Model name: model_name=EAM_Dynamo_ZopeMishin_2003_Al__MO_664470114311_005
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.050000011920929
cohesive_energy=3.3541843831092124
mass=26.981538
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: -0.00607941459516994 eV

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

Energy: 0.010336110765444871
Energy: 0.010873510657301348
Energy: 0.4012340093677305
Energy: 0.010873510657301348
Energy: 0.010873510657773304
Energy: 0.2986405328110886
Energy: 0.010873510657773304
Energy: 0.2986405328110886
Energy: 0.40123400936723086
Energy: 0.010873510657773304
Energy: 0.010336110765444871
Energy: 0.010873510657773304
Energy: 0.010873510657301348
Energy: 0.2986405328110886
Energy: 0.010873510657773304
Energy: 0.2986405328110886

minimum gb energy = 0.010336110765444871 eV
minimum distance =  2.83991059919517 Angstroms
sigma value = 1


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

Energy: 0.47513002262888754
Energy: 0.4829530695969326
Energy: 0.5223764027252648
Energy: 0.4829530695969326
Energy: 0.4749453844085431
Energy: 0.47326219557652593
Energy: 0.48378173093070487
Energy: 0.47326219557652593
Energy: 0.46660502295761563
Energy: 0.4746323193214585
Energy: 0.47151598696988695
Energy: 0.4746323193226706
Energy: 0.44780042195383246
Energy: 0.4587379967859899
Energy: 0.45425870738667523
Energy: 0.4587379967859899
Energy: 0.4492593626997504
Energy: 0.48678308593254305
Energy: 0.4853536135987117
Energy: 0.48678308593314906
Energy: 0.44940961894538456
Energy: 0.48360956058818766
Energy: 0.45603240504515674
Energy: 0.4836095605875817
Energy: 0.47662152363705385
Energy: 0.4703252236901468
Energy: 0.44980163857857763
Energy: 0.47032522368893465
Energy: 0.4391230379263821
Energy: 0.48604686524912183
Energy: 0.455228690445196
Energy: 0.48604686524972796
Energy: 0.45422564192954373
Energy: 0.45434409812950377
Energy: 0.46669269671158004
Energy: 0.4543440981288977
Energy: 0.4527005965303845
Energy: 0.4741305689613815
Energy: 0.4389218600758044
Energy: 0.4741305689613815
Energy: 0.46681241455822364
Energy: 0.47995776515472527
Energy: 0.4541862582793295
Energy: 0.4799577651541192
Energy: 0.47790059293177134
Energy: 0.4859453547285313
Energy: 0.4589173428695667
Energy: 0.4859453547285313
Energy: 0.45293684565095366
Energy: 0.4738664014258883
Energy: 0.47668792580177693
Energy: 0.47386640142528225
Energy: 0.45587151138368065
Energy: 0.4816563466090927
Energy: 0.4514383042602825
Energy: 0.4816563466078806
Energy: 0.46652185432933474
Energy: 0.4835328757676109
Energy: 0.45314332681686503
Energy: 0.48353287576821696
Energy: 0.4700010854086737
Energy: 0.48322863143198796
Energy: 0.4782194870942573
Energy: 0.48322863143198796
Energy: 0.47135695971552344
Energy: 0.47462933079241554
Energy: 0.44493360697417605
Energy: 0.4746293307942337
Energy: 0.48364824111992377
Energy: 0.4718269042307852
Energy: 0.47556724054131594
Energy: 0.4718269042301792
Energy: 0.4647320148216006
Energy: 0.48573898480977973
Energy: 0.45857966474409056
Energy: 0.48573898481099187
Energy: 0.5051224006038224
Energy: 0.45432967205613656
Energy: 0.45509899708470575
Energy: 0.4543296720567426
Energy: 0.4539616785621497
Energy: 0.47467745666854155
Energy: 0.44242851262331256
Energy: 0.47467745666914757
Energy: 0.45430670525007866
Energy: 0.4583597089785844
Energy: 0.4672500628790021
Energy: 0.45835970897919043
Energy: 0.46758831453530636
Energy: 0.4863151510900371
Energy: 0.44383326472889495
Energy: 0.4863151510900371
Energy: 0.4742102494381051
Energy: 0.47492096829539154
Energy: 0.4495089618765994
Energy: 0.47492096829720976
Energy: 0.4497491945231152
Energy: 0.4506897924031876
Energy: 0.4765403408695217
Energy: 0.4506897924025815
Energy: 0.45104318547109473
Energy: 0.48585202144753825
Energy: 0.4440423160391726
Energy: 0.4858520214481443
Energy: 0.4585532161104545
Energy: 0.47625056468946153
Energy: 0.4542196122971011
Energy: 0.47625056468885557
Energy: 0.4456233737831284
Energy: 0.47292857065627536
Energy: 0.46475141151389765
Energy: 0.47292857065627536
Energy: 0.47457386663065776
Energy: 0.4722795017459048
Energy: 0.466592584306509
Energy: 0.4722795017452987
Energy: 0.47635260264135376
Energy: 0.4837972778954759
Energy: 0.4847798690927333
Energy: 0.48379727789608185
Energy: 0.45891953958913595
Energy: 0.4765550447914274
Energy: 0.45306406781062464
Energy: 0.4765550447908214
Energy: 0.4724248140853023
Energy: 0.4758876729573405
Energy: 0.45589266620752444
Energy: 0.4758876729561285
Energy: 0.4491907997273629
Energy: 0.45955898437687204
Energy: 0.45540131176540727
Energy: 0.4595589843780567

minimum gb energy = 0.4389218600758044 eV
minimum distance =  2.55758700134751 Angstroms
sigma value = 1


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

Energy: 0.4866614982139762
Energy: 0.5150958059151983
Energy: 0.5492631850294172
Energy: 0.5150958059179623
Energy: 0.4863624442309184
Energy: 0.4909723631277837
Energy: 0.48777722228006354
Energy: 0.4909723631264017
Energy: 0.4805663744112993
Energy: 0.5140583363589389
Energy: 0.4617624484072408
Energy: 0.5140583363575568
Energy: 0.46410406356771644
Energy: 0.46592143758280224
Energy: 0.4556251187949664
Energy: 0.46592143758072924
Energy: 0.46407316654625735
Energy: 0.49949825751160964
Energy: 0.4900377590530919
Energy: 0.4994982575109187
Energy: 0.4972931592442406
Energy: 0.4996682225216381
Energy: 0.5155626415132968
Energy: 0.49966822252232923
Energy: 0.4965524730624019
Energy: 0.46583047031684105
Energy: 0.4556785186187954
Energy: 0.46583047031476804
Energy: 0.4489127630563559
Energy: 0.514320489202654
Energy: 0.46996135226738517
Energy: 0.5143204892019632
Energy: 0.46407015521382144
Energy: 0.47077580553421866
Energy: 0.48786832662964386
Energy: 0.4707758055404377
Energy: 0.47021769956983134
Energy: 0.5145911549482677
Energy: 0.4607366720627152
Energy: 0.5145911549517228
Energy: 0.49679741476200023
Energy: 0.4858043209020038
Energy: 0.4877448548520518
Energy: 0.4858043208992398
Energy: 0.45621253035030607
Energy: 0.5065065294273343
Energy: 0.4616658467429466
Energy: 0.5065065294280253
Energy: 0.4712284491507534
Energy: 0.4974196973833513
Energy: 0.49024556832197996
Energy: 0.4974196973805872
Energy: 0.4712933150634162
Energy: 0.49744778786131416
Energy: 0.485304722476584
Energy: 0.4974477878647692
Energy: 0.45629234193538665
Energy: 0.5065043137913378
Energy: 0.4616484213749842
Energy: 0.5065043137899558
Energy: 0.4967820149832707
Energy: 0.48579653246450843
Energy: 0.4877065733474163
Energy: 0.4857965324665815
Energy: 0.4702137455410543
Energy: 0.5145460177164041
Energy: 0.46352713116537003
Energy: 0.5145460177150221
Energy: 0.4640578665584131
Energy: 0.4708195882270094
Energy: 0.48799387856135523
Energy: 0.47081958822839143
Energy: 0.4489078399432332
Energy: 0.5142917059010675
Energy: 0.4698806008848412
Energy: 0.5142917059003765
Energy: 0.49656644480108697
Energy: 0.465722844368781
Energy: 0.4619570666195782
Energy: 0.465722844371545
Energy: 0.49732816489618265
Energy: 0.4997048119238858
Energy: 0.46973712136635437
Energy: 0.49970481192250377
Energy: 0.4643616171354406
Energy: 0.4994698869699654
Energy: 0.4974262616434226
Energy: 0.49946988697272937
Energy: 0.4642345180215478
Energy: 0.46591948757078155
Energy: 0.4556794273764622
Energy: 0.4659194875673266
Energy: 0.48051889286280897
Energy: 0.5140767455092615
Energy: 0.461772479668603
Energy: 0.5140767455085703
Energy: 0.48641053436452225
Energy: 0.4909865114903046
Energy: 0.4878990842184236
Energy: 0.49098651148961353
Energy: 0.4866614982139762
Energy: 0.5150958059151983
Energy: 0.5160680562226749
Energy: 0.5150958059179623
Energy: 0.4863624442309184
Energy: 0.4909723631284747
Energy: 0.4877772222807545
Energy: 0.4909723631264017
Energy: 0.4805663744112993
Energy: 0.5140583363589389
Energy: 0.4617624484058588
Energy: 0.5140583363575568
Energy: 0.4641040635684075
Energy: 0.46592143758280224
Energy: 0.4643617839556584
Energy: 0.46592143758142024

