Model name: model_name=EAM_Dynamo_FischerSchmitzEich_2019_CuNi__MO_266134052596_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.519999980926514
cohesive_energy=4.450349999665976
mass=58.6934
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: 0.018161334680330994
Energy: 0.01866666075461072
Energy: 0.018197365102594107
Energy: 0.01866666075461072
Energy: 0.01866666075461072
Energy: 1.2953802464295023
Energy: 0.01866666075461072
Energy: 1.2953802464295023
Energy: 0.01819736510321888
Energy: 0.01866666075461072
Energy: 0.018161334680330994
Energy: 0.018666660753949193
Energy: 0.01866666075461072
Energy: 1.2953802464301638
Energy: 0.01866666075461072
Energy: 1.2953802464301638

minimum gb energy = 0.018161334680330994 eV
minimum distance =  2.46557779388505 Angstroms
sigma value = 1


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

Energy: 1.4004691573710655
Energy: 1.4432229283150437
Energy: 1.2312067786348513
Energy: 1.4432229283158464
Energy: 1.3126073408325138
Energy: 1.3971807074271103
Energy: 1.3175854043730981
Energy: 1.3971807074271103
Energy: 1.2643934473324423
Energy: 1.4267127613374948
Energy: 1.291742162287263
Energy: 1.4267127613366926
Energy: 1.2793579518534701
Energy: 1.350113684243677
Energy: 1.2803444867871479
Energy: 1.3501136842420722
Energy: 1.2828413667957783
Energy: 1.4488760785962902
Energy: 1.2874448990885252
Energy: 1.448876078597895
Energy: 1.2524153384074188
Energy: 1.4112078028491877
Energy: 1.2408112129938929
Energy: 1.4112078028459787
Energy: 1.3138363019971502
Energy: 1.4223963020506933
Energy: 1.2543730144310423
Energy: 1.4223963020522978
Energy: 1.1761471943058985
Energy: 1.4502348118159165
Energy: 1.2137984076121004
Energy: 1.4502348118167185
Energy: 1.28017443655611
Energy: 1.5999230787450573
Energy: 1.321458774923517
Energy: 1.5999230787434526
Energy: 1.2243658241876407
Energy: 1.425382390497436
Energy: 1.159600439611979
Energy: 1.4253823904990406
Energy: 1.3291906642054494
Energy: 1.3963862295173977
Energy: 1.280463009190006
Energy: 1.3963862295190022
Energy: 1.2660725830759978
Energy: 1.449384845679946
Energy: 1.2474749055450345
Energy: 1.449384845679946
Energy: 1.3157173078934519
Energy: 1.4204819657064789
Energy: 1.3139034701916383
Energy: 1.4204819657064789
Energy: 1.2950968304504054
Energy: 1.4289227438062815
Energy: 1.2597930926627838
Energy: 1.4289227438070837
Energy: 1.3040283029211557
Energy: 1.4439076868488123
Energy: 1.2919211440449552
Energy: 1.44390768684801
Energy: 1.2927663751007186
Energy: 1.443647456030514
Energy: 1.3114412518036302
Energy: 1.4436474560321186
Energy: 1.2921857902249905
Energy: 1.4269026044911317
Energy: 1.2292113750932399
Energy: 1.4269026044903295
Energy: 1.317518858417777
Energy: 1.3793393380858987
Energy: 1.3129178542338864
Energy: 1.3793393380858987
Energy: 1.1983143137133345
Energy: 1.4491430209527134
Energy: 1.245962082335888
Energy: 1.4491430209551204
Energy: 1.3359907790860008
Energy: 1.2970068118788343
Energy: 1.2832550749833214
Energy: 1.2970068118764275
Energy: 1.228859898329521
Energy: 1.4266724733072658
Energy: 1.190922921900404
Energy: 1.4266724733088703
Energy: 1.2804112195291948
Energy: 1.3041469362481743
Energy: 1.294057346893464
Energy: 1.3041469362457674
Energy: 1.2877964046032335
Energy: 1.4487726038991635
Energy: 1.2286812481583778
Energy: 1.448772603898361
Energy: 1.2705135151297609
Energy: 1.4222208703521104
Energy: 1.2526513165855315
Energy: 1.4222208703521104
Energy: 1.2545123009209742
Energy: 1.4008945765688081
Energy: 1.316550445045927
Energy: 1.4008945765704128
Energy: 1.2817156939448773
Energy: 1.4500204112409771
Energy: 1.2453586074567309
Energy: 1.450020411240175
Energy: 1.3040694788428928
Energy: 1.3745342943440415
Energy: 1.280121278540392
Energy: 1.374534294342437
Energy: 1.235015643134898
Energy: 1.4225484554090657
Energy: 1.3687334793692691
Energy: 1.4225484554090657
Energy: 1.3115114345947074
Energy: 1.3670864722095135
Energy: 1.3099903153300476
Energy: 1.3670864722095135
Energy: 1.3187620024536177
Energy: 1.4448854692022777
Energy: 1.2714976898947523
Energy: 1.44488546920308
Energy: 1.3067268547097695
Energy: 1.4283138303623197
Energy: 1.3157818540579589
Energy: 1.428313830363122
Energy: 1.27141630010143
Energy: 1.42206828938902
Energy: 1.2957320133512318
Energy: 1.4220682893882177
Energy: 1.282709395920135
Energy: 1.4552597354392636
Energy: 1.28254933138355
Energy: 1.455259735440868

minimum gb energy = 1.159600439611979 eV
minimum distance =  2.18809099075216 Angstroms
sigma value = 1


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

Energy: 1.4844773447457658
Energy: 1.5378559735250121
Energy: 1.3155986257590906
Energy: 1.5378559735268418
Energy: 1.3558953680190773
Energy: 1.4715544069594726
Energy: 1.3720211822003459
Energy: 1.4715544069603874
Energy: 1.297104796039569
Energy: 1.5399151473618935
Energy: 1.3482003308133312
Energy: 1.5399151473618935
Energy: 1.3113699677941828
Energy: 1.3345187930258346
Energy: 1.3023688395716109
Energy: 1.3345187930267495
Energy: 1.311257129039704
Energy: 1.5060545800382685
Energy: 1.346712875472716
Energy: 1.5060545800391831
Energy: 1.3716965621715882
Energy: 1.5062648080996164
Energy: 1.3475089687264608
Energy: 1.5062648081041903
Energy: 1.3484709182440855
Energy: 1.3353202807697715
Energy: 1.3216361420371572
Energy: 1.3353202807734308
Energy: 1.211191126116481
Energy: 1.5404009464795496
Energy: 1.2741296741396169
Energy: 1.5404009464822939
Energy: 1.3255907352000504
Energy: 1.3752989255794419
Energy: 1.3949347366332305
Energy: 1.3752989255785273
Energy: 1.2951079301353274
Energy: 1.5400089433221222
Energy: 1.2954220061468216
Energy: 1.5400089433120598
Energy: 1.3482692785908827
Energy: 1.4474498889724747
Energy: 1.3768638458096967
Energy: 1.4474498889669865
Energy: 1.2691245336019874
Energy: 1.5215650604948114
Energy: 1.3482366604517353
Energy: 1.5215650605021294
Energy: 1.3691138985701667
Energy: 1.5016929152499543
Energy: 1.3470258835220106
Energy: 1.5016929152508693
Energy: 1.3690798605282457
Energy: 1.5017514558250673
Energy: 1.327405878886009
Energy: 1.5017514558214082
Energy: 1.2690025751462861
Energy: 1.521590501796185
Energy: 1.3552409840502841
Energy: 1.521590501789782
Energy: 1.3482664597929288
Energy: 1.4475511718920362
Energy: 1.3718915174142357
Energy: 1.4475511718975247
Energy: 1.2950886563203305
Energy: 1.5399769864049913
Energy: 1.2420253981891172
Energy: 1.5399769864031614
Energy: 1.3255967190243563
Energy: 1.3754688972400424
Energy: 1.3949815435000374
Energy: 1.375468897238213
Energy: 1.2111713403047473
Energy: 1.5403647887557501
Energy: 1.2543217637800916
Energy: 1.5403647887511764
Energy: 1.3484649472307286
Energy: 1.335231029804794
Energy: 1.3025319642041013
Energy: 1.3352310298066237
Energy: 1.3717728778758638
Energy: 1.5063311532827501
Energy: 1.277072224269992
Energy: 1.5063311532790913
Energy: 1.311317123120086
Energy: 1.5062442141981138
Energy: 1.3525755085135687
Energy: 1.5062442142026875
Energy: 1.3113171660852445
Energy: 1.3344626342740338
Energy: 1.2942538183061971
Energy: 1.3344626342667156
Energy: 1.297231660148276
Energy: 1.5399312425258738
Energy: 1.3494878215077146
Energy: 1.5399312425213
Energy: 1.35598421977653
Energy: 1.4715302198869205
Energy: 1.3719884377498583
Energy: 1.47153021988875
Energy: 1.4844773447448514
Energy: 1.5378559735250121
Energy: 1.3297056350955598
Energy: 1.5378559735268418
Energy: 1.355895368019992
Energy: 1.471554406958558
Energy: 1.3720211822003459
Energy: 1.4715544069603874
Energy: 1.2971047960377395
Energy: 1.5399151473618935
Energy: 1.3482003308124162
Energy: 1.5399151473618935
Energy: 1.3113699677950974
Energy: 1.3345187930258346
Energy: 1.3023688395716109
Energy: 1.3345187930267495

minimum gb energy = 1.2111713403047473 eV
minimum distance =  2.15798709971543 Angstroms
sigma value = 25


