Model name: model_name=EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.560000121593475
cohesive_energy=4.400346012135227
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[-6.3070484285727e-19, -6.83589489192342e-19, -1.7336352268197e-19, 2.6198311666177797e-19, 4.75580498976756e-19, 5.074429856971139e-19, 4.9400873462102395e-19, 5.080998781170539e-19, 5.33946191576742e-19, 5.622230069902079e-19, 5.891523918544799e-19, 6.13402937386704e-19, 6.34450731827562e-19, 6.52031416032444e-19, 6.66074494229454e-19, 6.76970897517288e-19, 6.852637637748719e-19, 6.914882199979619e-19, 6.961072952337839e-19, 6.99484683578256e-19, 7.018863463526219e-19, 7.0354780352208e-19, 7.04582809627644e-19, 7.0495771896e-19, 7.044674529099959e-19, 7.0264257372387e-19, 6.986611647883799e-19, 6.91400100283092e-19, 6.799333221135539e-19, 6.642432063367919e-19, 6.45646742145954e-19, 6.2680354275348e-19, 6.10756141587336e-19, 5.97222555559938e-19, 5.84022222272412e-19, 5.71691870897148e-19, 5.65196646822912e-19, 5.740743075519059e-19, 6.141383364617099e-19, 7.103923021025279e-19, 9.140305544605619e-19, 1.378115436088368e-18, 2.45536773513768e-18]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

========================================
theta = 0.0
========================================

Energy: 0.017500480017219194
Energy: 0.09399244584476459
Energy: 0.09399244584476459
Energy: 0.018468481276851908
Energy: 0.09399244584476459
Energy: 0.09399244584476459
Energy: 0.018468481276851908
Energy: 0.018468481276851908
Energy: 0.018468481276851908
Energy: 0.018468481276851908
Energy: 0.017500480017219194
Energy: 0.09399244585805881
Energy: 0.018468481276851908
Energy: 0.018468481276851908
Energy: 0.09399244584476459
Energy: 0.09399244584476459

minimum gb energy = 0.017500480017219194 eV
minimum distance =  2.49386293353683 Angstroms
sigma value = 1


========================================
theta = 14.250032697803595
========================================

Energy: 1.3422501804746274
Energy: 1.2711226211325717
Energy: 1.2698819517190527
Energy: 1.159764024708271
Energy: 1.2060432747493146
Energy: 1.2386781331770957
Energy: 1.206786922216991
Energy: 1.2386781331810175
Energy: 1.267760499302165
Energy: 1.270137595168803
Energy: 2.6482832846845246
Energy: 1.270137595168803
Energy: 1.27690670925624
Energy: 1.2421368754940314
Energy: 1.2064536323547783
Energy: 1.2421368754948159
Energy: 1.2741502035407857
Energy: 1.2692369648173756
Energy: 1.481119816811655
Energy: 1.2692369648189443
Energy: 1.2768250518577262
Energy: 1.3606797896073073
Energy: 1.2230781220831133
Energy: 1.3606797896080918
Energy: 1.2812929597255975
Energy: 1.366447328057603
Energy: 1.2754656573326504
Energy: 1.3664473280607405
Energy: 1.263935921753643
Energy: 1.346756576776294
Energy: 1.2897587826832058
Energy: 1.3467565767747252
Energy: 1.2853975670610063
Energy: 1.3378198455724288
Energy: 1.2792410263569758
Energy: 1.3378198455732133
Energy: 1.279041516556583
Energy: 1.3239074615389153
Energy: 1.279099242354647
Energy: 1.323907461538131
Energy: 1.2749449710226937
Energy: 1.3384251358625021
Energy: 1.2876707506210938
Energy: 1.3384251358632866
Energy: 1.285542879364896
Energy: 1.3360251328456616
Energy: 1.2915135184297883
Energy: 1.3360251328456616
Energy: 1.2988162788537696
Energy: 1.3592623507513037
Energy: 1.2745151192548654
Energy: 1.3592623507528723
Energy: 1.2775838204435137
Energy: 1.359313393154249
Energy: 1.2860333669765889
Energy: 1.3593133931534644
Energy: 1.272036415868838
Energy: 1.2702296702130083
Energy: 1.2061415150360077
Energy: 1.2702296702137927
Energy: 1.2935087794222062
Energy: 1.2061153970729777
Energy: 1.2059291792285396
Energy: 1.2061153970753307
Energy: 1.2693004198740208
Energy: 1.2696560100679104
Energy: 1.2913996791337394
Energy: 1.2696560100679104
Energy: 1.2061544352660512
Energy: 1.2060343828956634
Energy: 1.2478217327172805
Energy: 1.2060343828972322
Energy: 1.282075495249516
Energy: 1.2706996874932377
Energy: 1.2707879220276994
Energy: 1.2706996874932377
Energy: 1.2747350095479186
Energy: 1.2066499618749829
Energy: 1.2056960993083277
Energy: 1.2066499618757671
Energy: 1.2066508519896904
Energy: 1.2716253503022952
Energy: 1.273438975911354
Energy: 1.2716253503022952
Energy: 1.2064213657554514
Energy: 1.206285818728305
Energy: 1.2770372281557165
Energy: 1.2062858187306582
Energy: 1.2755862718037076
Energy: 1.3687866693832291
Energy: 1.279144140464816
Energy: 1.3687866693840138
Energy: 1.2901953021620172
Energy: 1.3069040323272527
Energy: 1.2660307712367327
Energy: 1.3069040323178405
Energy: 1.278884675230721
Energy: 1.3382054984072924
Energy: 2.042222140885372
Energy: 1.3382054984072924
Energy: 1.280067657364849
Energy: 1.3396387589572032
Energy: 1.2815653904501574
Energy: 1.3396387589556347
Energy: 1.288003239635102
Energy: 1.3396809061171193
Energy: 1.2749210454020183
Energy: 1.3396809061194723
Energy: 1.2890498335256761
Energy: 1.3362229960553076
Energy: 1.2794198840182525
Energy: 1.336222996056092
Energy: 1.2743180100351825
Energy: 1.359705912037143
Energy: 1.304661054701112
Energy: 1.3597059120379273
Energy: 1.2756262680346007
Energy: 1.36172576193282
Energy: 1.27890089306721
Energy: 1.3617257619343888
Energy: 1.2231202130706829
Energy: 1.269804534983102
Energy: 1.2718401635325132
Energy: 1.269804534982318
Energy: 1.2060952692080944
Energy: 1.2675208892531338
Energy: 1.2939943456287455
Energy: 1.2675208892523493
Energy: 1.291693179998359
Energy: 1.2696281192108336
Energy: 1.27149042878777
Energy: 1.2696281192100491

minimum gb energy = 1.159764024708271 eV
minimum distance =  2.29371248763311 Angstroms
sigma value = 1


========================================
theta = 16.26020470831196
========================================

Energy: 2.7896353177241675
Energy: 1.3622452693242229
Energy: 1.3604359552638043
Energy: 1.2374382336134384
Energy: 1.2925844486894127
Energy: 1.323230108151481
Energy: 1.29313133054548
Energy: 1.3232301081586355
Energy: 1.3603863699879173
Energy: 1.3611264862205223
Energy: 1.374170980127182
Energy: 1.361126486216945
Energy: 1.2915135640669748
Energy: 1.3667208382807219
Energy: 1.2933479739925287
Energy: 1.3667208382807219
Energy: 1.3773216008611595
Energy: 1.365019838991872
Energy: 1.6092860552908503
Energy: 1.3650198389954493
Energy: 1.3718551523797782
Energy: 1.3802761917225326
Energy: 1.2920116060543978
Energy: 1.3802761917189552
Energy: 1.3801921321997728
Energy: 1.4738905951530654
Energy: 1.3771636061990533
Energy: 1.4738905951584311
Energy: 1.3617125169202942
Energy: 1.4229830329950746
Energy: 1.3820483587629757
Energy: 1.422983032997717
Energy: 1.380045032587642
Energy: 1.4489116687180634
Energy: 1.3864757167298898
Energy: 1.4489116687135914
Energy: 1.3817433175577927
Energy: 1.4480218898917596
Energy: 1.3791189965864858
Energy: 1.4480218898953368
Energy: 1.3657216618977626
Energy: 1.4680846800022842
Energy: 1.3721212727906162
Energy: 1.4680846799996012
Energy: 1.3726613456567807
Energy: 1.4682170995517119
Energy: 1.3733954446758787
Energy: 1.46821709954098
Energy: 1.3132968403636784
Energy: 1.363978904761319
Energy: 1.340179457983124
Energy: 1.3639789047657906
Energy: 1.2932506446815468
Energy: 1.366112210751217
Energy: 1.311774662747922
Energy: 1.366112210745851
Energy: 1.3838516404838157
Energy: 1.362205908874754
Energy: 1.3604182736942514
Energy: 1.3622059088810141
Energy: 1.3434348085806491
Energy: 1.2914119964487436
Energy: 1.2934990331927316
Energy: 1.2914119964630524
Energy: 1.3622492828430997
Energy: 1.3622056288174018
Energy: 1.3739981322608539
Energy: 1.3622056288147188
Energy: 1.2915347359424183
Energy: 1.2929270624253348
Energy: 1.3688075449473804
Energy: 1.2929270624280178
Energy: 1.3765549634149
Energy: 1.3659047751787043
Energy: 1.292268769260547
Energy: 1.3659047751769158
Energy: 1.3714767794941347
Energy: 1.366013066582424
Energy: 1.2929996975456797
Energy: 1.36601306658153
Energy: 1.3642381561326071
Energy: 1.475647558315297
Energy: 1.377241251151424
Energy: 1.4756475583135085
Energy: 1.3715514504882915
Energy: 1.4106100557472334
Energy: 1.382217138453766
Energy: 1.410610055745445
Energy: 1.3806978009341957
Energy: 1.4498383568186872
Energy: 1.3852296184679498
Energy: 1.4498383568267361
Energy: 1.3814573362212836
Energy: 1.447731198748901
Energy: 1.3796830937039184
Energy: 1.4477311987497956
Energy: 1.3653461795402757
Energy: 1.4695050189075303
Energy: 1.4050898857310923
Energy: 1.4695050189057415
Energy: 1.3653324876292292
Energy: 1.4696699163034945
Energy: 1.374476778449976
Energy: 1.4696699163017057
Energy: 1.3147639053635156
Energy: 1.3627746105078713
Energy: 1.361852716779593
Energy: 1.362774610512343
Energy: 1.2930766464322863
Energy: 1.3639179009372657
Energy: 1.311598253834838
Energy: 1.363917900932835
Energy: 1.3822449742383442
Energy: 1.3614548749027824
Energy: 1.361998587963834
Energy: 1.3614548749090425

minimum gb energy = 1.2374382336134384 eV
minimum distance =  2.2879775741106 Angstroms
sigma value = 25


