525820327
Energy: 1.294220776796839
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Energy: 1.2869295722834795
Energy: 1.215010382405976
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Energy: 1.215474921469484
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Energy: 1.23370873979601
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Energy: 1.2186165993726066
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Energy: 1.3233565041498818
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Energy: 1.2854149559082089
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Energy: 1.1939425746659675
Energy: 1.1949652497181273
Energy: 1.2214717370469508
Energy: 1.2211126556910517
Energy: 1.1752532742938242
Energy: 1.215765794140854
Energy: 1.2337347100164906
Energy: 1.175036994154054
Energy: 1.2599005761788433
Energy: 1.2704137053996143
Energy: 1.3134768032071407
Energy: 1.3200272384143386
Energy: 1.2866042055569777
Energy: 1.3064569695435564
Energy: 1.3076968504367745
Energy: 1.2949385198645966
Energy: 1.279819897532541
Energy: 1.3835446069208137
Energy: 1.284399871556565
Energy: 1.2851678307980923
Energy: 1.305471161504387
Energy: 1.3028641138521704
Energy: 1.3127739689515614
Energy: 1.2583471691204613
Energy: 1.29746236189391
Energy: 1.3056527532276623
Energy: 1.2925023202309944
Energy: 1.3134652198868404
Energy: 1.3189117762601332
Energy: 1.248021574281519
Energy: 1.2840562088301413
Energy: 1.305804497231208
Energy: 1.3206549735534858
Energy: 1.2920359760016917
Energy: 1.3071844531390473
Energy: 1.2943783820583175
Energy: 1.4865084812091824
Energy: 1.2954777017818775
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Energy: 1.2240397658441582
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Energy: 1.2544868673190532
Energy: 1.3185064634075856
Energy: 1.2863901124450439
Energy: 1.2970672314754763
Energy: 1.343889047073772
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Energy: 1.3077535569638425
Energy: 1.209008953016142
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Energy: 1.1764556652013471
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Energy: 1.1987228939301577
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Energy: 1.1757921521041375
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Energy: 1.2185024191171843
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Energy: 1.2932302396482702
Energy: 1.3505840302377343
Energy: 1.3036553520899095
Energy: 1.2960609889359322
Energy: 1.3178448178380533
Energy: 1.3077495883903305
Energy: 1.3470717232344462
Energy: 1.2756771373072708
Energy: 1.3433336919450904
Energy: 1.3502156776571792
Energy: 1.2976777112307374
Energy: 1.303198218596869
Energy: 1.3115758863079077
Energy: 1.3482286067661613
Energy: 1.3110827212068532
Energy: 1.3131642649353414
Energy: 1.275377636304063
Energy: 1.291445126795337
Energy: 1.362466969950016
Energy: 1.2066278348827215
Energy: 1.2190858046817479
Energy: 1.2337597479017015
Energy: 1.2924688929018489
Energy: 1.2170396676791424
Energy: 1.2526516590474868
Energy: 1.2728588025430843
Energy: 1.1832761355132089
Energy: 1.1992590145537065
Energy: 1.2167319599194093
Energy: 1.2114991326853237
Energy: 1.2028784149929614
Energy: 1.2370326547425325
Energy: 1.1952164752431296
Energy: 1.2002228017539376
Energy: 1.208380709716498
Energy: 1.2289036469992287
Energy: 1.2185729094244413
Energy: 1.2155276125429295
Energy: 1.2259507347254168
Energy: 1.2090049866272368
Energy: 1.2497893404112261
Energy: 1.2787006905181737
Energy: 1.3244876285609104
Energy: 1.3160729223838457
Energy: 1.2930988839926003
Energy: 1.3579542959781465
Energy: 1.2901960368608991
Energy: 1.2314735606154312
Energy: 1.2927956611527702
Energy: 1.2542790864151288
Energy: 1.2447244553301484
Energy: 1.2463469814696926
Energy: 1.3619879740684973
Energy: 1.2368149105537
Energy: 1.22546719126739
Energy: 1.3036937064547145
Energy: 1.2679826472790094
Energy: 1.2302727763183379
Energy: 1.2474660548831698
Energy: 1.3359711328133836
Energy: 1.234244513871309
Energy: 1.3315774637807107
Energy: 1.272873658840506
Energy: 1.3653835081681107
Energy: 1.2769725560328555
Energy: 1.301819002570368
Energy: 1.3515628885692634
Energy: 1.2778514272728962
Energy: 1.283451633847167
Energy: 1.3248294255998667
Energy: 1.3943275870066598
Energy: 1.263676559687664
Energy: 1.2461646749569935
Energy: 1.3530166263541692
Energy: 1.3085880321203947

minimum gb energy = 1.1629992803516689 eV
minimum distance =  2.31347731773695 Angstroms
sigma value = 401


