Model name: model_name=EAM_MagneticCubic_DudarevDerlet_2005_Fe__MO_135034229282_002
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=3.608116634190083
cohesive_energy=4.229961104259564
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
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: 0.016418197914202043
Energy: 0.016614916383915355
Energy: 1.6911912022695266
Energy: 0.016614916383915355
Energy: 0.016614916383915355
Energy: 1.5023490695859218
Energy: 0.016614916383915355
Energy: 1.5023490695852924
Energy: 1.6911912017273958
Energy: 0.016614916383915355
Energy: 0.016418197914202043
Energy: 0.016614916383915355
Energy: 0.016614916383915355
Energy: 1.5023490695852924
Energy: 0.016614916383915355
Energy: 1.5023490695852924

minimum gb energy = 0.016418197914202043 eV
minimum distance =  2.49988081115244 Angstroms
sigma value = 1


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

Energy: 1.4335176479599816
Energy: 1.274211432281657
Energy: 0.9736899866488326
Energy: 1.274211431458098
Energy: 0.9794779975987105
Energy: 1.146020069164771
Energy: 0.9697563959565695
Energy: 1.1460196493415309
Energy: 1.0585270390575976
Energy: 1.2379269412187393
Energy: 1.0058658242125398
Energy: 1.2379269417400585
Energy: 0.948004523780363
Energy: 1.1781130729769749
Energy: 1.004943030582917
Energy: 1.1781153520278738
Energy: 0.9764174302532059
Energy: 1.2948528130330645
Energy: 0.9798424646197398
Energy: 1.2948528126720282
Energy: 0.98317346631306
Energy: 1.490940260946844
Energy: 1.041933207884899
Energy: 1.4909371299001726
Energy: 1.0218015289023015
Energy: 1.239690155990492
Energy: 1.0312784679901645
Energy: 1.2396912868291419
Energy: 0.9787963427309461
Energy: 1.2756557472479724
Energy: 1.0271760931872338
Energy: 1.2756562989384188
Energy: 1.0215176358379865
Energy: 1.4217733245694633
Energy: 1.0009415432890953
Energy: 1.4429130288072787
Energy: 1.1419513525965272
Energy: 1.251703292014897
Energy: 0.9559137905439038
Energy: 1.2517032948954103
Energy: 1.0073898520024138
Energy: 1.1565514053507502
Energy: 1.0193907168511984
Energy: 1.1573371836299542
Energy: 0.9560283833140005
Energy: 1.2579494972979377
Energy: 1.109655960747226
Energy: 1.2579428636894445
Energy: 0.9733182432253376
Energy: 1.2616118167928405
Energy: 1.0182406061687364
Energy: 1.2616117895533987
Energy: 0.9934502379178579
Energy: 1.2551257663529534
Energy: 1.0421108032114756
Energy: 1.2551257617772853
Energy: 1.0369114659952963
Energy: 1.2876637517207883
Energy: 1.022495273289663
Energy: 1.2876637424007698
Energy: 1.0082137321984952
Energy: 1.2767942946247468
Energy: 1.0043929893119519
Energy: 1.2767942945331865
Energy: 0.9977237886574829
Energy: 1.2529351516182514
Energy: 0.9915501442100997
Energy: 1.2529351478493438
Energy: 0.9846081181410676
Energy: 1.125402475611726
Energy: 1.0085369995153686
Energy: 1.132048089174385
Energy: 0.9563092315743381
Energy: 1.2680775743914852
Energy: 1.1937096470440447
Energy: 1.2680775722780255
Energy: 0.9770147654463804
Energy: 1.4222161259319084
Energy: 1.0169201732524469
Energy: 1.4231755496742533
Energy: 1.1049359822140372
Energy: 1.2382022316381565
Energy: 0.9772737195667064
Energy: 1.2382022302001907
Energy: 1.0280891650930457
Energy: 1.027758215848909
Energy: 0.9557880423705073
Energy: 1.0152389179318828
Energy: 1.058615784707439
Energy: 1.2919383273752203
Energy: 1.015461778960459
Energy: 1.2919383273599485
Energy: 1.002030131895829
Energy: 1.258694392559462
Energy: 1.0416503511940676
Energy: 1.2586945317309657
Energy: 1.0414264370570414
Energy: 1.4832733958364295
Energy: 1.0117053607600988
Energy: 1.4832794744343474
Energy: 0.98270297248735
Energy: 1.2744742334420707
Energy: 0.984099711732679
Energy: 1.2744742139754892
Energy: 0.9598904079347758
Energy: 1.5027513484982042
Energy: 1.0239452042066206
Energy: 1.5027513442476839
Energy: 0.9431162205255036
Energy: 1.2556212508732534
Energy: 1.004530470026892
Energy: 1.2556212561739784
Energy: 0.9814949349314613
Energy: 1.1376919613926844
Energy: 0.9474678356830128
Energy: 1.1348931112902978
Energy: 1.0210678987897228
Energy: 1.2697704328179136
Energy: 0.9723243833291955
Energy: 1.2697704330163064
Energy: 0.9859455727494768
Energy: 1.2624072701116988
Energy: 0.9695911696276993
Energy: 1.2623980087886324
Energy: 1.0205146654497113
Energy: 1.2600695887892732
Energy: 0.9899353063248858
Energy: 1.2600695880138197
Energy: 0.9446711090502719
Energy: 1.2945421702404847
Energy: 1.0339102930986503
Energy: 1.2945426472001553

minimum gb energy = 0.9431162205255036 eV
minimum distance =  2.22655245244653 Angstroms
sigma value = 1


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

Energy: 1.5367267070220356
Energy: 1.3535311784589523
Energy: 1.0288251418062337
Energy: 1.353531182010404
Energy: 1.0824941436058277
Energy: 1.2310157292327033
Energy: 1.0188897828545287
Energy: 1.2309889730032897
Energy: 1.0210366800272794
Energy: 1.3561004926791602
Energy: 1.054661549488084
Energy: 1.3561012818519098
Energy: 1.0981889974642227
Energy: 1.2110665225455628
Energy: 1.0891356066700488
Energy: 1.218611418527983
Energy: 1.0994026023500054
Energy: 1.3356733001495518
Energy: 1.0649436656578308
Energy: 1.3356752446800007
Energy: 1.0439291693115798
Energy: 1.3342035800009733
Energy: 1.0914669525368488
Energy: 1.3342041468537378
Energy: 1.10904747855054
Energy: 1.3473363207666698
Energy: 1.053665345603831
Energy: 1.3966357439500845
Energy: 1.0183237459437877
Energy: 1.3633176783979881
Energy: 1.1247414928148134
Energy: 1.3633176788835957
Energy: 1.1095700957313934
Energy: 1.8825031051575924
Energy: 1.0574083011082311
Energy: 1.8825065480052332
Energy: 1.1305204199464893
Energy: 1.3816275043645088
Energy: 1.0147672055866601
Energy: 1.3816275050632991
Energy: 1.1089895012311362
Energy: 1.215235366116069
Energy: 1.0504434562182758
Energy: 1.2154398988592723
Energy: 1.0649031795166262
Energy: 1.3708457587024594
Energy: 1.0863339817992792
Energy: 1.3708448691675867
Energy: 1.0701902858546386
Energy: 1.34586473959419
Energy: 1.0963918697815167
Energy: 1.3458642962578533
Energy: 1.0696729753509353
Energy: 1.3423481511123678
Energy: 1.0577761410388413
Energy: 1.342347420315676
Energy: 1.059194459611694
Energy: 1.370542900883859
Energy: 1.081396915725307
Energy: 1.3705429072678692
Energy: 1.1318215715356517
Energy: 1.2208361814150535
Energy: 1.0270171519649793
Energy: 1.2208271614465076
Energy: 1.2422626603045692
Energy: 1.361726663262468
Energy: 1.0320918387157532
Energy: 1.3617284010536053
Energy: 1.1161186876205074
Energy: 1.5025672348911077
Energy: 1.065983646457019
Energy: 1.5093681443617133
Energy: 1.0154779957163438
Energy: 1.363461087683362
Energy: 1.0902673320909486
Energy: 1.3634610852101317
Energy: 1.1099295641488063
Energy: 1.4225825657628002
Energy: 1.0507641490447508
Energy: 1.4223905005776483
Energy: 1.0428835690372682
Energy: 1.335237835691001
Energy: 1.0835554889842924
Energy: 1.335237928340273
Energy: 1.0975726431341934
Energy: 1.3294400278709413
Energy: 1.0962713331618645
Energy: 1.3294378613738205
Energy: 1.1175830529794446
Energy: 1.2353011190068204
Energy: 1.0491501316893803
Energy: 1.2390943677373982
Energy: 1.0203520242818471
Energy: 1.35303136560543
Energy: 1.0942346901680369
Energy: 1.3461741988181541
Energy: 1.0826021699659518
Energy: 1.2588325320334133
Energy: 1.0306737460841449
Energy: 1.2588322722473384
Energy: 1.5367267070185533
Energy: 1.3535311829249892
Energy: 1.0953794626728353
Energy: 1.3535311825447265
Energy: 1.0824936972933201
Energy: 1.2330186963750092
Energy: 1.0188901981815954
Energy: 1.230639360752735
Energy: 1.021036680912303
Energy: 1.3592606413572057
Energy: 1.106269172168197
Energy: 1.3592503394765088
Energy: 1.0981886264964098
Energy: 1.2067768071845868
Energy: 1.0891355769881617
Energy: 1.2173238650538871

minimum gb energy = 1.0147672055866601 eV
minimum distance =  2.2278308945999 Angstroms
sigma value = 25