minimum gb energy = 0.4489078399432332 eV
minimum distance =  2.52189735544476 Angstroms
sigma value = 25


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

Energy: 0.5028608625239757
Energy: 0.52728509485301
Energy: 0.5813636886581504
Energy: 0.52728509485301
Energy: 0.5108143789463649
Energy: 0.5084844919190644
Energy: 0.4786500193938142
Energy: 0.5084844919198677
Energy: 0.4963784260455758
Energy: 0.5542691382169019
Energy: 0.4798503801196356
Energy: 0.5542691382160987
Energy: 0.47996421654279
Energy: 0.48510952055389694
Energy: 0.4703840004906209
Energy: 0.48510952055389694
Energy: 0.47279328870755466
Energy: 0.5125363475097912
Energy: 0.5147442058949319
Energy: 0.5125363475097912
Energy: 0.5157941698919792
Energy: 0.5321247680361706
Energy: 0.584728624703797
Energy: 0.5321247680361706
Energy: 0.5104654133106823
Energy: 0.48180641717595135
Energy: 0.4870308575691857
Energy: 0.4818064171767547
Energy: 0.550099018487039
Energy: 0.5287406393938396
Energy: 0.46224744752701474
Energy: 0.528740639394643
Energy: 0.4870770954510464
Energy: 0.5082709511651466
Energy: 0.5106062119080631
Energy: 0.5082709511651466
Energy: 0.48938898165862255
Energy: 0.5320684918148553
Energy: 0.4678511801272189
Energy: 0.5320684918148553
Energy: 0.5072979404100043
Energy: 0.5155134483315097
Energy: 0.47840456614670374
Energy: 0.515513448332313
Energy: 0.5029751774123175
Energy: 0.5274409848920495
Energy: 0.4782448714395219
Energy: 0.5274409848928527
Energy: 0.4892413431429865
Energy: 0.5193848114897652
Energy: 0.46700925378676206
Energy: 0.5193848114897652
Energy: 0.4873092428408763
Energy: 0.5136335451301841
Energy: 0.5237668230697661
Energy: 0.5136335451293808
Energy: 0.47749639460816945
Energy: 0.5297779196033876
Energy: 0.46107002824457793
Energy: 0.5297779196033876
Energy: 0.4780967876046887
Energy: 0.48109757763878824
Energy: 0.4717316112553563
Energy: 0.48109757763798505
Energy: 0.4581530394307359
Energy: 0.5583142824755342
Energy: 0.45807492073796274
Energy: 0.5583142824755342
Energy: 0.47032543149699235
Energy: 0.512090195753231
Energy: 0.5060252889016426
Energy: 0.512090195753231
Energy: 0.4873773284359174
Energy: 0.48624957589556617
Energy: 0.471217318268362
Energy: 0.48624957589556617
Energy: 0.5225548121640081
Energy: 0.5571977276873564
Energy: 0.47883295823026895
Energy: 0.5571977276881597
Energy: 0.48446091357634175
Energy: 0.5137780668224777
Energy: 0.4785851628852725
Energy: 0.5137780668224777
Energy: 0.5039708174305958
Energy: 0.5282083627426076
Energy: 0.5152113721963834
Energy: 0.5282083627426076
Energy: 0.5102206621498573
Energy: 0.5097087494233625
Energy: 0.4786077083952598
Energy: 0.5097087494241476
Energy: 0.49688493130428574
Energy: 0.5532267434113948
Energy: 0.4898055038593732
Energy: 0.5532267434113948
Energy: 0.4787269169356625
Energy: 0.484627322587108
Energy: 0.46996061029683456
Energy: 0.484627322587108

minimum gb energy = 0.45807492073796274 eV
minimum distance =  2.5385627376801 Angstroms
sigma value = 9


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

Energy: 0.5193601097527598
Energy: 0.5403715468331742
Energy: 0.6199810408766748
Energy: 0.5403715468331742
Energy: 0.49672070973824073
Energy: 0.5357050159300109
Energy: 0.4979162014219827
Energy: 0.5357050159271362
Energy: 0.5156604402882514
Energy: 0.5036501314188483
Energy: 0.5113063037502319
Energy: 0.5036501314178902
Energy: 0.4988714270595384
Energy: 0.4980324177101902
Energy: 0.4721433659131568
Energy: 0.4980324177111484
Energy: 0.5406035475901922
Energy: 0.5363702208582564
Energy: 0.5109503402118917
Energy: 0.5363702208592146
Energy: 0.46484205192566563
Energy: 0.5152476435821997
Energy: 0.5288801319602369
Energy: 0.5152476435802832
Energy: 0.49815828308022764
Energy: 0.47163333259006135
Energy: 0.4722730357504113
Energy: 0.4716333325919778
Energy: 0.5218507942083451
Energy: 0.5154161432085942
Energy: 0.47199055952752605
Energy: 0.5154161432095524
Energy: 0.49868210779274263
Energy: 0.5370505338558198
Energy: 0.4973693887939049
Energy: 0.5370505338558198
Energy: 0.4991654787297325
Energy: 0.5186395961424396
Energy: 0.4767330358550743
Energy: 0.5186395961424396
Energy: 0.47932808824698636
Energy: 0.543902820176855
Energy: 0.5094981439926841
Energy: 0.5439028201778133
Energy: 0.49919056122756383
Energy: 0.5324017656561816
Energy: 0.47217536547997324
Energy: 0.5324017656561816
Energy: 0.4647334842143293
Energy: 0.5039966714828865
Energy: 0.5217203176794538
Energy: 0.5039966714819284
Energy: 0.5043464776726164
Energy: 0.5036820569460608
Energy: 0.4973596593349307
Energy: 0.5036820569451025
Energy: 0.4647416390597432
Energy: 0.5039599528616583
Energy: 0.5217909125971141
Energy: 0.5039599528616583
Energy: 0.49912937660935525
Energy: 0.5323710932746337
Energy: 0.47216384627498725
Energy: 0.5323710932736755
Energy: 0.4793362656146446
Energy: 0.5438797927913837
Energy: 0.5112455006955491
Energy: 0.5438797927904253
Energy: 0.4992147216038096
Energy: 0.5186459591729647
Energy: 0.47676814779106613
Energy: 0.51864595917009
Energy: 0.4987654319322745
Energy: 0.5370690797792891
Energy: 0.4973564482794953
Energy: 0.5370690797821638
Energy: 0.5218555969112258
Energy: 0.5154597839944165
Energy: 0.4719869892210184
Energy: 0.5154597839953746
Energy: 0.4981941893356903
Energy: 0.47159790780083555
Energy: 0.4722724837166693
Energy: 0.471597907798919

minimum gb energy = 0.4647334842143293 eV
minimum distance =  2.65169948006797 Angstroms
sigma value = 25