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

Energy: 2.182642373903712
Energy: 1.274746265508782
Energy: 1.6209905169999523
Energy: 2.0573458388639483
Energy: 2.060035049108544
Energy: 2.0267208985917082
Energy: 1.35613366163672
Energy: 1.2704399493053276
Energy: 1.2640023162176055
Energy: 1.386207905168465
Energy: 1.2278965238618011
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Energy: 1.308178597051167
Energy: 1.254916544996717
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Energy: 1.2794510792659002
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Energy: 1.5168116542636771
Energy: 1.247044735834691
Energy: 1.268213916787923
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Energy: 1.3530484712014708
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Energy: 1.4723326020320708
Energy: 1.2811772581111183
Energy: 1.2733907027340177
Energy: 1.4274907010782367
Energy: 1.3760718544912791
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Energy: 1.3813703281135012
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Energy: 1.3764544879559202
Energy: 1.3888513995631677
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Energy: 1.3799940912815147
Energy: 1.3507865321635466
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Energy: 1.3438605458291928
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Energy: 1.3679108871746901
Energy: 1.2640471656620667
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Energy: 1.2248207805391262
Energy: 1.3283021504385761
Energy: 1.1703975029705602
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Energy: 1.2150069327922954
Energy: 1.2499862845931118
Energy: 1.2385936083118654
Energy: 1.2727920532459895
Energy: 1.1723135457009946
Energy: 1.174150036952552
Energy: 1.2931894707869707
Energy: 1.2455881313732475
Energy: 1.3606319942996974
Energy: 1.2671145816512535
Energy: 1.3470726276316018
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Energy: 1.2205362941632536
Energy: 1.4297574477849775
Energy: 1.2490382463481728
Energy: 1.3286285306417915
Energy: 1.268864180566131
Energy: 1.322332337517077
Energy: 1.243921129597101
Energy: 1.2484540803963908
Energy: 1.3213391894394309
Energy: 1.4209613133424557
Energy: 1.3335032193987666
Energy: 1.395330621383685
Energy: 1.356042598419117
Energy: 1.2646713423271498
Energy: 1.2596122178828166
Energy: 1.3403669172059485
Energy: 1.4241667546943364
Energy: 1.4057415214203726
Energy: 1.41308365587986
Energy: 1.3622480669476678
Energy: 1.3507013171311262
Energy: 1.2550480584718238
Energy: 1.3379224305538011
Energy: 1.3539467604553432
Energy: 1.4692454541823057
Energy: 1.3818391340408072
Energy: 1.3644543257802095
Energy: 1.4342093643569267
Energy: 1.4810224387336834
Energy: 1.3931839998912565
Energy: 1.3421079543009764
Energy: 1.498108573599234
Energy: 1.3527469249205488
Energy: 1.3469468882109976
Energy: 1.3688798789124932
Energy: 1.3527771099741999
Energy: 1.3476749403204944
Energy: 1.3529509828717563
Energy: 1.3258268093005776
Energy: 1.336904833034848
Energy: 1.2846303149622604
Energy: 1.4215261339287815
Energy: 1.3503578889543792
Energy: 1.4106959149121572
Energy: 1.3696208593854962
Energy: 1.5752193244137271
Energy: 1.3972225853221414
Energy: 1.3005350031150553
Energy: 1.410455529526994
Energy: 1.4362506811645392
Energy: 1.311781806659974
Energy: 1.681311996404005
Energy: 1.4232879402797316
Energy: 1.362384852304138
Energy: 1.5468751569695287
Energy: 1.487129610277897
Energy: 1.3586743042333873
Energy: 1.4092581535816657
Energy: 1.2943661858663245
Energy: 1.554580387665229
Energy: 1.468028745074035
Energy: 1.3300153649660846
Energy: 1.4096004113442615
Energy: 1.5206404802577889
Energy: 1.2688240144489156
Energy: 1.321251778585452
Energy: 1.7821079191211204
Energy: 1.7239222917874848
Energy: 1.3558363441550771
Energy: 1.5180691108761821
Energy: 1.4423983816245292
Energy: 1.402421052598704
Energy: 1.397427686755162
Energy: 1.350868465833011
Energy: 1.4387997765705658
Energy: 1.323219192214563
Energy: 1.373672566341336
Energy: 1.4033394091694094
Energy: 1.3863840799642118
Energy: 1.347760981373578
Energy: 1.3262227579496864
Energy: 1.3137474481641749
Energy: 1.3188984843059228
Energy: 1.3005007130311896
Energy: 1.2531613106976744
Energy: 1.338566806299506
Energy: 1.3083415350585592
Energy: 1.3491944468360335
Energy: 1.3330601968330467
Energy: 1.3114586366124803
Energy: 1.3128159602762435
Energy: 1.3444909012933481
Energy: 1.3569483596255993
Energy: 1.3361350428300425
Energy: 1.3197617990469879
Energy: 1.3641468960050904
Energy: 1.4020946409211938
Energy: 1.3151560708991394
Energy: 1.2560812418600427
Energy: 1.3236943758486845
Energy: 1.3289366085374414
Energy: 1.3304149174973188
Energy: 1.2928916027033526
Energy: 1.4634828181080253
Energy: 1.2782994846103286
Energy: 1.2764710902553953
Energy: 1.5312596072200122
Energy: 1.2833157784053753
Energy: 1.3531604703486741
Energy: 1.2306429567760946
Energy: 1.2969205048623964
Energy: 1.2313334032589756
Energy: 1.5183213318825537
Energy: 1.6289312336255035
Energy: 1.4415960923746187
Energy: 1.359513582902941
Energy: 1.322430284113003
Energy: 1.3229032946419448
Energy: 1.2433055268791335
Energy: 1.2266802877169507
Energy: 1.3975493944174213
Energy: 1.2274242660080146
Energy: 1.2672947666046555
Energy: 1.2457276652707523
Energy: 1.3358837207140613
Energy: 1.192351981644958
Energy: 1.169715837640869
Energy: 1.2837785377781585
Energy: 1.2844258269380608

minimum gb energy = 1.1676094396663816 eV
minimum distance =  2.26987345852838 Angstroms
sigma value = 311