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

Energy: 1.3820982127370978
Energy: 1.4347089987582338
Energy: 1.1193836474883039
Energy: 1.4347090992115241
Energy: 1.170934349542901
Energy: 1.277211005838629
Energy: 1.1986241363343246
Energy: 1.2772401267642641
Energy: 1.0744054294752219
Energy: 1.4916974491059645
Energy: 1.221312942116018
Energy: 1.491740735061
Energy: 1.1803115716969899
Energy: 1.5073078469983068
Energy: 1.1724538894732073
Energy: 1.507307847532452
Energy: 1.115953353942668
Energy: 1.4417351230173738
Energy: 1.163512215616336
Energy: 1.4417350696349445
Energy: 1.242120455591981
Energy: 1.4898002152024297
Energy: 1.2270205165519328
Energy: 1.4898154982883143
Energy: 1.2198664984843668
Energy: 1.644306614199608
Energy: 1.2191066925860403
Energy: 1.644306614353397
Energy: 1.027385604045906
Energy: 1.447031713669357
Energy: 1.1273145111445473
Energy: 1.44703171366126
Energy: 1.2460365592452205
Energy: 1.3009195926974246
Energy: 1.154443582843837
Energy: 1.3014809734819115
Energy: 1.2315849686784024
Energy: 1.5281770332154743
Energy: 1.1461122868188671
Energy: 1.5281770332195224
Energy: 1.1905477325139457
Energy: 1.4434538464128615
Energy: 1.1274990071501454
Energy: 1.4434538580627045
Energy: 1.139736464049017
Energy: 1.4602499071563717
Energy: 1.1216443124512492
Energy: 1.4602499071847097
Energy: 1.205756458600355
Energy: 1.5370034475971988
Energy: 1.1417514211032462
Energy: 1.537003447584042
Energy: 1.186635969620375
Energy: 1.3064955910151057
Energy: 1.2135047466790208
Energy: 1.3220509224705839
Energy: 1.1388787973409642
Energy: 1.4444108697654199
Energy: 1.1176590012061052
Energy: 1.444410872183218
Energy: 1.1680836767756824
Energy: 1.661959287000143
Energy: 1.1481610270541693
Energy: 1.648576364598509
Energy: 1.0979864516353297
Energy: 1.4800895658008943
Energy: 1.0821498032481107
Energy: 1.480088993322606
Energy: 1.1507553824563241
Energy: 1.320195942008652
Energy: 1.1984521428635024
Energy: 1.3210377657693195
Energy: 1.1577741452244907
Energy: 1.477179519926226
Energy: 1.1164737921010086
Energy: 1.4771795192514487
Energy: 1.2247028293111353
Energy: 1.4862625317090894
Energy: 1.1968589762814776
Energy: 1.4862625238588931
Energy: 1.2121547035485893
Energy: 1.4295742997177248
Energy: 1.2106082403525629
Energy: 1.4295685710695925
Energy: 1.3563020259151937
Energy: 1.4367313496450358
Energy: 1.2105298733225112
Energy: 1.4366817665736922
Energy: 1.1682130834876505
Energy: 1.441264486555609
Energy: 1.1201840234594493
Energy: 1.4301268921454222
Energy: 1.1010194008282777
Energy: 1.5288022728230022
Energy: 1.3516927990095895
Energy: 1.528802272432526
Energy: 1.2014647027690126
Energy: 1.3362684246483694
Energy: 1.1813512603606464
Energy: 1.336260201808871

minimum gb energy = 1.027385604045906 eV
minimum distance =  2.23070750002963 Angstroms
sigma value = 9


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

Energy: 1.511963793738307
Energy: 1.567226376631741
Energy: 1.1844623799556364
Energy: 1.567218842217147
Energy: 1.3025027898238721
Energy: 1.4443773161079834
Energy: 1.3148130239957594
Energy: 1.4443763780408934
Energy: 1.1808944766453622
Energy: 1.5978795294944117
Energy: 1.360622003895943
Energy: 1.5978795332620255
Energy: 1.3796918500062907
Energy: 1.599718434263916
Energy: 1.297459391322229
Energy: 1.6003466910389244
Energy: 1.4279739378463792
Energy: 1.4338631528129313
Energy: 1.3151135960496452
Energy: 1.4344765318318362
Energy: 1.1729908734022934
Energy: 1.533324206585778
Energy: 1.2183210630370203
Energy: 1.533323556931849
Energy: 1.3876767429216905
Energy: 1.4525040885587215
Energy: 1.1883920467176494
Energy: 1.4525038326843935
Energy: 1.1859702024103569
Energy: 1.5960868539808308
Energy: 1.2057178377317932
Energy: 1.59608685242288
Energy: 1.400172028074052
Energy: 1.437471753591609
Energy: 1.3410449588877047
Energy: 1.437878020949623
Energy: 1.3763171702713897
Energy: 1.5629696628171126
Energy: 1.2547613767933379
Energy: 1.5629696623223261
Energy: 1.2939719254210866
Energy: 1.5388325580387296
Energy: 1.3158215345355284
Energy: 1.5388322356941342
Energy: 1.379986785806172
Energy: 1.5302980845239795
Energy: 1.253554223536031
Energy: 1.4286126744255108
Energy: 1.160572057670478
Energy: 1.5769750501586521
Energy: 1.198290447511765
Energy: 1.5769750452361442
Energy: 1.2620293543215353
Energy: 1.3954967921455956
Energy: 1.2200187612679823
Energy: 1.431627966816437
Energy: 1.1544652088585743
Energy: 1.5766635963872806
Energy: 1.232492249777705
Energy: 1.5766075710949317
Energy: 1.3948400039938302
Energy: 1.4393251300765928
Energy: 1.2917986763036358
Energy: 1.4394903612856464
Energy: 1.2925651105830236
Energy: 1.536733119882114
Energy: 1.2590024617847628
Energy: 1.5364155638179087
Energy: 1.3497674329600857
Energy: 1.5659898386246667
Energy: 1.2519024786101218
Energy: 1.5659891694495944
Energy: 1.4004440749818046
Energy: 1.4448740672725506
Energy: 1.2859547245472558
Energy: 1.4365010293056182
Energy: 1.1930402015300783
Energy: 1.5745084471491222
Energy: 1.2107704504498535
Energy: 1.574508447217913
Energy: 1.3684739498908576
Energy: 1.2337891682063669
Energy: 1.1859291686715354
Energy: 1.254715019507368

minimum gb energy = 1.1544652088585743 eV
minimum distance =  2.24700454259784 Angstroms
sigma value = 25


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

Energy: 1.3260314945790865
Energy: 1.6860941108544427
Energy: 1.3100816554933135
Energy: 1.6860940963987006
Energy: 1.4311140212948652
Energy: 1.7227982350940287
Energy: 1.329086244069269
Energy: 1.7227982348328381
Energy: 1.2781040563745172
Energy: 1.7429163853073308
Energy: 1.307863880174994
Energy: 1.742916384819291
Energy: 1.411217254419234
Energy: 1.7909296522501448
Energy: 1.4714692754318714
Energy: 1.7909296522501448
Energy: 1.2808615223998119
Energy: 1.3613725751689845
Energy: 1.34949203058323
Energy: 1.36140224949768
Energy: 1.272597468087344
Energy: 1.795637405925709
Energy: 1.2931715788348654
Energy: 1.795637405924216
Energy: 1.320578295795394
Energy: 1.5018602129486511
Energy: 1.2840352819569396
Energy: 1.501879037425899
Energy: 1.4279811329479295
Energy: 1.7506564263411206
Energy: 1.347914573156202
Energy: 1.7506564263157378
Energy: 1.2831573901764632
Energy: 1.6403809384713532
Energy: 1.4190920647260392
Energy: 1.6403809384713532
Energy: 1.5754668243341023
Energy: 1.593766303633383
Energy: 1.2810940190946876
Energy: 1.5950594799724096
Energy: 1.3223446135707948
Energy: 1.6647671984310985
Energy: 1.2541381924754473
Energy: 1.6647671980848353
Energy: 1.2881857998048385
Energy: 1.9724310035166928
Energy: 1.4212498214941016
Energy: 1.9724310040375466
Energy: 1.3232278630099887
Energy: 1.7648263327036058
Energy: 1.281500347923933
Energy: 1.7648263323857114
Energy: 1.4118430513589866
Energy: 1.6725667602973833
Energy: 1.3313974582431314
Energy: 1.6725667602988763
Energy: 1.4434970771232503
Energy: 1.671082071752676
Energy: 1.2637086479231008
Energy: 1.6710820717377788
Energy: 1.4039207068076334
Energy: 1.745692983654627
Energy: 1.2503193870015978
Energy: 1.745692983624765
Energy: 1.2787626630676316
Energy: 1.456688213820817
Energy: 1.5708972139219994
Energy: 1.4566882121045002

minimum gb energy = 1.2503193870015978 eV
minimum distance =  2.23165154459955 Angstroms
sigma value = 17