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

Energy: 0.4917572630795445
Energy: 0.5877594660439708
Energy: 0.6623057358240413
Energy: 0.5877594660439708
Energy: 0.47896305331513594
Energy: 0.544977681090265
Energy: 0.47736239210584297
Energy: 0.5449776810890801
Energy: 0.47964468579888797
Energy: 0.542320106506079
Energy: 0.48274326381658406
Energy: 0.542320106506079
Energy: 0.4924380468605283
Energy: 0.5444105224783298
Energy: 0.5420519149730426
Energy: 0.5444105224771717
Energy: 0.5413661210066558
Energy: 0.478992268124555
Energy: 0.4775106461289914
Energy: 0.478992268124555
Energy: 0.47981892422551914
Energy: 0.6114398614638641
Energy: 0.47822824608872744
Energy: 0.6114398614638641
Energy: 0.47799799571094786
Energy: 0.5526100839749403
Energy: 0.47857197712636035
Energy: 0.5526100839749403
Energy: 0.5391357944432882
Energy: 0.5882470089403418
Energy: 0.49214072214334265
Energy: 0.5882470089391567
Energy: 0.482590266840799
Energy: 0.527861085410587
Energy: 0.480302559414959
Energy: 0.527861085410587
Energy: 0.5555064775174611
Energy: 0.5597092547838307
Energy: 0.4796970119353316
Energy: 0.5597092547838307
Energy: 0.5226287197945036
Energy: 0.587466134516862
Energy: 0.6024329180174349
Energy: 0.587466134516862
Energy: 0.47890479776423667
Energy: 0.49588283471493305
Energy: 0.5570847066883898
Energy: 0.49588283471493305
Energy: 0.543917709985012
Energy: 0.54308738994689
Energy: 0.47900986910562654
Energy: 0.54308738994689
Energy: 0.4775166175040936
Energy: 0.47769419461356527
Energy: 0.49246121113021396
Energy: 0.47769419461356527
Energy: 0.5207804226350519
Energy: 0.5695785916471543
Energy: 0.539992976278996
Energy: 0.5695785916471543
Energy: 0.4797576668434795
Energy: 0.5426558340364247
Energy: 0.4798468043978658
Energy: 0.5426558340364247
Energy: 0.482504206564145
Energy: 0.5156548057589084
Energy: 0.5562826583015632
Energy: 0.5156548057589084

minimum gb energy = 0.47736239210584297 eV
minimum distance =  2.6580826808373 Angstroms
sigma value = 17


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

Energy: 0.5643567625131869
Energy: 0.5649456613010092
Energy: 0.6746112253721495
Energy: 0.5649456613010092
Energy: 0.5668054269914423
Energy: 0.5295211962005086
Energy: 0.49842179886564436
Energy: 0.5295211962005086
Energy: 0.6038678673225608
Energy: 0.5631295132911307
Energy: 0.49847352328372607
Energy: 0.5631295132918018
Energy: 0.5480932121747344
Energy: 0.599244582864747
Energy: 0.5341772068142653
Energy: 0.5992445828660894
Energy: 0.5705076104818693
Energy: 0.53675010913775
Energy: 0.5245131759851769
Energy: 0.536750109133723
Energy: 0.5057430850220932
Energy: 0.5177430292972747
Energy: 0.5610681878311314
Energy: 0.5177430292992882
Energy: 0.49972039829967424
Energy: 0.5541873883064375
Energy: 0.4998105556051872
Energy: 0.5541873883050952
Energy: 0.5603397658639784
Energy: 0.5353166181557079
Energy: 0.5049537713645271
Energy: 0.5353166181550367
Energy: 0.5066609092486608
Energy: 0.5921128551036421
Energy: 0.573413147906454
Energy: 0.5921128551036421
Energy: 0.6056774013039455
Energy: 0.54998960595472
Energy: 0.4990041353148931
Energy: 0.5499896059553911
Energy: 0.501136567648375
Energy: 0.5689331465086359
Energy: 0.6046060903584684
Energy: 0.5689331465079648
Energy: 0.5065190219247223
Energy: 0.5529054628654265
Energy: 0.5057644033720546
Energy: 0.55290546286744
Energy: 0.6113382430465705
Energy: 0.5631734765327231
Energy: 0.5600142682068083
Energy: 0.5631734765320519
Energy: 0.4986596443675082
Energy: 0.5709836392049519
Energy: 0.5699759863911137
Energy: 0.570983639201596
Energy: 0.5395654640211986
Energy: 0.5553838401515933
Energy: 0.5064455650267745
Energy: 0.5553838401509221
Energy: 0.5594190606051015
Energy: 0.5195207127010881
Energy: 0.5590701911082434
Energy: 0.5195207127017593
Energy: 0.5008886535815565
Energy: 0.5763071393235962
Energy: 0.6112887395294525
Energy: 0.5763071393222537
Energy: 0.590973247549099
Energy: 0.5536254566074322
Energy: 0.5057435508050652
Energy: 0.5536254566074322
Energy: 0.5322735142350515
Energy: 0.577249972625177
Energy: 0.5208562188786952
Energy: 0.5772499726258481
Energy: 0.5302135920626684
Energy: 0.6017505554600027
Energy: 0.5000141302782298
Energy: 0.6017505554606739
Energy: 0.5288707960733697
Energy: 0.5641105815650105
Energy: 0.5581198250072222
Energy: 0.5641105815650105
Energy: 0.49902706214151515
Energy: 0.5976353994874439
Energy: 0.6074966331302889
Energy: 0.5976353994861016
Energy: 0.5754256804412798
Energy: 0.5710914027013251
Energy: 0.49849274421048667
Energy: 0.5710914027019963
Energy: 0.5072052612798361
Energy: 0.5555963543580389
Energy: 0.5573000991854187
Energy: 0.5555963543600524
Energy: 0.5379513699446294
Energy: 0.56372418892438
Energy: 0.60361139473717
Energy: 0.5637241889257224
Energy: 0.5737375230839077
Energy: 0.5622552058989984
Energy: 0.49911755494523924
Energy: 0.5622552058983272
Energy: 0.5171570447716957
Energy: 0.5668097804324165
Energy: 0.6211923105424048
Energy: 0.5668097804324165
Energy: 0.5619200606426974
Energy: 0.5337292042020392
Energy: 0.5582986299012227
Energy: 0.5337292041980121
Energy: 0.6058385498533291
Energy: 0.6018843042257943
Energy: 0.49967972954791534
Energy: 0.6018843042264654
Energy: 0.5050376787848742
Energy: 0.5777250422836624
Energy: 0.5914980326884985
Energy: 0.5777250422836624

minimum gb energy = 0.49842179886564436 eV
minimum distance =  2.45904353876791 Angstroms
sigma value = 53