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

Energy: 1.5774505518549529
Energy: 1.5116292023159277
Energy: 1.4839686778015306
Energy: 1.6261377556067946
Energy: 1.6610015478263351
Energy: 1.4784665118181919
Energy: 1.446695187577416
Energy: 1.4013241930490217
Energy: 1.3437353582329992
Energy: 1.2697874316942643
Energy: 1.2682770709295024
Energy: 1.3489938192406894
Energy: 1.2575218879475851
Energy: 1.2464493571305681
Energy: 1.2510487605939686
Energy: 1.3262860676298893
Energy: 1.2266956718587565
Energy: 1.2515957609216704
Energy: 1.3275151117513235
Energy: 1.2628475290095653
Energy: 1.2284015841921796
Energy: 1.3250288293915575
Energy: 1.3722559734251034
Energy: 1.279538158539603
Energy: 1.3006362005332417
Energy: 1.37017090346167
Energy: 1.2061749221687366
Energy: 1.3473549255804385
Energy: 1.2941375482833002
Energy: 1.2957141164587829
Energy: 1.238139638693118
Energy: 1.2374930740229215
Energy: 1.303149361282494
Energy: 1.270664578304863
Energy: 1.238646633527538
Energy: 1.3900253358589323
Energy: 1.378140134676149
Energy: 1.3446700226930905
Energy: 1.4012016890239993
Energy: 1.3907035934735033
Energy: 1.38001690089891
Energy: 1.349068561060757
Energy: 1.3992724493668394
Energy: 1.3829803857732932
Energy: 1.4009629814520386
Energy: 1.3780936562302897
Energy: 1.387229093958832
Energy: 1.3824704543124406
Energy: 1.4009294503941905
Energy: 1.3621906766509444
Energy: 1.3228363841398734
Energy: 1.314888598156221
Energy: 1.292975059688768
Energy: 1.2739836793573427
Energy: 1.3140215285074073
Energy: 1.2930065251919372
Energy: 1.275415063584528
Energy: 1.2345066473567543
Energy: 1.2904826035664843
Energy: 1.2764246410199065
Energy: 1.265079612944397
Energy: 1.3100328889286537
Energy: 1.2848555195974698
Energy: 1.285736687836566
Energy: 1.3234834214476472
Energy: 1.2920461462491333
Energy: 1.3646793724180004
Energy: 1.2708861177949338
Energy: 1.3141546071061805
Energy: 1.264059845561177
Energy: 1.2784983691901002
Energy: 1.2694645499627857
Energy: 1.2715208759850312
Energy: 1.284609502785272
Energy: 1.248707118354775
Energy: 1.2663850449489422
Energy: 1.2723117113310691
Energy: 1.472777082762103
Energy: 1.4432134845797018
Energy: 1.3765710654023022
Energy: 1.4592441561819895
Energy: 1.41198205424869
Energy: 1.3265634659620038
Energy: 1.4327908605334752
Energy: 1.4489370718609087
Energy: 1.3958912256172167
Energy: 1.4545122130406556
Energy: 1.4476061099777644
Energy: 1.44561675424783
Energy: 1.3491210809414949
Energy: 1.4432901091617247
Energy: 1.3789167012786052
Energy: 1.3019715795069278
Energy: 1.2676390720004322
Energy: 1.339696413597369
Energy: 1.3234368274776651
Energy: 1.2771832029897072
Energy: 1.3754195662240611
Energy: 1.2681501466272849
Energy: 1.2503836294394564
Energy: 1.2779279741519396
Energy: 1.2701857061411157
Energy: 1.2402912213989248
Energy: 1.2843572729703996
Energy: 1.3280136054413036
Energy: 1.3457801277150805
Energy: 1.249784392046602
Energy: 1.24861701201031
Energy: 1.3281827976557523
Energy: 1.3798165119690073
Energy: 1.2879701250567468
Energy: 1.2334776997865422
Energy: 1.3068640006021932
Energy: 1.2363653380803958
Energy: 1.3028005863517378
Energy: 1.2660881439610054
Energy: 1.2594424662621162
Energy: 1.30980448699471
Energy: 1.2954034748823908
Energy: 1.4056559809802487
Energy: 1.380168462704165
Energy: 1.37072578298442
Energy: 1.3811143404877193
Energy: 1.4107446567772444
Energy: 1.3716450940023075
Energy: 1.3648850001800683
Energy: 1.4085377353120072
Energy: 1.4164873449454254
Energy: 1.3583154487354796
Energy: 1.3893977005747942
Energy: 1.4355878354002924
Energy: 1.3579454861271008
Energy: 1.3468411404467329
Energy: 1.3005614677135842
Energy: 1.2614200832046858
Energy: 1.2502196789508089
Energy: 1.2505575438787992
Energy: 1.2733530829161197
Energy: 1.2636076523917235
Energy: 1.2447119481109694
Energy: 1.253246873413308
Energy: 1.3478020600276759
Energy: 1.3226466522638467
Energy: 1.3164377678688388
Energy: 1.2665823397454479
Energy: 1.3097011748545468
Energy: 1.2663023260123223
Energy: 1.2360455198571143
Energy: 1.265151962825931
Energy: 1.255915121378892
Energy: 1.2334800200934573
Energy: 1.2921403777082785
Energy: 1.2287068245503774
Energy: 1.23066644759072
Energy: 1.3352942334452187
Energy: 1.274646777035525
Energy: 1.196154980685049
Energy: 1.2328101130674822
Energy: 1.2958045728813357
Energy: 1.2061543169369813
Energy: 1.2140268471276012
Energy: 1.3965067538943827
Energy: 1.398903926378254
Energy: 1.3660247799163887
Energy: 1.3621641716545405
Energy: 1.405465706095115
Energy: 1.3651923732098963
Energy: 1.3724605238960679
Energy: 1.3667729633761545
Energy: 1.3527191467136057
Energy: 1.36617188865528
Energy: 1.364718026374335
Energy: 1.3587492119940967
Energy: 1.3627690725589587
Energy: 1.3845882312431437
Energy: 1.2767802004855318
Energy: 1.2331006446351407
Energy: 1.2056084728992122
Energy: 1.3049988717879837
Energy: 1.2496059723832247
Energy: 1.2035747394471499
Energy: 1.2425785848359119
Energy: 1.2358949610537773
Energy: 1.2360863655307672
Energy: 1.220511382693077
Energy: 1.241206288664858
Energy: 1.240583632070126
Energy: 1.2294265878616868
Energy: 1.2421052510962491
Energy: 1.144637589442782
Energy: 1.291556072115557
Energy: 1.3057885855841573
Energy: 1.1621001352835547
Energy: 1.166994650078626
Energy: 1.323494304744031
Energy: 1.5658010446851451
Energy: 1.3028106060014266
Energy: 1.2900621372955268
Energy: 1.259899092649946
Energy: 1.270431306772885
Energy: 1.2660532989445346
Energy: 1.2592139654417163
Energy: 1.2801017389866243
Energy: 1.364559143299731
Energy: 1.4119303601639819
Energy: 1.5014957144185077
Energy: 1.465691211414942
Energy: 1.4554049135331153
Energy: 1.5079820818748997
Energy: 1.398352253935521
Energy: 1.4456545011837711
Energy: 1.3844464186654148
Energy: 1.4255335744939042
Energy: 1.4649792956406325
Energy: 1.3945546623832061
Energy: 1.4223540970782353
Energy: 1.4638238126699519
Energy: 1.3075912082630932
Energy: 1.2635794446500934
Energy: 1.297944375207412
Energy: 1.2690455562035345
Energy: 1.2539156992993783
Energy: 1.2490103412611224
Energy: 1.3106647988418707
Energy: 1.3662162336262533
Energy: 1.2300332564226413
Energy: 1.3100751482440198
Energy: 1.3220012738232276
Energy: 1.4535417959572303
Energy: 1.3674614433039503
Energy: 1.4545624327622493
Energy: 1.2600608299822564
Energy: 1.2826236851726602
Energy: 1.2455534533525003
Energy: 1.2647105698375367
Energy: 1.2920236686427398
Energy: 1.2845906553920714
Energy: 1.253423366665496
Energy: 1.358500895345973
Energy: 1.424547130725017
Energy: 1.3655723626135683
Energy: 1.362324716958356
Energy: 1.3750715903899802
Energy: 1.2538627270205425
Energy: 1.366566836512788
Energy: 1.3820901022979521
Energy: 1.4250851095600923
Energy: 1.4225088823348158
Energy: 1.3939300014951141
Energy: 1.4301211754743157
Energy: 1.4196735173765211
Energy: 1.3804947768955835