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

Energy: 1.5409092804295061
Energy: 1.6604057344403105
Energy: 1.3879467711035423
Energy: 1.6604129097359006
Energy: 1.3746200460554172
Energy: 1.4070844408244345
Energy: 1.2889865243975305
Energy: 1.4108267570403323
Energy: 1.2903392436702514
Energy: 1.7338158400668455
Energy: 1.3941112039378045
Energy: 1.7338158418629803
Energy: 1.3223558307673255
Energy: 1.6242976074475803
Energy: 1.444177375951588
Energy: 1.6152199531410976
Energy: 1.3598929135280067
Energy: 1.6002360821072623
Energy: 1.3294342563350232
Energy: 1.60018932845708
Energy: 1.357922727520304
Energy: 1.6661278485197621
Energy: 1.3077859556672202
Energy: 1.6631496716616292
Energy: 1.366802687727582
Energy: 1.5129179993081823
Energy: 1.4268133853934977
Energy: 1.5129120043556474
Energy: 1.2539897251996102
Energy: 1.727401139221395
Energy: 1.344590994631868
Energy: 1.7257027146582267
Energy: 1.3466227475734815
Energy: 1.8339459779511862
Energy: 1.4292313703620692
Energy: 1.8339459780078042
Energy: 1.4160782757095385
Energy: 1.5699293732682382
Energy: 1.371305557522308
Energy: 1.5699250345980553
Energy: 1.3038689055722403
Energy: 1.711387042119561
Energy: 1.2927228715524617
Energy: 1.7113872570136315
Energy: 1.401853198988383
Energy: 1.532160234954903
Energy: 1.471507907701292
Energy: 1.5320781541391846
Energy: 1.4220773251924064
Energy: 1.6414465972316805
Energy: 1.4329671380666245
Energy: 1.6277058795592354
Energy: 1.3189221033203884
Energy: 1.7481051710081872
Energy: 1.5773603291499139
Energy: 1.7480933492957633
Energy: 1.510728266296604
Energy: 1.561236011921943
Energy: 1.3185651971208878
Energy: 1.5612359753541563
Energy: 1.299343330501126
Energy: 1.8418053004327837
Energy: 1.2677919654577865
Energy: 1.8418053007523125
Energy: 1.3685739226818772
Energy: 1.5608046213931932
Energy: 1.3837554803455203
Energy: 1.5608042060799094
Energy: 1.360318433834013
Energy: 1.6435362672484743
Energy: 1.3382211349393927
Energy: 1.6435369518481644
Energy: 1.3658856100872199
Energy: 1.6771250337354893
Energy: 1.4685780106223663
Energy: 1.6771250337244963
Energy: 1.3846762230003857
Energy: 1.6926925035913825
Energy: 1.2939642161764897
Energy: 1.6926921803133492
Energy: 1.4239372910670915
Energy: 1.714123840983112
Energy: 1.2863494132594944
Energy: 1.7141238965418644
Energy: 1.3551288551061087
Energy: 1.5333096543663225
Energy: 1.3978749089580982
Energy: 1.5039312247613963
Energy: 1.430500688270885
Energy: 1.7324761487176483
Energy: 1.300421383381985
Energy: 1.7324761511207072
Energy: 1.3880001369446897
Energy: 1.6301397743569443
Energy: 1.281804087568998
Energy: 1.6301397760043268
Energy: 1.4145625474185661
Energy: 1.684503978026224
Energy: 1.2835237347334292
Energy: 1.6844983189230507
Energy: 1.4102835265888554
Energy: 1.7351948948921316
Energy: 1.316088835069583
Energy: 1.7322573484683557
Energy: 1.3482327307249315
Energy: 1.6500154883472642
Energy: 1.4653779252163666
Energy: 1.6500156204031593
Energy: 1.2705979119074113
Energy: 1.6452626805571655
Energy: 1.28766552442263
Energy: 1.6428577716842285
Energy: 1.4572628275524788
Energy: 1.600884200104494
Energy: 1.2855136497678061
Energy: 1.6008825378183573
Energy: 1.4152023988354765
Energy: 1.6398406448902572
Energy: 1.367068626096515
Energy: 1.6398374947924312

minimum gb energy = 1.2539897251996102 eV
minimum distance =  2.2253922852444 Angstroms
sigma value = 53


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

Energy: 1.268630948950055
Energy: 1.4122261411287993
Energy: 1.4856491304574395
Energy: 1.4122261410704406
Energy: 1.6606280229088806
Energy: 1.3708298158316312
Energy: 1.3525717730509779
Energy: 1.3708298587425745
Energy: 1.2748817343671996
Energy: 1.6986660070692583
Energy: 1.4775932848058635
Energy: 1.6986662825851255
Energy: 1.2678999964388913
Energy: 1.8182746055896528
Energy: 1.4459697770589395
Energy: 1.818274605595493
Energy: 1.6806259672514883
Energy: 1.446328043949479
Energy: 1.273235539703274
Energy: 1.4463280462709054
Energy: 1.268630949068763
Energy: 1.4122261412864427
Energy: 1.2676208216145906
Energy: 1.4122261411872021
Energy: 1.660628022910827
Energy: 1.370831315304023
Energy: 1.4433232451281883
Energy: 1.3708336561906476
Energy: 1.2748817465037612
Energy: 1.6986672333569428
Energy: 1.4775932847163569
Energy: 1.6986664133514373
Energy: 1.267900004444334
Energy: 1.8182746055877061
Energy: 1.5012929905735406
Energy: 1.8182746055915995
Energy: 1.6806259672514883
Energy: 1.4463280439864237
Energy: 1.346266660875047
Energy: 1.4463280452726583
Energy: 1.2686309486406524
Energy: 1.412226141494658
Energy: 1.2633966698596297
Energy: 1.4122261415219126
Energy: 1.6606280229069337
Energy: 1.3708319737143255
Energy: 1.4433232463988492
Energy: 1.37082941688158
Energy: 1.274881733857369
Energy: 1.6986666014575675
Energy: 1.4775932847533009
Energy: 1.6986665503271265

minimum gb energy = 1.2633966698596297 eV
minimum distance =  2.22427847971123 Angstroms
sigma value = 9


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

Energy: 1.4931489871635661
Energy: 1.8181115479464485
Energy: 1.4963888241029755
Energy: 1.8181117304345589
Energy: 1.3786436804391111
Energy: 1.4196160273475176
Energy: 1.3692469826923976
Energy: 1.4175819561775918
Energy: 1.3147191775289058
Energy: 1.6769255307195257
Energy: 1.2933705720843245
Energy: 1.679534607988307
Energy: 1.2915106916898
Energy: 1.766308161309217
Energy: 1.3159114938622631
Energy: 1.766308007867867
Energy: 1.4263630178113662
Energy: 1.5039660762804998
Energy: 1.329913587558781
Energy: 1.5039614022804255
Energy: 1.5129444775077505
Energy: 1.587715433070646
Energy: 1.2952500566435545
Energy: 1.5877154326817566
Energy: 1.503915988607352
Energy: 1.4467494758995985
Energy: 1.3328568158603233
Energy: 1.438665306383822
Energy: 1.3240154345393464
Energy: 1.7140448098013876
Energy: 1.3537619911940153
Energy: 1.7140467963353199
Energy: 1.3189045783162399
Energy: 1.7521894545024395
Energy: 1.4424724847814716
Energy: 1.752189440761554
Energy: 1.3926473008287896
Energy: 1.4349961720878013
Energy: 1.3640297284690768
Energy: 1.4445215993598393
Energy: 1.3721600169898842
Energy: 1.7471107788757494
Energy: 1.3556249059568855
Energy: 1.7471107942133275
Energy: 1.3597464458895687
Energy: 1.7696282866137827
Energy: 1.2836191814935802
Energy: 1.7696224017862163
Energy: 1.3359204256904316
Energy: 1.6645293700245327
Energy: 1.3467152975719467
Energy: 1.6645293706122226
Energy: 1.3995680458914133
Energy: 1.7506757538140147
Energy: 1.4279885345255054
Energy: 1.7506757610254642
Energy: 1.354532084685034
Energy: 1.5277831471352754
Energy: 1.4198272156631078
Energy: 1.5297853696719284
Energy: 1.3472727964023117
Energy: 1.7640146066529074
Energy: 1.294112678483932
Energy: 1.7640146011246138
Energy: 1.3098277413406472
Energy: 1.656616459487864
Energy: 1.3681040301341572
Energy: 1.6566164410864646
Energy: 1.3660129556509515
Energy: 1.4931132279771164
Energy: 1.4688511959233244
Energy: 1.499539715903761
Energy: 1.3630964288048397
Energy: 1.7118820129362085
Energy: 1.470896757055181
Energy: 1.7118819972312915
Energy: 1.339361800459317
Energy: 1.5875651004746067
Energy: 1.399483006723924
Energy: 1.5875650997839466
Energy: 1.3663759137489808
Energy: 1.7641523465536462
Energy: 1.3008970944797769
Energy: 1.7641523467221847
Energy: 1.395652179686113
Energy: 1.5824554893796547
Energy: 1.303284654269892
Energy: 1.581949977767204
Energy: 1.4387545520754934
Energy: 1.5791139332389614
Energy: 1.3041691088926326
Energy: 1.5791138594102614
Energy: 1.4119776432985756
Energy: 1.759323078108207
Energy: 1.3460134485813695
Energy: 1.7555343714559581
Energy: 1.352056768993128
Energy: 1.7100767272503368
Energy: 1.4451251113513914
Energy: 1.6944037566796573
Energy: 1.309102885489682
Energy: 1.6301485417184214
Energy: 1.327042270154615
Energy: 1.6301487820717104
Energy: 1.4708139982531163
Energy: 1.6251594241721907
Energy: 1.287851982099686
Energy: 1.6255689306634444
Energy: 1.4722458817467898
Energy: 1.5719110308903368
Energy: 1.2845213309293337
Energy: 1.5708631714766317
Energy: 1.2812307885443819
Energy: 1.5622915935820787
Energy: 1.329906774830005
Energy: 1.5622310737228169
Energy: 1.3425797667290893
Energy: 1.7239352190937145
Energy: 1.4894550880028912
Energy: 1.7239574222889662
Energy: 1.3670875694128939
Energy: 1.7646406466611
Energy: 1.3560923355915875
Energy: 1.7646406465537412
Energy: 1.388409471223622
Energy: 1.5593627458861266
Energy: 1.338433170125536
Energy: 1.5594076251429985
Energy: 1.3488068477707549
Energy: 1.623273620382252
Energy: 1.302674485364861
Energy: 1.6232736436867874
Energy: 1.3206179806511429
Energy: 1.7345423504541773
Energy: 1.301897048087186
Energy: 1.7345422983801544
Energy: 1.2966542404333539
Energy: 1.730475106378989
Energy: 1.468278835085022
Energy: 1.7304622185980827

minimum gb energy = 1.2812307885443819 eV
minimum distance =  2.19852062196039 Angstroms
sigma value = 73