========================================
theta = 18.924644416051233
========================================

Energy: 2.777231031631444
Energy: 1.4648678259658527
Energy: 1.4651404025802457
Energy: 1.3261128566873401
Energy: 1.397230098245131
Energy: 1.416588221211758
Energy: 1.3976051988745355
Energy: 1.4165882212096785
Energy: 1.4653585372282065
Energy: 1.4652510518278639
Energy: 1.4861806294109463
Energy: 1.4652510518268242
Energy: 1.3948988478349533
Energy: 1.4166697744718166
Energy: 1.397128555213365
Energy: 1.416669774472856
Energy: 1.4886206632334873
Energy: 1.477648917356292
Energy: 1.7661863280124246
Energy: 1.4776489173542127
Energy: 1.4867062538832039
Energy: 1.4849403682915903
Energy: 1.3974197916127542
Energy: 1.4849403682905509
Energy: 1.4871421337869273
Energy: 1.6021434034796322
Energy: 1.4819730011956993
Energy: 1.6021434034817115
Energy: 1.4864345585296053
Energy: 1.5475560691435029
Energy: 1.4933305799957082
Energy: 1.5475560691424632
Energy: 1.8634268684722521
Energy: 1.601414582484985
Energy: 1.4874279240724784
Energy: 1.601414582484985
Energy: 1.4874239336635149
Energy: 1.6032313980371673
Energy: 1.4852172702202155
Energy: 1.603231398036128
Energy: 1.4881882566998754
Energy: 1.4763920387138951
Energy: 1.7620141573889412
Energy: 1.4763920387138951
Energy: 1.4065040841657706
Energy: 1.4816935622860827
Energy: 1.3969168117814852
Energy: 1.4816935622850431
Energy: 1.4646589849516514
Energy: 1.4648778324081337
Energy: 1.4843578849608323
Energy: 1.4648778324070943
Energy: 1.3971353922228875
Energy: 1.3952159970858136
Energy: 1.4620604065150544
Energy: 1.3952159970858136
Energy: 1.475949783090807
Energy: 1.4649833268504748
Energy: 1.4673916916018823
Energy: 1.4649833268483958
Energy: 1.4815085078516657
Energy: 1.4819407711232968
Energy: 1.3945162638330997
Energy: 1.4819407711191384
Energy: 1.4023178283742739
Energy: 1.4798088656442592
Energy: 1.4891166322492173
Energy: 1.4798088656442592
Energy: 1.3991725932041381
Energy: 1.479877583162402
Energy: 1.4865595511608585
Energy: 1.479877583162402
Energy: 1.4818731584723017
Energy: 1.6036576413785721
Energy: 1.4882125588618664
Energy: 1.6036576413785721
Energy: 1.494507009643634
Energy: 1.6041202083948387
Energy: 1.487887142199086
Energy: 1.6041202083948387
Energy: 1.4877624655260389
Energy: 1.603337096242224
Energy: 1.863310201594181
Energy: 1.6033370962432638
Energy: 1.4874771319283566
Energy: 1.6015725119816078
Energy: 1.4890561313231716
Energy: 1.6015725119816078
Energy: 1.7611866082407879
Energy: 1.4756350672569138
Energy: 1.4875619799266573
Energy: 1.4756350672558738
Energy: 1.3972606585583038
Energy: 1.4763437129594357
Energy: 1.4069369470485729
Energy: 1.476343712958396
Energy: 1.4844755458916916
Energy: 1.465200826613068
Energy: 1.4667828327119778
Energy: 1.4652008266141077

minimum gb energy = 1.3261128566873401 eV
minimum distance =  2.29033574176543 Angstroms
sigma value = 9


========================================
theta = 22.619864948040426
========================================

Energy: 2.8686891110290715
Energy: 1.6014761940450168
Energy: 1.6023472779270898
Energy: 1.4942512836995732
Energy: 1.5311608373853305
Energy: 1.530042711680133
Energy: 1.5077852062369594
Energy: 1.5300427115921078
Energy: 1.5989303893174844
Energy: 1.5978693375566262
Energy: 1.5536199852777748
Energy: 1.5978693375578663
Energy: 1.5220609432420542
Energy: 1.5348652532555234
Energy: 1.502913301073616
Energy: 1.5348652532592442
Energy: 1.47670201312942
Energy: 1.5097853994451986
Energy: 1.7369099147282225
Energy: 1.5097853994451986
Energy: 1.5919523854225692
Energy: 1.5088648227070398
Energy: 1.503539302504434
Energy: 1.5088648227057995
Energy: 1.573932772512262
Energy: 1.7328032219492158
Energy: 1.4519954928339789
Energy: 1.7328032219516962
Energy: 1.835216469176198
Energy: 1.6831041486537515
Energy: 1.6113187156727258
Energy: 1.6831041486326683
Energy: 2.1103188480289448
Energy: 1.7274017277427045
Energy: 1.4876552686023006
Energy: 1.7274017277414646
Energy: 1.5959444668944152
Energy: 1.767449751217125
Energy: 1.4630689104237073
Energy: 1.7674497512258063
Energy: 1.4101089787379373
Energy: 1.4113717691286642
Energy: 1.4328281872100679
Energy: 1.411371769134865
Energy: 1.5946569449353085
Energy: 1.4116534148498512
Energy: 1.4319406741703182
Energy: 1.4116534148461306
Energy: 1.6942359711150472
Energy: 1.6942132814348296
Energy: 1.5831770362687831
Energy: 1.6942132814323494
Energy: 1.6428173513646347
Energy: 1.7672260925682053
Energy: 1.5545002171433897
Energy: 1.7672260925669652
Energy: 1.477401111014103
Energy: 1.5528139569842765
Energy: 1.5087765016212875
Energy: 1.5528139569867567
Energy: 1.5271182035890807
Energy: 1.5528242702007646
Energy: 1.5081436606532006
Energy: 1.552824270203245
Energy: 1.573769802074116
Energy: 1.8043453182724702
Energy: 2.4223745467265188
Energy: 1.8043453182724702
Energy: 1.5741623083755116
Energy: 1.8045682633812596
Energy: 1.5060280659186038
Energy: 1.8045682633787794
Energy: 1.9665423899257013
Energy: 1.6247306438448486
Energy: 1.4873518320234267
Energy: 1.6247306438473008
Energy: 1.5266535628208364
Energy: 1.625313279584441
Energy: 1.4877191588369543
Energy: 1.6253132795869212
Energy: 1.4830511066012486
Energy: 1.6011899997043288
Energy: 1.602818906824187
Energy: 1.6011899997043288

minimum gb energy = 1.4101089787379373 eV
minimum distance =  2.28416597420736 Angstroms
sigma value = 25


========================================
theta = 28.072486935852957
========================================

Energy: 1.8575620788114502
Energy: 1.7079127587084109
Energy: 1.7096457762116504
Energy: 1.5080073142471466
Energy: 1.5244054871730157
Energy: 2.32061768620086
Energy: 1.5307410542312967
Energy: 2.320617686206995
Energy: 1.7075222301691806
Energy: 1.7071837853395408
Energy: 3.027593604932825
Energy: 1.7071837853410745
Energy: 1.5023150918815202
Energy: 1.5790362397956776
Energy: 1.5281694481301324
Energy: 1.5790362398094813
Energy: 1.5201658607879454
Energy: 1.7739338659877841
Energy: 1.7233913613634722
Energy: 1.7739338659877841
Energy: 1.5055120920478309
Energy: 1.7746544510262023
Energy: 1.5264408424647649
Energy: 1.7746544510262023
Energy: 1.49827920375664
Energy: 1.7677331548995083
Energy: 2.1729740619133424
Energy: 1.7677331548995083
Energy: 1.4991593373741312
Energy: 1.580484871971423
Energy: 1.533243221550748
Energy: 1.5804848719698894
Energy: 1.7060929257199544
Energy: 1.7069811045954513
Energy: 1.5006284671543133
Energy: 1.7069811045984842
Energy: 1.5309055285333368
Energy: 1.7071837181474079
Energy: 1.5005382070473818
Energy: 1.7071837181474079
Energy: 1.498269659937403
Energy: 1.707257714747289
Energy: 1.7080823938575727
Energy: 1.707257714745755
Energy: 1.703040694578233
Energy: 1.5025664253561433
Energy: 1.7092384705332007
Energy: 1.5025664254465987
Energy: 1.5302988133397408
Energy: 1.774599207762826
Energy: 1.5194651824330647
Energy: 1.7745992077643595
Energy: 1.5251952739312251
Energy: 2.1822905607156082
Energy: 1.5046454434021665
Energy: 2.18229056071411
Energy: 2.1764578917815744
Energy: 1.7654634455738623
Energy: 1.4990515881174182
Energy: 1.7654634455738623
Energy: 1.5297189378647011
Energy: 1.7658657921716687
Energy: 1.498729004075971
Energy: 1.7658657921716687
Energy: 1.5007127820113424
Energy: 1.7064467133594368
Energy: 1.709470058192039
Energy: 1.7064467133594368

minimum gb energy = 1.498269659937403 eV
minimum distance =  2.29765933927307 Angstroms
sigma value = 17


========================================
theta = 31.890791801845708
========================================