minimum gb energy = 1.144637589442782 eV
minimum distance =  2.26986531674705 Angstroms
sigma value = 39


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

Energy: 1.6417754163536635
Energy: 1.4426044966669558
Energy: 1.4693201825326137
Energy: 1.4743565762237705
Energy: 1.419402907261372
Energy: 1.4165310718767739
Energy: 1.3601571067587792
Energy: 1.2932149438801757
Energy: 1.203941851849216
Energy: 1.2321168406492533
Energy: 1.2929505036219675
Energy: 1.2733836488437973
Energy: 1.2250834862729585
Energy: 1.2978990797984025
Energy: 1.2934122871394704
Energy: 1.2250685311655074
Energy: 1.2480485357166515
Energy: 1.3195424567517182
Energy: 1.2557690093220888
Energy: 1.2472794946994628
Energy: 1.3435192410282504
Energy: 1.331453490212096
Energy: 1.1332296550809113
Energy: 1.2284807931362531
Energy: 1.3711856296794989
Energy: 1.134008901319866
Energy: 1.12150279393338
Energy: 1.2865681758121192
Energy: 1.3324642610943578
Energy: 1.2328174812586208
Energy: 1.2422634624272704
Energy: 1.2524634363806921
Energy: 1.2437401965457004
Energy: 1.2419207340413263
Energy: 1.249361673846068
Energy: 1.2931663993716564
Energy: 1.2135110208756839
Energy: 1.2276994432208252
Energy: 1.2864320182451823
Energy: 1.2543236857361266
Energy: 1.2129161580632102
Energy: 1.2572876317752255
Energy: 1.3272959292998199
Energy: 1.211889879501725
Energy: 1.2249274250522144
Energy: 1.3247674853434361
Energy: 1.2512992900074023
Energy: 1.217334378498826
Energy: 1.239260839689918
Energy: 1.2891923864264287
Energy: 1.2360576979565634
Energy: 1.262761455498714
Energy: 1.2858637121747107
Energy: 1.270914384610728
Energy: 1.2581485276400923
Energy: 1.3414407041262286
Energy: 1.315041638601459
Energy: 1.3243280056990046
Energy: 1.454408862840667
Energy: 1.328161908893346
Energy: 1.309547084533737
Energy: 1.4250407851088056
Energy: 1.28182989423263
Energy: 1.3113860477029882
Energy: 1.3442739985399923
Energy: 1.4136454597588712
Energy: 1.3646708821698883
Energy: 1.3082368427306594
Energy: 1.3636217201118885
Energy: 1.3860745135756927
Energy: 1.2908745836292668
Energy: 1.2984668282369365
Energy: 1.230482349000595
Energy: 1.3109711222493088
Energy: 1.2833327927807514
Energy: 1.2629247309064973
Energy: 1.3120719081775107
Energy: 1.314878728683501
Energy: 1.246112136531686
Energy: 1.238267205233008
Energy: 1.3153041396223406
Energy: 1.2898866108309515
Energy: 1.2399695071236394
Energy: 1.3106654987104884
Energy: 1.3313013055017047
Energy: 1.2552023521573492
Energy: 1.4238595718957425
Energy: 1.370626663539619
Energy: 1.282505290446464
Energy: 1.248020177767318
Energy: 1.4633542707461622
Energy: 1.2876513316874243
Energy: 1.259254470923514
Energy: 1.237987768969987
Energy: 1.3060146428498383
Energy: 1.2669339301695648
Energy: 1.2490630182155873
Energy: 1.3135677667085546
Energy: 1.2868946679349549
Energy: 1.3112934554212266
Energy: 1.2545475458048192
Energy: 1.3146331767038366
Energy: 1.3195781205827326
Energy: 1.394651392320767
Energy: 1.3155104566568159
Energy: 1.366803676417799
Energy: 1.3819458324648979
Energy: 1.4264837197693474
Energy: 1.4384919528030136
Energy: 1.3700787057897836
Energy: 1.3640173001088975
Energy: 1.3613500940800376
Energy: 1.2836262097705204
Energy: 1.2026755630206836
Energy: 1.23220632042104
Energy: 1.3078501299374579
Energy: 1.2735878998938959
Energy: 1.2246961569058548
Energy: 1.3043729505110324
Energy: 1.2960696091901243
Energy: 1.2122407746492536
Energy: 1.2474305848562852
Energy: 1.3010584539863677
Energy: 1.2980091339532673
Energy: 1.2466477458116425
Energy: 1.349789454145658
Energy: 1.3456689216516984
Energy: 1.131187161878299
Energy: 1.2345459914368249
Energy: 1.308323475120578
Energy: 1.1669933398330758
Energy: 1.1216197624773265
Energy: 1.3154871950245877
Energy: 1.3360122523565445
Energy: 1.2339893425241866
Energy: 1.2348418059815969
Energy: 1.255056947804356
Energy: 1.2373669958409652
Energy: 1.2541520407359985
Energy: 1.2488618410887677
Energy: 1.2858966802332739
Energy: 1.2137708710876154
Energy: 1.2282275533280826
Energy: 1.2596273664517106
Energy: 1.255104955366224
Energy: 1.21315839470142
Energy: 1.2643831863692336
Energy: 1.3040359731093265
Energy: 1.2156436567930988
Energy: 1.2249674760858247
Energy: 1.3248065374672149
Energy: 1.248439464118564
Energy: 1.216085290827349
Energy: 1.2416766773213253
Energy: 1.289123308825821
Energy: 1.23637103273914
Energy: 1.2578028449339784
Energy: 1.284316976973699
Energy: 1.2701008387723403
Energy: 1.2581293696678053
Energy: 1.3415631339987206
Energy: 1.3118260292721315
Energy: 1.3240977873959239
Energy: 1.4534188648144737
Energy: 1.3265002921843962
Energy: 1.3095340582845885
Energy: 1.4175775475380328
Energy: 1.3246180123465128
Energy: 1.312112172307666
Energy: 1.332295911237935
Energy: 1.3551640541236978
Energy: 1.3708143021308283
Energy: 1.3082642612497017
Energy: 1.4490577016199901
Energy: 1.4177922928611477
Energy: 1.2814077475556562
Energy: 1.3192204521688633
Energy: 1.2303570642878365
Energy: 1.310767824939765
Energy: 1.2822434133144494
Energy: 1.2505169669487743
Energy: 1.2990828708233515
Energy: 1.3139047797673855
Energy: 1.2384536376984718
Energy: 1.245428847687705
Energy: 1.2943906302462485
Energy: 1.3067188160936858
Energy: 1.240094795157129
Energy: 1.3159686946394038
Energy: 1.3298902792481062
Energy: 1.2554910835205435
Energy: 1.4267383378269431
Energy: 1.3723737828430131
Energy: 1.2449932219647033
Energy: 1.2255328436838169
Energy: 1.4604686982791388
Energy: 1.2922457661221658
Energy: 1.2295795681059185
Energy: 1.2499413885678459
Energy: 1.3057521277518191
Energy: 1.2772215626696275
Energy: 1.2485633672237741
Energy: 1.3131302363063815
Energy: 1.2790989098205676
Energy: 1.3107834912375849
Energy: 1.256078097352576
Energy: 1.317196063810035
Energy: 1.312306713331132
Energy: 1.420277042684667
Energy: 1.3162474799735047