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

Energy: 0.482031276824929
Energy: 0.48240467845863905
Energy: 0.7301480858132829
Energy: 0.48240467845863905
Energy: 0.5740762817534327
Energy: 0.5323003366882818
Energy: 0.5254634523163835
Energy: 0.5323003366898269
Energy: 0.4933059605127918
Energy: 0.48204424893366027
Energy: 0.5310990143654372
Energy: 0.48204424893366027
Energy: 0.49338653072666305
Energy: 0.48204647016384977
Energy: 0.5314773169962308
Energy: 0.4820464701623047
Energy: 0.5739988149558833
Energy: 0.5322910737687617
Energy: 0.5254729247362023
Energy: 0.5322910737687617
Energy: 0.482031276824929
Energy: 0.48240467845863905
Energy: 0.6388730552293164
Energy: 0.4824046784570939
Energy: 0.5740762817565229
Energy: 0.5323003366882818
Energy: 0.5310192532640176
Energy: 0.5323003366882818
Energy: 0.4933067201351838
Energy: 0.48204424893366027
Energy: 0.5701847870147031
Energy: 0.48204424893366027
Energy: 0.49338023051098123
Energy: 0.48204647016384977
Energy: 0.5567529879604695
Energy: 0.48204647016384977
Energy: 0.5739988149558833
Energy: 0.5322910737672165
Energy: 0.569545730986604
Energy: 0.5322910737672165
Energy: 0.4820312768264742
Energy: 0.48240467845863905
Energy: 0.6587125899681803
Energy: 0.48240467845863905
Energy: 0.5740762817549778
Energy: 0.5323003366882818
Energy: 0.5570373203412334
Energy: 0.5323003366898269
Energy: 0.49330238182885133
Energy: 0.48204424893366027
Energy: 0.5701847870131579
Energy: 0.48204424893366027

minimum gb energy = 0.482031276824929 eV
minimum distance =  2.59781064318752 Angstroms
sigma value = 9


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

Energy: 0.5317903860427323
Energy: 0.630609597087095
Energy: 0.7240519408389162
Energy: 0.6306095970882387
Energy: 0.6286537710924188
Energy: 0.5638861428918202
Energy: 0.5446572114276043
Energy: 0.563886142892964
Energy: 0.5458304984742056
Energy: 0.5221060483263343
Energy: 0.5338315388306051
Energy: 0.5221060483269063
Energy: 0.599858416320094
Energy: 0.6209696760387527
Energy: 0.5450390787246457
Energy: 0.6209696760370371
Energy: 0.6464640581295327
Energy: 0.5496375016747613
Energy: 0.5498055898576216
Energy: 0.5496375016736177
Energy: 0.5233570704830696
Energy: 0.5208785582193649
Energy: 0.5990135847027543
Energy: 0.520878558218793
Energy: 0.6859864364137468
Energy: 0.5468557095237526
Energy: 0.5454046650314273
Energy: 0.5468557095231809
Energy: 0.5471818421174088
Energy: 0.5686781991777462
Energy: 0.5928373073861553
Energy: 0.5686781991794618
Energy: 0.5492145691865755
Energy: 0.6236324940184077
Energy: 0.5276759083441431
Energy: 0.6236324940178358
Energy: 0.5452026653390251
Energy: 0.5614037865868474
Energy: 0.5447788435022309
Energy: 0.5614037865874194
Energy: 0.5543599684134892
Energy: 0.5698622883157898
Energy: 0.6781932226910061
Energy: 0.5698622883163615
Energy: 0.5976051998497168
Energy: 0.5931264464205324
Energy: 0.5437813361237727
Energy: 0.5931264464188167
Energy: 0.5495349529864959
Energy: 0.6310302006896576
Energy: 0.633724000569919
Energy: 0.6310302006896576
Energy: 0.6107581865708608
Energy: 0.6133774280898265
Energy: 0.5335633883308479
Energy: 0.6133774280898265
Energy: 0.5456617013093367
Energy: 0.5937786853485493
Energy: 0.5820473607961996
Energy: 0.5937786853485493
Energy: 0.5513095844115451
Energy: 0.6161191162555899
Energy: 0.6027758295622505
Energy: 0.6161191162544463
Energy: 0.5682079475258072
Energy: 0.5945894722209448
Energy: 0.5460304254958229
Energy: 0.5945894722203731
Energy: 0.5561527795237884
Energy: 0.5457476815932035
Energy: 0.6149550321508077
Energy: 0.5457476815943474
Energy: 0.6136650895172016
Energy: 0.5863892881118719
Energy: 0.5238467045308618
Energy: 0.5863892881118719
Energy: 0.5415999088628184
Energy: 0.5706793364331473
Energy: 0.5746308404056389
Energy: 0.5706793364325754
Energy: 0.5941900498675974
Energy: 0.6025216833125984
Energy: 0.5990305106990828
Energy: 0.6025216833125984
Energy: 0.5745331050460735
Energy: 0.5436074578948755
Energy: 0.5456663943669061
Energy: 0.543607457897163
Energy: 0.5278194684098417
Energy: 0.5883123072061253
Energy: 0.5520783588614419
Energy: 0.5883123072066972
Energy: 0.6651174194495235
Energy: 0.5992210794844125
Energy: 0.551377994816806
Energy: 0.5992210794838406
Energy: 0.5441381794742162
Energy: 0.6066499495447093
Energy: 0.6354127673334948
Energy: 0.6066499495435655
Energy: 0.5823229338578109
Energy: 0.5664762942206006
Energy: 0.5483372271910297
Energy: 0.5664762942206006
Energy: 0.5844354397594262
Energy: 0.6051994104936965
Energy: 0.5970818601391733
Energy: 0.6051994104942683
Energy: 0.5311701194881483
Energy: 0.6240577364256793
Energy: 0.598893627093806
Energy: 0.6240577364251074
Energy: 0.5593508290527628
Energy: 0.5662273711065291
Energy: 0.5478828347046035
Energy: 0.5662273711059571
Energy: 0.5443800493104421
Energy: 0.667577738969529
Energy: 0.6581533892357464
Energy: 0.6675777389701009
Energy: 0.6506735609422469
Energy: 0.5986367274728912
Energy: 0.5508082089105824
Energy: 0.5986367274723192
Energy: 0.5227589409083965
Energy: 0.547717796947614
Energy: 0.5486921308003181
Energy: 0.5477177969481859
Energy: 0.5243785719146431
Energy: 0.5823330785444739
Energy: 0.5447915865255284
Energy: 0.5823330785450458
Energy: 0.5946560513571614
Energy: 0.5668719740412514
Energy: 0.5995223861156531
Energy: 0.5668719740412514
Energy: 0.5579927244977878
Energy: 0.622064342935108
Energy: 0.6878540620556772
Energy: 0.6220643429356799

minimum gb energy = 0.520878558218793 eV
minimum distance =  2.5114956046161 Angstroms
sigma value = 73