Energy: 3.2870943953691176
Energy: 1.889513799448581
Energy: 1.8895353205691627
Energy: 1.7586806000559332
Energy: 1.560296507992882
Energy: 1.8109925250977084
Energy: 2.357197410198305
Energy: 1.8109925250977084
Energy: 1.6518391796448078
Energy: 1.6476436449335772
Energy: 3.2034293303941404
Energy: 1.6476436449327085
Energy: 1.9255576123643146
Energy: 1.8143216080643167
Energy: 1.8011595731735865
Energy: 1.814321608070397
Energy: 2.30080880212425
Energy: 1.6534121503835872
Energy: 2.2793917561247405
Energy: 1.6534121503844559
Energy: 1.6490201808241662
Energy: 1.9246309764801164
Energy: 1.649084456458454
Energy: 1.9246309764818534
Energy: 2.3298930243062714
Energy: 1.6467770508493798
Energy: 1.649641762628091
Energy: 1.6467770508997606
Energy: 3.16015544262161
Energy: 1.6464333668008782
Energy: 1.5609699834978754
Energy: 1.6464333668008782
Energy: 1.8947347274205393
Energy: 1.8888800669230421
Energy: 2.171851041876727
Energy: 1.8888800669221733
Energy: 2.1772028813439106
Energy: 1.8976288007241635
Energy: 1.8000990915288635
Energy: 1.8976288007232949
Energy: 2.2943319206469868
Energy: 2.1036415538959097
Energy: 1.5601077142993545
Energy: 2.103641553897647
Energy: 2.7366216561423258
Energy: 1.5606353404319198
Energy: 1.9136661789553555
Energy: 1.5606353403277624
Energy: 2.306234349428897
Energy: 1.559637704290912
Energy: 1.9172498949516303
Energy: 1.5596377042292782
Energy: 2.32376473942334
Energy: 2.815345803737568
Energy: 1.5600549139789823
Energy: 2.8153458037288814
Energy: 1.8909922666208285
Energy: 1.8900793083021126
Energy: 2.040097271199335
Energy: 1.8900793083029814
Energy: 1.8881140728710974
Energy: 1.8887796594046062
Energy: 2.0411740775585843
Energy: 1.8887796594020003
Energy: 2.7574365318271457
Energy: 1.6471402284409706
Energy: 1.6485081302616929
Energy: 1.6471402284453134
Energy: 2.7359810562717026
Energy: 1.6470372496069876
Energy: 1.6461866421202347
Energy: 1.6470372496729646
Energy: 1.9251393030551893
Energy: 1.9235770508140473
Energy: 2.311227445455441
Energy: 1.9235770508739438
Energy: 2.2922748219985105
Energy: 2.2595171812313324
Energy: 2.295885125548336
Energy: 2.2595171812330697
Energy: 1.9252593009644114
Energy: 1.647737557536347
Energy: 2.051980491157302
Energy: 1.6477375575372157
Energy: 1.6480350245338355
Energy: 1.6578007598865598
Energy: 2.3158393450206565
Energy: 1.657800759883954
Energy: 2.3542953422548885
Energy: 1.8987222736650655
Energy: 1.8002974304326376
Energy: 1.8987222736650655
Energy: 2.1712759462023605
Energy: 1.8891928273892982
Energy: 1.8893434129602982
Energy: 1.8891928273875611
Energy: 1.5592037948967068
Energy: 1.9815735112577213
Energy: 2.734662202065847
Energy: 1.9815735112577213
Energy: 1.913973510189084
Energy: 1.9842525966458326
Energy: 2.2941122769951052
Energy: 1.9842525966475697
Energy: 1.557734537362283
Energy: 1.5659648617274888
Energy: 1.747534533807778
Energy: 1.5659648617274888
Energy: 1.9125885892705383
Energy: 1.5606340595625434
Energy: 3.0876870027657892
Energy: 1.5606340595755728
Energy: 1.5593914328726386
Energy: 1.811040194655827
Energy: 2.3012600955335247
Energy: 1.8110401946549584
Energy: 3.2988983157443124
Energy: 1.8895738611461952
Energy: 1.8903611792344748
Energy: 1.8895738611435893

minimum gb energy = 1.557734537362283 eV
minimum distance =  2.28803789322657 Angstroms
sigma value = 53


========================================
theta = 36.86989764584402
========================================

Energy: 3.299989441704564
Energy: 1.7997327448063407
Energy: 1.8028628022146511
Energy: 1.5152918157223683
Energy: 1.803029438692308
Energy: 1.566789580530476
Energy: 2.42153127829891
Energy: 1.5667895805084788
Energy: 1.7991750117771284
Energy: 2.795741998368695
Energy: 1.815593545162885
Energy: 2.795741998394646
Energy: 2.413475478161895
Energy: 1.5726318769429026
Energy: 1.8126213262122235
Energy: 1.5726318769389032
Energy: 2.413846294536784
Energy: 1.5728689533216382
Energy: 1.4992322575504702
Energy: 1.5728689532996407
Energy: 1.7989063434775616
Energy: 2.419609782282144
Energy: 1.4997186523052373
Energy: 2.4196091519592113
Energy: 3.2882572717678236
Energy: 1.7976184780667046
Energy: 1.7970236648365687
Energy: 1.7976184780687043
Energy: 3.2884933138410837
Energy: 1.7965424891421098
Energy: 2.41042128598685
Energy: 1.7965424891421098
Energy: 1.7993534948765229
Energy: 2.735834476522976
Energy: 1.8129217286830088
Energy: 2.7358344765169766
Energy: 1.798267266455585
Energy: 1.8112224428370978
Energy: 2.4100018060844364
Energy: 1.8112224428370978
Energy: 1.7978329547115077
Energy: 2.4472840150209993
Energy: 1.5102163715648982
Energy: 2.4472840150549953
Energy: 1.799283693791512
Energy: 2.517988063045282
Energy: 1.4965573441506703
Energy: 2.5179880630492817
Energy: 3.3027816037554243
Energy: 1.797721094747576
Energy: 2.415799384581202
Energy: 1.7977210947535753

minimum gb energy = 1.4965573441506703 eV
minimum distance =  2.31161279986923 Angstroms
sigma value = 9


========================================
theta = 41.112090439166934
========================================

Energy: 2.5547509245947793
Energy: 2.011080383947003
Energy: 2.016802366816417
Energy: 1.8236974754071211
Energy: 1.6067325619883566
Energy: 2.1190428711766223
Energy: 2.2256418355494563
Energy: 2.119042871172182
Energy: 1.6118084602982385
Energy: 2.123616187305804
Energy: 2.574656567361278
Energy: 2.123616187325787
Energy: 1.6104981656104036
Energy: 1.6069884376598922
Energy: 2.1632236121261292
Energy: 1.6069884376613726
Energy: 1.6061966869515802
Energy: 1.604991290232233
Energy: 2.917732253374121
Energy: 1.6049912902314925
Energy: 1.6039171797316383
Energy: 2.1184776589663508
Energy: 2.9195930867546127
Energy: 2.1184776589641303
Energy: 3.2047812483730724
Energy: 1.9687363351701954
Energy: 1.979902929348309
Energy: 1.9687363351650142
Energy: 2.1989849831413277
Energy: 1.9742263721376099
Energy: 1.9742551022256791
Energy: 1.9742263721368698
Energy: 1.9258085793731463
Energy: 2.399846203124387
Energy: 1.9208329307210827
Energy: 2.3998462031266077
Energy: 1.6021828675313907
Energy: 1.9808937692098982
Energy: 2.5893245685500594
Energy: 1.9808937692158195
Energy: 1.9294568890996857
Energy: 1.708351489850672
Energy: 1.8133787197544546
Energy: 1.708351489850672
Energy: 1.7195212121176293
Energy: 1.7108290719340404
Energy: 2.9126344219854237
Energy: 1.71082907193182
Energy: 2.4031061158354694
Energy: 1.7089718640717282
Energy: 1.7254035378435
Energy: 1.7089718640680274
Energy: 3.1787955790458233
Energy: 1.709795978724683
Energy: 1.711602864882988
Energy: 1.7097959787276436
Energy: 2.1834442839790107
Energy: 1.9618773044502387
Energy: 1.924318727831549
Energy: 1.9618773044975402
Energy: 2.2358683294158492
Energy: 1.7667496407501848
Energy: 1.9263348319558753
Energy: 1.7667496407538854
Energy: 2.5899648750426287
Energy: 2.1740962786440887
Energy: 1.7087677983151899
Energy: 2.174096278648529
Energy: 2.0131534115624903
Energy: 2.0040385393075852
Energy: 2.5503996398250113
Energy: 2.004038539310546
Energy: 2.406187952081799
Energy: 2.118819577324293
Energy: 1.6070232820952202
Energy: 2.118819577325773
Energy: 2.5924194386499164
Energy: 2.1356706359855724
Energy: 1.6225412591773967
Energy: 2.135670636080243
Energy: 2.532088907890292
Energy: 1.6054075443192815
Energy: 1.6097444652971262
Energy: 1.6054075443192815
Energy: 2.9216008047420194
Energy: 1.6046002724471267
Energy: 1.6040795265491248
Energy: 1.6046002724486068
Energy: 2.9462766005238685
Energy: 1.6054062295336635
Energy: 1.6041218081125017
Energy: 1.6054062296039768
Energy: 1.9799308775673594
Energy: 1.9669449758959907
Energy: 2.192576834226155
Energy: 1.9669449758930302
Energy: 1.9706249630617758
Energy: 1.9671608317251075
Energy: 2.1986888897142647
Energy: 1.9671608317258475
Energy: 1.9212403580065593
Energy: 2.4393586692409683
Energy: 1.9253256603175455
Energy: 2.439358669242449
Energy: 2.582575166115609
Energy: 1.9479836606279501
Energy: 1.6023359980754432
Energy: 1.947983661297506
Energy: 1.8134042838762428
Energy: 1.7095272022772436
Energy: 1.9267528243842307
Energy: 1.7095272022772436
Energy: 2.91293475900297
Energy: 1.7157079372127002
Energy: 1.7183853202887935
Energy: 1.7157079372082593
Energy: 1.7253460366670794
Energy: 1.708365917130087
Energy: 2.876792206760339
Energy: 1.7083659171278665
Energy: 1.715893582935412
Energy: 1.7103006334933564
Energy: 2.3903347223984923
Energy: 1.710300633491876
Energy: 1.9278847750678072
Energy: 1.9871972365626462
Energy: 1.799417104551245
Energy: 1.9871972365767088
Energy: 1.9247800861433104
Energy: 1.7667470168895851
Energy: 2.2365106139819773
Energy: 1.7667470168207522
Energy: 1.708381565370245
Energy: 2.177272784384828
Energy: 2.2306319494826483
Energy: 2.1772727843855684
Energy: 2.543514206242042
Energy: 1.9711503444183538
Energy: 2.009893685309198
Energy: 1.9711503444198342

minimum gb energy = 1.6021828675313907 eV
minimum distance =  2.2684561207082 Angstroms
sigma value = 73


========================================
theta = 43.60281897270362
========================================