minimum gb energy = 1.12150279393338 eV
minimum distance =  2.23324204141314 Angstroms
sigma value = 21


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

Energy: 1.8174246721235054
Energy: 1.3012605431994373
Energy: 1.488416776007126
Energy: 1.3053415765580085
Energy: 1.3624047844381288
Energy: 1.9797327509812517
Energy: 1.3626352772961043
Energy: 1.250482954004176
Energy: 1.22176089793528
Energy: 1.1600241780163643
Energy: 1.2766402652509383
Energy: 1.2311541309224587
Energy: 1.124594514854927
Energy: 1.2866372830031352
Energy: 1.2693771204175015
Energy: 1.120876845269179
Energy: 1.173366834446435
Energy: 1.1877093100221008
Energy: 1.2698662442386595
Energy: 1.1613124559600077
Energy: 1.174316220679213
Energy: 1.2659840976752101
Energy: 1.0768361973240936
Energy: 1.10423720236322
Energy: 1.2466002596623817
Energy: 1.2154643009834663
Energy: 1.1039442347090125
Energy: 1.426419937260323
Energy: 1.1046059134557784
Energy: 1.1198273516145618
Energy: 1.1732361165192629
Energy: 1.1657106051286068
Energy: 1.141110274995333
Energy: 1.0970496022422975
Energy: 1.1547560565330244
Energy: 1.1400194296763866
Energy: 1.2044377112381404
Energy: 1.160806573340131
Energy: 1.1214158414049933
Energy: 1.2016562849027594
Energy: 1.1238730790826519
Energy: 1.1729327405906054
Energy: 1.140139812408968
Energy: 1.1077637106916323
Energy: 1.0500052886364337
Energy: 1.1125263083046952
Energy: 1.0705327891724847
Energy: 1.1465464676712345
Energy: 1.1221973491318802
Energy: 1.077328528402245
Energy: 1.0485592632252054
Energy: 1.0898137865074826
Energy: 1.0700091530737577
Energy: 1.0437032275832316
Energy: 1.1432722044607815
Energy: 1.0966902207041547
Energy: 1.0824440385076026
Energy: 1.0560893967263927
Energy: 1.1177975093331833
Energy: 1.0872870734567046
Energy: 1.0807812314925906
Energy: 1.1690608364682173
Energy: 1.1373618092115665
Energy: 1.0341917608557971
Energy: 1.018675287158069
Energy: 1.0891243306244827
Energy: 1.0356657776441964
Energy: 1.018661885851295
Energy: 1.0320120613842465
Energy: 1.083514011291405
Energy: 1.062935788528518
Energy: 1.0545396484859846
Energy: 1.09115226014319
Energy: 1.113032609583579
Energy: 1.0601491169472796
Energy: 1.1046398740008219
Energy: 1.1119461484372262
Energy: 1.1031703485120787
Energy: 1.068200014175522
Energy: 1.1032544336475725
Energy: 1.0947185730050697
Energy: 1.081859356622718
Energy: 1.1076283981484434
Energy: 1.1087897757602807
Energy: 1.041386576228454
Energy: 1.031961220200466
Energy: 1.023385528250183
Energy: 1.0955074052414848
Energy: 1.1521915332051225
Energy: 1.0265446895819896
Energy: 1.0364362595788583
Energy: 1.0899318878402084
Energy: 1.16365854543251
Energy: 1.0733244171404202
Energy: 1.128121907855456
Energy: 1.1914657037213399
Energy: 1.0735457212759334
Energy: 1.0672694056264513
Energy: 1.1149491874766906
Energy: 1.1522270838323314
Energy: 1.0732034567764757
Energy: 1.0917253449441322
Energy: 1.1651628614978768
Energy: 1.047459037829416
Energy: 1.0891055144433415
Energy: 1.1720028981956092
Energy: 1.1701202905476276
Energy: 1.1693455977907972
Energy: 1.1185356771361257
Energy: 1.1057316598938347
Energy: 1.2160843565090749
Energy: 1.119702441322696
Energy: 1.1633712362823627
Energy: 1.1133942868245046
Energy: 1.0701311176468153
Energy: 1.1407489861878968
Energy: 1.1950284215403362
Energy: 1.1734186030896876
Energy: 1.1177228445542258
Energy: 1.175230405363565
Energy: 1.1244355133335415
Energy: 1.1891667533560153
Energy: 1.1926803806615047
Energy: 1.174607936628118
Energy: 1.1179439360806762
Energy: 1.2219402954755114
Energy: 1.2245824881665648
Energy: 1.0994516031645105
Energy: 1.1612588705293405
Energy: 1.162715620811777
Energy: 1.102090977175518
Energy: 1.1321522305979965
Energy: 1.2267014855483267
Energy: 1.1754631377422808
Energy: 1.171933565939283
Energy: 1.2240008078630795
Energy: 1.1607441694627163
Energy: 1.1593598474118763
Energy: 1.1284131488031905
Energy: 1.2854378583179278
Energy: 1.2473498374182173
Energy: 1.1689301356749136
Energy: 1.2458189858414692
Energy: 1.277375775699411
Energy: 1.1742789433006793
Energy: 1.1618749853670338
Energy: 1.291494223959674
Energy: 1.2482516289921448
Energy: 1.1025057023436617
Energy: 1.2819773051149672
Energy: 1.2411645167705914
Energy: 1.0806041155983357
Energy: 1.187629728013815
Energy: 1.241885775399131
Energy: 1.2706890770994572
Energy: 1.1075059606265194
Energy: 1.2965842053073096
Energy: 1.240773106704587
Energy: 1.2384757183944386
Energy: 1.1596333010312891
Energy: 1.2768237026180478
Energy: 1.2651936241847097
Energy: 1.2307356503109044
Energy: 1.1760135247547185
Energy: 1.2701094234816455
Energy: 1.1758056313195127
Energy: 1.1984369366384158
Energy: 1.2719383008877376
Energy: 1.253372182153608
Energy: 1.2205844142016586
Energy: 1.2029084594701687
Energy: 1.2560645768827996
Energy: 1.2552429103444194
Energy: 1.1979636976724493
Energy: 1.3039712438973192