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

Energy: 0.5472423820925778
Energy: 0.5477716769327869
Energy: 0.7004272964388203
Energy: 0.5477716769327869
Energy: 0.5667667661555427
Energy: 0.5625386271499875
Energy: 0.5134685900632455
Energy: 0.5625386271518021
Energy: 0.5535118149603796
Energy: 0.5511813604408268
Energy: 0.526978004183557
Energy: 0.5511813604408268
Energy: 0.5580976877134561
Energy: 0.5357885760488428
Energy: 0.5618425652081696
Energy: 0.5357885760506574
Energy: 0.5401926645352131
Energy: 0.5681953594352238
Energy: 0.5395720857248192
Energy: 0.5681953594361312
Energy: 0.549363987256478
Energy: 0.5315110817000843
Energy: 0.6470867059760365
Energy: 0.5315110817009916
Energy: 0.6683535707994748
Energy: 0.5862383377134328
Energy: 0.5523409124511717
Energy: 0.5862383377143401
Energy: 0.5471756572034683
Energy: 0.5131020488476601
Energy: 0.6204901435991479
Energy: 0.5131020488467527
Energy: 0.6552385623839387
Energy: 0.5134773152029561
Energy: 0.5135545247548299
Energy: 0.5134773152029561
Energy: 0.5497728574564753
Energy: 0.5481703009569475
Energy: 0.5132804292600527
Energy: 0.5481703009569475
Energy: 0.5466644057392486
Energy: 0.5522847445972571
Energy: 0.627166821040474
Energy: 0.5522847445963498
Energy: 0.5928389928519886
Energy: 0.5330281809596742
Energy: 0.5471061828587762
Energy: 0.5330281809596742
Energy: 0.5464688792038125
Energy: 0.5477208913666836
Energy: 0.6166462111617608
Energy: 0.5477208913666836
Energy: 0.6591968360054696
Energy: 0.5785726731937415
Energy: 0.5591557255791367
Energy: 0.5785726731937415
Energy: 0.5348714434057029
Energy: 0.5702354286752718
Energy: 0.6094318397824682
Energy: 0.5702354286752718
Energy: 0.6245151134107235
Energy: 0.5611709009718513
Energy: 0.5509851185772024
Energy: 0.561170900973666
Energy: 0.5488789507298254
Energy: 0.5812618047313791
Energy: 0.5533626357390076
Energy: 0.5812618047350083
Energy: 0.5536689350121113
Energy: 0.5472915752772007
Energy: 0.5629573157046762
Energy: 0.5472915752772007
Energy: 0.555278623109601
Energy: 0.5131884007845344
Energy: 0.5481841167304555
Energy: 0.5131884007845344
Energy: 0.5513436056395277
Energy: 0.5716234771904489
Energy: 0.6907775924561207
Energy: 0.5716234771859123
Energy: 0.626202615326688
Energy: 0.5507535402662124
Energy: 0.5575074258847252
Energy: 0.5507535402653051
Energy: 0.5615387103642033
Energy: 0.5663944299248422
Energy: 0.6048470444199855
Energy: 0.5663944299230275

minimum gb energy = 0.5131020488467527 eV
minimum distance =  2.5331142539944 Angstroms
sigma value = 7


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

Energy: 0.5484084260193343
Energy: 0.5497793778839882
Energy: 0.7163117349401164
Energy: 0.5497793778833466
Energy: 0.6863355000425124
Energy: 0.5819429401501863
Energy: 0.5470563763824352
Energy: 0.5819429401495448
Energy: 0.5420962799189306
Energy: 0.5252969011419603
Energy: 0.5285692518590372
Energy: 0.5252969011374692
Energy: 0.5981408375304945
Energy: 0.5778249149347146
Energy: 0.5474108550585034
Energy: 0.5778249149385639
Energy: 0.5416272352881909
Energy: 0.5706976682297408
Energy: 0.5442797122614514
Energy: 0.5706976682303824
Energy: 0.5373958781102549
Energy: 0.5542296757142992
Energy: 0.6312686134713903
Energy: 0.5542296757104498
Energy: 0.6115727290019337
Energy: 0.6222106021939549
Energy: 0.5671186667389889
Energy: 0.6222106021926718
Energy: 0.5374440506605915
Energy: 0.5779152230501382
Energy: 0.7109320369818644
Energy: 0.5779152230475718
Energy: 0.6295420524151175
Energy: 0.5728797398940741
Energy: 0.5483641773470523
Energy: 0.572879739897282
Energy: 0.5513892248140914
Energy: 0.5436959262725187
Energy: 0.5909828240961822
Energy: 0.5436959262705939
Energy: 0.555694849411512
Energy: 0.6048837439128996
Energy: 0.5717214347402585
Energy: 0.6048837439135412
Energy: 0.5254060783111314
Energy: 0.5812421540479024
Energy: 0.5653739073828726
Energy: 0.5812421540485441
Energy: 0.5250651402823661
Energy: 0.5500374171326633
Energy: 0.6001866718371038
Energy: 0.5500374171307386
Energy: 0.5469705063888998
Energy: 0.5216347443246543
Energy: 0.5522021767226145
Energy: 0.5216347443259374
Energy: 0.5426531100206001
Energy: 0.6553510184686677
Energy: 0.6795703647330913
Energy: 0.6553510184661013
Energy: 0.6581700698588853
Energy: 0.5442274760488952
Energy: 0.5461609913831337
Energy: 0.544227476047612
Energy: 0.5462667228069273
Energy: 0.5620848209597764
Energy: 0.5636363107256588
Energy: 0.5620848209591348
Energy: 0.5304553935517768
Energy: 0.5876299771930006
Energy: 0.5646209976358049
Energy: 0.5876299771917175
Energy: 0.5462551660710696
Energy: 0.5770918476757816
Energy: 0.5701362396063941
Energy: 0.5770918476757816
Energy: 0.5385392064398119
Energy: 0.5747876700524241
Energy: 0.5441155408365216
Energy: 0.5747876700524241
Energy: 0.5942660824400172
Energy: 0.5961820764042135
Energy: 0.5422612954372389
Energy: 0.596182076403572
Energy: 0.5417199698117869
Energy: 0.5540695741580489
Energy: 0.6022245414866358
Energy: 0.5540695741618985
Energy: 0.6612567493742635
Energy: 0.5512297765269392
Energy: 0.5579454996897115
Energy: 0.5512297765243728
Energy: 0.5509853511101596
Energy: 0.5494107405353187
Energy: 0.6676693794497175
Energy: 0.5494107405346773
Energy: 0.5606432056414187
Energy: 0.5723815884574198
Energy: 0.5403914807249921
Energy: 0.5723815884619109
Energy: 0.5790177635804065
Energy: 0.5903304225504493
Energy: 0.5545907275402208
Energy: 0.5903304225504493
Energy: 0.5514314015907122
Energy: 0.5353839376731588
Energy: 0.5329836647503516
Energy: 0.5353839376757251
Energy: 0.6216026149549354
Energy: 0.577722630633389
Energy: 0.5435010695621809
Energy: 0.5777226306353138
Energy: 0.5397290546515191
Energy: 0.5529821334794155
Energy: 0.5904467413348379
Energy: 0.552982133478774
Energy: 0.6500974852022041
Energy: 0.5632359721973226
Energy: 0.5556350221795091
Energy: 0.5632359721966811
Energy: 0.539729614730221
Energy: 0.5774747779994497
Energy: 0.6070548261703277
Energy: 0.5774747780032992

minimum gb energy = 0.5216347443246543 eV
minimum distance =  2.52134086632278 Angstroms
sigma value = 29


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

Energy: 0.48950051269526623
Energy: 0.4905380082320909
Energy: 0.832959940862917
Energy: 0.49053800823231447
Energy: 0.4665667031770744
Energy: 0.490487554426238
Energy: 0.4896474513985328
Energy: 0.4904875544273305
Energy: 0.6307287143814302
Energy: 0.5044547556427715
Energy: 0.4668368372461488
Energy: 0.5044547556419025
Energy: 0.4895174738722389
Energy: 0.467857573686015
Energy: 0.4895553014056407
Energy: 0.4678575736862385
Energy: 0.48980003530677113
Energy: 0.493817276103115
Energy: 0.4904720997102125
Energy: 0.493817276103115
Energy: 0.49014226675722145
Energy: 0.5034667422933572
Energy: 0.49043483346831523
Energy: 0.5034667422924881
Energy: 0.490708955380664
Energy: 0.49381091562993223
Energy: 0.4898077458452456
Energy: 0.49381091562993223
Energy: 0.48950604617521054
Energy: 0.46773100445209487
Energy: 0.48951821577158594
Energy: 0.46773100445164795
Energy: 0.46872627596341776
Energy: 0.5044809185359046
Energy: 0.6308411282735575
Energy: 0.5044809185356811

minimum gb energy = 0.4665667031770744 eV
minimum distance =  2.60277911523758 Angstroms
sigma value = 5