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

Energy: 1.4318302427817593
Energy: 1.6055976419053741
Energy: 1.364110664334518
Energy: 1.605597641907501
Energy: 1.4508667602477512
Energy: 1.5003540421439716
Energy: 1.3985318807442162
Energy: 1.5003540421439716
Energy: 1.3696088809939209
Energy: 1.663522149143754
Energy: 1.398658775078236
Energy: 1.663522149143754
Energy: 1.3617243890905137
Energy: 1.4172618965875337
Energy: 1.3583264931539363
Energy: 1.4172618965885966
Energy: 1.3587324547855855
Energy: 1.6058990138814333
Energy: 1.3883248382822062
Energy: 1.605899013882497
Energy: 1.4599644841891908
Energy: 1.6618372363882459
Energy: 1.446741450217165
Energy: 1.6618372363882459
Energy: 1.446374446518709
Energy: 1.3972519439922677
Energy: 1.4095813863805173
Energy: 1.3972519439901891
Energy: 1.4814583955208824
Energy: 1.6126111744990639
Energy: 1.3039566602534092
Energy: 1.6126111744980003
Energy: 1.4095158345398102
Energy: 1.5189187740724395
Energy: 1.446303090820778
Energy: 1.5189187740724395
Energy: 1.3850180000156445
Energy: 1.662200699199164
Energy: 1.340364800125844
Energy: 1.6622006992002274
Energy: 1.4237234519918809
Energy: 1.6028614346927494
Energy: 1.407688973727976
Energy: 1.6028614346927494
Energy: 1.3995956661146356
Energy: 1.605089224647732
Energy: 1.407787317944968
Energy: 1.605089224647732
Energy: 1.3850139708628095
Energy: 1.5374124138928218
Energy: 1.3401223694965727
Energy: 1.5374124138928218
Energy: 1.4083531665922944
Energy: 1.479036487362094
Energy: 1.4467321781146585
Energy: 1.4790364873610307
Energy: 1.3230871925916836
Energy: 1.6141312985594198
Energy: 1.3022366909210683
Energy: 1.6141312985594198
Energy: 1.4457442214732288
Energy: 1.399062416632264
Energy: 1.358526048755212
Energy: 1.399062416631201
Energy: 1.2675076151640743
Energy: 1.6636898769512154
Energy: 1.2675857781541282
Energy: 1.6636898769512154
Energy: 1.35822779000828
Energy: 1.5384301332621588
Energy: 1.4213088370899891
Energy: 1.5384301332621588
Energy: 1.3272425302223128
Energy: 1.54276021658458
Energy: 1.3589857090911006
Energy: 1.54276021658458
Energy: 1.447015646258199
Energy: 1.661542002443004
Energy: 1.3999714503478333
Energy: 1.6615420024419405
Energy: 1.4167366830769774
Energy: 1.503430265010017
Energy: 1.4004290502870145
Energy: 1.503430265010017
Energy: 1.434057742208225
Energy: 1.6062047046087744
Energy: 1.4340353028847754
Energy: 1.6062047046087744
Energy: 1.4504864802000248
Energy: 1.5384206367885687
Energy: 1.4078959325655178
Energy: 1.5384206367885687
Energy: 1.3678335340154784
Energy: 1.66219045170122
Energy: 1.3849905224011745
Energy: 1.66219045170122
Energy: 1.408538573359808
Energy: 1.4160857024428002
Energy: 1.3587149062456043
Energy: 1.4160857024417368

minimum gb energy = 1.2675076151640743 eV
minimum distance =  2.15594944030729 Angstroms
sigma value = 9


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

Energy: 1.4998206708116535
Energy: 1.4994946552902084
Energy: 1.4390915911578916
Energy: 1.4994946552876711
Energy: 1.466823511673688
Energy: 1.601966033710099
Energy: 1.4868290346072979
Energy: 1.6019660337075619
Energy: 1.4521525457612081
Energy: 1.5071682852866783
Energy: 1.4104453379481392
Energy: 1.507168285290484
Energy: 1.5102540056395006
Energy: 1.4919179612223297
Energy: 1.3927784107909231
Energy: 1.4919179612197928
Energy: 1.5650014501302396
Energy: 1.6021461849298422
Energy: 1.427785846604708
Energy: 1.6021461849260368
Energy: 1.3235132714706808
Energy: 1.5063202005732645
Energy: 1.5018980089650005
Energy: 1.50632020057707
Energy: 1.4994059742341306
Energy: 1.3931209994728893
Energy: 1.3938697574069192
Energy: 1.393120999474158
Energy: 1.4383987081834253
Energy: 1.5064465481781588
Energy: 1.377930632058222
Energy: 1.5064465481794271
Energy: 1.4998045958470865
Energy: 1.602182739963901
Energy: 1.536374095993201
Energy: 1.602182739961364
Energy: 1.508239222237262
Energy: 1.499267224001518
Energy: 1.392964323533846
Energy: 1.499267224001518
Energy: 1.4136371376965924
Energy: 1.590525241306268
Energy: 1.4103517126306755
Energy: 1.590525241306268
Energy: 1.5089112273062202
Energy: 1.5809565713449487
Energy: 1.3931383903872219
Energy: 1.5809565713449487
Energy: 1.3233151125486484
Energy: 1.5069587986466324
Energy: 1.3239350214106669
Energy: 1.5069587986453639
Energy: 1.4929127933777355
Energy: 1.5056621477409133
Energy: 1.5033327731120083
Energy: 1.5056621477383765
Energy: 1.3233158823046727
Energy: 1.5069646676430546
Energy: 1.4388605751047443
Energy: 1.5069646676455914
Energy: 1.5086612348805282
Energy: 1.580907725045279
Energy: 1.393256586103964
Energy: 1.5809077250465473
Energy: 1.4137806036806497
Energy: 1.590504343434003
Energy: 1.4101812491124621
Energy: 1.5905043434327344
Energy: 1.5082315845253078
Energy: 1.4992490424895482
Energy: 1.3928549867803828
Energy: 1.4992490424895482
Energy: 1.4999692681538082
Energy: 1.6021897819628064
Energy: 1.4276135275187518
Energy: 1.6021897819628064
Energy: 1.4383179687339043
Energy: 1.5064305473315645
Energy: 1.3779459134327088
Energy: 1.5064305473328328
Energy: 1.4994018463685614
Energy: 1.3930972603426737
Energy: 1.393881047696947
Energy: 1.3930972603414051

minimum gb energy = 1.3233151125486484 eV
minimum distance =  2.28718623949148 Angstroms
sigma value = 25


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

Energy: 1.443099088510353
Energy: 1.781272760218008
Energy: 1.6014434038798684
Energy: 1.7812727602164395
Energy: 1.408668815847795
Energy: 1.611103664301681
Energy: 1.3792577523665766
Energy: 1.611103664301681
Energy: 1.3792678587349465
Energy: 1.7427536124663767
Energy: 1.3791493760273645
Energy: 1.7427536124663767
Energy: 1.4418000072187214
Energy: 1.6006714810615863
Energy: 1.549930329979853
Energy: 1.6006714810584486
Energy: 1.5489317976621708
Energy: 1.4074688834425941
Energy: 1.4502127321208411
Energy: 1.4074688834425941
Energy: 1.3794431109157248
Energy: 1.6474942929667022
Energy: 1.3794449625610232
Energy: 1.6474942929667022
Energy: 1.448790610365188
Energy: 1.6026819315665044
Energy: 1.3787188902322587
Energy: 1.6026819315665044
Energy: 1.530980931870024
Energy: 1.6114145165088398
Energy: 1.4430448632067576
Energy: 1.6114145165088398
Energy: 1.3792406700087279
Energy: 1.515634590665393
Energy: 1.4095482731127151
Energy: 1.515634590665393
Energy: 1.6147324623145773
Energy: 1.6485412145589564
Energy: 1.3789634809210798
Energy: 1.6485412145558547
Energy: 1.4956083830481222
Energy: 1.7061872777602354
Energy: 1.6955114431619507
Energy: 1.7061872777586664
Energy: 1.3787285118281303
Energy: 1.544751161311619
Energy: 1.6173533733034513
Energy: 1.544751161313188
Energy: 1.523179660945341
Energy: 1.5186721535332992
Energy: 1.3790363316947662
Energy: 1.5186721535332992
Energy: 1.378698859747058
Energy: 1.4896074257920027
Energy: 1.441712106304565
Energy: 1.4896074257920027
Energy: 1.5175645157170772
Energy: 1.6100986493589171
Energy: 1.531298189774833
Energy: 1.6100986493589171
Energy: 1.407892763730309
Energy: 1.5473494192191395
Energy: 1.3792105238752026
Energy: 1.5473494192191395
Energy: 1.3787434308855213
Energy: 1.5270851137526895
Energy: 1.6158116464501555
Energy: 1.5270851137526895

minimum gb energy = 1.378698859747058 eV
minimum distance =  2.26927986198783 Angstroms
sigma value = 17