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

Energy: 1.5501603056874578
Energy: 1.7416551087905296
Energy: 1.3115685134460437
Energy: 1.7416551088133674
Energy: 1.5648596424034824
Energy: 1.6893708429102043
Energy: 1.402348177116676
Energy: 1.6893457277277857
Energy: 1.299708049938614
Energy: 1.7386709141567918
Energy: 1.3168495547434567
Energy: 1.7386707928954093
Energy: 1.2820063433484679
Energy: 1.6735876242721666
Energy: 1.362048892688036
Energy: 1.6735876407597619
Energy: 1.3154976472009392
Energy: 1.547944779556392
Energy: 1.3188145646005327
Energy: 1.5479447649450644
Energy: 1.3438882730986201
Energy: 1.7339891191113936
Energy: 1.294727863702243
Energy: 1.7340304411942653
Energy: 1.502496010989702
Energy: 1.5262903674418151
Energy: 1.3275191039986705
Energy: 1.5289925817487007
Energy: 1.3106893722342605
Energy: 1.6159444709961168
Energy: 1.4275398879551384
Energy: 1.6159444742835865
Energy: 1.4300010317799907
Energy: 1.5939049261038607
Energy: 1.4505024505638053
Energy: 1.5939051271110862
Energy: 1.3565705186873933
Energy: 1.4832227297192024
Energy: 1.3642198831124608
Energy: 1.4832123495399878
Energy: 1.3127056509715054
Energy: 1.6678491602538212
Energy: 1.314515814487969
Energy: 1.66784916271285
Energy: 1.3975697151393813
Energy: 1.718310033346329
Energy: 1.263970889088857
Energy: 1.7183100303033956
Energy: 1.3529280010446751
Energy: 1.5542150480972081
Energy: 1.5683385369403293
Energy: 1.5542273269281164
Energy: 1.3412738376266378
Energy: 1.650509505844162
Energy: 1.3473729823862757
Energy: 1.6110207914060013
Energy: 1.3514205427927584
Energy: 1.6542228325382262
Energy: 1.4615080311816246
Energy: 1.6542231940770151
Energy: 1.4027105498629286
Energy: 1.7555396357737576
Energy: 1.3168638039823055
Energy: 1.7555395177107025
Energy: 1.4503624732285294
Energy: 1.7251656739863366
Energy: 1.2981413123213539
Energy: 1.7251635389342743
Energy: 1.5465671736740372
Energy: 1.6602214028503297
Energy: 1.3058221188725754
Energy: 1.660221283310964
Energy: 1.329370366845525
Energy: 1.5634901133967285
Energy: 1.3161478714875547
Energy: 1.5634901140012103
Energy: 1.3879028819629733
Energy: 1.8144772248133645
Energy: 1.5781328547716202
Energy: 1.7426526668665256
Energy: 1.3657871709792662
Energy: 1.686784308942799
Energy: 1.3503801373318125
Energy: 1.6900211213593423
Energy: 1.3480570101868032
Energy: 1.6556116168444757
Energy: 1.4951612200423368
Energy: 1.6556116121846727

minimum gb energy = 1.263970889088857 eV
minimum distance =  2.23593551288097 Angstroms
sigma value = 7


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

Energy: 1.5930745271456925
Energy: 1.67351551489781
Energy: 1.4855455716492507
Energy: 1.6735152363399257
Energy: 1.4220769682474634
Energy: 1.6431185401359134
Energy: 1.386860979660585
Energy: 1.6431173239181116
Energy: 1.3397542728929053
Energy: 1.6964247700487005
Energy: 1.315380678129228
Energy: 1.6991362699395696
Energy: 1.2680693593504944
Energy: 1.7464732981262037
Energy: 1.3860651653316745
Energy: 1.7464732980930981
Energy: 1.2885242873802585
Energy: 1.5425098119648353
Energy: 1.4185146529637445
Energy: 1.5425098105968877
Energy: 1.3936175889615163
Energy: 1.6442043051471993
Energy: 1.3304367244463822
Energy: 1.644201661678247
Energy: 1.4129092815695297
Energy: 1.6822633916664924
Energy: 1.277074029089003
Energy: 1.682085714418059
Energy: 1.39488014043863
Energy: 1.6004994756316755
Energy: 1.5154926788851244
Energy: 1.6005068838908492
Energy: 1.402427057183551
Energy: 1.8603409725484013
Energy: 1.4128869012465801
Energy: 1.8603409777397302
Energy: 1.2882209287320976
Energy: 1.6051695500109915
Energy: 1.4342517280815612
Energy: 1.605151701169492
Energy: 1.26890811544772
Energy: 1.7830221852129833
Energy: 1.3393459829732064
Energy: 1.7830221841585652
Energy: 1.334020804509211
Energy: 1.599516711224824
Energy: 1.313684488047536
Energy: 1.5999136053544512
Energy: 1.4972004441181566
Energy: 1.5958686330990997
Energy: 1.2880299184695272
Energy: 1.5958809078607292
Energy: 1.3003154220743722
Energy: 1.6665488118081588
Energy: 1.2935544397890695
Energy: 1.666548812727656
Energy: 1.3690533503563802
Energy: 1.5579153530697736
Energy: 1.5044903623966903
Energy: 1.5579152480908167
Energy: 1.4237822920546543
Energy: 1.6539544825542578
Energy: 1.441800785163984
Energy: 1.6340027769194152
Energy: 1.3258379873153991
Energy: 1.4984581354759814
Energy: 1.3799837512659172
Energy: 1.4984559820612997
Energy: 1.300698903932652
Energy: 1.7128995525828
Energy: 1.2815269327571954
Energy: 1.7127584417612844
Energy: 1.408215689811471
Energy: 1.6345760414305446
Energy: 1.279588984678975
Energy: 1.6369131917064146
Energy: 1.3495431300048557
Energy: 1.6015306721691402
Energy: 1.2955802807698855
Energy: 1.6015314204627755
Energy: 1.2685643393903394
Energy: 1.819643030474733
Energy: 1.4243723822008678
Energy: 1.818591397497785
Energy: 1.348104332098439
Energy: 1.5935185210765892
Energy: 1.3363922100566332
Energy: 1.5910743287867781
Energy: 1.4749594973396245
Energy: 1.6708823078124901
Energy: 1.32916808395006
Energy: 1.6706784825392424
Energy: 1.5512704649898006
Energy: 1.6548149312066462
Energy: 1.4019798929553098
Energy: 1.654854717052602
Energy: 1.4109611678648637
Energy: 1.5085224453151216
Energy: 1.4108180233428376
Energy: 1.5085026464284765
Energy: 1.2883864311575437
Energy: 1.704174148851492
Energy: 1.2978204319762705
Energy: 1.704174893739405
Energy: 1.3061702509993447
Energy: 1.6300983708403614
Energy: 1.2992408097007504
Energy: 1.6395293223574794
Energy: 1.3092999453689835
Energy: 1.4026751598316898
Energy: 1.5330705247036855
Energy: 1.4104211727494682
Energy: 1.3894727963201283
Energy: 1.6926535959412985
Energy: 1.3052608112228152
Energy: 1.6926535968987881
Energy: 1.459087869500121
Energy: 1.5888420377317065
Energy: 1.3986291006660132
Energy: 1.588860125575953
Energy: 1.3916619960407797
Energy: 1.7724706912313937
Energy: 1.3222931431803724
Energy: 1.7724706912281603

minimum gb energy = 1.2680693593504944 eV
minimum distance =  2.23685959131932 Angstroms
sigma value = 29


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

Energy: 1.4972047155823365
Energy: 1.7197113457986568
Energy: 1.358380523838196
Energy: 1.7197113442179486
Energy: 1.1681947887125443
Energy: 1.6122493023886486
Energy: 1.336796280580626
Energy: 1.6122493028000553
Energy: 1.144124999711129
Energy: 1.554859792087465
Energy: 1.5701881145790688
Energy: 1.554859791334544
Energy: 1.508550780161529
Energy: 1.654679942219877
Energy: 1.3357362556207277
Energy: 1.6754787051343856
Energy: 1.5050459872028055
Energy: 1.6555128771300647
Energy: 1.4144963261195431
Energy: 1.655510536235008
Energy: 1.1286085551851626
Energy: 1.5586751438862332
Energy: 1.129298126370477
Energy: 1.558675143847971
Energy: 1.1412932435284517
Energy: 1.6905959368429408
Energy: 1.5032019256946045
Energy: 1.6905959368401877
Energy: 1.3927868596356578
Energy: 1.6495973159192847
Energy: 1.5097746200663966
Energy: 1.6495919463645592
Energy: 1.5365969998871893
Energy: 1.5494628091277962
Energy: 1.2307496349872067
Energy: 1.5494628081473034

minimum gb energy = 1.1286085551851626 eV
minimum distance =  2.25464318790339 Angstroms
sigma value = 5


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

Energy: 1.40299444775577
Energy: 1.4626003908596164
Energy: 1.341625298045305
Energy: 1.4623840715646494
Energy: 1.4458980849531164
Energy: 1.7591538593444696
Energy: 1.176301284858295
Energy: 1.759498758490886
Energy: 1.2747601997475988
Energy: 1.4070098388476908
Energy: 1.4698435483007206
Energy: 1.4060291581422497
Energy: 1.1450717209842882
Energy: 1.4219778447339202
Energy: 1.2144304352175999
Energy: 1.4219728896909016
Energy: 1.249897108969339
Energy: 1.3416025826315263
Energy: 1.4815390550061092
Energy: 1.34223308154015
Energy: 1.202513100600714
Energy: 1.3358135491775431
Energy: 1.1891999212977171
Energy: 1.3380222791118495
Energy: 1.1904475729671475
Energy: 1.3899704622673952
Energy: 1.148977325213908
Energy: 1.3899704497685104
Energy: 1.238396742840606
Energy: 1.517433136541694
Energy: 1.165219369588265
Energy: 1.5174330965400702
Energy: 1.2498229607185891
Energy: 1.6071699758202715
Energy: 1.1208220984345332
Energy: 1.607163892783367
Energy: 1.2455139097462482
Energy: 1.3218946913220422
Energy: 1.115151174966046
Energy: 1.326393950176642
Energy: 1.178435633290513
Energy: 1.5697023626151532
Energy: 1.2177590030517218
Energy: 1.5697018887611138
Energy: 1.1832582415313508
Energy: 1.6088059533778316
Energy: 1.1723206705372748
Energy: 1.6088067522815266
Energy: 1.193607021857641
Energy: 1.3883252337156196
Energy: 1.3027211397412743
Energy: 1.3804887384048035
Energy: 1.2095200675821354
Energy: 1.5623332018913287
Energy: 1.5463554177796817
Energy: 1.570785239913033
Energy: 1.3963358191853592
Energy: 1.7996719824141763
Energy: 1.1866489049100812
Energy: 1.799670391356931
Energy: 1.2517471726267049
Energy: 1.2763873829783912
Energy: 1.345908259510057
Energy: 1.2742914314606404
Energy: 1.4650655164391073
Energy: 1.5984494860621379
Energy: 1.1724199152951824
Energy: 1.5984493282545533
Energy: 1.2976629531370854
Energy: 1.3771400012602608
Energy: 1.285335965400995
Energy: 1.3953918875030191
Energy: 1.1849509669274279
Energy: 1.3091133610124457
Energy: 1.1892913691332885
Energy: 1.3092379587305318
Energy: 1.149046415239476
Energy: 1.5904475996419642
Energy: 1.147347970668042
Energy: 1.5772888094117485
Energy: 1.1660258086030888
Energy: 1.5185845983807804
Energy: 1.2416537798120606
Energy: 1.5251644312858588
Energy: 1.258604499457761
Energy: 1.369746241675251
Energy: 1.21004380085382
Energy: 1.3697840988471972
Energy: 1.2115268382848912
Energy: 1.566970629558995
Energy: 1.1514462363973195
Energy: 1.5665675890223267
Energy: 1.2295204617767097
Energy: 1.6205252255795768
Energy: 1.2272163253782942
Energy: 1.601676863732279
Energy: 1.3058642104751288
Energy: 1.3443545194164783
Energy: 1.1687776070852862
Energy: 1.3444139951429357
Energy: 1.2166397323331641
Energy: 1.6358627827301422
Energy: 1.2429542495275647
Energy: 1.6358627912990729
Energy: 1.165362443780831
Energy: 1.5144843927867526
Energy: 1.206683339578116
Energy: 1.5030464875989777
Energy: 1.1701300602665496
Energy: 1.8075996556903446
Energy: 1.3787903483662591
Energy: 1.8075996556964533
Energy: 1.1884721917233716
Energy: 1.866604909911953
Energy: 1.555262123096693
Energy: 1.8666048937960442
Energy: 1.3468002081707655
Energy: 1.3873263674492997
Energy: 1.2437882122287105
Energy: 1.3752041503570382
Energy: 1.1904567339739875
Energy: 1.2976132260612285
Energy: 1.3372320402763078
Energy: 1.2976133950984143
Energy: 1.4007474323838938
Energy: 1.563315607233938
Energy: 1.1817594599016366
Energy: 1.5585553246604384
Energy: 1.2173364345931954
Energy: 1.529136105521869
Energy: 1.1778632525647654
Energy: 1.5249629885318383