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

Energy: 0.4914070284258188
Energy: 0.49535613946128676
Energy: 0.6712216650776441
Energy: 0.49535613946128676
Energy: 0.5820819293605635
Energy: 0.5077482628468657
Energy: 0.5033333399233402
Energy: 0.5077482628474717
Energy: 0.48290322562331434
Energy: 0.49319360479486035
Energy: 0.6224096993258535
Energy: 0.49319360479364827
Energy: 0.5039398062600702
Energy: 0.515995903510905
Energy: 0.4851274649674993
Energy: 0.5159959035096928
Energy: 0.4932235756977792
Energy: 0.5182595594111529
Energy: 0.5853278214151661
Energy: 0.5182595594111529
Energy: 0.5365262852333953
Energy: 0.49590916484106046
Energy: 0.4821645393167044
Energy: 0.4959091648392423
Energy: 0.47995884085369206
Energy: 0.5165042122036542
Energy: 0.4777294589619763
Energy: 0.5165042122036542
Energy: 0.48001627751492104
Energy: 0.5540929761526365
Energy: 0.48498587536101173
Energy: 0.5540929761532427
Energy: 0.4822040779812269
Energy: 0.5649880891929617
Energy: 0.48940404322499576
Energy: 0.5649880891923557
Energy: 0.4820643493998925
Energy: 0.516907640182577
Energy: 0.4833881659784382
Energy: 0.516907640183789
Energy: 0.5064470358515846
Energy: 0.5537727100404483
Energy: 0.4840427829026224
Energy: 0.5537727100398422
Energy: 0.5051615029631695
Energy: 0.4893161544259304
Energy: 0.49543922853756434
Energy: 0.48931615442532433
Energy: 0.5663771059750847
Energy: 0.49538287523484714
Energy: 0.49705640486153735
Energy: 0.49538287523484714
Energy: 0.49228305918774573
Energy: 0.49595578147265906
Energy: 0.5098790710594089
Energy: 0.4959557814714469
Energy: 0.6085679302579808
Energy: 0.5169621985205108
Energy: 0.4839748387436909
Energy: 0.516962198521117
Energy: 0.48235222365390273
Energy: 0.49338712150618236
Energy: 0.5401072790058987
Energy: 0.49338712150618236
Energy: 0.5729184248702117
Energy: 0.4897163938910717
Energy: 0.4914652209626061
Energy: 0.4897163938910717
Energy: 0.4853087641164148
Energy: 0.4953953149056857
Energy: 0.5875410413091032
Energy: 0.4953953149056857
Energy: 0.49887409183080955
Energy: 0.5180099053890279
Energy: 0.4799916372780606
Energy: 0.5180099053878158
Energy: 0.49212506795914146
Energy: 0.5924703878879464
Energy: 0.4870148010560729
Energy: 0.5924703878885523
Energy: 0.4908149281041154
Energy: 0.5148456577063829
Energy: 0.482524565356189
Energy: 0.5148456577063829
Energy: 0.507982734389552
Energy: 0.5166745771880406
Energy: 0.48219334381297896
Energy: 0.5166745771874346
Energy: 0.4864376962851466
Energy: 0.4957946233755464
Energy: 0.49166382739867737
Energy: 0.49579462337433433
Energy: 0.495253081057128
Energy: 0.4983867456932934
Energy: 0.5041924415057081
Energy: 0.49838674569389946
Energy: 0.4952225262895641
Energy: 0.49247579011528714
Energy: 0.48754791800874103
Energy: 0.492475790114075
Energy: 0.5079637164220572
Energy: 0.49597153988959963
Energy: 0.4946428797478409
Energy: 0.49597153989020565
Energy: 0.48288035147310454
Energy: 0.47879580962370194
Energy: 0.5233503493759677
Energy: 0.47879580962127777
Energy: 0.5511106506741799
Energy: 0.517238822171365
Energy: 0.48236926192303353
Energy: 0.5172388221707588
Energy: 0.4892730000106735
Energy: 0.5205849158280021
Energy: 0.6156235626373322
Energy: 0.5205849158286083
Energy: 0.5950533058227775
Energy: 0.4952057554587376
Energy: 0.48541720201533284
Energy: 0.4952057554587376
Energy: 0.48107243290740676
Energy: 0.48678834472198307
Energy: 0.5954809337871
Energy: 0.48678834472198307
Energy: 0.5782206239793088
Energy: 0.5238096264570298
Energy: 0.48962228923204537
Energy: 0.5238096264570298
Energy: 0.4834223802761988
Energy: 0.5217181595149902
Energy: 0.48959345889683425
Energy: 0.5217181595143844

minimum gb energy = 0.4777294589619763 eV
minimum distance =  2.52067871997509 Angstroms
sigma value = 1


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

Energy: 0.5373970164217792
Energy: 0.47629590940089034
Energy: 0.6523743442059627
Energy: 0.47629590940005234
Energy: 0.5328083296084931
Energy: 0.5014681130523736
Energy: 0.4697064946257815
Energy: 0.5014681130523736
Energy: 0.4630676854081694
Energy: 0.47173699022789495
Energy: 0.5666528340141985
Energy: 0.47173699022957083
Energy: 0.548792501984147
Energy: 0.5012651915610984
Energy: 0.4686816765705367
Energy: 0.5012651915619362
Energy: 0.4687404167121492
Energy: 0.4710074520757564
Energy: 0.6756663931411164
Energy: 0.47100745207743233
Energy: 0.4580481020062137
Energy: 0.5155062040654486
Energy: 0.46863520119846347
Energy: 0.5155062040662866
Energy: 0.4632415253076505
Energy: 0.5186459106648349
Energy: 0.5205491362093738
Energy: 0.5186459106648349
Energy: 0.4631194763849058
Energy: 0.5153615989388196
Energy: 0.5100411685985345
Energy: 0.5153615989388196
Energy: 0.471345040124702
Energy: 0.47486034429680124
Energy: 0.5061716056245609
Energy: 0.47486034429680124
Energy: 0.4713602767046124
Energy: 0.47698194175318553
Energy: 0.4900205874795683
Energy: 0.47698194175402353
Energy: 0.46303159905361047
Energy: 0.5565667629420195
Energy: 0.48172853331764115
Energy: 0.5565667629403434
Energy: 0.46301801249119484
Energy: 0.51211496629817
Energy: 0.4698486062291618
Energy: 0.5121149662973321
Energy: 0.4688706348362517
Energy: 0.5563646794593299
Energy: 0.46895572629794574
Energy: 0.5563646794576539
Energy: 0.4694483508695482
Energy: 0.47455722719235827
Energy: 0.538773059235822
Energy: 0.4745572271915204
Energy: 0.5438245841968774
Energy: 0.5009543033654871
Energy: 0.4689691844359196
Energy: 0.5009543033654871
Energy: 0.46308363627612703
Energy: 0.47162817817598207
Energy: 0.48750536160790653
Energy: 0.47162817817598207
Energy: 0.5760707234788194
Energy: 0.5658415294002814
Energy: 0.46885205807170466
Energy: 0.5658415294019573
Energy: 0.5373970164209411
Energy: 0.47629590940172833
Energy: 0.6523743442059627
Energy: 0.47629590940089034
Energy: 0.5328083296084931
Energy: 0.5014681130523736
Energy: 0.4697064946266195
Energy: 0.5014681130523736
Energy: 0.4630676854073315
Energy: 0.47173699022873294
Energy: 0.5851240103128255
Energy: 0.4717369902304088
Energy: 0.548792501984147
Energy: 0.5012651915619362
Energy: 0.4686816765705367
Energy: 0.5012651915619362
Energy: 0.46874041671047334
Energy: 0.47100745207659434
Energy: 0.6124735686086501
Energy: 0.4710074520782703
Energy: 0.4580481020045377
Energy: 0.5155062040654486
Energy: 0.46863520119846347
Energy: 0.5155062040662866
Energy: 0.46324152530848844
Energy: 0.5186459106648349
Energy: 0.5205491362093738
Energy: 0.518645910663997

minimum gb energy = 0.4580481020045377 eV
minimum distance =  2.54059841450356 Angstroms
sigma value = 17