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

Energy: 1.5739485270411664
Energy: 1.5721563672085734
Energy: 1.7037811352553436
Energy: 1.5721563672076848
Energy: 1.6110654994430265
Energy: 1.5335625528889663
Energy: 1.4269334016590713
Energy: 1.5335625528880776
Energy: 1.5844658629567443
Energy: 1.5558257908232966
Energy: 1.4264212693977982
Energy: 1.5558257908241848
Energy: 1.4287953757966068
Energy: 1.6929491328012667
Energy: 1.5319032269386708
Energy: 1.6929491327994897
Energy: 1.6381586174764353
Energy: 1.5381836909826967
Energy: 1.4975321108157638
Energy: 1.5381836909826967
Energy: 1.4550374311245655
Energy: 1.583879940009793
Energy: 1.5686030531036275
Energy: 1.5838799400089043
Energy: 1.4287823901125039
Energy: 1.5981014018571489
Energy: 1.5142078827706216
Energy: 1.5981014018571489
Energy: 1.5678031666843169
Energy: 1.583679536315052
Energy: 1.4528072151994191
Energy: 1.5836795363141634
Energy: 1.4537588131207342
Energy: 1.5964289277701131
Energy: 1.6220912862304837
Energy: 1.5964289277674477
Energy: 1.720821720611538
Energy: 1.5523118602515258
Energy: 1.4277514300533052
Energy: 1.5523118602506374
Energy: 1.4329955185889993
Energy: 1.5991015563229942
Energy: 1.5870991861717574
Energy: 1.5991015563238826
Energy: 1.453533907149683
Energy: 1.5953572801524094
Energy: 1.452655222974158
Energy: 1.5953572801524094
Energy: 1.7132985804141365
Energy: 1.5726517975622207
Energy: 1.5758243555599196
Energy: 1.5726517975631094
Energy: 1.4268441571278667
Energy: 1.6150236317966424
Energy: 1.6134411477679491
Energy: 1.615023631797531
Energy: 1.5574946941301782
Energy: 1.5949493826024608
Energy: 1.4559624071803643
Energy: 1.5949493826024608
Energy: 1.5846279598701252
Energy: 1.5833755477162257
Energy: 1.568164193538129
Energy: 1.5833755477162257
Energy: 1.5144870167967877
Energy: 1.6458579829963393
Energy: 1.7274566128141342
Energy: 1.6458579829963393
Energy: 1.55994194868183
Energy: 1.5555887232440033
Energy: 1.454857808689469
Energy: 1.5555887232422265
Energy: 1.5010515688916763
Energy: 1.6498616098292824
Energy: 1.50648507311174
Energy: 1.6498616098301708
Energy: 1.516139691785725
Energy: 1.6921881041312603
Energy: 1.4293747630480385
Energy: 1.6921881041312603
Energy: 1.4983833303687528
Energy: 1.5816191840775233
Energy: 1.5842393528203207
Energy: 1.5816191840757463
Energy: 1.5140210629442092
Energy: 1.684044373381849
Energy: 1.7203634434110464
Energy: 1.684044373381849
Energy: 1.5894818263686734
Energy: 1.600066675982623
Energy: 1.4266604263134477
Energy: 1.600066675982623
Energy: 1.5386555916995068
Energy: 1.5973153502091053
Energy: 1.5982739845738723
Energy: 1.5973153502091053
Energy: 1.5384680061164882
Energy: 1.555299214013315
Energy: 1.5969506480996079
Energy: 1.5552992140124262
Energy: 1.6706174476678577
Energy: 1.595686760179988
Energy: 1.4283014786870645
Energy: 1.595686760178211
Energy: 1.516501011149539
Energy: 1.6198634841300261
Energy: 1.7671423061530669
Energy: 1.6198634841291377
Energy: 1.5675718007794879
Energy: 1.5833252459354001
Energy: 1.5857410166345716
Energy: 1.5833252459354001
Energy: 1.7270631240183514
Energy: 1.692108348262128
Energy: 1.4291479563945384
Energy: 1.6921083482630166
Energy: 1.452386240232593
Energy: 1.647981026547509
Energy: 1.6989017671511952
Energy: 1.6479810265466202

minimum gb energy = 1.4264212693977982 eV
minimum distance =  2.13987680235197 Angstroms
sigma value = 53


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

Energy: 1.377517030034746
Energy: 1.376929423595423
Energy: 1.5753029553831486
Energy: 1.376929423595423
Energy: 1.6418544900721228
Energy: 1.547472762900281
Energy: 1.4819534946519455
Energy: 1.5474727629023262
Energy: 1.406290614225975
Energy: 1.3769384532589282
Energy: 1.5771787996671842
Energy: 1.3769384532568827
Energy: 1.4062311134703827
Energy: 1.3769207815831195
Energy: 1.463852453653354
Energy: 1.3769207815810738
Energy: 1.6418971187681068
Energy: 1.5492929807065952
Energy: 1.5116027043105689
Energy: 1.54929298070455
Energy: 1.377517030034746
Energy: 1.376929423595423
Energy: 1.6795855124772818
Energy: 1.3769294235933776
Energy: 1.6418544900721228
Energy: 1.547472762900281
Energy: 1.5719991349640319
Energy: 1.5474727629023262
Energy: 1.4062906095378502
Energy: 1.3769384532609734
Energy: 1.5771787996671842
Energy: 1.3769384532589282
Energy: 1.4062311055743881
Energy: 1.3769207815851647
Energy: 1.48480760189292
Energy: 1.3769207815831195
Energy: 1.6418971187741966
Energy: 1.54929298070455
Energy: 1.674581329881364
Energy: 1.54929298070455
Energy: 1.377517030034746
Energy: 1.376929423595423
Energy: 1.794566178273683
Energy: 1.376929423595423
Energy: 1.6418544900721228
Energy: 1.5474727629023262
Energy: 1.5720007839830563
Energy: 1.5474727629043716
Energy: 1.4062906099508452
Energy: 1.3769384532589282
Energy: 1.5771787996651385
Energy: 1.3769384532589282

minimum gb energy = 1.3769207815810738 eV
minimum distance =  2.24881187229236 Angstroms
sigma value = 9


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

Energy: 1.4959902757249697
Energy: 1.6575536411470333
Energy: 1.842095671218369
Energy: 1.657553641145519
Energy: 1.7360229606199051
Energy: 1.5732459147019264
Energy: 1.5067824569671924
Energy: 1.5732459147004123
Energy: 1.4890077439168297
Energy: 1.4756777134631167
Energy: 1.4829667364746948
Energy: 1.4756777134638737
Energy: 1.6285959273812296
Energy: 1.7335578248750005
Energy: 1.5058294001633028
Energy: 1.7335578248734864
Energy: 1.652459920179002
Energy: 1.5654540874041927
Energy: 1.5133010788655095
Energy: 1.5654540874034357
Energy: 1.4759515573071726
Energy: 1.4746609242447362
Energy: 1.6207436957492878
Energy: 1.4746609242439788
Energy: 1.858112838706262
Energy: 1.5587518402869456
Energy: 1.5074232881340333
Energy: 1.5587518402861884
Energy: 1.5066230210525937
Energy: 1.737973241962931
Energy: 1.6524907680344731
Energy: 1.73797324196066
Energy: 1.4927393437746392
Energy: 1.7482954187756108
Energy: 1.4745364053716437
Energy: 1.7482954187748536
Energy: 1.4976033857158961
Energy: 1.5709360913954522
Energy: 1.5086421918315622
Energy: 1.5709360913931811
Energy: 1.5092022574666974
Energy: 1.733459920734944
Energy: 1.8060832115427932
Energy: 1.733459920734944
Energy: 1.6772119892205124
Energy: 1.681403949219109
Energy: 1.4981224487076374
Energy: 1.6814039492168378
Energy: 1.492503442714692
Energy: 1.5743438108356982
Energy: 1.7513397570229228
Energy: 1.574343810837212
Energy: 1.6333161163498937
Energy: 1.6575000801873738
Energy: 1.4934305059179056
Energy: 1.6575000801873738
Energy: 1.5111301104261337
Energy: 1.6669351665196614
Energy: 1.66218066389077
Energy: 1.6669351665189043
Energy: 1.4967543400463974
Energy: 1.7464416180437716
Energy: 1.6264200186229845
Energy: 1.746441618044529
Energy: 1.5934476250714968
Energy: 1.6667807977746185
Energy: 1.5110964605027735
Energy: 1.6667807977746185
Energy: 1.513203633728296
Energy: 1.558607467495356
Energy: 1.6967220794816888
Energy: 1.5586074674938417
Energy: 1.6873346838135386
Energy: 1.5726109730015108
Energy: 1.479052363422103
Energy: 1.5726109730015108
Energy: 1.4965193549628855
Energy: 1.5926631484029097
Energy: 1.6182401360057823
Energy: 1.5926631484013956
Energy: 1.6276092785641434
Energy: 1.7317574920635863
Energy: 1.6314133512842863
Energy: 1.7317574920651002
Energy: 1.6171978580293163
Energy: 1.6591898414938588
Energy: 1.5031904143044321
Energy: 1.6591898414931017
Energy: 1.4745880425287385
Energy: 1.6503890215560122
Energy: 1.4927017215986313
Energy: 1.6503890215560122
Energy: 1.8393469166278857
Energy: 1.5812746188560483
Energy: 1.50606662834695
Energy: 1.5812746188568054
Energy: 1.5071897685463203
Energy: 1.696753691642724
Energy: 1.7802021581981529
Energy: 1.6967536916472663
Energy: 1.5566116602391253
Energy: 1.4754277853341862
Energy: 1.4894921707890365
Energy: 1.475427785332672
Energy: 1.6599340697987994
Energy: 1.672634494823381
Energy: 1.62760378613747
Energy: 1.672634494822693
Energy: 1.494038715860898
Energy: 1.7351466558274564
Energy: 1.6282675331524317
Energy: 1.7351466558274564
Energy: 1.547615084065116
Energy: 1.4749136132382195
Energy: 1.488437873697905
Energy: 1.4749136132412475
Energy: 1.5068794768812868
Energy: 1.6970161878336953
Energy: 1.7796513842185258
Energy: 1.697016187831424
Energy: 1.743124562335751
Energy: 1.5806589204118402
Energy: 1.5046217916707096
Energy: 1.5806589204133545
Energy: 1.4750188584948591
Energy: 1.5604324708233226
Energy: 1.4896183222301187
Energy: 1.5604324708240795
Energy: 1.5078451665012254
Energy: 1.6544960367851633
Energy: 1.4892322106459905
Energy: 1.6544960367851633
Energy: 1.6274699586795376
Energy: 1.7328198772663217
Energy: 1.628255650278893
Energy: 1.7328198772678358
Energy: 1.51341729411726
Energy: 1.7262262217218691
Energy: 1.8600387087732038
Energy: 1.7262262217218691

minimum gb energy = 1.4745364053716437 eV
minimum distance =  2.18235687955583 Angstroms
sigma value = 73