Energy: 2.439275445523361
Energy: 1.9370515477440386
Energy: 1.9361826073111352
Energy: 1.7173523462415452
Energy: 1.6410790054447468
Energy: 1.6296660696801186
Energy: 2.0112409608236765
Energy: 1.6296660696801186
Energy: 1.6297273508226828
Energy: 1.6321468676214357
Energy: 2.38141151317143
Energy: 1.6321468676190871
Energy: 1.622744483430623
Energy: 1.6291182827065636
Energy: 2.019445072227799
Energy: 1.629118282704215
Energy: 1.6354447764442614
Energy: 1.6347751994827098
Energy: 2.8690500313224057
Energy: 1.634775199480361
Energy: 1.7823266730895364
Energy: 2.2280569786844535
Energy: 2.8252941886272063
Energy: 2.2280569786668396
Energy: 2.0550211160482497
Energy: 1.9349166542637182
Energy: 1.947034453164381
Energy: 1.9349166542648926
Energy: 2.0435150997138773
Energy: 1.946816503786021
Energy: 1.9537176902835873
Energy: 1.9468165037836722
Energy: 2.0033987285609505
Energy: 2.4506006337000654
Energy: 2.3856307414575793
Energy: 2.4506006336965425
Energy: 1.8668805579264023
Energy: 1.6393128844519727
Energy: 2.3796427999583485
Energy: 1.6393128844507985
Energy: 1.9983786786124742
Energy: 1.6151803355770988
Energy: 1.621294058376914
Energy: 1.6151803355641818
Energy: 1.6977245808550094
Energy: 1.6094640882625217
Energy: 2.639420606781424
Energy: 1.6094640882589988
Energy: 2.3898292982655005
Energy: 1.692457792091839
Energy: 1.7126336641857962
Energy: 1.6924577920894905
Energy: 2.385029148656368
Energy: 1.707420970277067
Energy: 1.869671093535388
Energy: 1.7074209702747183
Energy: 1.96666160882951
Energy: 1.8592868099836242
Energy: 1.8571916092214047
Energy: 1.8592868099719078
Energy: 2.8694296282261744
Energy: 1.6979502741047434
Energy: 1.699604546184309
Energy: 1.697950274120009
Energy: 2.827117015001501
Energy: 2.023226035521124
Energy: 1.708414783612666
Energy: 2.02322603551995
Energy: 1.9423137019438896
Energy: 1.863413682904899
Energy: 2.2978011321618963
Energy: 1.8634136805914159
Energy: 2.16189526386405
Energy: 1.881604227263901
Energy: 2.3039478207270285
Energy: 1.8816042272615525
Energy: 2.139931589257753
Energy: 1.9242528040872493
Energy: 2.157138256511787
Energy: 1.924252804090772
Energy: 2.1703929562855526
Energy: 1.7029607582802053
Energy: 1.8727227669579205
Energy: 1.702960758293096
Energy: 2.8292617898997183
Energy: 1.860159651478088
Energy: 1.864622572146629
Energy: 1.860159651478088

minimum gb energy = 1.6094640882589988 eV
minimum distance =  2.27131425106783 Angstroms
sigma value = 7


========================================
theta = 46.39718102729638
========================================

Energy: 3.7015489907541657
Energy: 1.9581041539475
Energy: 1.9554589880306494
Energy: 1.645603193220909
Energy: 1.6310536950242007
Energy: 2.014856022834692
Energy: 2.2347100073340584
Energy: 2.014856022818085
Energy: 1.626130490147461
Energy: 2.043403974245033
Energy: 2.0115385016463754
Energy: 2.043403974240051
Energy: 1.6225822660137426
Energy: 1.6224528992486191
Energy: 2.6626267281245486
Energy: 1.6224528992436371
Energy: 1.6343668605571755
Energy: 1.6229664411557343
Energy: 2.3786488600875004
Energy: 1.6229664411565647
Energy: 2.220548402586012
Energy: 1.6242047039617036
Energy: 2.3817433713516354
Energy: 1.6242047039633645
Energy: 2.8913472648339673
Energy: 1.6261188010046028
Energy: 1.6323387527341655
Energy: 1.626118800998828
Energy: 2.2299207444088127
Energy: 1.6412746788538481
Energy: 1.657490673228196
Energy: 1.6412746788530177
Energy: 2.913365282819792
Energy: 1.6268373154116964
Energy: 1.6367132383087948
Energy: 1.6268373154108662
Energy: 2.3832377111572147
Energy: 2.0510297765678613
Energy: 1.6367750395482217
Energy: 2.0510297768774297
Energy: 2.6466384139681343
Energy: 1.8446827927476026
Energy: 1.8697452623364508
Energy: 1.844682792730996
Energy: 1.8383489143563336
Energy: 1.8393572368359112
Energy: 2.229929171159235
Energy: 1.839357236847536
Energy: 2.0179150889856703
Energy: 2.0404136619567494
Energy: 1.8495988178846288
Energy: 2.040413661949276
Energy: 2.016904350493493
Energy: 1.6984351046137403
Energy: 1.6415585039097906
Energy: 1.69843510454652
Energy: 1.8459646769933271
Energy: 2.0175044154224073
Energy: 1.6457173268985636
Energy: 2.017504415492949
Energy: 3.403395001865213
Energy: 1.8387491809247172
Energy: 1.8374390744702847
Energy: 1.8387491809288692
Energy: 2.060158778943945
Energy: 1.8430450484382643
Energy: 2.2813714247406787
Energy: 1.843045048425809
Energy: 1.6361044839401102
Energy: 2.5863530333736944
Energy: 2.0071023201143694
Energy: 2.5863530333720335
Energy: 1.6296624637527872
Energy: 1.6264007587257154
Energy: 2.234868446087171
Energy: 1.6264007587223943
Energy: 1.6591170565892728
Energy: 1.6416584537233754
Energy: 2.066855497442262
Energy: 1.6416584537291878
Energy: 1.6309994797006122
Energy: 1.6223074975065386
Energy: 2.372579775045982
Energy: 1.622307497403651
Energy: 2.2322662953341967
Energy: 1.6256378867353527
Energy: 1.893446170715198
Energy: 1.625637886736183
Energy: 2.912520292048143
Energy: 1.6226106927227093
Energy: 1.6332316986146171
Energy: 1.6226106927110842
Energy: 2.4406347968369206
Energy: 1.6228751999751871
Energy: 1.622527238971988
Energy: 1.6228751999735265
Energy: 2.370805031418431
Energy: 2.424569021858794
Energy: 1.6242811218504694
Energy: 2.424569021855472
Energy: 2.420603792000316
Energy: 1.8356680797183262
Energy: 1.6314641785504334
Energy: 1.83566807959049
Energy: 1.9530649575058998
Energy: 1.8494380432791273
Energy: 2.802306827773563
Energy: 1.8494380432841095
Energy: 2.029230463614994
Energy: 1.8360815676784792
Energy: 1.6321735112254099
Energy: 1.8360815676768185
Energy: 2.015783300344572
Energy: 1.8493155897431837
Energy: 2.043702615784432
Energy: 1.8493155897448443
Energy: 1.864385806906697
Energy: 2.0113870437616472
Energy: 1.6406877554942925
Energy: 2.011387043758326
Energy: 2.1213193437528286
Energy: 1.838874798735327
Energy: 1.845551618968273
Energy: 1.8388747987403091

minimum gb energy = 1.622307497403651 eV
minimum distance =  2.27598341251799 Angstroms
sigma value = 29


========================================
theta = 53.13010235415598
========================================

Energy: 1.5385562648917135
Energy: 1.9114607854741241
Energy: 1.5594898457375261
Energy: 1.5410184768511594
Energy: 1.5529653404461692
Energy: 1.6656290853078586
Energy: 1.5529946010145157
Energy: 1.665629085309851
Energy: 1.5510737631094937
Energy: 1.552799608379335
Energy: 1.5382709820771256
Energy: 1.552799608377921
Energy: 1.5406711638661608
Energy: 1.5487904827794265
Energy: 1.5564560662923086
Energy: 1.5487904827240222
Energy: 1.555671586368116
Energy: 1.5506344809867718
Energy: 1.539747687739436
Energy: 1.5506344876159133
Energy: 1.557217770883218
Energy: 1.6255199352132388
Energy: 1.5395719490855801
Energy: 1.6255199352104106
Energy: 1.5391273754300883
Energy: 1.6221805607442716
Energy: 1.5565318717949983
Energy: 1.6221805607374906
Energy: 1.5607879092911345
Energy: 1.5486271443180626
Energy: 1.5399695776965932
Energy: 1.5486271439618553
Energy: 1.5406621684359179
Energy: 1.5517731491129354
Energy: 1.5481298878847916
Energy: 1.55177314949286

minimum gb energy = 1.5382709820771256 eV
minimum distance =  2.32498216301968 Angstroms
sigma value = 5


========================================
theta = 59.48976259388444
========================================