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

Energy: 0.4736497589721248
Energy: 0.4738022195150597
Energy: 0.7598422876597568
Energy: 0.47380221951557755
Energy: 0.5846105895528219
Energy: 0.4697643387486303
Energy: 0.46627620067805187
Energy: 0.46976433874914825
Energy: 0.46227205915514175
Energy: 0.46892496875398243
Energy: 0.600913641530078
Energy: 0.46892496875035694
Energy: 0.5548838937247453
Energy: 0.5456695807203086
Energy: 0.4615577827288972
Energy: 0.5456695807203086
Energy: 0.4645388119993791
Energy: 0.502085308654333
Energy: 0.4970022513894154
Energy: 0.5020853086501896
Energy: 0.5101722929658491
Energy: 0.5516188332593606
Energy: 0.4670551603111015
Energy: 0.5516188332598785
Energy: 0.4768244174692745
Energy: 0.49396767142705705
Energy: 0.4689174707741867
Energy: 0.49396767142757503
Energy: 0.4763653314690826
Energy: 0.5556346623094363
Energy: 0.4624102346093318
Energy: 0.5556346623084003
Energy: 0.4691965149820408
Energy: 0.555619304730436
Energy: 0.4971846770200544
Energy: 0.5556193047288822
Energy: 0.4687826353745909
Energy: 0.5566548832972026
Energy: 0.4688031447455555
Energy: 0.5566548832982385
Energy: 0.45925375415564895
Energy: 0.5480039211669387
Energy: 0.46782919045338334
Energy: 0.5480039211664209
Energy: 0.45919976687028347
Energy: 0.49094522833207116
Energy: 0.45810285413504387
Energy: 0.4909452283310353
Energy: 0.47808264273256706
Energy: 0.6239534393571758
Energy: 0.4646960619044537
Energy: 0.6239534393551042
Energy: 0.47753424267540934
Energy: 0.5010439888606677
Energy: 0.47421203480755564
Energy: 0.5010439888585959
Energy: 0.47270627610910004
Energy: 0.5477819063942975
Energy: 0.47911305512842606
Energy: 0.5477819063942975
Energy: 0.46725089599689135
Energy: 0.5552487021911193
Energy: 0.500169914180409
Energy: 0.5552487021906014
Energy: 0.49206367049805316
Energy: 0.5478036412624169
Energy: 0.46459635726348125
Energy: 0.5478036412624169
Energy: 0.4587987092450272
Energy: 0.47410635363106424
Energy: 0.49362364307923373
Energy: 0.4741063536321001
Energy: 0.5483189145271776
Energy: 0.49298431265221004
Energy: 0.46468731678669567
Energy: 0.49298431265117415
Energy: 0.464377579696204
Energy: 0.4689570456799583
Energy: 0.5983478960403964
Energy: 0.4689570456799583
Energy: 0.6621971659650784
Energy: 0.4658887778017961
Energy: 0.4741639977274435
Energy: 0.46588877780283194
Energy: 0.4736395820762244
Energy: 0.5267369301814654
Energy: 0.5901191551604541
Energy: 0.5267369301814654
Energy: 0.5364940606029783
Energy: 0.5506415186539946
Energy: 0.465467422142337
Energy: 0.5506415186560664
Energy: 0.464839391549084
Energy: 0.4948463722954944
Energy: 0.5488004420981948
Energy: 0.4948463722965302
Energy: 0.5095846886143067
Energy: 0.47415378213608367
Energy: 0.4599442037971664
Energy: 0.4741537821381554
Energy: 0.4662199984400528
Energy: 0.5013804078768351
Energy: 0.4932351247024203
Energy: 0.501380407877871
Energy: 0.543014242989293
Energy: 0.5507402723370525
Energy: 0.46832527872831003
Energy: 0.550740272339124
Energy: 0.4815571951203528
Energy: 0.5483402764954707
Energy: 0.4736653939069974
Energy: 0.5483402764970244
Energy: 0.4740659371372233
Energy: 0.5008218919137627
Energy: 0.4741800582059124
Energy: 0.5008218919127739
Energy: 0.46593689006433653
Energy: 0.6226059683045876
Energy: 0.5041742316628427
Energy: 0.6226059683056234
Energy: 0.45791599382888254
Energy: 0.49964988864023757
Energy: 0.45897716603371064
Energy: 0.49964988864075544
Energy: 0.4663194125846216
Energy: 0.5475543418097137
Energy: 0.46475414158671735
Energy: 0.5475543418091957
Energy: 0.46777362352952906
Energy: 0.5564088410304303
Energy: 0.5481908619865579
Energy: 0.5564088410304303
Energy: 0.49732808900185993
Energy: 0.5552860493640623
Energy: 0.47069218605173785
Energy: 0.5552860493650982
Energy: 0.46168255574376466
Energy: 0.4743986760752766
Energy: 0.4898905197225116
Energy: 0.4743986760742407
Energy: 0.4690056058147575
Energy: 0.4947595812148034
Energy: 0.4756361922435816
Energy: 0.49475958121583924
Energy: 0.46545955293237223
Energy: 0.5534536530544025
Energy: 0.4996692150340729
Energy: 0.5534536530544025
Energy: 0.49565805293972276
Energy: 0.5022110186375118
Energy: 0.466904573446014
Energy: 0.5022110186375118

minimum gb energy = 0.45791599382888254 eV
minimum distance =  2.5332728269942 Angstroms
sigma value = 89


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

Energy: 0.4121993335571258
Energy: 0.41240317964277284
Energy: 0.7845318390881316
Energy: 0.41240317964277284
Energy: 0.4130720962453161
Energy: 0.4263504741970056
Energy: 0.4236380367320219
Energy: 0.4263504741970056
Energy: 0.42201490027901023
Energy: 0.48814585329613497
Energy: 0.7492548836894402
Energy: 0.48814585329613497
Energy: 0.4765992548753959
Energy: 0.42647025492193413
Energy: 0.4236094933652396
Energy: 0.42647025492193413
Energy: 0.4221650885300822
Energy: 0.45290912106592723
Energy: 0.5017008424287789
Energy: 0.4529091210672824
Energy: 0.4221230261712292
Energy: 0.4124865708856871
Energy: 0.4123752606772109
Energy: 0.4124865708856871
Energy: 0.4221941287144573
Energy: 0.4888528757367667
Energy: 0.412427016687423
Energy: 0.4888528757381219
Energy: 0.4392216116031394
Energy: 0.48671686784427715
Energy: 0.42352717402280393
Energy: 0.48671686784427715
Energy: 0.422186007198744
Energy: 0.45292284407297845
Energy: 0.4354411886989871
Energy: 0.45292284407297845
Energy: 0.42675152330521776
Energy: 0.4512012204311671
Energy: 0.42233572972086686
Energy: 0.4512012204311671
Energy: 0.412333426578672
Energy: 0.42645398662245493
Energy: 0.42212456064185777
Energy: 0.4264539866238101
Energy: 0.4124092602122749
Energy: 0.48675216354011547
Energy: 0.4238591002548785
Energy: 0.48675216354011547
Energy: 0.42212544436357746
Energy: 0.4124169968705622
Energy: 0.4365015474708868
Energy: 0.4124169968705622
Energy: 0.4226987661457058
Energy: 0.4512347804494231
Energy: 0.4223829741939236
Energy: 0.4512347804494231
Energy: 0.43908852694216494
Energy: 0.41240229753296126
Energy: 0.4221332898285916
Energy: 0.41240229753296126

minimum gb energy = 0.4121993335571258 eV
minimum distance =  2.56270942280548 Angstroms
sigma value = 13