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

Energy: 1.4744183204194883
Energy: 1.4740201816431233
Energy: 1.8468329454371744
Energy: 1.4740201816419218
Energy: 1.5965356014826406
Energy: 1.6215815008734618
Energy: 1.5282257666166639
Energy: 1.6215815008734618
Energy: 1.526913960240582
Energy: 1.6272863674449904
Energy: 1.48545084324629
Energy: 1.6272863674437892
Energy: 1.49845049787967
Energy: 1.6231019657292478
Energy: 1.5286785567536787
Energy: 1.6231019657280739
Energy: 1.496707842844487
Energy: 1.5940688789185002
Energy: 1.5367586291171191
Energy: 1.5940688789197013
Energy: 1.537343680693121
Energy: 1.5169880439412653
Energy: 1.7680520602217054
Energy: 1.5169880439412653
Energy: 1.858554261038761
Energy: 1.788666935607916
Energy: 1.5294200777710618
Energy: 1.788666935607916
Energy: 1.4986959149012984
Energy: 1.4737494876422552
Energy: 1.8007746107192135
Energy: 1.4737494876422552
Energy: 1.7702824733540405
Energy: 1.4743900460003527
Energy: 1.4736879802225629
Energy: 1.4743900460003527
Energy: 1.5269232446004213
Energy: 1.6058081238496291
Energy: 1.5276001794202898
Energy: 1.6058081238496291
Energy: 1.4961625650752852
Energy: 1.628627246606662
Energy: 1.7684667775824294
Energy: 1.628627246605461
Energy: 1.657607142453933
Energy: 1.6545811196791145
Energy: 1.5017430391301643
Energy: 1.6545811196791145
Energy: 1.5371870911370935
Energy: 1.5893266427482555
Energy: 1.6407599398486519
Energy: 1.5893266427482555
Energy: 1.826059250741126
Energy: 1.5896951022397523
Energy: 1.5371780474560155
Energy: 1.5896951022385513
Energy: 1.5020475238410125
Energy: 1.5783927808667118
Energy: 1.6854891822117946
Energy: 1.5783927808667118
Energy: 1.781611040608438
Energy: 1.4740684611056345
Energy: 1.4988431769792843
Energy: 1.4740684611056345
Energy: 1.5283865687576434
Energy: 1.473819657299171
Energy: 1.5268828420351193
Energy: 1.473819657299171
Energy: 1.4736573176349896
Energy: 1.4755073458015446
Energy: 1.537463026733593
Energy: 1.4755073458015446
Energy: 1.6372971814618893
Energy: 1.4738821606230554
Energy: 1.4956334264894946
Energy: 1.4738821606230554
Energy: 1.528323845615397
Energy: 1.5778241834899427
Energy: 1.8571703011945002
Energy: 1.5778241834911437
Energy: 1.7788775452928287
Energy: 1.5090939220483621
Energy: 1.5385907136098604
Energy: 1.5090939220483621
Energy: 1.5284165534789709
Energy: 1.5912740086723731
Energy: 1.6395842826862401
Energy: 1.591274008673574

minimum gb energy = 1.4736573176349896 eV
minimum distance =  2.21197628198958 Angstroms
sigma value = 7


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

Energy: 1.5004241021138378
Energy: 1.4997729878537527
Energy: 1.8507990919512871
Energy: 1.4997729878554513
Energy: 1.82776025033325
Energy: 1.5560260972787259
Energy: 1.528503869231574
Energy: 1.556026097274479
Energy: 1.4937409571841753
Energy: 1.6988145157794394
Energy: 1.5245094972278046
Energy: 1.6988145157845354
Energy: 1.5505205756017886
Energy: 1.6049309483882537
Energy: 1.544920566444705
Energy: 1.6049309483882537
Energy: 1.5094474537482077
Energy: 1.5950154020354501
Energy: 1.4975760615102327
Energy: 1.5950154020303544
Energy: 1.4983320322749047
Energy: 1.619366235552315
Energy: 1.7402055538899808
Energy: 1.6193662355548628
Energy: 1.6712845459281378
Energy: 1.697488654230622
Energy: 1.5547190636667332
Energy: 1.6974886542289234
Energy: 1.4982440348626294
Energy: 1.5009022013783178
Energy: 1.8026904863985496
Energy: 1.500902201379167
Energy: 1.672590316025425
Energy: 1.588388343014126
Energy: 1.5189662160818889
Energy: 1.5883883430124273
Energy: 1.5101152350051479
Energy: 1.6053988745832835
Energy: 1.6192695916639368
Energy: 1.6053988745790368
Energy: 1.5351795973414633
Energy: 1.7029612136620458
Energy: 1.5653928242071338
Energy: 1.7029612136569499
Energy: 1.5010298081938491
Energy: 1.592614773117344
Energy: 1.5632328296740465
Energy: 1.5926147731139464
Energy: 1.4998793855976338
Energy: 1.5015725081861069
Energy: 1.5653776426142851
Energy: 1.5015725081895042
Energy: 1.5238356000323168
Energy: 1.4902461854895475
Energy: 1.5611217052626398
Energy: 1.4902461854869997
Energy: 1.5072148673622552
Energy: 1.727523047523088
Energy: 1.7193119029043162
Energy: 1.7275230475179917
Energy: 1.8410984551571947
Energy: 1.489550425930124
Energy: 1.5147820352640975
Energy: 1.4895504259318226
Energy: 1.530847196237208
Energy: 1.620755025138992
Energy: 1.7183411943232754
Energy: 1.6207550251364442
Energy: 1.4977220469657933
Energy: 1.698644462163548
Energy: 1.5626813630691374
Energy: 1.698644462161849
Energy: 1.4935140192129923
Energy: 1.620173397592758
Energy: 1.5644805459193087
Energy: 1.6201733975987032
Energy: 1.5097267963983472
Energy: 1.593198123395718
Energy: 1.5392425176257714
Energy: 1.5931981233914714
Energy: 1.5464860623393066
Energy: 1.7079371407115016
Energy: 1.5186468009552303
Energy: 1.707937140707255
Energy: 1.5114891957952943
Energy: 1.698903371400123
Energy: 1.6448663834337731
Energy: 1.6989033713992734
Energy: 1.7791144357111162
Energy: 1.5906851335817476
Energy: 1.5547974791400756
Energy: 1.5906851335851446
Energy: 1.5057996006867418
Energy: 1.500819110070468
Energy: 1.7448792602426455
Energy: 1.5008191100696187
Energy: 1.5863231131737838
Energy: 1.5927467401396918
Energy: 1.5136335945123462
Energy: 1.5927467401388424
Energy: 1.5503336631296596
Energy: 1.7013991481686424
Energy: 1.537601336367154
Energy: 1.7013991481660942
Energy: 1.510373082396742
Energy: 1.6052409389457807
Energy: 1.5595364680812251
Energy: 1.6052409389474793
Energy: 1.5504410301423586
Energy: 1.6192780321949964
Energy: 1.5443821756263794
Energy: 1.6192780321958458
Energy: 1.4929164930322323
Energy: 1.500683010168806
Energy: 1.6488197306311418
Energy: 1.5006830101671074
Energy: 1.685594976894304
Energy: 1.554967558565427
Energy: 1.5283736928352798
Energy: 1.554967558565427
Energy: 1.4929171170663662
Energy: 1.5008509400894858
Energy: 1.7565664958206106
Energy: 1.5008509400920338

minimum gb energy = 1.489550425930124 eV
minimum distance =  2.19780274830849 Angstroms
sigma value = 29


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

Energy: 1.4320472912132987
Energy: 1.4278325302862196
Energy: 1.3871338431244384
Energy: 1.4278325302859238
Energy: 1.4365983227072234
Energy: 1.4331870247898566
Energy: 1.5014191468514697
Energy: 1.4331870247892649
Energy: 1.435587183709056
Energy: 1.5026712236719593
Energy: 1.3846794727767608
Energy: 1.5026712236719593
Energy: 1.4300318706908883
Energy: 1.3864083065832753
Energy: 1.380449905654118
Energy: 1.3864083065832753
Energy: 1.4321160718529111
Energy: 1.484087473081815
Energy: 1.6401055006227447
Energy: 1.484087473081256
Energy: 1.4893098670970568
Energy: 1.5038207581965122
Energy: 1.4891446476957229
Energy: 1.5038207581959533
Energy: 1.4779922256723068
Energy: 1.484060324607558
Energy: 1.432122453726624
Energy: 1.4840603246072621
Energy: 1.3806348364011993
Energy: 1.3864254471935387
Energy: 1.4300278572325749
Energy: 1.3864254471938018
Energy: 1.3853525718416262
Energy: 1.5026616429442265
Energy: 1.53348470386105
Energy: 1.502661642944522

minimum gb energy = 1.380449905654118 eV
minimum distance =  2.2624708563414 Angstroms
sigma value = 5


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

Energy: 1.403499283791135
Energy: 1.4049078673302104
Energy: 1.6351572029762167
Energy: 1.4049078673294082
Energy: 1.610385523980044
Energy: 1.487925765880753
Energy: 1.37940852721902
Energy: 1.4879257658823573
Energy: 1.3724484284638296
Energy: 1.3962756486916486
Energy: 1.6334406262559122
Energy: 1.3962756486916486
Energy: 1.3864247198865396
Energy: 1.480810875599262
Energy: 1.3799243387543396
Energy: 1.4808108755984597
Energy: 1.3831919381108546
Energy: 1.4862796308639612
Energy: 1.589816171990921
Energy: 1.4862796308647637
Energy: 1.4735565248235127
Energy: 1.4067642053754792
Energy: 1.362936611663804
Energy: 1.406764205377084
Energy: 1.3627009034428368
Energy: 1.4841815176895552
Energy: 1.3629865551421285
Energy: 1.4841815176895552
Energy: 1.3701707805965422
Energy: 1.4079968212855696
Energy: 1.3847095561569915
Energy: 1.407996821283965
Energy: 1.3833570579115921
Energy: 1.4839402140622944
Energy: 1.3728674103495857
Energy: 1.4839402140622944
Energy: 1.3758086670102325
Energy: 1.4849304716855207
Energy: 1.3665545575513507
Energy: 1.484930471686323
Energy: 1.4029279221434934
Energy: 1.4078280598672002
Energy: 1.3748261249555478
Energy: 1.4078280598655957
Energy: 1.3736202170037632
Energy: 1.4901289683208139
Energy: 1.4058525861783342
Energy: 1.4901289683208139
Energy: 1.472735193057918
Energy: 1.4063666233727934
Energy: 1.4051823361968707
Energy: 1.4063666233703866
Energy: 1.3949021000649697
Energy: 1.406124569065994
Energy: 1.4250708692781018
Energy: 1.406124569065994
Energy: 1.6785339021280228
Energy: 1.4832987888591112
Energy: 1.3748214979791549
Energy: 1.4832987888591112
Energy: 1.3779576229459152
Energy: 1.3963091131581922
Energy: 1.4014780434615133
Energy: 1.39630911315739
Energy: 1.5889121177489447
Energy: 1.391097691591896
Energy: 1.3963993950457627
Energy: 1.391097691591896
Energy: 1.3825841093902531
Energy: 1.4059526929149968
Energy: 1.5906028161924137
Energy: 1.405952692915799
Energy: 1.3672057224368144
Energy: 1.4876715180712867
Energy: 1.3644230764085592
Energy: 1.487671518069682
Energy: 1.372169113369837
Energy: 1.484954086846576
Energy: 1.3834710602113025
Energy: 1.4849540868473783
Energy: 1.3852982252452153
Energy: 1.4767287708290922
Energy: 1.3756608683696254
Energy: 1.4767287708282897
Energy: 1.3838840252816333
Energy: 1.4846214019384119
Energy: 1.3722414662439253
Energy: 1.4846214019368074
Energy: 1.373964053893024
Energy: 1.4074482972982578
Energy: 1.3675978378285554
Energy: 1.4074482972974556
Energy: 1.4047712808191475
Energy: 1.4180789975186967
Energy: 1.372673044200832
Energy: 1.4180789975178947
Energy: 1.404585621073044
Energy: 1.4011684533769744
Energy: 1.3741518082675745
Energy: 1.4011684533761721
Energy: 1.3918566994422252
Energy: 1.4057253438706985
Energy: 1.3842843427071851
Energy: 1.4057253438698962
Energy: 1.3755195634897217
Energy: 1.4727663575247176
Energy: 1.4566242665132947
Energy: 1.4727663575255197
Energy: 1.4238309227961659
Energy: 1.4882330346963635
Energy: 1.37801412066284
Energy: 1.4882330346963635
Energy: 1.3748282667706215
Energy: 1.486399523649044
Energy: 1.8272267634326962
Energy: 1.486399523649044
Energy: 1.5856011321114105
Energy: 1.4054630267600527
Energy: 1.382648481711257
Energy: 1.405463026760855
Energy: 1.3712770991046905
Energy: 1.3838725672091323
Energy: 1.5830849713323425
Energy: 1.3838725672107368
Energy: 1.5906929065126225
Energy: 1.4635927403242528
Energy: 1.373761312952311
Energy: 1.4635927403242528
Energy: 1.3812446983580486
Energy: 1.4817624611006868
Energy: 1.385073011019936
Energy: 1.4817624611006868