Energy: 2.6012713901142313
Energy: 1.4811575645756223
Energy: 1.8425774503829802
Energy: 1.464903398733268
Energy: 1.7487810261159087
Energy: 1.4783062243288376
Energy: 2.0590051053025933
Energy: 1.4783062243257001
Energy: 2.064780658381922
Energy: 1.479234179006229
Energy: 1.8610470233500525
Energy: 1.4792341790423098
Energy: 1.4925048693925052
Energy: 2.069545514838723
Energy: 2.030919131319458
Energy: 2.069545514837154
Energy: 1.9956645806173976
Energy: 1.4778037629160536
Energy: 2.0249749220979854
Energy: 1.477803762918407
Energy: 1.4783543499113618
Energy: 1.4773221673673658
Energy: 2.068953241217845
Energy: 1.4773221673650125
Energy: 1.4777670050428435
Energy: 1.4777757516592267
Energy: 1.9991665752973025
Energy: 1.477775751657658
Energy: 1.4771994490206912
Energy: 1.5189246158202288
Energy: 2.571368546282624
Energy: 1.5189246158194445
Energy: 1.5297314657098846
Energy: 1.5247464373706239
Energy: 2.5888607681203513
Energy: 1.5247464373674864
Energy: 2.0507107454564912
Energy: 1.4642617300782095
Energy: 1.48876045345636
Energy: 1.4642617300523255
Energy: 1.5291709914960234
Energy: 1.463382035953147
Energy: 1.468045509093994
Energy: 1.4633820359570688
Energy: 2.556966585631102
Energy: 1.462653594223943
Energy: 1.4636323605693757
Energy: 1.4626535942215897
Energy: 2.5569507952782273
Energy: 1.4644551304259057
Energy: 2.0035850913248505
Energy: 1.4644551304298274
Energy: 1.4783986634149002
Energy: 1.5155139439922567
Energy: 2.0398996542434102
Energy: 1.5155139439891192
Energy: 1.4796402832644717
Energy: 1.4783165160490788
Energy: 2.105179567024239
Energy: 1.478316516045157
Energy: 1.4814126956964273
Energy: 1.4778645419704617
Energy: 1.7490847138787664
Energy: 1.477864541968893
Energy: 1.4813468216519108
Energy: 1.4783143054070924
Energy: 1.4852244386622122
Energy: 1.478314305391405
Energy: 2.0422573572362
Energy: 1.4777262305378744
Energy: 1.4891347558121688
Energy: 1.4777262305355214
Energy: 2.034574616345327
Energy: 1.4794632279417546
Energy: 2.125686783376731
Energy: 1.4794632279456763
Energy: 2.0682814190537107
Energy: 2.0519554594803773
Energy: 1.4889155517403434
Energy: 2.0519554594144904
Energy: 2.0684759916054456
Energy: 1.481350234961837
Energy: 1.998074957753736
Energy: 1.4813502349610526
Energy: 2.0573395222507447
Energy: 1.4777585740419903
Energy: 1.4788738897336398
Energy: 1.4777585740419903
Energy: 1.9964115126376403
Energy: 1.4777856921829202
Energy: 1.479714886688053
Energy: 1.477785692182136
Energy: 2.5730653814451134
Energy: 1.5180904002338744
Energy: 1.4835174212336517
Energy: 1.518090400230737
Energy: 2.562855840632814
Energy: 1.5225578673548983
Energy: 1.5290895485987233
Energy: 1.522557867359604
Energy: 1.487722234787045
Energy: 2.369844055525487
Energy: 2.023709136218779
Energy: 2.369844055528625
Energy: 1.4675853238454175
Energy: 1.4635418026303115
Energy: 1.5295676475624511
Energy: 1.4635418026310962
Energy: 1.462775951887405
Energy: 1.462433577022204
Energy: 1.5342037681095804
Energy: 1.462433577022204
Energy: 1.494586420157498
Energy: 2.3686123944985287
Energy: 2.558216563106302
Energy: 2.3686123944906847
Energy: 2.026406330778483
Energy: 1.5174804731636844
Energy: 1.494106917238435
Energy: 1.5174804731629001
Energy: 2.0303852830345126
Energy: 1.4786512298817336
Energy: 1.480179301002875
Energy: 1.478651229889506
Energy: 1.9942280283238025
Energy: 1.4793650252595945
Energy: 1.4862077869883377
Energy: 1.4793650252603785
Energy: 1.4867513685885616
Energy: 1.4781589644836328
Energy: 1.4802557227863564
Energy: 1.4781589644812798

minimum gb energy = 1.462433577022204 eV
minimum distance =  2.30009058586579 Angstroms
sigma value = 1


========================================
theta = 61.92751306414704
========================================

Energy: 3.241337142773801
Energy: 1.407467716694356
Energy: 1.7948494206045864
Energy: 1.3936688243221087
Energy: 1.6613367089097957
Energy: 1.406852959345636
Energy: 2.1669140750919773
Energy: 1.406852959345636
Energy: 2.2020271529607522
Energy: 1.405772299748502
Energy: 2.164251408280851
Energy: 1.4057722997398256
Energy: 1.7966083501779628
Energy: 1.704379893682987
Energy: 2.1473143218418236
Energy: 1.7043798936840715
Energy: 1.6357122005533071
Energy: 1.4177379146035656
Energy: 1.8388364510226738
Energy: 1.4177379146154954
Energy: 1.417402826520829
Energy: 1.417819967458159
Energy: 1.8293538683432315
Energy: 1.4178199674614127
Energy: 1.4198040661383389
Energy: 1.4169281800574773
Energy: 2.1651012077547835
Energy: 1.4169281800596463
Energy: 1.417747814353638
Energy: 2.1089853117786803
Energy: 2.538699283049738
Energy: 2.1089853117754265
Energy: 1.4944433719985384
Energy: 1.4803370888443559
Energy: 2.4867006656915027
Energy: 1.480337088842187
Energy: 2.52305452418213
Energy: 1.375437055119763
Energy: 1.7614937294513462
Energy: 1.3754370551165096
Energy: 1.4981954123827097
Energy: 1.8259102501751818
Energy: 1.8182207138331603
Energy: 1.8259102501751818
Energy: 2.8768769240745673
Energy: 1.3750065624495396
Energy: 1.734110888465478
Energy: 1.3750065624506238
Energy: 2.879596034668107
Energy: 1.3748795692276017
Energy: 1.5614567352303528
Energy: 1.3748795692265172
Energy: 1.418406183635965
Energy: 1.3749425396459953
Energy: 2.560843849359789
Energy: 1.374942539642742
Energy: 1.8003099515868863
Energy: 1.6674369478730318
Energy: 2.506503990405919
Energy: 1.6674369478730318
Energy: 1.8105707057416092
Energy: 1.6737976037842683
Energy: 1.8312298425312696
Energy: 1.6737976037842683
Energy: 1.4299842080824565
Energy: 1.41885796908444
Energy: 1.8059459421703306
Energy: 1.4188579690855248
Energy: 1.4320756264900285
Energy: 1.4192297689736768
Energy: 1.8222548712124031
Energy: 1.4192297689747613
Energy: 1.4308697936164472
Energy: 1.4174984484631188
Energy: 2.529149154061741
Energy: 1.4174984484457667
Energy: 1.4556971398474718
Energy: 2.1672321727465147
Energy: 2.5283891629113517
Energy: 2.1672321728018247
Energy: 2.5195885257945903
Energy: 1.4078585369904912
Energy: 2.1214098240874875
Energy: 1.4078585369883219
Energy: 2.5230644127851365
Energy: 1.4063838464664167
Energy: 1.4065955439567526
Energy: 1.4063838464620784
Energy: 1.6680422519798488
Energy: 1.4070778313763321
Energy: 1.4087335558003145
Energy: 1.4070778313752477
Energy: 2.5219756765085917
Energy: 1.4063336004596168
Energy: 1.4081734773323231
Energy: 1.4063336004552787

minimum gb energy = 1.3748795692265172 eV
minimum distance =  2.29403951117746 Angstroms
sigma value = 17


========================================
theta = 64.01076641616699
========================================

Energy: 3.2954179290120234
Energy: 1.3613545390999802
Energy: 1.7637845875783216
Energy: 1.3486922280172677
Energy: 1.6569699494623495
Energy: 1.3579814989228134
Energy: 1.9307006604547452
Energy: 1.3579814989234835
Energy: 2.2913478966696
Energy: 1.3597350032888182
Energy: 1.836319441192512
Energy: 1.3597350032888182
Energy: 2.2993158525081485
Energy: 1.3448984934707047
Energy: 1.832719300587889
Energy: 1.3448984934613206
Energy: 2.6778215376116936
Energy: 1.3441119599313645
Energy: 2.5391220452658505
Energy: 1.3441119599286833
Energy: 1.3454114759104747
Energy: 1.3446573976082143
Energy: 2.728509608037579
Energy: 1.3446573976068739
Energy: 1.3452763937855445
Energy: 1.344629254276816
Energy: 1.8385594387020958
Energy: 1.3446292542754752
Energy: 1.3548884357022384
Energy: 1.3452968919341874
Energy: 3.314666211275403
Energy: 1.3452968919321766
Energy: 2.77616079750688
Energy: 1.3452445163135243
Energy: 2.2776631233300786
Energy: 1.3452445163141946
Energy: 1.870035849520714
Energy: 1.3518729594852141
Energy: 1.8589696946995728
Energy: 1.3518729594899064
Energy: 2.678367164136354
Energy: 1.3608921387272117
Energy: 1.3647003963846793
Energy: 1.36089213872386
Energy: 2.725947031136351
Energy: 1.384229764315806
Energy: 1.830229592551514
Energy: 1.3842297643164763
Energy: 2.756844900036514
Energy: 1.3555460399295027
Energy: 1.3568291508385977
Energy: 1.3555460399308432
Energy: 2.2605490683205836
Energy: 1.3562279813587874
Energy: 1.3584138577832592
Energy: 1.3562279813594575
Energy: 2.292285548701885
Energy: 1.357106313496461
Energy: 1.3695017169457158
Energy: 1.3571063134957908
Energy: 3.1666402708969086
Energy: 1.3577234030580458
Energy: 2.5166743925244726
Energy: 1.3577234030613974
Energy: 1.395026548547302
Energy: 1.3981720970811315
Energy: 2.736051031126481
Energy: 1.398172097075769
Energy: 1.3582005512991746
Energy: 1.357260221858736
Energy: 2.6974632910148637
Energy: 1.3572602218614171
Energy: 1.3770931248485436
Energy: 1.3585189995705176
Energy: 2.2764640022034537
Energy: 1.3585189995772209
Energy: 1.3698195536610995
Energy: 1.3566054601534605
Energy: 3.188315581976525
Energy: 1.3566054601467574
Energy: 1.8536948007146217
Energy: 1.3589959791768893
Energy: 1.6576303571100388
Energy: 1.358995979182252
Energy: 1.8479451391358586
Energy: 1.3626037265361264
Energy: 2.2873006086956242
Energy: 1.362603726533445
Energy: 1.6301205565519559
Energy: 1.3451859062705194
Energy: 2.2845790937553634
Energy: 1.3451859062671678
Energy: 2.584967985312878
Energy: 1.3457512736187196
Energy: 1.5866871784034624
Energy: 1.3457512736173791
Energy: 2.721534605388436
Energy: 1.3441049140539465
Energy: 1.3443548432945693
Energy: 1.3441049140532761
Energy: 1.8634005425898172
Energy: 1.345352741331294
Energy: 1.349557281744008
Energy: 1.3453527413272721
Energy: 3.3361565829534636
Energy: 1.3457575804880701
Energy: 1.3523121952459112
Energy: 1.3457575804880701
Energy: 2.2765504458125982
Energy: 1.3448250291157053
Energy: 2.820967360105066
Energy: 1.344825029117046
Energy: 1.6123636316517787
Energy: 1.407265639981256
Energy: 1.8433861185657185
Energy: 1.407265639978575
Energy: 1.3662386944065967
Energy: 1.3618557941943303
Energy: 2.705076842104448
Energy: 1.361855794213099
Energy: 1.8015054980826442
Energy: 1.3554814940073612
Energy: 2.728712245904606
Energy: 1.355481493999988
Energy: 1.355893243019222
Energy: 1.3554375288958673
Energy: 2.759501689122625
Energy: 1.3554375288938565
Energy: 1.3559352778117069
Energy: 1.355833431329623
Energy: 2.4644418487746753
Energy: 1.355833431328282
Energy: 1.3634254252111884
Energy: 1.3572039416073216
Energy: 2.297275912822443
Energy: 1.3572039416066515
Energy: 2.698998240465122
Energy: 1.388525148388164
Energy: 3.2114958715833386
Energy: 1.3885251483962078
Energy: 2.81727554316287
Energy: 1.396310678084973
Energy: 1.3941804305079653
Energy: 1.396310677916846
Energy: 2.6996606648909176
Energy: 1.3566210816009276
Energy: 1.3573691667060594
Energy: 1.3566210815989168
Energy: 2.279897199921355
Energy: 1.3870219912989545
Energy: 1.385113088711287
Energy: 1.387021991298284

minimum gb energy = 1.3441049140532761 eV
minimum distance =  2.30729637024949 Angstroms
sigma value = 89