minimum gb energy = 1.018661885851295 eV
minimum distance =  2.29963955756228 Angstroms
sigma value = 113


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

Energy: 1.9219141431499354
Energy: 1.9797595889652395
Energy: 1.2610372958476785
Energy: 1.2348327178700043
Energy: 1.2455022729322391
Energy: 1.1158999417437778
Energy: 1.047288111662011
Energy: 1.125428251649097
Energy: 1.039222607180776
Energy: 1.1036827677202858
Energy: 1.1812059964354038
Energy: 1.1063574853142404
Energy: 1.0512177209525386
Energy: 1.122611343737562
Energy: 1.0719873105160025
Energy: 1.04783171669126
Energy: 1.0682079671649405
Energy: 1.3085617176872761
Energy: 1.0359380127081785
Energy: 1.0899034290499425
Energy: 1.0571792078034055
Energy: 1.0776908190272523
Energy: 1.0456448615516458
Energy: 1.0488025253031712
Energy: 0.9609259345030621
Energy: 1.015451598977479
Energy: 1.038089495341825
Energy: 1.068738072799378
Energy: 0.9810582727161435
Energy: 1.0523188149005536
Energy: 1.0124848648345413
Energy: 1.076953800438805
Energy: 1.0179122824760585
Energy: 1.1819347436024565
Energy: 1.063869054465687
Energy: 0.9967741167382935
Energy: 1.0411383689791
Energy: 1.0040541079108725
Energy: 1.0426393906682119
Energy: 1.0066700419794288
Energy: 1.0323335925704584
Energy: 1.0106973529328422
Energy: 1.0388893726603472
Energy: 1.1346882650738492
Energy: 1.0062299581653236
Energy: 1.018370008097067
Energy: 1.0045989717615156
Energy: 1.0301472726178005
Energy: 1.034722533538072
Energy: 1.007549618305166
Energy: 1.1084899275695579
Energy: 1.0797982575024434
Energy: 0.9812190984138686
Energy: 1.006902050739916
Energy: 1.0452573927896058
Energy: 0.9901300549797358
Energy: 0.997949500277185
Energy: 1.0240903879404055
Energy: 0.9925038626859631
Energy: 1.027635606453712
Energy: 1.014756230811669
Energy: 1.055575692515613
Energy: 0.9900731015203688
Energy: 0.9452387361240226
Energy: 0.9750532839904296
Energy: 0.9689979682956695
Energy: 0.9882271967101615
Energy: 0.9689088962560108
Energy: 1.0038398036211302
Energy: 0.9901022226437062
Energy: 0.9825643207254048
Energy: 0.9982402442997036
Energy: 0.9760219132784931
Energy: 0.9822164164528875
Energy: 0.9760927301192984
Energy: 0.9520544536179174
Energy: 0.994337229096024
Energy: 0.9920222230701686
Energy: 0.9505747021317704
Energy: 0.9663762244202518
Energy: 0.9802086682608131
Energy: 1.0003402775077856
Energy: 0.9746587937940189
Energy: 0.9944636552643351
Energy: 1.038172344847264
Energy: 0.943172962876813
Energy: 0.9236731881058778
Energy: 0.9423987057123707
Energy: 1.024369967397745
Energy: 0.9264861564865275
Energy: 0.9316071903986414
Energy: 0.9716859619062974
Energy: 0.9280887497710418
Energy: 0.9392255317613541
Energy: 0.973250085347067
Energy: 1.0336439482216035
Energy: 0.9215635610304465
Energy: 0.9326470437384552
Energy: 0.9290637175184833
Energy: 0.9609589728904973
Energy: 0.938028316145388
Energy: 0.956169101417661
Energy: 0.9694619375737109
Energy: 0.9638887844298536
Energy: 0.9549038930408373
Energy: 0.9180378369324415
Energy: 0.9656003489028001
Energy: 0.9729897217342905
Energy: 0.9387900175654259
Energy: 0.9147575414250052
Energy: 0.9645207088451043
Energy: 0.9577906659137554
Energy: 0.9189175875070628
Energy: 0.9225074260426869
Energy: 0.9320908624999136
Energy: 0.9600179471954015
Energy: 0.9312605546276191
Energy: 0.9664144370590028
Energy: 0.9398759559895857
Energy: 0.9402578208179132
Energy: 0.9570637856088225
Energy: 0.9698574430745956
Energy: 0.9532217308830336
Energy: 0.9367673302799656
Energy: 0.9643736781596883
Energy: 0.9478893484224864
Energy: 0.9311348921410546
Energy: 0.9314575925007863
Energy: 0.9466512807571178
Energy: 0.9495660073661194
Energy: 0.9340531341570333
Energy: 0.950986265449237
Energy: 0.9656851562231404
Energy: 0.8974799829287843
Energy: 0.9073507153003629
Energy: 0.9922226956073816
Energy: 0.938362869944515
Energy: 0.8995964581069065
Energy: 0.9439902013572261
Energy: 0.9249416987417316
Energy: 0.9424428461799397
Energy: 0.947133162013581
Energy: 0.9394112223246882
Energy: 0.9458631364545854
Energy: 0.9456746314458462
Energy: 0.9431745755205412
Energy: 0.9493029916011254
Energy: 0.9638027089914327
Energy: 0.9520397221843011
Energy: 0.9466797695126463
Energy: 0.9531778755100082
Energy: 0.9230941792555046
Energy: 0.9450536164256734
Energy: 0.9536001087520585
Energy: 0.9415811031888126