minimum gb energy = 1.3627009034428368 eV
minimum distance =  2.20499599413563 Angstroms
sigma value = 1


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

Energy: 1.347393598629281
Energy: 1.3468898751136191
Energy: 1.374330766940627
Energy: 1.3468898751158376
Energy: 1.4186401468119614
Energy: 1.373141853398139
Energy: 1.3353386075828897
Energy: 1.373141853398139
Energy: 1.3038068452217644
Energy: 1.3470177619864088
Energy: 1.8040474004455507
Energy: 1.3470177619897366
Energy: 1.4022108113104843
Energy: 1.447322940465407
Energy: 1.3185522190824217
Energy: 1.447322940465407
Energy: 1.3040962760185917
Energy: 1.47960783033146
Energy: 1.5825159226616001
Energy: 1.4796078303259135
Energy: 1.3051158310242472
Energy: 1.3506037258170491
Energy: 1.3182953556532153
Energy: 1.3506037258192678
Energy: 1.304131794841354
Energy: 1.4801011323837299
Energy: 1.3201579037661473
Energy: 1.4801011323859483
Energy: 1.29895740531995
Energy: 1.3510220846200722
Energy: 1.3328682514960821
Energy: 1.3510220846234005
Energy: 1.3463603320871422
Energy: 1.3530350965533149
Energy: 1.3333613767865384
Energy: 1.353035096551096
Energy: 1.3463409162246092
Energy: 1.3530598012259438
Energy: 1.3546183387041726
Energy: 1.3530598012281627
Energy: 1.298797451050255
Energy: 1.351219191364471
Energy: 1.3337476430902853
Energy: 1.3512191913633618
Energy: 1.2995514734033067
Energy: 1.4800639510812186
Energy: 1.3383488898785487
Energy: 1.4800639510778906
Energy: 1.3049134926055583
Energy: 1.3505374261277743
Energy: 1.3182935507702842
Energy: 1.3505374261266652
Energy: 1.304307317846257
Energy: 1.4796188614110934
Energy: 1.491413690575679
Energy: 1.4796188614122028
Energy: 1.4023801259892885
Energy: 1.4473286253829252
Energy: 1.318277206483446
Energy: 1.447328625384034
Energy: 1.3038092888914172
Energy: 1.3469700738355432
Energy: 1.685762817462217
Energy: 1.3469700738344343
Energy: 1.418804280848303
Energy: 1.3731265569619282
Energy: 1.3353730514014552
Energy: 1.3731265569597098
Energy: 1.3473935986303904
Energy: 1.3468898751136191
Energy: 1.5758870659420032
Energy: 1.3468898751147282
Energy: 1.41864014681418
Energy: 1.3731418533992483
Energy: 1.335338607583999
Energy: 1.373141853398139
Energy: 1.3038068452217644
Energy: 1.3470177619864088
Energy: 1.8040474004455507
Energy: 1.3470177619897366
Energy: 1.402210811309375
Energy: 1.447322940465407
Energy: 1.3185522190824217
Energy: 1.447322940465407
Energy: 1.3040962760208104
Energy: 1.47960783033146
Energy: 1.5825159226627095
Energy: 1.479607830327023
Energy: 1.305115831027575
Energy: 1.3506037258170491
Energy: 1.318295355655434
Energy: 1.3506037258181587
Energy: 1.3041317948424636
Energy: 1.4801011323837299
Energy: 1.3201579037672568
Energy: 1.4801011323859483

minimum gb energy = 1.298797451050255 eV
minimum distance =  2.22443125964931 Angstroms
sigma value = 17


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

Energy: 1.3359094691407476
Energy: 1.3357101872287633
Energy: 1.6462923900526252
Energy: 1.3357101872267063
Energy: 1.5486934227177698
Energy: 1.3253453965003283
Energy: 1.3098424518360205
Energy: 1.325345396501014
Energy: 1.3060714816556944
Energy: 1.3195872024508992
Energy: 1.59675791858089
Energy: 1.3195872024522706
Energy: 1.3985784195041373
Energy: 1.2960245306950111
Energy: 1.3041283479683536
Energy: 1.2960245306922686
Energy: 1.295637154796275
Energy: 1.422225307995379
Energy: 1.6278294485584035
Energy: 1.422225307995379
Energy: 1.2955043225068088
Energy: 1.3142899728733302
Energy: 1.3216716190471138
Energy: 1.3142899728733302
Energy: 1.3299158162171918
Energy: 1.4017500735037791
Energy: 1.3198546070470851
Energy: 1.4017500735051502
Energy: 1.2912561151468915
Energy: 1.5977402912707634
Energy: 1.2988336836744347
Energy: 1.5977402912728202
Energy: 1.333280759779997
Energy: 1.6029738175227013
Energy: 1.3572598423288815
Energy: 1.6029738175220154
Energy: 1.3200277490439358
Energy: 1.4008611842846856
Energy: 1.306725367210849
Energy: 1.4008611842846856
Energy: 1.3102829144162877
Energy: 1.3752522303879804
Energy: 1.3012444332314634
Energy: 1.3752522303893517
Energy: 1.2975214947804004
Energy: 1.40014209643414
Energy: 1.28865366364868
Energy: 1.4001420964334546
Energy: 1.2930478553902232
Energy: 1.388277336065496
Energy: 1.3082903787425697
Energy: 1.388277336063439
Energy: 1.3162221733658657
Energy: 1.4215995985979386
Energy: 1.3346924198731291
Energy: 1.4215995985993097
Energy: 1.2980542885193096
Energy: 1.3063441267693245
Energy: 1.3469175229167374
Energy: 1.3063441267706957
Energy: 1.3116446078248296
Energy: 1.320572416976412
Energy: 1.6247081802015775
Energy: 1.3205724169750406
Energy: 1.3051322620506538
Energy: 1.304444984770773
Energy: 1.3075108212254496
Energy: 1.30444498477283
Energy: 1.298604558892171
Energy: 1.4570276503093649
Energy: 1.354996868309793
Energy: 1.4570276503086792
Energy: 1.4885182184652885
Energy: 1.4030469016184226
Energy: 1.3093407374912573
Energy: 1.4030469016197937
Energy: 1.3162604571578496
Energy: 1.3202313338620206
Energy: 1.515512333255505
Energy: 1.3202313338606495
Energy: 1.5429585367684735
Energy: 1.3156021500343191
Energy: 1.3276887803698671
Energy: 1.3156021500343191
Energy: 1.3283032610952674
Energy: 1.4576057222528593
Energy: 1.3568165867047908
Energy: 1.4576057222521734
Energy: 1.4895905255401247
Energy: 1.3123039844335063
Energy: 1.318153735341772
Energy: 1.3123039844314495
Energy: 1.3089707960075414
Energy: 1.4035473348139909
Energy: 1.4946695766153562
Energy: 1.4035473348167333
Energy: 1.379405046145443
Energy: 1.3362552771981588
Energy: 1.300982521241018
Energy: 1.3362552771967877
Energy: 1.3113852147716345
Energy: 1.4249784393660407
Energy: 1.3040798194760974
Energy: 1.4249784393646696
Energy: 1.4810279318075996
Energy: 1.3911848367295414
Energy: 1.3035749714651728
Energy: 1.3911848367288557
Energy: 1.3450442513340357
Energy: 1.4802885904092482
Energy: 1.30436908942409
Energy: 1.48028859040582
Energy: 1.3344726051449216
Energy: 1.4211196195953002
Energy: 1.3212308274176137
Energy: 1.421119619597357
Energy: 1.3238860857872858
Energy: 1.3913688809612252
Energy: 1.336505403322703
Energy: 1.391368880966025
Energy: 1.303782434638709
Energy: 1.4210099810320973
Energy: 1.3097638066061366
Energy: 1.4210099810341539
Energy: 1.3052341207693967
Energy: 1.3714730352577897
Energy: 1.3073785260385793
Energy: 1.3714730352605324
Energy: 1.3036341611973752
Energy: 1.4013684906785162
Energy: 1.5051147900047959
Energy: 1.4013684906778308
Energy: 1.3671846611892393
Energy: 1.5019370279674755
Energy: 1.3227856932273405
Energy: 1.5019370279681614
Energy: 1.297985116854416
Energy: 1.3370613862997622
Energy: 1.340995210298034
Energy: 1.3370613863031906
Energy: 1.3210336121457105
Energy: 1.4042711330101714
Energy: 1.327529768671366
Energy: 1.4042711330067432
Energy: 1.3181708062330775
Energy: 1.3145352547852298
Energy: 1.2994540515969701
Energy: 1.314535254784544
Energy: 1.3547671868198472
Energy: 1.4245490489514032
Energy: 1.3124152488853018
Energy: 1.424549048950032

minimum gb energy = 1.28865366364868 eV
minimum distance =  2.21464818359199 Angstroms
sigma value = 89