minimum gb energy = 1.115151174966046 eV
minimum distance =  2.20706149047576 Angstroms
sigma value = 1


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

Energy: 1.4782080697849547
Energy: 1.5641115223532247
Energy: 1.313166375809409
Energy: 1.5641115337621792
Energy: 1.313784110625946
Energy: 1.6919236897966248
Energy: 1.1192947563295472
Energy: 1.6911562622906204
Energy: 1.1800176041086465
Energy: 1.3979677365421432
Energy: 1.3422675248917733
Energy: 1.397967877845194
Energy: 1.1432358736047756
Energy: 1.4009638689099624
Energy: 1.1631953426635142
Energy: 1.4012752781261963
Energy: 1.0873182462903355
Energy: 1.3341708071464518
Energy: 1.453661040729417
Energy: 1.334500414036878
Energy: 1.1103088511185126
Energy: 1.5572604797910437
Energy: 1.2177455573079659
Energy: 1.564183437568565
Energy: 1.134317879602943
Energy: 1.4902802526459775
Energy: 1.2420031673958276
Energy: 1.4902802526692047
Energy: 1.1275432214660814
Energy: 1.3806741988965177
Energy: 1.0912872125067563
Energy: 1.4488248380019522
Energy: 1.2073604354727017
Energy: 1.1518426570328077
Energy: 1.1006079081794329
Energy: 1.1553092298225995
Energy: 1.2076555413656254
Energy: 1.4892099538146575
Energy: 1.1477959340089205
Energy: 1.4892099534959558
Energy: 1.1360223215169982
Energy: 1.5322652015812777
Energy: 1.1797175821985881
Energy: 1.5318341432431617
Energy: 1.1240876827960555
Energy: 1.3327582930808166
Energy: 1.2537511735588114
Energy: 1.3350534020716938
Energy: 1.120716026266927
Energy: 1.5058157293379715
Energy: 1.2858892235274346
Energy: 1.569049570002263
Energy: 1.0995020666187132
Energy: 1.6809124038386105
Energy: 1.369086421566928
Energy: 1.680912403902965
Energy: 1.1883815289174249
Energy: 1.3562900243984735
Energy: 1.134861144560357
Energy: 1.3566039572689859
Energy: 1.148978426503242
Energy: 1.232230817861527
Energy: 1.401792010589644
Energy: 1.2273745584863642
Energy: 1.5556538859949571
Energy: 1.8200451526935368
Energy: 1.1824150740149795
Energy: 1.8200451525542218
Energy: 1.478208051733846
Energy: 1.5641114426877347
Energy: 1.4023095911393717
Energy: 1.5641114837995336
Energy: 1.3137841270867134
Energy: 1.7100787136711482
Energy: 1.1192947537461488
Energy: 1.7101186039170606
Energy: 1.180017602804278
Energy: 1.3979675145425852
Energy: 1.342278058820194
Energy: 1.3979675348499445
Energy: 1.143235991121095
Energy: 1.3992178095794843
Energy: 1.1629316158639902
Energy: 1.4008139203227579
Energy: 1.087318249018328
Energy: 1.3318173592285385
Energy: 1.4536894947259604
Energy: 1.3375270578948049
Energy: 1.110308851025652
Energy: 1.5642793641423494
Energy: 1.2177455588972992
Energy: 1.5643502972963386
Energy: 1.134317879691581
Energy: 1.490280253114552
Energy: 1.1435887231055644
Energy: 1.4902802531346118

minimum gb energy = 1.0873182462903355 eV
minimum distance =  2.24732131001656 Angstroms
sigma value = 17


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

Energy: 1.3294059577211081
Energy: 1.2929416033560865
Energy: 1.2694831417794465
Energy: 1.2914484102832202
Energy: 1.2943442157964613
Energy: 1.5685632538503125
Energy: 1.0956400165647886
Energy: 1.5685777401263128
Energy: 1.0910830053708218
Energy: 1.291311909170174
Energy: 1.5175823649407607
Energy: 1.1956358873405095
Energy: 1.1273956752366125
Energy: 1.3867346946494414
Energy: 1.0869053020322539
Energy: 1.3889872761427162
Energy: 1.0630956052098943
Energy: 1.601412173067876
Energy: 1.4712757830040535
Energy: 1.591315727755539
Energy: 1.1332512833079453
Energy: 1.6533980419799426
Energy: 1.108548880394195
Energy: 1.653390676459742
Energy: 1.0778660546486498
Energy: 1.2313377723479186
Energy: 1.0907912577920262
Energy: 1.2239267430413903
Energy: 1.0908978910430696
Energy: 1.4465864285654915
Energy: 1.041065106209908
Energy: 1.4467680648586436
Energy: 1.1339545190688443
Energy: 1.4475616967152045
Energy: 1.0959716992452255
Energy: 1.4475612458189264
Energy: 1.1304157803199133
Energy: 1.7183341324063135
Energy: 1.124405535783741
Energy: 1.7183341492563275
Energy: 1.081572150585598
Energy: 1.5885555517963765
Energy: 1.0872057606261252
Energy: 1.588556501218132
Energy: 1.076584843690805
Energy: 1.2850930414606794
Energy: 1.0952642041077438
Energy: 1.2851013014843817
Energy: 1.0556999240570668
Energy: 1.6806111122214977
Energy: 1.1188470960339765
Energy: 1.680611117996681
Energy: 1.0598842948862581
Energy: 1.2530154518030623
Energy: 1.15920086047882
Energy: 1.318176411747317
Energy: 1.085792118616317
Energy: 1.6343750672345791
Energy: 1.1583929836028128
Energy: 1.6343763726947063
Energy: 1.0778295413690393
Energy: 1.1804255808264834
Energy: 1.4686837121644198
Energy: 1.1717556202302652
Energy: 1.1037792063554328
Energy: 1.4404781732552752
Energy: 1.0744111242021788
Energy: 1.440492452651865
Energy: 1.2279208554041066
Energy: 1.3079173352193805
Energy: 1.0792242355243782
Energy: 1.3168551131205086
Energy: 1.4224171719736152
Energy: 1.7686873554230764
Energy: 1.0693042905937233
Energy: 1.7686873547375364
Energy: 1.2332068959478193
Energy: 1.2789310521168473
Energy: 1.2572589370804805
Energy: 1.2794126475673655
Energy: 1.2363904755769295
Energy: 1.5103375072704226
Energy: 1.077279229521675
Energy: 1.5103337024210013
Energy: 1.0799122962422627
Energy: 1.6787828277193
Energy: 1.4647865650301262
Energy: 1.6787828272216367
Energy: 1.255508142446196
Energy: 1.487034188374773
Energy: 1.2409564822663766
Energy: 1.4528314031777967
Energy: 1.0768879479193862
Energy: 1.572828874100588
Energy: 1.2910779704787472
Energy: 1.5800102895723283
Energy: 1.1145274407032915
Energy: 1.4182903931043194
Energy: 1.1269864515656318
Energy: 1.418291511540724
Energy: 1.0923256920053597
Energy: 1.3831877453651409
Energy: 1.0853081210902775
Energy: 1.3831877529913894
Energy: 1.3010265904935245
Energy: 1.4612480502154628
Energy: 1.1528905052297185
Energy: 1.4612585383239984
Energy: 1.157342244004253
Energy: 1.6371820357435034
Energy: 1.0831953126587475
Energy: 1.6371746832098861
Energy: 1.1581007412171025
Energy: 1.642019664936281
Energy: 1.066075393478293
Energy: 1.6420196652858732
Energy: 1.1001127279250955
Energy: 1.6220142322450601
Energy: 1.093249889939769
Energy: 1.6220142039686065
Energy: 1.0876221961291297
Energy: 1.4235418113233562
Energy: 1.0725177947412037
Energy: 1.4233136526530747
Energy: 1.0937695807986767
Energy: 1.5854140955368279
Energy: 1.0810753620799083
Energy: 1.5854140379540678
Energy: 1.1206081950613571
Energy: 1.7300074205625264
Energy: 1.3336424346741542
Energy: 1.7300074094478897
Energy: 1.1010864128244033
Energy: 1.4676932992066456
Energy: 1.0977907823844695
Energy: 1.467706840896867
Energy: 1.0939911202057504
Energy: 1.274756125464401
Energy: 1.141138211854448
Energy: 1.2124481443789161
Energy: 1.097794059655121
Energy: 1.4311837339547169
Energy: 1.0766591587264243
Energy: 1.4347934678363963
Energy: 1.134746877655172
Energy: 1.637380786043948
Energy: 1.1001793302798164
Energy: 1.6343098224507044
Energy: 1.2417257343972963
Energy: 1.7181474914440058
Energy: 1.0935810054015438
Energy: 1.7181474917140451

minimum gb energy = 1.041065106209908 eV
minimum distance =  2.21598313985273 Angstroms
sigma value = 89