Energy: 0.9275188931789969
Energy: 0.8998184297181366
Energy: 0.9503047547557496
Energy: 0.924574232708569
Energy: 0.8998859274580495
Energy: 0.9041722975494464
Energy: 0.9526233397522126
Energy: 0.9268250491067898
Energy: 0.9346069516625448
Energy: 0.9507580435449681
Energy: 0.9579293244001842
Energy: 0.9426975165937845
Energy: 0.9382341203062007
Energy: 0.9484144070034592
Energy: 0.9589376583871005
Energy: 0.9337009915448673
Energy: 0.9478837224938041
Energy: 0.968329953550954
Energy: 0.9369035946718219
Energy: 0.9387335133551337
Energy: 0.9701538738979558
Energy: 0.9343368227448697
Energy: 0.9096595525052763
Energy: 0.9257605872387549
Energy: 0.9314262752297113
Energy: 0.9252658931662715
Energy: 0.928278856528333
Energy: 0.9650167059927972
Energy: 0.9292315712903
Energy: 0.9142425522711616
Energy: 0.9128614535845037
Energy: 0.9724945765945322
Energy: 0.9735467678713144
Energy: 0.9582445055456044
Energy: 0.9561279934751223
Energy: 0.9949400474226989
Energy: 1.1212468952199366
Energy: 0.9601544919947728
Energy: 0.9563951284360329
Energy: 0.9639009141626279
Energy: 0.966344240553358
Energy: 0.9259433662840847
Energy: 0.9468695393908918
Energy: 0.9818400645343897
Energy: 0.924186513903668
Energy: 0.9295203705382358
Energy: 1.0032589654230242
Energy: 0.9572348121691494
Energy: 0.9233644762042099
Energy: 0.9305763028956048
Energy: 0.950824502463714
Energy: 0.9349028520803443
Energy: 0.9230370170386024
Energy: 1.0150240381771563
Energy: 0.9875304887235811
Energy: 0.9746197246298597
Energy: 0.9769886773349701
Energy: 1.0038694902638483
Energy: 0.9827135636210991
Energy: 0.9729011132026762
Energy: 1.0068658205427388
Energy: 0.9874236733697502
Energy: 0.9471136918976839
Energy: 0.965105664593965
Energy: 1.0060375263707944
Energy: 0.9887405302586275
Energy: 0.9453038326160078
Energy: 1.012007798042261
Energy: 1.0126556668672755
Energy: 0.9848336720687705
Energy: 0.9684941318514344
Energy: 0.9712833410197694
Energy: 0.9808647700884956
Energy: 1.0211642389169597
Energy: 0.9698190068721758
Energy: 0.9731439962852431
Energy: 0.9920307224485698
Energy: 0.9985492840057165
Energy: 1.00950851569545
Energy: 1.0321078026962724
Energy: 1.0268460393282766
Energy: 1.0183064833571154
Energy: 1.0097951693236502
Energy: 1.0036003581275847
Energy: 1.0343413117025377
Energy: 1.007684263831354
Energy: 1.002142754913934
Energy: 1.0092567465832567
Energy: 1.017262387727499
Energy: 1.0028597699358064
Energy: 0.9928106342387089
Energy: 1.098896483760826
Energy: 1.0119402496864804
Energy: 0.9645370696296331
Energy: 1.019591662023052
Energy: 1.0323795877559012
Energy: 1.0219467259192752
Energy: 1.0516646262706042
Energy: 1.0225915549521243
Energy: 1.0081311590431783
Energy: 1.010874325369311
Energy: 1.0373586093570684
Energy: 1.0013575587525487
Energy: 1.0087673793440601
Energy: 1.0791058431342588
Energy: 1.0256908144690886
Energy: 1.0307944566081506
Energy: 1.2150856741001228
Energy: 1.0343551159883595
Energy: 1.0743498945681682
Energy: 1.1164641445520496
Energy: 1.1173774182742546
Energy: 1.1307277984948372
Energy: 0.9915165053747639
Energy: 1.0265941036901964
Energy: 1.0430802817385447
Energy: 1.0159769531436262
Energy: 1.0042675450816163
Energy: 1.0755288349468122
Energy: 1.1058604492821287
Energy: 1.0189235262760012
Energy: 1.0586775491744742
Energy: 1.0703277008550844
Energy: 1.0484494309102694
Energy: 1.0980980618090908
Energy: 1.0554318516239019
Energy: 1.0546281634229673
Energy: 1.108972079743145
Energy: 1.0537708263965346
Energy: 1.0544960856442154
Energy: 1.044398315519371
Energy: 1.19443369090077
Energy: 0.9880790620862746
Energy: 1.270245210362963
Energy: 1.23419736563709
Energy: 0.9892318309734751
Energy: 1.0063779338990124
Energy: 1.0598616494315918
Energy: 1.1483441706196682
Energy: 1.0936208199157604
Energy: 1.0595945377242406
Energy: 1.1357489687896463
Energy: 1.062255628125472
Energy: 1.1976633038909497
Energy: 1.0474738447527276
Energy: 1.1314498522598415
Energy: 1.1201182197664805
Energy: 1.039689324117003
Energy: 1.1174250452925873
Energy: 1.0678985039273705
Energy: 1.1089640273521095
Energy: 1.0491593709827487
Energy: 1.211143237223107
Energy: 1.0918050615533657
Energy: 1.1545787057923111
Energy: 0.999655379394107
Energy: 1.1165242121121528
Energy: 1.1382656518751209
Energy: 1.0006510063171385
Energy: 0.9952834447982819