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

Energy: 1.1851618400944712
Energy: 1.1851944519002813
Energy: 1.9637803707583534
Energy: 1.1851944519002813
Energy: 1.1851145941251109
Energy: 1.2251168883157126
Energy: 1.2040718275592832
Energy: 1.2251168883157126
Energy: 1.2011865272894513
Energy: 1.409176375782862
Energy: 1.9640877518551272
Energy: 1.409176375784656
Energy: 1.213038106346035
Energy: 1.2252708119786064
Energy: 1.2038883923924395
Energy: 1.2252708119804003
Energy: 1.200414123460692
Energy: 1.311434960491699
Energy: 1.9039018307989057
Energy: 1.311434960491699
Energy: 1.2004660075968843
Energy: 1.186227748915128
Energy: 1.1890547300654197
Energy: 1.186227748915128
Energy: 1.2016135244600177
Energy: 1.4088700093042
Energy: 1.1848988685766846
Energy: 1.4088700093042
Energy: 1.2020852849207178
Energy: 1.4085279803799968
Energy: 1.2040528796370842
Energy: 1.4085279803799968
Energy: 1.2004854076160734
Energy: 1.311831159275996
Energy: 1.2126092949507579
Energy: 1.311831159275996
Energy: 1.2246676979996929
Energy: 1.3104412013289013
Energy: 1.2004125124213865
Energy: 1.3104412013306952
Energy: 1.1845763004981744
Energy: 1.2261534027576708
Energy: 1.2006885285797406
Energy: 1.2261534027576708
Energy: 1.1846085849102947
Energy: 1.4101288179543043
Energy: 1.204052797355131
Energy: 1.4101288179560982
Energy: 1.200510641065334
Energy: 1.1888670302084539
Energy: 1.2125197131776908
Energy: 1.1888670302066595
Energy: 1.2004348051727112
Energy: 1.311030982623084
Energy: 1.2004803241591755
Energy: 1.3110309826212898
Energy: 1.1839024589122356
Energy: 1.1889882178823272
Energy: 1.2005270188291153
Energy: 1.1889882178823272

minimum gb energy = 1.1839024589122356 eV
minimum distance =  2.23953292318495 Angstroms
sigma value = 13


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

Energy: 1.1821970669164439
Energy: 1.1428527720776342
Energy: 1.352566829999465
Energy: 1.1428527720671076
Energy: 1.3455736649310641
Energy: 1.1718556072834
Energy: 1.1311933800765224
Energy: 1.1718556072894155
Energy: 1.1445695869087975
Energy: 1.143296054332161
Energy: 1.706264406888709
Energy: 1.143296054341936
Energy: 1.1689594645043349
Energy: 1.171661172350676
Energy: 1.1292736981382376
Energy: 1.1716611723484203
Energy: 1.15054354277985
Energy: 1.2347748548701563
Energy: 1.2107866559995601
Energy: 1.2347748548694044
Energy: 1.1574741950846557
Energy: 1.17176302324588
Energy: 1.1538867476772028
Energy: 1.1717630232391123
Energy: 1.1502634410123809
Energy: 1.238411245942838
Energy: 1.4958403456560112
Energy: 1.2384112459383265
Energy: 1.1192704755971206
Energy: 1.1726192455250417
Energy: 1.1540261242289185
Energy: 1.1726192455220341
Energy: 1.1503710572866708
Energy: 1.2381396576813786
Energy: 1.3269182259193162
Energy: 1.2381396576768668
Energy: 1.3573952125690472
Energy: 1.2599148408413374
Energy: 1.1297056530190572
Energy: 1.259914840846601
Energy: 1.1504699937231
Energy: 1.2607997217628493
Energy: 1.157304497831474
Energy: 1.2607997217538263
Energy: 1.4982296072164674
Energy: 1.2596388516384505
Energy: 1.1371154817229039
Energy: 1.2596388516346912
Energy: 1.1942870593625134
Energy: 1.1606462261356616
Energy: 1.1388850144923095
Energy: 1.1606462261386694
Energy: 1.527398284863863
Energy: 1.2603241110171313
Energy: 1.13711466553766
Energy: 1.2603241110133716
Energy: 1.1507688220148182
Energy: 1.1420037616479626
Energy: 1.1380034088672584
Energy: 1.142003761646459
Energy: 1.1327765877537392
Energy: 1.2602381492229393
Energy: 1.1266386467404987
Energy: 1.2602381492274508
Energy: 1.1460690428975326
Energy: 1.2272046227183404
Energy: 1.1267338082485114
Energy: 1.2272046227175883
Energy: 1.1644302891174028
Energy: 1.234053799885495
Energy: 1.150113613007647
Energy: 1.2340537998847432
Energy: 1.146192964188422
Energy: 1.2352555064747237
Energy: 1.149869992444982
Energy: 1.2352555064574298
Energy: 1.1462353490901354
Energy: 1.2349261872595152
Energy: 1.1499138043103883
Energy: 1.2349261872565074
Energy: 1.1644298808507794
Energy: 1.2340494093415133
Energy: 1.150062049459951
Energy: 1.2340494093460248
Energy: 1.1459967824152195
Energy: 1.227172144754968
Energy: 1.1267407600844195
Energy: 1.2271721447474484
Energy: 1.1325055052790607
Energy: 1.2602375140983386
Energy: 1.1265952589980497
Energy: 1.260237514105106
Energy: 1.1505922797723205
Energy: 1.1421010115393349
Energy: 1.1680660250213537
Energy: 1.1421010115513657
Energy: 1.5273861155908086
Energy: 1.2603574818841787
Energy: 1.137454685104827
Energy: 1.260357481881171
Energy: 1.1894796033242316
Energy: 1.1607920623132824
Energy: 1.1670601986677909
Energy: 1.1607920623155383
Energy: 1.4982486586907906
Energy: 1.2597655570776496
Energy: 1.1371709900994227
Energy: 1.2597655570761457
Energy: 1.1502476583415329
Energy: 1.2607682165594232
Energy: 1.159563945774427
Energy: 1.2607682165564158
Energy: 1.3578767971100452
Energy: 1.25985237592174
Energy: 1.129689295722664
Energy: 1.2598523759270033
Energy: 1.1505554461566918
Energy: 1.2379267505514724
Energy: 1.5039101156203403
Energy: 1.237926750546209
Energy: 1.1192294390767905
Energy: 1.1726566031459145
Energy: 1.1538028934280862
Energy: 1.1726566031586974
Energy: 1.1507131101502737
Energy: 1.2385036811432102
Energy: 1.673677561266972
Energy: 1.2385036811507297
Energy: 1.157281431849325
Energy: 1.17174778652219
Energy: 1.1538717642312382
Energy: 1.1717477865319648
Energy: 1.150640859339391
Energy: 1.2345957586389489
Energy: 1.198443289844118
Energy: 1.234595758638197
Energy: 1.1686495217210429
Energy: 1.1718633324722527
Energy: 1.1293156030153964
Energy: 1.1718633324865393

minimum gb energy = 1.1192294390767905 eV
minimum distance =  2.25576096159881 Angstroms
sigma value = 37


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

Energy: 1.0870704092057542
Energy: 1.0860929468517044
Energy: 1.306372761660487
Energy: 1.0860929468517044
Energy: 1.1571051646412625
Energy: 1.3804165135837458
Energy: 1.0352411334516594
Energy: 1.3804165135837458
Energy: 1.0516916964352594
Energy: 1.4875096790712676
Energy: 1.7993441582049081
Energy: 1.4875096790725613
Energy: 1.0253973980959838
Energy: 1.3797441637165333
Energy: 1.0353958251478235
Energy: 1.379744163717827
Energy: 1.033596536426931
Energy: 1.3794616807888134
Energy: 1.0252976908351172
Energy: 1.379461680790107
Energy: 1.0381507111635426
Energy: 1.3796393706875139
Energy: 1.02863411960676
Energy: 1.3796393706875139
Energy: 1.0689099928839763
Energy: 1.8314771501734495
Energy: 1.3538459881971152
Energy: 1.8314771501734495
Energy: 1.0331213446007976
Energy: 1.0871312941347377
Energy: 1.0869360346105246
Energy: 1.0871312941347377
Energy: 1.0336658813174513
Energy: 1.3796240341469732
Energy: 1.3547893992629545
Energy: 1.3796240341482668
Energy: 1.4206808024089537
Energy: 1.3788173759446554
Energy: 1.0288295839318178
Energy: 1.3788173759433617
Energy: 1.069013435343401
Energy: 1.8236428616404974
Energy: 1.0252089716218047
Energy: 1.8236428616404974
Energy: 1.399943027014207
Energy: 1.0856916829158823
Energy: 1.0352554378155412
Energy: 1.0856916829158823
Energy: 1.0250105627193813
Energy: 1.3793591837609662
Energy: 1.0381222888451258
Energy: 1.3793591837609662
Energy: 1.353892044205482
Energy: 1.8242741018060167
Energy: 1.0332137379934088
Energy: 1.8242741018060167
Energy: 1.0853226098611317
Energy: 1.1426752020287172
Energy: 1.033270007770072
Energy: 1.1426752020274233
Energy: 1.0855811407561746
Energy: 1.3790681489116654
Energy: 1.0352563532695789
Energy: 1.379068148912959
Energy: 1.0250092403467566
Energy: 1.379054478768158
Energy: 1.038102512816122
Energy: 1.379054478768158
Energy: 1.0251684966434822
Energy: 1.8248331827351278
Energy: 1.0331366363851884
Energy: 1.8248331827351278
Energy: 1.033945271059119
Energy: 1.0874630959531275
Energy: 1.0331713794669681
Energy: 1.0874630959531275
Energy: 1.0332704390412943
Energy: 1.3790875557877849
Energy: 1.0250287578305024
Energy: 1.3790875557877849

minimum gb energy = 1.0250092403467566 eV
minimum distance =  2.16689470697104 Angstroms
sigma value = 25