========================================
theta = 67.38013505195957
========================================

Energy: 3.7654369886616528
Energy: 1.2209458373854656
Energy: 1.2179358316750395
Energy: 1.2396218332267148
Energy: 2.3834398018214378
Energy: 1.3066145567709118
Energy: 2.3910749015107884
Energy: 1.3066145567691578
Energy: 1.2110870943027066
Energy: 1.307162706632377
Energy: 2.3930178526267905
Energy: 1.3071627066306233
Energy: 1.2153866217755303
Energy: 2.3613567407834517
Energy: 2.383139051873167
Energy: 2.3613567407834517
Energy: 2.3812929023830582
Energy: 2.294731234923722
Energy: 2.374752725413835
Energy: 2.294731234921968
Energy: 1.2215178598521828
Energy: 1.217975434589406
Energy: 2.3840837063888953
Energy: 1.21797543459116
Energy: 1.219556777707018
Energy: 1.2180511251976422
Energy: 2.3805863755633743
Energy: 1.2180511251993964
Energy: 1.2182712129230495
Energy: 1.2188289327850805
Energy: 3.5537809602466917
Energy: 1.2188289327885882
Energy: 2.4098931360345395
Energy: 1.2186753758902455
Energy: 3.5350458084830207
Energy: 1.218675375888492
Energy: 2.413072708515946
Energy: 1.3035325310790813
Energy: 2.3826817067611032
Energy: 1.3035325310773274
Energy: 2.387922003480672
Energy: 2.2850678528258688
Energy: 1.2102501129778234
Energy: 2.285067852801354
Energy: 1.22272353819663
Energy: 1.2178550733237519
Energy: 2.3846299235376875
Energy: 1.217855073321998
Energy: 2.4121349111090398
Energy: 1.2185649889769108
Energy: 1.2174526405972437
Energy: 1.2185649858545873
Energy: 3.5731816095805216
Energy: 1.217387810192178
Energy: 1.2179244742735786
Energy: 1.2173878102079627
Energy: 3.5405850038560933
Energy: 1.219051878815496
Energy: 1.2189308434135007
Energy: 1.21905187881725

minimum gb energy = 1.2102501129778234 eV
minimum distance =  2.32149250448661 Angstroms
sigma value = 13


========================================
theta = 71.07535558394876
========================================

Energy: 2.815064806620404
Energy: 1.1255427483884362
Energy: 1.567119277039269
Energy: 1.1180660740093098
Energy: 1.6266728098354957
Energy: 1.1230970451687616
Energy: 1.635164440467218
Energy: 1.1230970451599402
Energy: 3.0950563377218976
Energy: 1.1217911067798407
Energy: 1.66925237406694
Energy: 1.1217911067783706
Energy: 2.1213254250959883
Energy: 1.1233744822127203
Energy: 1.3993364346622548
Energy: 1.1233744822097798
Energy: 1.6968657171390387
Energy: 1.1824559145563365
Energy: 2.6046364710624172
Energy: 1.1824559145563365
Energy: 1.6543792368249797
Energy: 1.1221765103770454
Energy: 2.6155798250315865
Energy: 1.122176510374105
Energy: 1.6438720472716402
Energy: 1.1228638735507455
Energy: 1.3973554302932583
Energy: 1.1228638735382483
Energy: 1.4042519388448043
Energy: 1.1232674188906857
Energy: 3.401865517428425
Energy: 1.1232674188958316
Energy: 1.1425475129913312
Energy: 1.1414618500802345
Energy: 3.1259477841026935
Energy: 1.1414618500647968
Energy: 1.1265825277696482
Energy: 1.1224664032808744
Energy: 3.1103791287702007
Energy: 1.1224664032816094
Energy: 1.146432971008228
Energy: 1.1247717334781644
Energy: 3.2095162663826793
Energy: 1.1247717334744887
Energy: 2.6131178171687974
Energy: 1.122146849589411
Energy: 2.6621525778622352
Energy: 1.1221468495827949
Energy: 2.630972027623355
Energy: 1.1695977715345935
Energy: 2.624888574449827
Energy: 1.16959777154562
Energy: 1.9165066011604452
Energy: 2.5392174327315686
Energy: 2.1208237684146787
Energy: 2.5392174327249526
Energy: 3.351290908873327
Energy: 1.1232072686217058
Energy: 1.9125212320080303
Energy: 1.1232072686217058
Energy: 3.3417478502471725
Energy: 1.1228647379716268
Energy: 1.131767693882454
Energy: 1.1228647379708914
Energy: 2.399351286650405
Energy: 1.123090451817854
Energy: 1.1279828525264202
Energy: 1.1230904518193243
Energy: 2.6413028747283076
Energy: 1.1229381864238495
Energy: 1.1283807763169273
Energy: 1.1229381864187034
Energy: 3.5849191171145605
Energy: 1.1425273719689883
Energy: 1.633748078369823
Energy: 1.1425273719616371
Energy: 3.3914923330556066
Energy: 1.122661699598173
Energy: 1.6881158851881999
Energy: 1.1226616996069945
Energy: 2.158038322984814
Energy: 1.1249229451279954
Energy: 1.647137408864482
Energy: 1.12492294512579
Energy: 3.3896712950132173
Energy: 1.1774906930900546
Energy: 2.6297032745718307
Energy: 1.1774906930885845
Energy: 1.6931884161743116
Energy: 1.1233559668524236
Energy: 2.6860528229439655
Energy: 1.1233559668472777
Energy: 1.1246651763385627
Energy: 1.1233308165098992
Energy: 2.6581234210709614
Energy: 1.123330816504753
Energy: 1.6155398212814616
Energy: 1.1223504430091298
Energy: 3.356526638485364
Energy: 1.1223504430069247
Energy: 1.1234798798257728
Energy: 1.1218651053537594
Energy: 3.167561306835957
Energy: 1.1218651053596402
Energy: 1.1212570653556657
Energy: 1.1217888438849044
Energy: 2.6587608015299207
Energy: 1.121788843894461
Energy: 1.1475283883394891
Energy: 1.1230178331402365
Energy: 3.151914375106836
Energy: 1.1230178331395015
Energy: 2.6151057613006046
Energy: 1.1215696471312353
Energy: 3.6053497839655693
Energy: 1.1215696471305001
Energy: 1.6259372981684803
Energy: 1.1729346905226907
Energy: 2.627582541947185
Energy: 1.172934690530777
Energy: 2.36546410830177
Energy: 1.1227128837307485
Energy: 2.1753888900603022
Energy: 1.1227128837380995
Energy: 3.34428576689694
Energy: 1.12298823740017
Energy: 2.593123400945493
Energy: 1.122988237389143
Energy: 3.350594267610139
Energy: 1.122536816040975
Energy: 1.1280660884932447
Energy: 1.1225368160453857
Energy: 1.6954856645784333
Energy: 1.1220745353345736
Energy: 1.1230715784403134
Energy: 1.1220745353411898
Energy: 3.6686365825217178
Energy: 1.1221503889010698
Energy: 1.12867171885073
Energy: 1.1221503889010698

minimum gb energy = 1.1180660740093098 eV
minimum distance =  2.31057528935543 Angstroms
sigma value = 37


========================================
theta = 73.73979529168804
========================================

Energy: 3.0380175241319445
Energy: 1.024551959019026
Energy: 1.0225170088513666
Energy: 1.0255266358996482
Energy: 2.1308216136112454
Energy: 1.02314243452978
Energy: 1.8639029483426302
Energy: 1.023142434531045
Energy: 2.909276501013045
Energy: 1.0228965017218186
Energy: 1.859123820334809
Energy: 1.0228965017218186
Energy: 2.9356702327410513
Energy: 1.1141942724292875
Energy: 1.4927350869691318
Energy: 1.114194272430552
Energy: 2.5079492623661994
Energy: 1.1148615368530381
Energy: 2.2789268980043214
Energy: 1.1148615368555679
Energy: 1.7011281646707663
Energy: 1.0200386946216988
Energy: 3.1395184308141593
Energy: 1.0200386946216988
Energy: 1.4473543060520782
Energy: 1.019702970679882
Energy: 2.141217953606982
Energy: 1.0197029706811467
Energy: 1.658337561704671
Energy: 1.0044441487226337
Energy: 3.3734433979223004
Energy: 1.0044441487238984
Energy: 1.4405588496459365
Energy: 1.008199948960721
Energy: 3.349413925019246
Energy: 1.008199948964515
Energy: 1.4254560841199024
Energy: 1.0044323456885638
Energy: 3.5669138469815853
Energy: 1.004432345687299
Energy: 1.30038043043792
Energy: 1.3009448245248671
Energy: 2.7701991161116593
Energy: 1.3009448245248671
Energy: 2.2619812534952395
Energy: 1.0039879101598508
Energy: 3.5769539751386668
Energy: 1.0039879101598508
Energy: 2.3004323035704757
Energy: 1.0038455715381212
Energy: 2.909185252267925
Energy: 1.0038455715381212
Energy: 2.134084772460109
Energy: 1.0973350480105732
Energy: 2.910397991574608
Energy: 1.097335048011838
Energy: 2.278926898006822
Energy: 1.1133310173404198
Energy: 2.516234781843915
Energy: 1.1133310173404198
Energy: 2.964446908147533
Energy: 1.1125116527406178
Energy: 1.8805019761606077
Energy: 1.1125116527418824
Energy: 2.1281881516807424
Energy: 1.0256346753190473
Energy: 1.4422220081009618
Energy: 1.0256346753165178
Energy: 3.3734433963964108
Energy: 1.0243679167808402
Energy: 1.025528993163876
Energy: 1.024367916782105
Energy: 3.3494139250179815
Energy: 1.0244868128797642
Energy: 1.0220611097897683
Energy: 1.0244868128772344
Energy: 2.9678099261297772
Energy: 1.0224886790629533
Energy: 1.0223025047420076
Energy: 1.0224886790642178

minimum gb energy = 1.0038455715381212 eV
minimum distance =  2.30901162029226 Angstroms
sigma value = 25