minimum gb energy = 0.8974799829287843 eV
minimum distance =  2.31170266600924 Angstroms
sigma value = 365


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

Energy: 1.1276396485383593
Energy: 1.2604035139895182
Energy: 1.1059579965953374
Energy: 1.1172084419989479
Energy: 1.1175069592517315
Energy: 1.1010031334247092
Energy: 1.1037689130188422
Energy: 1.0723414167784606
Energy: 0.39214208652678395
Energy: 0.3993926480897378
Energy: 0.38501057808105005
Energy: 0.385404598733904
Energy: 0.39931318641495156
Energy: 0.39240883546305094
Energy: 0.3691223276996576
Energy: 0.3990791883600595
Energy: 0.3852344937199115
Energy: 0.3848332273123942
Energy: 0.38476542423628063
Energy: 0.38633993237127096
Energy: 0.38350764361000933
Energy: 1.0907513640185522
Energy: 1.088621117472038
Energy: 1.0998100666223718
Energy: 1.1004152752277232
Energy: 1.0993838345749278
Energy: 1.0984422549740493
Energy: 1.091128815048265
Energy: 1.0837813811034582
Energy: 1.085062180070676
Energy: 1.0924219516066924
Energy: 1.09289210276359
Energy: 1.1018289880559493
Energy: 1.0932365114796299
Energy: 1.085240627409882
Energy: 0.36888238485629704
Energy: 0.37104659980253957
Energy: 0.38510090750650455
Energy: 0.3854456898417315
Energy: 0.3852762296719398
Energy: 0.38481131697169346
Energy: 0.38433343825491306
Energy: 1.0939919789353811
Energy: 1.0878821029516563
Energy: 1.1006027070067004
Energy: 1.1007636160129421
Energy: 1.0996310548140933
Energy: 1.1041024194395643
Energy: 1.0931525507211277
Energy: 1.087645768217879
Energy: 1.087900160516166
Energy: 1.0988117371270119
Energy: 1.105907730489094
Energy: 1.1010354148054609
Energy: 1.1023524734767567
Energy: 1.0932114798138513
Energy: 0.3689258902585755
Energy: 0.3807167344723554
Energy: 0.38471609552063796
Energy: 0.3853725024951266
Energy: 0.3853587549592457
Energy: 0.38497388583178427
Energy: 0.38069808855247395
Energy: 1.0873271078918574
Energy: 1.084229369534931
Energy: 1.0918533397582855
Energy: 1.0941561748810409
Energy: 1.1057242113537504
Energy: 1.0932522623819816
Energy: 1.084740058875352
Energy: 1.0902378363865644
Energy: 1.0953597851912205
Energy: 1.1030085863852157
Energy: 1.1036158819430137
Energy: 1.0987903890611044
Energy: 1.1015171797183523
Energy: 1.0911427809434333
Energy: 0.3689153017653138
Energy: 0.39215091438157024
Energy: 0.386272550635166
Energy: 0.3868705785481199
Energy: 0.3847586790363199
Energy: 0.38588585231291156
Energy: 0.40114151213060073
Energy: 0.36916279654287426
Energy: 0.39208226260092244
Energy: 0.39904233246626913
Energy: 0.3852905670299718
Energy: 0.3852118498063018
Energy: 0.39948489567930867
Energy: 0.4014670831673419
Energy: 1.0962277394813322
Energy: 1.0959161578726486
Energy: 1.10329028244488
Energy: 1.0988720047710432
Energy: 1.0951295385836812
Energy: 1.1033142257451367
Energy: 1.090989183972091
Energy: 1.0720808899608432
Energy: 1.0847494718320736
Energy: 1.0891009908690312
Energy: 0.3853114690924666
Energy: 0.38531972794562475
Energy: 0.39898719193370824
Energy: 1.073908865880336
Energy: 0.36903489912285736
Energy: 0.3992919183972269
Energy: 0.38538694659212264
Energy: 0.3849804559460331
Energy: 0.3848069043763095
Energy: 0.3846416558335848
Energy: 0.38218890245802584
Energy: 1.0889187159995721
Energy: 1.0939972025902942
Energy: 1.0998038717678493
Energy: 1.100508566017773
Energy: 1.1006185593269164
Energy: 1.1001102591812046
Energy: 1.0910543874678345
Energy: 1.0877217069244711
Energy: 1.0848591993063303
Energy: 1.0921968825941757
Energy: 1.101528646976695
Energy: 1.1007692864944172
Energy: 1.092725193026932
Energy: 1.0847359888047898
Energy: 0.3688303139861119
Energy: 0.40093193374270897
Energy: 0.38547250212380574
Energy: 0.4036556157594282
Energy: 0.38567354250706937
Energy: 0.7899461187542451
Energy: 0.7328204357426233
Energy: 1.0958788402089685
Energy: 1.0838639403793706
Energy: 1.0920642188326488
Energy: 1.101079617564335
Energy: 1.1012077561316214
Energy: 1.101902130283555
Energy: 1.0844617933320506

minimum gb energy = 0.3688303139861119 eV
minimum distance =  2.37542122257376 Angstroms
sigma value = 23