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

Energy: 1.1412066313124023
Energy: 1.282710374443209
Energy: 1.2018627159959232
Energy: 1.282710374439794
Energy: 1.0035107447122789
Energy: 1.1087318813286806
Energy: 0.9675151221330383
Energy: 1.091634822872896
Energy: 0.9617158481304665
Energy: 1.6896559299190712
Energy: 1.7893983708229735
Energy: 1.6896559300266
Energy: 1.0328525042950618
Energy: 1.1117074048890658
Energy: 1.0624030548438337
Energy: 1.0268641780405459
Energy: 1.057362029008566
Energy: 1.065893891861063
Energy: 1.7119299497472007
Energy: 1.0608430846152093
Energy: 1.0637576190770746
Energy: 0.9719228760108999
Energy: 1.1553821616524556
Energy: 0.9949342962606252
Energy: 0.9626428500295017
Energy: 1.2534389870133325
Energy: 0.9874234504447005
Energy: 1.2534389834003459
Energy: 0.9590349598054423
Energy: 1.6815016538675447
Energy: 0.9660516788649202
Energy: 1.6815016539170597
Energy: 1.0775439699160063
Energy: 1.2708517741148417
Energy: 0.9829032576315864
Energy: 1.2708517755552866
Energy: 1.0399951872750166
Energy: 1.6261681987017813
Energy: 0.9837917737602485
Energy: 1.6261681986352305
Energy: 0.9631410325564901
Energy: 1.189757502003834
Energy: 1.0822422161153415
Energy: 1.189757754808859
Energy: 0.9800643933971837
Energy: 1.342020923868166
Energy: 1.1565578791607516
Energy: 1.342020923868166
Energy: 1.0748528074612032
Energy: 1.4212926498025642
Energy: 0.9737218734292014
Energy: 1.4212895751518686
Energy: 0.9838729607217245
Energy: 1.0746860740138926
Energy: 0.9808489525884526
Energy: 1.0824908235441646
Energy: 0.9292535314527393
Energy: 1.4794870992076468
Energy: 1.0655095969417139
Energy: 1.4794870993032234

minimum gb energy = 0.9292535314527393 eV
minimum distance =  2.21496414111583 Angstroms
sigma value = 13


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

Energy: 0.954157042091432
Energy: 1.5256142228806837
Energy: 1.18726096840113
Energy: 1.5256143359594982
Energy: 1.1393159068648528
Energy: 1.5160388619333198
Energy: 0.8906152620045791
Energy: 1.5160388858037632
Energy: 0.9154329012466109
Energy: 1.5163213392689487
Energy: 1.3905922888483468
Energy: 1.5163211836482078
Energy: 0.9785031364327252
Energy: 1.4519313459257912
Energy: 0.8830208406036713
Energy: 1.4507212289316793
Energy: 0.9223889509042522
Energy: 1.210908151952205
Energy: 1.3438557813160243
Energy: 1.2154221973384445
Energy: 0.9664553076926703
Energy: 1.422657510186744
Energy: 0.9070759727542671
Energy: 1.422657475481252
Energy: 0.9115030500806893
Energy: 1.6308023961046807
Energy: 1.5759286995035902
Energy: 1.6307863078150915
Energy: 0.972162395651448
Energy: 1.5108243257932505
Energy: 0.9132404920392445
Energy: 1.5108062907061526
Energy: 0.9216434649890278
Energy: 1.4631244688367027
Energy: 1.2578105790931557
Energy: 1.456798647628311
Energy: 1.1906211187638904
Energy: 1.47524570757677
Energy: 0.875981784965325
Energy: 1.4691399197821813
Energy: 0.9170975323968262
Energy: 1.2750874805608288
Energy: 0.9220923499351839
Energy: 1.2829783264824746
Energy: 1.6487550929038857
Energy: 1.5167306164038834
Energy: 0.8817758411383689
Energy: 1.4773499562622796
Energy: 1.0151390205000275
Energy: 1.4917798948683065
Energy: 0.9638657232419542
Energy: 1.4917784038238808
Energy: 1.5073639241354273
Energy: 1.2479669641477413
Energy: 0.8917299710984131
Energy: 1.2479718378960558
Energy: 0.9204524419712697
Energy: 1.4279496942687013
Energy: 0.9114245484835584
Energy: 1.4285864301597302
Energy: 0.9206679072591323
Energy: 1.2656461483805932
Energy: 0.8874248338425177
Energy: 1.2728007116181863
Energy: 0.9084511030144754
Energy: 1.5679890957882314
Energy: 0.8860824548532102
Energy: 1.5679890321098828
Energy: 0.8942045964872155
Energy: 1.446270054196096
Energy: 0.9856211273862743
Energy: 1.442142969097767
Energy: 0.9116064987235566
Energy: 1.4453240408643322
Energy: 0.9754944388188137
Energy: 1.445524424102501
Energy: 0.9119196566246349
Energy: 1.450531756559354
Energy: 0.9315603419422857
Energy: 1.4481129155642942
Energy: 0.9042538918669096
Energy: 1.467774108184607
Energy: 0.9764321103283938
Energy: 1.4682776768748063
Energy: 0.9065064566037118
Energy: 1.5625882242021245
Energy: 0.8903114099598113
Energy: 1.562588754392161
Energy: 0.906480440376324
Energy: 1.302929578979444
Energy: 0.8939980825175752
Energy: 1.262458540630731
Energy: 0.91995014556366
Energy: 1.4334245864212025
Energy: 0.9021029157337315
Energy: 1.432754465597881
Energy: 1.4053722556920452
Energy: 1.2692878804457413
Energy: 0.8812147448623208
Energy: 1.2692826731513958
Energy: 1.0057851208811173
Energy: 1.491915421183701
Energy: 0.909334204238053
Energy: 1.491913129662449
Energy: 1.3337415521504379
Energy: 1.2468699321144114
Energy: 0.8772471377679634
Energy: 1.2478084673549843
Energy: 0.918661260130804
Energy: 1.3012113446061544
Energy: 0.9040792054406227
Energy: 1.295013891209161
Energy: 1.1894013574839457
Energy: 1.2393681846952547
Energy: 0.8755134431875096
Energy: 1.2413455839300624
Energy: 0.9246410846376164
Energy: 1.4837661809832123
Energy: 1.1461209081147314
Energy: 1.4591670648713082
Energy: 0.9697801908263831
Energy: 1.4672640998770297
Energy: 0.9130206930615128
Energy: 1.4672641452795163
Energy: 0.9240513636380953
Energy: 1.6259721935907836
Energy: 1.3745374321656134
Energy: 1.625958899580408
Energy: 0.944007781275753
Energy: 1.4297713709809436
Energy: 0.908188093165212
Energy: 1.4297713710381301
Energy: 0.9197674003806522
Energy: 1.219594442425802
Energy: 1.3794636512088563
Energy: 1.2227357960418175
Energy: 0.9755316144958173
Energy: 1.518295490058043
Energy: 0.8779969808492453
Energy: 1.5182535289875931

minimum gb energy = 0.8755134431875096 eV
minimum distance =  2.20629648897182 Angstroms
sigma value = 37


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

Energy: 1.1029286069712398
Energy: 1.3219560366411165
Energy: 1.0335233896190714
Energy: 1.3219560366288041
Energy: 1.1318203436610332
Energy: 1.2855060776342615
Energy: 0.797503990461802
Energy: 1.2808044168094304
Energy: 0.8485060571794824
Energy: 1.6130498400265543
Energy: 1.2331687855431999
Energy: 1.6130498400265543
Energy: 1.0741943419506423
Energy: 1.103162742910003
Energy: 0.8241746998804675
Energy: 1.1220413234964781
Energy: 0.8606454892599512
Energy: 1.2794746060096418
Energy: 1.2640773031032781
Energy: 1.270295027607702
Energy: 0.9455163109894902
Energy: 1.4861263538922642
Energy: 1.013454135497151
Energy: 1.4861263451469562
Energy: 0.863941944870714
Energy: 1.6647828142063772
Energy: 1.4931440992637213
Energy: 1.6647828384239622
Energy: 0.932195228471625
Energy: 0.8785544350305867
Energy: 0.870729444747077
Energy: 0.8780551816362723
Energy: 0.8160712882898915
Energy: 1.2744644345012004
Energy: 1.4202964469455772
Energy: 1.2715696360219217
Energy: 1.3375184132321076
Energy: 1.3081931371172584
Energy: 1.0048032950795103
Energy: 1.3071008128115462
Energy: 0.8276022190355554
Energy: 1.7091788039853315
Energy: 1.071666224634156
Energy: 1.709178803987794
Energy: 1.3512036193901371
Energy: 1.2869403344321617
Energy: 0.80675694523618
Energy: 1.2532067931189184
Energy: 1.0303305013980728
Energy: 1.530242479516638
Energy: 0.8384289710509873
Energy: 1.5302424791585147
Energy: 1.429994890425822
Energy: 1.6574625692004177
Energy: 0.7887141285686499
Energy: 1.6574625564627272
Energy: 1.1605832852001343
Energy: 1.222145910444852
Energy: 0.9295751965067145
Energy: 1.2290692848240437
Energy: 1.0976946684971225
Energy: 1.3155490614151801
Energy: 0.8104059740408693
Energy: 1.321504188219374
Energy: 1.1019495698392159
Energy: 1.6161607803348288
Energy: 0.8224030382454474
Energy: 1.6161607803483722
Energy: 1.0406194640127842
Energy: 1.6027152767959267
Energy: 0.8345510021780194
Energy: 1.6022909576864544
Energy: 0.828584205102749
Energy: 1.2702993613018119
Energy: 0.8462941792940541
Energy: 1.2562456867781222
Energy: 0.8621016820653483
Energy: 1.5431429419280913
Energy: 1.038687317219327
Energy: 1.5431429391750364

minimum gb energy = 0.7887141285686499 eV
minimum distance =  2.20924137676654 Angstroms
sigma value = 25