========================================
theta = 77.31961650818018
========================================

Energy: 3.2604203626636883
Energy: 0.8754386348896648
Energy: 1.3657645684602557
Energy: 0.8746160185544262
Energy: 2.444464974460975
Energy: 0.874396768379948
Energy: 1.5319047157390782
Energy: 0.8743967683829108
Energy: 3.055261468835932
Energy: 0.87518255066821
Energy: 1.5330191025689428
Energy: 0.8751825506741356
Energy: 2.361142605384704
Energy: 0.9454384678036463
Energy: 1.53849055594114
Energy: 0.9454384678075967
Energy: 2.592833421838749
Energy: 0.9507231856041188
Energy: 2.540226931808427
Energy: 0.9507231856002134
Energy: 2.354071497103924
Energy: 0.9457097006032419
Energy: 2.5373208430222354
Energy: 0.9457097006062049
Energy: 2.362542159340053
Energy: 0.8768221338536656
Energy: 2.0984999836508633
Energy: 0.8768221338536656
Energy: 1.3736882786377032
Energy: 0.8694178203025378
Energy: 2.7419590621734153
Energy: 0.8694178203035253
Energy: 1.3983441524024678
Energy: 0.8769270524645014
Energy: 3.235241655818708
Energy: 0.8769270524645014
Energy: 1.4127160418241802
Energy: 0.8768213959317431
Energy: 2.8831368098930463
Energy: 0.876821395910016
Energy: 1.0700784817899072
Energy: 0.8701968894562749
Energy: 2.835643420528925
Energy: 0.8701968894394857
Energy: 1.2248642806894325
Energy: 0.8765600005284852
Energy: 2.8833077002961893
Energy: 0.8765600005284852
Energy: 1.209345866106028
Energy: 0.8674301409381918
Energy: 2.92691710803428
Energy: 0.867430140940167
Energy: 1.0832195625064387
Energy: 0.8795711467622342
Energy: 2.929947374143111
Energy: 0.8795711467612466
Energy: 1.8454135713483055
Energy: 0.8676104812531031
Energy: 2.278338631086771
Energy: 0.8676104812521156
Energy: 1.8488475749080686
Energy: 0.8683830751068582
Energy: 3.0588056269239945
Energy: 0.8683830751088334
Energy: 2.3887252704359287
Energy: 0.8676038871024678
Energy: 3.060501830698578
Energy: 0.8676038870649839
Energy: 1.8549988690073356
Energy: 0.8770557074679216
Energy: 1.8149543897971359
Energy: 0.8770557074610085
Energy: 2.404355452947907
Energy: 0.9501706692557725
Energy: 2.354499397568051
Energy: 0.9501706692587355
Energy: 2.5928059757930693
Energy: 0.9527319560257941
Energy: 2.354099303349992
Energy: 0.9527319560297446
Energy: 2.8474940821767896
Energy: 0.9452380747177934
Energy: 1.4065541891661342
Energy: 0.9452380747326073
Energy: 3.2587218482731486
Energy: 0.8748135674798407
Energy: 1.2033647306112976
Energy: 0.8748135674788532
Energy: 3.396376970475974
Energy: 0.8753101158661012
Energy: 1.5865859360584411
Energy: 0.8753101158670888
Energy: 2.7984948045876337
Energy: 0.876420739154515
Energy: 0.8832282089159339
Energy: 0.8764207391614282
Energy: 2.5937651921210843
Energy: 0.8740170842349181
Energy: 0.8792384438607631
Energy: 0.8740170842339304
Energy: 3.0536643600889892
Energy: 0.8841555693585135
Energy: 0.882520705506498
Energy: 0.8841555693555507

minimum gb energy = 0.8674301409381918 eV
minimum distance =  2.31664717384698 Angstroms
sigma value = 41


========================================
theta = 79.61114218453038
========================================

Energy: 3.8391243546641984
Energy: 0.774751828528106
Energy: 1.2736925795843257
Energy: 0.7777537992758307
Energy: 2.754937605134441
Energy: 0.7705206170932325
Energy: 1.3084768126030863
Energy: 0.7705206170924228
Energy: 3.0031120782684004
Energy: 0.7708416025435424
Energy: 1.3162041036588643
Energy: 0.7708416025411133
Energy: 2.474780047118889
Energy: 0.7700557098967807
Energy: 1.940868142694274
Energy: 0.7700557098927324
Energy: 2.762721818235806
Energy: 0.7836076276616969
Energy: 2.137646910416432
Energy: 0.7836076276633162
Energy: 2.444795310482294
Energy: 1.122347926193856
Energy: 2.1629385124881604
Energy: 1.122347926193856
Energy: 2.4290480251903084
Energy: 0.8305821238450242
Energy: 2.7231431317046626
Energy: 0.8305821238417855
Energy: 2.450180686518539
Energy: 0.8323309167792462
Energy: 2.1397769804572686
Energy: 0.8323309167824849
Energy: 1.837081008940836
Energy: 0.7713635256407947
Energy: 2.7231437044820104
Energy: 0.771363525644843
Energy: 1.8361168371591012
Energy: 0.7706243835771156
Energy: 2.7560083971353504
Energy: 0.7706243835771156
Energy: 1.3310135576444917
Energy: 0.7727141280593277
Energy: 2.814366713032922
Energy: 0.7727141280593277
Energy: 1.3184215583894476
Energy: 0.7708255171650975
Energy: 2.755945262183742
Energy: 0.7708255171667168
Energy: 1.3675660644045065
Energy: 0.7707649462521904
Energy: 3.9923820631730225
Energy: 0.7707649462521904
Energy: 0.7778189760207284
Energy: 0.7727448132831106
Energy: 2.7258304998459266
Energy: 0.7727448132912074
Energy: 0.7743723535811802
Energy: 0.7708021105284588
Energy: 2.7518138887551493
Energy: 0.7708021105276491
Energy: 0.7759049261865907
Energy: 0.7709692921382799
Energy: 2.9996738434203967
Energy: 0.7709692921350413
Energy: 1.3115895611665649
Energy: 0.7713843487553692
Energy: 3.003858067830609
Energy: 0.7713843487561789
Energy: 1.3068346297563158
Energy: 0.7702192681204754
Energy: 3.010434704755141
Energy: 0.7702192681237141
Energy: 1.320880853941105
Energy: 0.771507562488979
Energy: 2.424112888259012
Energy: 0.7715075624905984
Energy: 2.142546268557275
Energy: 0.7700409953387054
Energy: 2.447332836203731
Energy: 0.770040995337086
Energy: 2.1731649798251
Energy: 0.7724694950229605
Energy: 2.719203136903034
Energy: 0.7724694949071773
Energy: 2.1538314025291734
Energy: 0.8300866781872233
Energy: 3.1183035708572513
Energy: 0.8300866781548364
Energy: 2.769404389314524
Energy: 0.8277110657725495
Energy: 2.423281675614092
Energy: 0.8277110657741689
Energy: 2.1337031370469046
Energy: 0.8317346338744908
Energy: 2.151420457766916
Energy: 0.8317346338728715
Energy: 2.722716853999083
Energy: 0.7719403898434667
Energy: 1.876201020475523
Energy: 0.7719403898418473
Energy: 2.7124361647960438
Energy: 0.7706599455736433
Energy: 2.1430281979998216
Energy: 0.7706599455720239
Energy: 2.7597583378425288
Energy: 0.7705107805388981
Energy: 1.3264487352679695
Energy: 0.7705107805469947
Energy: 2.7529086430684435
Energy: 0.7711964439624825
Energy: 1.3209770274448538
Energy: 0.7711964439916307
Energy: 2.718662773970591
Energy: 0.7716565150937104
Energy: 1.3327493412133955
Energy: 0.7716565150937104
Energy: 2.7219513611719655
Energy: 0.7716639351795357
Energy: 0.7759636275159766
Energy: 0.7716639351795357
Energy: 2.7533017911012996
Energy: 0.7712697611566444
Energy: 0.773596814011549
Energy: 0.7712697611558348
Energy: 3.0015973117874797
Energy: 0.7717971848028121
Energy: 0.7766565672411478
Energy: 0.7717971847987638

minimum gb energy = 0.770040995337086 eV
minimum distance =  2.32175118935855 Angstroms
sigma value = 15


========================================
theta = 81.20258929000894
========================================