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

Energy: 1.009298979324704
Energy: 0.9487382449796233
Energy: 1.278014953797187
Energy: 0.9487382449786133
Energy: 1.432947600051978
Energy: 0.9740124787242074
Energy: 0.9500648035589558
Energy: 0.9740124787242074
Energy: 0.9448982798795434
Energy: 0.9445664634690805
Energy: 1.2580210133326066
Energy: 0.9445664634680704
Energy: 1.1839969246445459
Energy: 1.1977871127101003
Energy: 0.9499221217614048
Energy: 1.1977871127121207
Energy: 0.9520010044625481
Energy: 0.9737083288605198
Energy: 0.9144214678989818
Energy: 0.9737083288615299
Energy: 0.913614405428101
Energy: 1.197719657484973
Energy: 0.9499506724970195
Energy: 1.1977196574859834
Energy: 0.9522858717858318
Energy: 0.9445226353032968
Energy: 1.1853527839858866
Energy: 0.9445226353043071
Energy: 0.9194503477746122
Energy: 1.010086277276063
Energy: 0.9468004796349657
Energy: 1.0100862772770731
Energy: 0.9491921454078815
Energy: 0.9741101866215802
Energy: 1.37586262417889
Energy: 0.9741101866215802
Energy: 0.9181952550607102
Energy: 0.9456433836551286
Energy: 1.0111010859133185
Energy: 0.9456433836551286
Energy: 0.9522146458394722
Energy: 0.9446322766323887
Energy: 1.4157157808858003
Energy: 0.9446322766344091
Energy: 1.2319694081132384
Energy: 1.4871584986581072
Energy: 0.9468735147994428
Energy: 1.4871584986581072
Energy: 0.9517744827468837
Energy: 0.9738506525684164
Energy: 1.1656211721853287
Energy: 0.9738506525684164
Energy: 1.2275336703357291
Energy: 1.0530539166732917
Energy: 0.9501842245403596
Energy: 1.0530539166743018
Energy: 0.9524091197252709
Energy: 0.9445001502838142
Energy: 0.9133907515164021
Energy: 0.9445001502857886
Energy: 1.214087635737334
Energy: 1.5763626610454244
Energy: 0.9501546226554893
Energy: 1.5763626610444141
Energy: 0.949073473189647
Energy: 1.0102287023383314
Energy: 0.9196613931236348
Energy: 1.0102287023383314
Energy: 1.1994372104509585
Energy: 0.9739288573575157
Energy: 0.9503451517542004
Energy: 0.9739288573554953
Energy: 1.011721219356821
Energy: 0.9452694631386369
Energy: 0.9193234908235557
Energy: 0.9452694631386369
Energy: 1.4150313143290125
Energy: 1.3321078213592576
Energy: 0.9502144888254478
Energy: 1.3321078213592576
Energy: 0.9491869954679106
Energy: 1.353963065995556
Energy: 0.9405005734557744
Energy: 1.3539630659965662
Energy: 0.9445070656328325
Energy: 0.9740605944684025
Energy: 0.9501191111533569
Energy: 0.9740605944673923
Energy: 0.9524284753325557
Energy: 1.0514600768320597
Energy: 1.2281184273735437
Energy: 1.0514600768320597
Energy: 0.9135505556793438
Energy: 1.6134695455966677
Energy: 0.9505731679176466
Energy: 1.6134695455966677
Energy: 0.950249084361644
Energy: 1.3545330088882377
Energy: 1.2281699733054359
Energy: 1.3545330088892478
Energy: 0.9183618653928801
Energy: 1.0104482712178624
Energy: 0.9443467645498153
Energy: 1.0104482712148317

minimum gb energy = 0.9133907515164021 eV
minimum distance =  2.26268396107125 Angstroms
sigma value = 41


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

Energy: 1.2536472319222296
Energy: 0.88581007148586
Energy: 1.1386899670035622
Energy: 0.88581007148586
Energy: 1.5995228218493847
Energy: 0.8633792078873512
Energy: 0.8521058824489227
Energy: 0.8633792078873512
Energy: 0.883630042307301
Energy: 0.8492932896686786
Energy: 1.138615849098151
Energy: 0.8492932896686786
Energy: 1.2334808533090358
Energy: 0.8640041851140947
Energy: 0.8519329783102407
Energy: 0.8640041851140947
Energy: 0.8465152492876656
Energy: 1.0890208257142688
Energy: 0.830064396527232
Energy: 1.0890208257142688
Energy: 1.0522243703419623
Energy: 0.864523643680759
Energy: 0.8519270078533886
Energy: 0.8645236436815872
Energy: 0.8509419875901777
Energy: 1.0529237957893298
Energy: 0.902978825043583
Energy: 1.0529237957885016
Energy: 0.8289829128180503
Energy: 0.8836789494228431
Energy: 0.8476845466133301
Energy: 0.8836789494253278
Energy: 0.8548317603022323
Energy: 1.2222890095190486
Energy: 1.2803627154159956
Energy: 1.222289009520705
Energy: 0.8280636121603807
Energy: 0.8492913816939831
Energy: 0.8848898978825466
Energy: 0.8492913816939831
Energy: 0.85094004987725
Energy: 0.863796665085612
Energy: 1.41574671843159
Energy: 0.8637966650864404
Energy: 0.8327227876466573
Energy: 0.8859277065009675
Energy: 1.254413429814846
Energy: 0.8859277065009675
Energy: 0.855145580257158
Energy: 1.2218477824341207
Energy: 1.4155207012347495
Energy: 1.2218477824341207
Energy: 1.0962588271857239
Energy: 1.2206095026762223
Energy: 0.8849452519138371
Energy: 1.220609502675394
Energy: 0.8509992464380935
Energy: 0.8636744081108101
Energy: 1.2330739010716767
Energy: 0.8636744081083256
Energy: 1.0937357636637022
Energy: 1.068818486151133
Energy: 0.8476585743551552
Energy: 1.0688184861503047
Energy: 0.8551445370632452
Energy: 1.2192887030820827
Energy: 1.0322292184270703
Energy: 1.2192887030812545
Energy: 1.0908868140926724
Energy: 1.220308037846649
Energy: 0.8521202093102795
Energy: 1.2203080378474773
Energy: 0.8510548095793249
Energy: 0.8835805887985374
Energy: 0.8290739353759451
Energy: 0.8835805887977092
Energy: 1.1003228342979567
Energy: 1.4055224731729365
Energy: 0.8547522469786791
Energy: 1.4055224731721083
Energy: 0.888155690997274
Energy: 1.2192096892447022
Energy: 0.8290343510223055
Energy: 1.219209689243874
Energy: 1.416146305849363
Energy: 1.5389661327399293
Energy: 0.8522125649497688
Energy: 1.5389661327415856
Energy: 1.256753706136439
Energy: 0.8832773076386898
Energy: 0.8326266191678883
Energy: 0.8832773076386898
Energy: 1.2542607984165963
Energy: 1.40396536550624
Energy: 0.85475304164226
Energy: 1.40396536550624
Energy: 0.8880586102669094
Energy: 1.2197664506126358
Energy: 0.8337469034482642
Energy: 1.2197664506126358
Energy: 1.2334557360162985
Energy: 1.5382386985160799
Energy: 0.8520548082936221
Energy: 1.5382386985152519
Energy: 0.8510536367346017
Energy: 0.884273382395046
Energy: 1.0940245045649981
Energy: 0.8842733823958743
Energy: 0.8467784126284423
Energy: 1.2188792445589764
Energy: 0.8545765145583153
Energy: 1.2188792445589764
Energy: 0.8552435213386801
Energy: 1.2199870063469633
Energy: 1.0908846636307128
Energy: 1.219987006345307
Energy: 0.8289310320977927
Energy: 1.270529669598263
Energy: 0.8557271366817224
Energy: 1.2705296695990913
Energy: 0.8586034678148294
Energy: 0.8843884240768277
Energy: 1.1000735201724843
Energy: 0.8843884240784841
Energy: 0.8329311839906418
Energy: 1.2192086334200896
Energy: 0.8929615448223425
Energy: 1.2192086334184329

minimum gb energy = 0.8280636121603807 eV
minimum distance =  2.23838592038333 Angstroms
sigma value = 15