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

Energy: 0.9879176629413537
Energy: 1.415866017016994
Energy: 0.9914607713767452
Energy: 1.4158661180884284
Energy: 1.4873086751920095
Energy: 1.4099953898605306
Energy: 0.7241043860263794
Energy: 1.4099953894550226
Energy: 0.9145516376506401
Energy: 0.945907748026864
Energy: 1.1085302634319698
Energy: 0.9459102665621414
Energy: 1.210210305402425
Energy: 1.2940631488239236
Energy: 0.7238841683888178
Energy: 1.2941402247182663
Energy: 0.7528146462381787
Energy: 1.4034245541372459
Energy: 1.129242165959156
Energy: 1.4034235070737453
Energy: 0.9306408066151819
Energy: 1.3891372984029182
Energy: 0.787564223492786
Energy: 1.389146219016914
Energy: 0.766532780040601
Energy: 1.0913124716794038
Energy: 1.2250796342202463
Energy: 1.0854937015855914
Energy: 0.7887073388070256
Energy: 1.2911214259973804
Energy: 0.891728780785107
Energy: 1.2911186455270804
Energy: 0.7238953100226659
Energy: 1.4012394239754655
Energy: 1.5498261228165304
Energy: 1.4011919214619601
Energy: 0.8417851022314078
Energy: 1.3774718895358746
Energy: 0.7866986047993271
Energy: 1.3774718902979453
Energy: 0.7594162548586462
Energy: 1.0650144915996558
Energy: 1.365428079894762
Energy: 1.0690877471731683
Energy: 1.1480834821203583
Energy: 1.4468823729804716
Energy: 0.9154956362359161
Energy: 1.446984441378806
Energy: 0.7203316091443934
Energy: 1.2813822346537544
Energy: 1.2122877987899494
Energy: 1.281381914302744
Energy: 1.1028066835040513
Energy: 1.4143775987670741
Energy: 0.7841910752243832
Energy: 1.4143775607590858
Energy: 0.7903662961300333
Energy: 1.237285284060914
Energy: 0.9337542825037222
Energy: 1.232714870963533
Energy: 1.260398481214899
Energy: 1.4459443556664837
Energy: 0.7660053617767499
Energy: 1.4459443667296588
Energy: 0.8973478974741301
Energy: 1.2946354037776948
Energy: 0.7525817252789313
Energy: 1.29463603635631
Energy: 1.2716138011387774
Energy: 1.449971004837251
Energy: 0.7213829243653492
Energy: 1.4499709911073104
Energy: 0.9856737998924902
Energy: 1.4114734620944962
Energy: 0.8318348326989081
Energy: 1.4114734588933457
Energy: 1.5461827558268653
Energy: 1.4283582851487076
Energy: 0.7186146463150357
Energy: 1.4283584240714593
Energy: 0.9037704497699651
Energy: 1.4541191620702498
Energy: 0.7672078127404103
Energy: 1.454119163612658
Energy: 0.928407671011404
Energy: 1.2855427521810927
Energy: 0.7768574844662565
Energy: 1.2828303646680397
Energy: 0.7269006496304768
Energy: 1.4028149579843638
Energy: 1.16412922304874
Energy: 1.4028151232205706
Energy: 0.8857824922150717
Energy: 1.4246061838719888
Energy: 0.7445959985259143
Energy: 1.4246061459447612
Energy: 0.7248006412409554
Energy: 1.4515550499765708
Energy: 1.2534053811990509
Energy: 1.451555049972725
Energy: 0.7427129410820636
Energy: 1.2874656772010347
Energy: 0.9532300261584594
Energy: 1.2896141090011646

minimum gb energy = 0.7186146463150357 eV
minimum distance =  2.2067020709886 Angstroms
sigma value = 41


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

Energy: 1.2478333554429697
Energy: 1.2328522096306513
Energy: 0.9321317217752086
Energy: 1.2328522132958082
Energy: 1.3074587065587935
Energy: 1.2293510432061565
Energy: 0.6144731820492803
Energy: 1.22933427171429
Energy: 0.7049975100231313
Energy: 1.2037571969424994
Energy: 1.2758295345255037
Energy: 1.2037571759733072
Energy: 1.1820426293147968
Energy: 1.2326171304609848
Energy: 0.6381480809015034
Energy: 1.2326170564979968
Energy: 0.6333032377926952
Energy: 1.2546661343522914
Energy: 0.7204641891801153
Energy: 1.2546644559123317
Energy: 0.9208810778811174
Energy: 1.2185054517165315
Energy: 0.6471162239898781
Energy: 1.2185051269473235
Energy: 0.6364828404613453
Energy: 1.243109599873749
Energy: 1.0125798537061081
Energy: 1.2431095643037262
Energy: 0.7515891570457303
Energy: 0.9916634796495223
Energy: 0.6308692278855293
Energy: 0.9788642596595098
Energy: 0.6170205116700793
Energy: 1.270819533596621
Energy: 1.1736115656663288
Energy: 1.2708195171954932
Energy: 0.7336288359414357
Energy: 1.2103861231282558
Energy: 0.6738101510440142
Energy: 1.2054026694115478
Energy: 0.6342128386592508
Energy: 1.2201020820774242
Energy: 1.4438271682521568
Energy: 1.2201017921636446
Energy: 0.7692336921243164
Energy: 1.253407314341003
Energy: 1.2348690990584672
Energy: 1.2534073106537758
Energy: 0.6394245057943091
Energy: 1.2744582065920045
Energy: 1.4028997715742717
Energy: 1.2737678272573876
Energy: 0.9434350937275366
Energy: 1.2924614128476488
Energy: 0.702593810235458
Energy: 1.2990267874610504
Energy: 0.6367893894874572
Energy: 1.2234027094868243
Energy: 1.165222656468338
Energy: 1.2234351493831015
Energy: 0.9838137185504462
Energy: 1.268280185324345
Energy: 0.6321383919427465
Energy: 1.2682801872924614
Energy: 0.6159186191917768
Energy: 1.2705719555034438
Energy: 1.033421706494257
Energy: 1.270571969205344
Energy: 0.9593072686076322
Energy: 1.2974483875373852
Energy: 0.6337693566780886
Energy: 1.2999766982233698
Energy: 0.6347780031741178
Energy: 0.9871041044105491
Energy: 0.7471682069812106
Energy: 0.9871038721949204
Energy: 0.9873679268599764
Energy: 1.2833651711534133
Energy: 0.6193365217208305
Energy: 1.2833605298495512
Energy: 0.6797263466162764
Energy: 1.264810747075872
Energy: 0.7308627744947341
Energy: 1.2648106904862109
Energy: 1.3746432633827397
Energy: 1.3189435008881585
Energy: 0.6354748948540146
Energy: 1.3180065642122027
Energy: 1.2111784235286867
Energy: 1.2226919616444236
Energy: 0.7646834090196629
Energy: 1.2226919555352795
Energy: 1.2716196923430108
Energy: 1.2658661634509798
Energy: 0.6660482572144993
Energy: 1.265962104792039
Energy: 0.6805806396895127
Energy: 1.304424131169068
Energy: 0.7672120238443833
Energy: 1.304426399390531
Energy: 1.2372684621662364
Energy: 1.3655523191592922
Energy: 0.6262165318487622
Energy: 1.3655523173857944
Energy: 0.640038080492102
Energy: 1.3151287887996672
Energy: 0.9734131969176911
Energy: 1.3151287887973027
Energy: 0.6501464985637999
Energy: 1.2653143301322214
Energy: 0.616181033032294
Energy: 1.2653218271794693
Energy: 0.7070767285353456
Energy: 1.29314486834288
Energy: 0.9641360380326535
Energy: 1.2931440976858204
Energy: 0.7440713507041623
Energy: 1.3361339667702583
Energy: 0.6329755094824628
Energy: 1.3361345096742394
Energy: 0.6448341584969149
Energy: 1.2710611478068925
Energy: 0.9615408042976129
Energy: 1.2710729613833125
Energy: 0.6649266933808358
Energy: 1.2673635485500077
Energy: 0.6756648796845456
Energy: 1.2673641144527432

minimum gb energy = 0.6144731820492803 eV
minimum distance =  2.21860778269505 Angstroms
sigma value = 15