Energy: 2.7685576437773562
Energy: 0.6992365430289552
Energy: 1.2084759477788702
Energy: 0.6997230509999931
Energy: 2.8704840296748406
Energy: 0.6946551909755717
Energy: 1.1598559938726913
Energy: 0.6946551909748859
Energy: 3.080293431089232
Energy: 0.6944179871087652
Energy: 1.151480432791923
Energy: 0.694417987110823
Energy: 2.6006397920483795
Energy: 0.6980482325686814
Energy: 1.685795296816935
Energy: 0.6980482325673095
Energy: 2.4163023425964383
Energy: 0.7071957194023659
Energy: 1.8480844125847182
Energy: 0.7071957194208854
Energy: 2.595527760429037
Energy: 0.7058074489808133
Energy: 1.850419212780568
Energy: 0.7058074489506334
Energy: 2.098344578112903
Energy: 0.7009516963361462
Energy: 2.391323071845634
Energy: 0.7009516963080863
Energy: 2.166580666150584
Energy: 0.7533791548899866
Energy: 1.9147119592597466
Energy: 0.7533791548975316
Energy: 2.10075419526215
Energy: 1.2786718626630706
Energy: 2.3532390295229466
Energy: 1.2786718626637565
Energy: 2.12651362160408
Energy: 1.2761448319708328
Energy: 2.839644786197848
Energy: 1.2761448319674036
Energy: 1.4943140077857582
Energy: 0.7465744953366987
Energy: 2.997151562623536
Energy: 0.7465744948883031
Energy: 1.6250423250302308
Energy: 0.707358718055556
Energy: 2.840018029938111
Energy: 0.7073587180925949
Energy: 1.853366507189308
Energy: 0.6965366016922865
Energy: 2.8346376711544723
Energy: 0.6965366016922865
Energy: 1.165918137968769
Energy: 0.6973305868899006
Energy: 2.385341737967906
Energy: 0.6973305868933302
Energy: 1.1941357859827175
Energy: 0.6948488034459699
Energy: 2.864320365090444
Energy: 0.6948488032971906
Energy: 1.1589744694545099
Energy: 0.6955490000409679
Energy: 2.846563746479161
Energy: 0.695549000040282
Energy: 0.703904090270167
Energy: 0.6956841516784644
Energy: 2.85363295348729
Energy: 0.6956841516764067
Energy: 0.6942448105634094
Energy: 0.6952330170736856
Energy: 3.0952478768489002
Energy: 0.6952330170764293
Energy: 0.7015365759659771
Energy: 0.695061117291262
Energy: 2.596192624010631
Energy: 0.6950611173029223
Energy: 1.164324133556911
Energy: 0.695459097298639
Energy: 3.0998861653568377
Energy: 0.6954590973041261
Energy: 1.1537825747484196
Energy: 0.6941514334280205
Energy: 2.8667891369047362
Energy: 0.6941514334197897
Energy: 1.161419256986637
Energy: 0.697472681308284
Energy: 3.241343850342806
Energy: 0.6974726813069122
Energy: 1.8539496721328943
Energy: 0.7095825458352717
Energy: 2.5890417979127074
Energy: 0.7095825458435027
Energy: 1.8556889426062118
Energy: 0.7058285458661977
Energy: 2.8439908985973936
Energy: 0.7058285459004929
Energy: 1.868646114423373
Energy: 0.7054196699272003
Energy: 2.146008595546119
Energy: 0.7054196699704124
Energy: 2.347903693407297
Energy: 1.2752071604393023
Energy: 2.8522023137570627
Energy: 1.2752071604434176
Energy: 1.8472767724252233
Energy: 1.2795279340280208
Energy: 2.3497125415748124
Energy: 1.2795279340273351
Energy: 2.3638054485387965
Energy: 0.7469478499510677
Energy: 2.1324828414190105
Energy: 0.746947850041545
Energy: 2.3740681423397625
Energy: 0.6978977112193949
Energy: 2.353863124402079
Energy: 0.6978977112084204
Energy: 2.3776497964280345
Energy: 0.7025139485133831
Energy: 1.8581093817969687
Energy: 0.7025139484962356
Energy: 2.41543580689158
Energy: 0.706912187668031
Energy: 1.60571599330171
Energy: 0.7069121876577424
Energy: 2.358998701405353
Energy: 0.6980181690715409
Energy: 1.7000577377422363
Energy: 0.698018169063996
Energy: 2.8392263758386656
Energy: 0.6955714886797627
Energy: 1.178991219156806
Energy: 0.6955714886790767
Energy: 2.8449140078241086
Energy: 0.6954410516872882
Energy: 1.1509967160228864
Energy: 0.69544105168866
Energy: 2.9446178328990333
Energy: 0.6960220265115435
Energy: 0.7040002694729961
Energy: 0.6960220265204605
Energy: 2.864537375839983
Energy: 0.6954916168420996
Energy: 0.7046735176174456
Energy: 0.6954916168571895
Energy: 3.0802121424166917
Energy: 0.6951669092126429
Energy: 0.7057177285625584
Energy: 0.6951669092126429

minimum gb energy = 0.6941514334197897 eV
minimum distance =  2.31805551064959 Angstroms
sigma value = 85


========================================
theta = 82.3718503314193
========================================

Energy: 3.348441851910954
Energy: 0.6133070324141048
Energy: 0.617633394728658
Energy: 0.6239109947346422
Energy: 2.7220729303018416
Energy: 0.615339360731956
Energy: 1.008804565480415
Energy: 0.6153393607343085
Energy: 2.6933928216741223
Energy: 0.6147083845229238
Energy: 1.008135310278262
Energy: 0.6147083845235187
Energy: 2.264673671802971
Energy: 0.6143851360916035
Energy: 1.4829563059434987
Energy: 0.6143851360916035
Energy: 2.5235874292274776
Energy: 0.6128018297929496
Energy: 1.6158270305265368
Energy: 0.6128018297923546
Energy: 2.261709328117891
Energy: 0.6136317410932665
Energy: 1.6448049453623301
Energy: 0.6136317410445128
Energy: 2.263878291906274
Energy: 0.6169195432313574
Energy: 2.0645684153045685
Energy: 0.6169195432087786
Energy: 2.1218488273090252
Energy: 0.906359928369172
Energy: 1.616572175183293
Energy: 0.9063599283632231
Energy: 2.781326538389037
Energy: 1.150646860856808
Energy: 2.0530120068434647
Energy: 1.150646860856808
Energy: 2.7628662507544766
Energy: 1.1517815775702334
Energy: 2.4971473861141384
Energy: 1.1517815775696385
Energy: 2.051650086783002
Energy: 0.6982930331502591
Energy: 2.343940800318207
Energy: 0.6982930331484746
Energy: 1.8365494523134376
Energy: 0.6200783557699533
Energy: 2.494748333545035
Energy: 0.6200783557669789
Energy: 2.056150867947904
Energy: 0.617492838065819
Energy: 2.4811882255021707
Energy: 0.6174928380521366
Energy: 1.623175722340261
Energy: 0.6167243456085618
Energy: 2.0421938388140006
Energy: 0.6167243456097516
Energy: 1.3900927561147673
Energy: 0.6130306319969379
Energy: 2.9197137492697816
Energy: 0.6130306319678155
Energy: 1.6405560349077832
Energy: 0.6151872980747989
Energy: 2.4751144085420123
Energy: 0.6151872980771784
Energy: 1.0831700550681302
Energy: 0.6151884099648401
Energy: 2.4744016481182025
Energy: 0.6151884099684093
Energy: 1.011152128517937
Energy: 1.1093115938745997
Energy: 3.128861632099029
Energy: 1.109311593867461
Energy: 1.0533217918141553
Energy: 0.6160065896397849
Energy: 2.721153785875669
Energy: 0.6160065896356207
Energy: 0.6126611907569431
Energy: 0.6160277023706424
Energy: 2.9026317082716013
Energy: 0.6160277023712374
Energy: 0.6154119900503434
Energy: 0.6143538122869451
Energy: 2.9239213062018714
Energy: 0.61435381228635
Energy: 0.6130364642633573
Energy: 0.6178749105483744
Energy: 2.708514553771566
Energy: 0.6178749105465898
Energy: 1.0126971450000852
Energy: 0.6155457686326846
Energy: 3.1148883605883557
Energy: 0.6155457686338744
Energy: 1.0141991030398543
Energy: 0.6138772693930917
Energy: 2.72049179748171
Energy: 0.613877269391307
Energy: 0.8607830365805392
Energy: 0.6154968349677007
Energy: 2.273137130841598
Energy: 0.6154968349653213
Energy: 1.6212207359311783
Energy: 0.6132003270238858
Energy: 3.1218612846328107
Energy: 0.6132003270244807
Energy: 1.6171356505326964
Energy: 0.6161437547111454
Energy: 2.700217759420749
Energy: 0.6161437547099556
Energy: 1.686139623422897
Energy: 0.6148393977213341
Energy: 2.843249738688041
Energy: 0.6148393977272829
Energy: 2.0553015294662194
Energy: 0.9066116008076786
Energy: 2.526185628189727
Energy: 0.906611600805299
Energy: 2.052573260054966
Energy: 1.1479120135611238
Energy: 2.2671759387992485
Energy: 1.1479120135617185
Energy: 2.4974202242757664
Energy: 0.6140985900799688
Energy: 1.8365314798730363
Energy: 0.6140985896114137
Energy: 2.065246068551432
Energy: 0.6147342896289473
Energy: 2.49195494896128
Energy: 0.6147342896158596
Energy: 2.489235130015611
Energy: 1.1468285770147246
Energy: 1.830463371175463
Energy: 1.14682857701413
Energy: 2.9172851399362685
Energy: 0.6183444545489145
Energy: 1.6711634912338351
Energy: 0.618344454510274
Energy: 2.6048027101913696
Energy: 0.6148816237657417
Energy: 1.4804727286178143
Energy: 0.6148816237645519
Energy: 2.9139904315846494
Energy: 0.6131063437810841
Energy: 1.6143320236223144
Energy: 0.6131063437822737
Energy: 2.9065495198744995
Energy: 0.6139361151950401
Energy: 1.6144086127169324
Energy: 0.6139361151944454
Energy: 2.5172245344963127
Energy: 0.614488430367647
Energy: 1.027237927077307
Energy: 0.6144884303694317
Energy: 2.924419840360765
Energy: 0.6138412252293066
Energy: 1.045420651407378
Energy: 0.6138412252744908
Energy: 2.8996582528817014
Energy: 0.6153363386615128
Energy: 1.010652017972917
Energy: 0.6153363386615128
Energy: 2.474245242784109
Energy: 0.6182773077269103
Energy: 0.6134190534665865
Energy: 0.6182773077257204
Energy: 2.9283115289632073
Energy: 0.6146509984467218
Energy: 0.6158684549236356
Energy: 0.6146509984449641
Energy: 2.718105547616486
Energy: 0.6163653716513479
Energy: 0.6130234223262384
Energy: 0.6163653716507529

minimum gb energy = 0.6126611907569431 eV
minimum distance =  2.32321340815904 Angstroms
sigma value = 113


========================================
theta = 90.0
========================================

Energy: 0.019799532959442284
Energy: 0.6054923133672733
Energy: 2.196028047737274
Energy: 0.0205553341449525
Energy: 1.641578387551929
Energy: 1.641578387551929
Energy: 3.5169152126512735
Energy: 3.5169152126512735
Energy: 0.021964571401672177
Energy: 0.021964571401672177
Energy: 3.5304139818149527
Energy: 3.5304139818149527
Energy: 0.02182847707802528
Energy: 0.1019167965234109
Energy: 1.6393816559847347
Energy: 0.10191642959850926
Energy: 1.6396980754618005
Energy: 1.6396980754618005
Energy: 3.530051979970107
Energy: 3.530051979970107
Energy: 0.025489817729952582
Energy: 0.025489817729952582
Energy: 3.521547376505629
Energy: 3.521547376505629

minimum gb energy = 0.019799532959442284 eV
minimum distance =  1.67191098543139 Angstroms
sigma value = 1