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

Energy: 1.1396004701562974
Energy: 0.8029880495624491
Energy: 1.501666362642314
Energy: 0.8029880495603445
Energy: 1.4153761648807288
Energy: 0.8016720387066728
Energy: 0.8002173061909849
Energy: 0.8016720387101807
Energy: 0.83142019779568
Energy: 0.798236949727114
Energy: 1.036843513603465
Energy: 0.7982369497278156
Energy: 1.2611862616338858
Energy: 0.8026927174498354
Energy: 0.8001600051485517
Energy: 0.8026927174526418
Energy: 0.7967416354545701
Energy: 1.3838690373742648
Energy: 0.7642276288438445
Energy: 1.3838690373749662
Energy: 1.1026543293176112
Energy: 0.8000432811632747
Energy: 0.8000131432517811
Energy: 0.8000432811618715
Energy: 0.7991737450448512
Energy: 0.9690572458171647
Energy: 0.8228489151433912
Energy: 0.9690572458192694
Energy: 0.9531204179925721
Energy: 0.8149009265850354
Energy: 0.7999060589161986
Energy: 0.8149009265850354
Energy: 0.8021577540608893
Energy: 1.390926035893393
Energy: 1.1638845828457327
Energy: 1.3909260358926918
Energy: 0.7628448294158959
Energy: 0.7997692299915815
Energy: 0.7972226729953198
Energy: 0.7997692299922832
Energy: 0.799459064096507
Energy: 0.8003948256797079
Energy: 1.3171539060751458
Energy: 0.8003948256825141
Energy: 0.7630750961971519
Energy: 0.7983355253817218
Energy: 0.8322130594628873
Energy: 0.7983355253775124
Energy: 0.8022489332485111
Energy: 1.3902673926663476
Energy: 1.407678621825511
Energy: 1.3902673926670492
Energy: 0.7663936176843593
Energy: 0.8035321878498379
Energy: 1.1402526347994257
Energy: 0.8035321878470315
Energy: 0.7993902999259666
Energy: 0.801733796308385
Energy: 1.4154042783509484
Energy: 0.801733796316804
Energy: 0.9891398146635123
Energy: 0.7982945805763738
Energy: 0.8320358540921802
Energy: 0.7982945805728658
Energy: 0.8021031482012
Energy: 1.389690725549826
Energy: 1.261100393112118
Energy: 1.3896907255470197
Energy: 0.9885984186327623
Energy: 1.3815221416430457
Energy: 0.7972493711941265
Energy: 1.3815221416451504
Energy: 0.7993676685314045
Energy: 0.800085609954959
Energy: 1.1021305803906953
Energy: 0.800085609956362
Energy: 0.986699705772066
Energy: 0.800234810994482
Energy: 0.8001719310889256
Energy: 0.8002348109930788
Energy: 0.8021016674260583
Energy: 1.1284179514805253
Energy: 0.933236718991499
Energy: 1.1284179514798238
Energy: 0.9924431730048969
Energy: 1.3864395201757276
Energy: 0.8053839877694632
Energy: 1.3864395201757276
Energy: 0.799347073144933
Energy: 0.8001491393772974
Energy: 0.7628562566662335
Energy: 0.8001491393786369
Energy: 1.317777412228504
Energy: 0.7992012161015029
Energy: 0.8001637090178332
Energy: 0.7992012161000996
Energy: 0.834172127724129
Energy: 1.1281725849917772
Energy: 0.76342836857286
Energy: 1.1281725849931803
Energy: 1.2804481557272616
Energy: 1.3881162043132442
Energy: 0.8054706634342513
Energy: 1.3881162043146473
Energy: 1.141967750298509
Energy: 1.378403600178277
Energy: 0.7665137314567465
Energy: 1.3784036001789788
Energy: 1.4276758964784213
Energy: 0.9584810433800548
Energy: 0.8000177110860981
Energy: 0.9584810433828612
Energy: 0.8343637980228824
Energy: 1.4099148439038096
Energy: 0.7672609503794505
Energy: 1.4099148439038096
Energy: 1.115091499671439
Energy: 1.387618028792455
Energy: 0.8056081853299482
Energy: 1.387618028791052
Energy: 0.7994960727208554
Energy: 1.116466621541494
Energy: 0.9892517908922923
Energy: 1.116466621541494
Energy: 1.1020521279764892
Energy: 0.80053570708504
Energy: 0.8000471513048546
Energy: 0.800535707081532
Energy: 0.8021205843698009
Energy: 1.4101269278397395
Energy: 0.9863820450762496
Energy: 1.4101269278397395
Energy: 0.7741942846213472
Energy: 1.128194322004341
Energy: 0.8055802973074727
Energy: 1.1281943220064459
Energy: 0.7915737788598534
Energy: 1.1176687710212683
Energy: 0.9924917145178437
Energy: 1.1176687710212683
Energy: 0.7624391207983476
Energy: 0.800062321174654
Energy: 0.802781035493089
Energy: 0.8000623211739525
Energy: 0.8023417356179338
Energy: 1.409887835736471
Energy: 1.3328752713344914
Energy: 1.4098878357350682

minimum gb energy = 0.7624391207983476 eV
minimum distance =  2.194632842916 Angstroms
sigma value = 85


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

Energy: 1.1606523188204938
Energy: 1.3239432184489521
Energy: 0.6915874759603536
Energy: 1.3239432184477353
Energy: 1.569461090726254
Energy: 1.0545062842478428
Energy: 0.7356738057100901
Energy: 1.0545062842490598
Energy: 1.1126856470170066
Energy: 0.7959019623074989
Energy: 1.0957415880726757
Energy: 0.7959019623026311
Energy: 1.3309388681652514
Energy: 0.7812566457742561
Energy: 0.7355717000588516
Energy: 0.7812566457742561
Energy: 0.8533216733488382
Energy: 0.7465433660675566
Energy: 0.789637729082044
Energy: 0.746543366066948
Energy: 1.196841803786244
Energy: 0.856075906953868
Energy: 0.7357608115253581
Energy: 0.8560759069581274
Energy: 0.8068427356069672
Energy: 0.9281048869842147
Energy: 0.8588080003141543
Energy: 0.9281048869823892
Energy: 1.054675553356394
Energy: 0.8411998319938745
Energy: 0.7472430971915092
Energy: 0.8411998319926576
Energy: 0.7463160156046674
Energy: 0.8816549977339354
Energy: 1.113797647499892
Energy: 0.8816549977351523
Energy: 0.9260131769707648
Energy: 0.8557716883882236
Energy: 0.8076316204635818
Energy: 0.8557716883870067
Energy: 0.735755285936183
Energy: 0.7799512395475754
Energy: 1.2563712790099184
Energy: 0.7799512395518348
Energy: 0.7598494768036439
Energy: 0.8486280439352382
Energy: 0.8539102087578837
Energy: 0.8486280439346297
Energy: 0.7350462023928277
Energy: 0.7537626610685296
Energy: 1.3681175721379641
Energy: 0.7537626610697465
Energy: 0.688347314836596
Energy: 0.7969994553372299
Energy: 1.1130946732091367
Energy: 0.7969994553360406
Energy: 0.7352961396503334
Energy: 0.7806235735814366
Energy: 1.459843667015993
Energy: 0.7806235735808281
Energy: 0.6877808681746618
Energy: 1.2937357436775225
Energy: 1.078859519596298
Energy: 1.2937357436756969
Energy: 0.7349693040527002
Energy: 0.7559483757811749
Energy: 1.3946657949422427
Energy: 0.7559483757823919
Energy: 0.8814820699285645
Energy: 0.7968629652435308
Energy: 1.1129499482664307
Energy: 0.7968629652441392
Energy: 0.7352647290051049
Energy: 0.7812384576118241
Energy: 1.3308214568637247
Energy: 0.7812384576130411
Energy: 0.8846527125183259
Energy: 1.3187463896689549
Energy: 0.8541730951446723
Energy: 1.3187463896695633
Energy: 0.736540698210411
Energy: 0.7667885718201188
Energy: 1.196605739078474
Energy: 0.7667885718158592
Energy: 0.9542917820464512
Energy: 0.9926912531967206
Energy: 0.8076724941393264
Energy: 0.9926912531985461
Energy: 0.7470518583220601
Energy: 0.7787975220136245
Energy: 1.0544279754541594
Energy: 0.77879752201545
Energy: 0.9665693547969132
Energy: 1.3151147297621864
Energy: 0.7475176731951138
Energy: 1.3151147297609695
Energy: 0.8096673547834288
Energy: 0.8411480959441854
Energy: 0.9070186946962174
Energy: 0.8411480959411429
Energy: 1.2553845696735446
Energy: 1.0309777845912846
Energy: 0.7362531254311843
Energy: 1.030977784588242
Energy: 0.8560225302243166
Energy: 0.7779766993406525
Energy: 0.7594766249836149
Energy: 0.777976699341261
Energy: 1.2634386032344147
Energy: 1.3222586377171806
Energy: 0.7356723016467306
Energy: 1.3222586377196144
Energy: 1.1130389934589566
Energy: 0.8583066636393554
Energy: 0.6865370608827263
Energy: 0.8583066636381385
Energy: 1.4599171230792287
Energy: 0.9037187659261671
Energy: 0.7362693659138332
Energy: 0.9037187659237331
Energy: 1.1615281119670018
Energy: 1.3116775429284702
Energy: 0.6877421300403695
Energy: 1.3116775429284702
Energy: 1.36584439803691
Energy: 1.3090645669681442
Energy: 0.7357170801671833
Energy: 1.3090645669675358
Energy: 1.1130054257907487
Energy: 0.8583641632129203
Energy: 0.6890689444607033
Energy: 0.8583641632177881
Energy: 1.3309303375628074
Energy: 0.8419625178365484
Energy: 0.7364337341369043
Energy: 0.841962517838374
Energy: 0.8561054604568779
Energy: 1.3086980931512633
Energy: 0.8849023265919339
Energy: 1.3086980931518717
Energy: 1.0758652840246747
Energy: 1.0059498403921854
Energy: 0.7386097467213802
Energy: 1.0059498403940106
Energy: 0.8097958803527362
Energy: 1.0315296036105448
Energy: 0.9542147217217641
Energy: 1.0315296036129789
Energy: 1.0540806957662776
Energy: 0.778786993508098
Energy: 0.7450996480845087
Energy: 0.7787869935062723
Energy: 0.7470507187355003
Energy: 1.3084440959421644
Energy: 0.9665434592497548
Energy: 1.308444095939122
Energy: 0.7752622157078056
Energy: 1.2199653461214888
Energy: 0.8098951976591998
Energy: 1.2199653461220974
Energy: 0.7344584939024696
Energy: 0.9051075607973307
Energy: 1.2453568855244397
Energy: 0.905107560795505
Energy: 0.7596703648341049
Energy: 0.8415469114459709
Energy: 0.8531285920492783
Energy: 0.8415469114447539
Energy: 0.7353968812492022
Energy: 1.3084983403505495
Energy: 1.2632040179834658
Energy: 1.3084983403517663

minimum gb energy = 0.6865370608827263 eV
minimum distance =  2.19462600155992 Angstroms
sigma value = 113


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

Energy: 0.02053900980169366
Energy: 0.02169636443352225
Energy: 1.1772921844355737
Energy: 0.02169636443440582
Energy: 1.1771048923011416
Energy: 0.4279933264828932
Energy: 0.42865319241051925
Energy: 0.42799332648195776
Energy: 0.02053900980169366
Energy: 0.02169636443352225
Energy: 1.1772921844337547
Energy: 0.02169636443440582
Energy: 1.1771048923011416
Energy: 0.4279933264814899
Energy: 0.4286531924100515
Energy: 0.4279933264814899
Energy: 0.02053900980169366
Energy: 0.02169636443352225
Energy: 1.1772921844341706
Energy: 0.021696364433938044
Energy: 1.1771048923011416
Energy: 0.42799332648242544
Energy: 0.4286531924132219
Energy: 0.4279933264814899

minimum gb energy = 0.02053900980169366 eV
minimum distance =  2.47852803427122 Angstroms
sigma value = 1