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

Energy: 1.1348650085454735
Energy: 1.1730280813686276
Energy: 1.0052255498367786
Energy: 1.1731523435089963
Energy: 1.423036027366511
Energy: 1.1340078352464762
Energy: 0.5994155263590074
Energy: 1.131695635119737
Energy: 0.6270063317388638
Energy: 1.120476375150992
Energy: 1.1465788198391862
Energy: 1.12047470058593
Energy: 1.2765642930995378
Energy: 1.1316447792643005
Energy: 0.6363984219205044
Energy: 1.1316451144514725
Energy: 0.6485956071543756
Energy: 1.1731518998190968
Energy: 1.1752569662664771
Energy: 1.1731682102623469
Energy: 1.0582111523803055
Energy: 1.1370550051304071
Energy: 0.5792119958179283
Energy: 1.137061734272994
Energy: 0.6380946910812151
Energy: 1.1121564978879768
Energy: 0.8448583710666351
Energy: 1.1121367313931299
Energy: 0.8705868238795016
Energy: 1.1037705435711445
Energy: 0.5985468426083885
Energy: 1.102866429995222
Energy: 0.6317904057166723
Energy: 1.1840873228106208
Energy: 0.8625805283745146
Energy: 1.184086280638093
Energy: 0.6924478174038111
Energy: 1.1299176499497192
Energy: 0.6441573981014515
Energy: 1.1322742445005505
Energy: 0.5990398406474469
Energy: 1.1405726050683809
Energy: 1.3254487607674932
Energy: 1.140306777129099
Energy: 0.7120286119145406
Energy: 1.1066919393100023
Energy: 0.6375899408412199
Energy: 1.107589597493507
Energy: 0.5922302319407337
Energy: 1.1751819091715492
Energy: 1.4217755867647899
Energy: 1.1761078683386805
Energy: 0.6715312234816186
Energy: 1.1628777916367368
Energy: 1.1346141273254797
Energy: 1.1629072084746808
Energy: 0.5963198583478541
Energy: 1.1913989806672385
Energy: 1.3973721822193097
Energy: 1.1913989838108698
Energy: 0.8540683516486701
Energy: 1.105353669885976
Energy: 0.6860326089113405
Energy: 1.094495767022968
Energy: 0.5907878838548771
Energy: 1.1787736971147993
Energy: 1.224803529000328
Energy: 1.1787735411172362
Energy: 0.8836255189630565
Energy: 1.182645793981782
Energy: 0.5967390878375823
Energy: 1.1826614541831757
Energy: 0.6438193264856299
Energy: 1.1411007589395183
Energy: 1.049006404213789
Energy: 1.140961423346231
Energy: 0.8489313160974011
Energy: 1.1364968662957118
Energy: 0.5932305686660447
Energy: 1.1365097572221952
Energy: 0.5907113583267781
Energy: 1.15826272481713
Energy: 0.8674197975432141
Energy: 1.1582627529335925
Energy: 0.8702296144658228
Energy: 1.1810549288573151
Energy: 0.5804408863294961
Energy: 1.1812588996020854
Energy: 0.59633357901211
Energy: 1.130991602068795
Energy: 0.6843816339217467
Energy: 1.1309915304914604
Energy: 1.272470868705103
Energy: 1.1352801436040452
Energy: 0.6010858116267956
Energy: 1.1352801549571034
Energy: 0.6316324046578224
Energy: 1.1593425628707585
Energy: 0.7063233842212303
Energy: 1.1598145573526437
Energy: 1.2891855061260664
Energy: 1.1740512917895494
Energy: 0.5896842754019025
Energy: 1.176606377658209
Energy: 1.1107422296810712
Energy: 1.1703084811037043
Energy: 0.6846631752278384
Energy: 1.1703083536811552
Energy: 1.4268363823806973
Energy: 1.1430377413953428
Energy: 0.5816021487982215
Energy: 1.1457797923698627
Energy: 0.6600301522539562
Energy: 1.1974588027176114
Energy: 0.6984377957671154
Energy: 1.1974562272525302
Energy: 1.1381861648409017
Energy: 1.1783849940360185
Energy: 0.605174936194208
Energy: 1.1782852855198054
Energy: 0.5935571731854928
Energy: 1.1809752749025806
Energy: 0.882053234771865
Energy: 1.181595020513159
Energy: 1.0702162436122873
Energy: 1.1281148206246714
Energy: 0.5981563738059078
Energy: 1.128115011447058
Energy: 0.594202292091665
Energy: 1.2043521024598063
Energy: 0.8633900432267446
Energy: 1.2043441706058684
Energy: 0.6624634453993125
Energy: 1.1529311836987228
Energy: 0.5982852718548101
Energy: 1.1529312708747512
Energy: 0.6057401922169806
Energy: 1.1721880945963186
Energy: 0.8785050606938554
Energy: 1.1721879784875526
Energy: 0.6891550283043429
Energy: 1.1366799116435917
Energy: 0.6106156638348469
Energy: 1.1366810581313045
Energy: 0.6295191320580036
Energy: 1.2091869627282068
Energy: 1.3100735494755114
Energy: 1.2033717699599904

minimum gb energy = 0.5792119958179283 eV
minimum distance =  2.22194975721146 Angstroms
sigma value = 85


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

Energy: 1.1288187345638174
Energy: 1.1033814545571867
Energy: 0.8349280208444727
Energy: 1.1033810352151447
Energy: 1.3605992436966003
Energy: 1.042413565129129
Energy: 0.5338364526958721
Energy: 1.0424134031236951
Energy: 1.0793090245899448
Energy: 1.0392925090352738
Energy: 0.7966531714696541
Energy: 1.0392925090092129
Energy: 1.334137129321715
Energy: 1.04030355504483
Energy: 0.5280099048316377
Energy: 1.0402761100869058
Energy: 0.6926166833596545
Energy: 1.004172190074881
Energy: 0.7937547654403051
Energy: 1.0041713344895538
Energy: 1.1862996443685978
Energy: 1.0315447162595124
Energy: 0.5373901562957104
Energy: 1.031285211598386
Energy: 0.6535648786715726
Energy: 1.0251548447632084
Energy: 0.878766909295837
Energy: 1.025154741624823
Energy: 1.017507085904829
Energy: 1.042013001136062
Energy: 0.5589629356709683
Energy: 1.042022470912411
Energy: 0.5408393139604761
Energy: 0.9733520368542172
Energy: 0.9329480911542456
Energy: 0.9592195015707368
Energy: 0.8595021967170832
Energy: 1.0152098153004345
Energy: 0.6543833847014081
Energy: 1.0152078943462113
Energy: 0.5531904642893827
Energy: 1.0530080106266508
Energy: 1.244246163115217
Energy: 1.0530110301155573
Energy: 0.7033969904182735
Energy: 1.0586578123355628
Energy: 0.7040193783350212
Energy: 1.0586710804980424
Energy: 0.5623277006813507
Energy: 0.9936079862246886
Energy: 1.3547312664831759
Energy: 0.9936077686801857
Energy: 0.6041950000062146
Energy: 1.034529735730073
Energy: 1.0775775930067995
Energy: 1.0279867751694765
Energy: 0.5381311982400868
Energy: 1.0410236649669196
Energy: 1.4739584207060246
Energy: 1.0410621362713408
Energy: 0.5908996962525578
Energy: 1.086389279940717
Energy: 1.0126382974849344
Energy: 1.0863899618187436
Energy: 0.5424083671314969
Energy: 0.9812405011173837
Energy: 1.4041925480782893
Energy: 0.9812281183172828
Energy: 0.7546311379754672
Energy: 1.0471512785939945
Energy: 1.0634262796793221
Energy: 1.0415000085573047
Energy: 0.5343050835912236
Energy: 1.0542334931176864
Energy: 1.3189873922001216
Energy: 1.054251454804629
Energy: 0.771698604941203
Energy: 1.097049692997706
Energy: 0.7032204065477085
Energy: 1.0970723751276976
Energy: 0.5601304776082451
Energy: 0.892067601969992
Energy: 1.171715287604936
Energy: 0.8795739884454407
Energy: 0.8621085757491999
Energy: 1.0563225772236784
Energy: 0.6658788185227641
Energy: 1.0563225384463348
Energy: 0.549374420650276
Energy: 1.046620437412186
Energy: 1.0192273100547828
Energy: 1.0466281855432897
Energy: 0.9016700822478577
Energy: 1.1038207893735255
Energy: 0.5445199931872373
Energy: 1.103638644361649
Energy: 0.6476060371080503
Energy: 0.9001395374203258
Energy: 0.8614186235504616
Energy: 0.895737814808519
Energy: 1.207547729409173
Energy: 1.0559677781588974
Energy: 0.5384800845756613
Energy: 1.0559668556428896
Energy: 0.7069465460313602
Energy: 1.0713703779202832
Energy: 0.7050408455645121
Energy: 1.0713703667521348
Energy: 1.2917703039439952
Energy: 1.1036416084828293
Energy: 0.5354616950301541
Energy: 1.1204909921938233
Energy: 1.0520497872548606
Energy: 1.0505025900246754
Energy: 0.6056662649251614
Energy: 1.0505025915679436
Energy: 1.470828415712725
Energy: 1.0542725608068533
Energy: 0.5351964887953689
Energy: 1.0542725470754626
Energy: 1.0985931050435922
Energy: 1.1020150827360988
Energy: 0.6122248839918946
Energy: 1.1020150916790568
Energy: 1.3543558014430497
Energy: 1.1006940907275549
Energy: 0.5354362342575917
Energy: 1.1008343290396794
Energy: 1.0563581576808578
Energy: 1.036563198452124
Energy: 0.6204302173044717
Energy: 1.0365632040665762
Energy: 1.3140952279982934
Energy: 1.0480136083952847
Energy: 0.5356143300966287
Energy: 1.0480136128971547
Energy: 0.7049489801813948
Energy: 1.096165111349018
Energy: 0.7927031414376788
Energy: 1.0961653639545272
Energy: 1.0873586907740567
Energy: 1.096171237721201
Energy: 0.528326233782182
Energy: 1.0961712982310485
Energy: 0.649116232354374
Energy: 1.0440384122770454
Energy: 0.8567932799594705
Energy: 1.0440384448645215
Energy: 1.0115612924782509
Energy: 1.0496557287269568
Energy: 0.5528270220061556
Energy: 1.0496553483486577
Energy: 0.5492429363245602
Energy: 1.094627930484982
Energy: 0.9023004839746683
Energy: 1.0946277949958516
Energy: 0.7207102307160732
Energy: 1.0840978035070707
Energy: 0.6391779139483734
Energy: 1.084083059077035
Energy: 0.5287654141537211
Energy: 1.0422534515152997
Energy: 1.230232706170712
Energy: 1.0350401116352086
Energy: 0.690952395634543
Energy: 1.0659324589180277
Energy: 0.7000319339790241
Energy: 1.065933284182713
Energy: 0.5357902987984376
Energy: 1.0942094610583943
Energy: 1.2836412626500442
Energy: 1.0943398163279334

minimum gb energy = 0.5280099048316377 eV
minimum distance =  2.21746906584611 Angstroms
sigma value = 113


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

Energy: 0.018570291160536705
Energy: 0.01893677249158908
Energy: 1.9380102849438974
Energy: 0.018936772492034282
Energy: 0.6283248378488079
Energy: 0.2910021012277924
Energy: 0.29040311326991053
Energy: 0.2910021012277924
Energy: 0.018570291160536705
Energy: 0.01893677249158908
Energy: 0.853063680239405
Energy: 0.01893677249158908
Energy: 0.6283248378479669
Energy: 0.2910021012277924
Energy: 0.2904031378561355
Energy: 0.2910021012273967
Energy: 0.018570291160536705
Energy: 0.018936772492034282
Energy: 0.8535883440507342
Energy: 0.018936772492034282
Energy: 0.6283248378488079
Energy: 0.2910021012277924
Energy: 0.29040310665048713
Energy: 0.2910021012273967

minimum gb energy = 0.018570291160536705 eV
minimum distance =  2.54422242150557 Angstroms
sigma value = 1