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

Energy: 0.4234192203798798
Energy: 0.40817921427049164
Energy: 0.5734966670921707
Energy: 0.40817921426992365
Energy: 0.5428566535048959
Energy: 0.4176199744084371
Energy: 0.4082528898125459
Energy: 0.41761997441525317
Energy: 0.408554763735189
Energy: 0.40853801257250355
Energy: 0.4993589232193968
Energy: 0.4085380125702316
Energy: 0.40948182657584914
Energy: 0.4178804076745375
Energy: 0.4056728670848104
Energy: 0.4178804076785135
Energy: 0.4131425164097245
Energy: 0.4385171804050605
Energy: 0.45317814129489353
Energy: 0.43851718041130855
Energy: 0.40923721935798274
Energy: 0.4184458167408715
Energy: 0.414978093441526
Energy: 0.4184458167442537
Energy: 0.4128962371136712
Energy: 0.43661633214957296
Energy: 0.5960070708265753
Energy: 0.43661633215241297
Energy: 0.40887868875063227
Energy: 0.4187146266028657
Energy: 0.4151018299468308
Energy: 0.4187146266045697
Energy: 0.4132635466438707
Energy: 0.43636850476671646
Energy: 0.5396163781021212
Energy: 0.4363685047695564
Energy: 0.5039427491288289
Energy: 0.44602826923321937
Energy: 0.4054960688131107
Energy: 0.44602826923151534
Energy: 0.4125314000191919
Energy: 0.4460987882002994
Energy: 0.4096497172494601
Energy: 0.44609878819691723
Energy: 0.5796405014310384
Energy: 0.44612429583661883
Energy: 0.4100853422492909
Energy: 0.4461242958354828
Energy: 0.4300817777307004
Energy: 0.41536104104465194
Energy: 0.42789148467847854
Energy: 0.41536104104465194
Energy: 0.5862668703023627
Energy: 0.4460666784636002
Energy: 0.4099045962232651
Energy: 0.4460666784681443
Energy: 0.41255231511691426
Energy: 0.4077057146186023
Energy: 0.4166003035697891
Energy: 0.40770571461689825
Energy: 0.40906759362842143
Energy: 0.44602316474572584
Energy: 0.40445212902739663
Energy: 0.4460231647445898
Energy: 0.4164877992493646
Energy: 0.4344246204915471
Energy: 0.4045914498875022
Energy: 0.43442462048927516
Energy: 0.4263150448130372
Energy: 0.4349090109806952
Energy: 0.41358616885237276
Energy: 0.4349090109863494
Energy: 0.41676117420675657
Energy: 0.4148119370718336
Energy: 0.41347902287119687
Energy: 0.41481193706728964
Energy: 0.41674678473323584
Energy: 0.41495567386578647
Energy: 0.4136333085541267
Energy: 0.4149556738652185
Energy: 0.4262227368482171
Energy: 0.4349276387852086
Energy: 0.41358151407954985
Energy: 0.4349276387857766
Energy: 0.41610899084064573
Energy: 0.4345418944653048
Energy: 0.40476830470632874
Energy: 0.43454189446360075
Energy: 0.40923707426274364
Energy: 0.4460843423403699
Energy: 0.4046235800983257
Energy: 0.44608434233980193
Energy: 0.412043344790679
Energy: 0.4076611366297859
Energy: 0.4142726678608477
Energy: 0.4076611366309219
Energy: 0.5864644730983921
Energy: 0.4461379104196564
Energy: 0.4100761685197022
Energy: 0.4461379104224964
Energy: 0.42988131190609924
Energy: 0.4154227013605441
Energy: 0.4099755380851189
Energy: 0.41542270136168014
Energy: 0.5795330821304272
Energy: 0.4461378576991707
Energy: 0.4103495635906677
Energy: 0.44613785770144265
Energy: 0.41259874862452006
Energy: 0.4460967988980146
Energy: 0.4064516628680426
Energy: 0.44609679889687864
Energy: 0.5037745159838601
Energy: 0.4460986194486647
Energy: 0.4054688762213496
Energy: 0.4460986194543447
Energy: 0.4132941913666179
Energy: 0.43627670535283675
Energy: 0.496939556902199
Energy: 0.4362767053499967
Energy: 0.40878611103184137
Energy: 0.4186178962767372
Energy: 0.41513456434227336
Energy: 0.41861789627503315
Energy: 0.4132492210198385
Energy: 0.4364014609181761
Energy: 0.5845152202048025
Energy: 0.4364014609181761
Energy: 0.4087319858757306
Energy: 0.4183835980342938
Energy: 0.4150807270523596
Energy: 0.4183835980308858
Energy: 0.4123822642521036
Energy: 0.438506456705439
Energy: 0.5686106571605754
Energy: 0.438506456710551
Energy: 0.4085443763851258
Energy: 0.41815089990930354
Energy: 0.4057154022236418
Energy: 0.4181508999121436

minimum gb energy = 0.40445212902739663 eV
minimum distance =  2.58154451902163 Angstroms
sigma value = 37


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

Energy: 0.45963927293699547
Energy: 0.40093775585367986
Energy: 0.4613912029573282
Energy: 0.4009377558546571
Energy: 0.5116797892141807
Energy: 0.5117733965721516
Energy: 0.3814622423410267
Energy: 0.5117733965731067
Energy: 0.44025715467231696
Energy: 0.5286389878748148
Energy: 0.5229301546506049
Energy: 0.5286389878748148
Energy: 0.44028926357445525
Energy: 0.38513397472955374
Energy: 0.3800652164273133
Energy: 0.38513397473053096
Energy: 0.3798126052507559
Energy: 0.38495305326835116
Energy: 0.5204465362911785
Energy: 0.384953053267374
Energy: 0.3890846087581346
Energy: 0.5119004362968252
Energy: 0.4411508931526543
Energy: 0.5119004362968252
Energy: 0.3743436717168941
Energy: 0.6489427488287963
Energy: 0.5901308957010439
Energy: 0.6489427488287963
Energy: 0.3745411380920849
Energy: 0.3852456352279053
Energy: 0.38648979090365954
Energy: 0.38524563522692806
Energy: 0.3819118128996236
Energy: 0.5118614418780741
Energy: 0.5770590328602417
Energy: 0.5118614418790511
Energy: 0.522701247677456
Energy: 0.5296799322575828
Energy: 0.44194853722286676
Energy: 0.5296799322575828
Energy: 0.37981967458657534
Energy: 0.5482171934491181
Energy: 0.44045238449021945
Energy: 0.5482171934481409
Energy: 0.5342210105015037
Energy: 0.385003727750668
Energy: 0.3803996270969239
Energy: 0.385003727750668
Energy: 0.44033024795008874
Energy: 0.5120060994884557
Energy: 0.445311901465899
Energy: 0.5120060994884557
Energy: 0.5902280248737641
Energy: 0.5310936534955575
Energy: 0.3744373521884979
Energy: 0.5310936534965346
Energy: 0.4599097727166442
Energy: 0.4047618660390791
Energy: 0.3743395285385189
Energy: 0.4047618660381019
Energy: 0.46004354566072697
Energy: 0.5119969326648476
Energy: 0.3814240841014978
Energy: 0.5119969326628931
Energy: 0.44030113012387184
Energy: 0.4270922454367544
Energy: 0.3856328676755726
Energy: 0.42709224543479996
Energy: 0.44019739688879284
Energy: 0.5482517255194359
Energy: 0.37963066816715557
Energy: 0.5482517255204131
Energy: 0.37985785736599736
Energy: 0.38506846682875856
Energy: 0.37954592628920986
Energy: 0.38506846682875856
Energy: 0.3798815081653368
Energy: 0.5120689130084577
Energy: 0.4403857694271249
Energy: 0.5120689130055259

minimum gb energy = 0.3743395285385189 eV
minimum distance =  2.54707088919852 Angstroms
sigma value = 25


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

Energy: 0.4228281657604597
Energy: 0.5611566762225164
Energy: 0.40940932658965795
Energy: 0.5611566762209903
Energy: 0.5149964717486958
Energy: 0.41600456409388326
Energy: 0.35168509534525266
Energy: 0.4160045640961725
Energy: 0.4008540972584042
Energy: 0.35678537569432767
Energy: 0.45747987583616745
Energy: 0.35678537569280144
Energy: 0.44775779784268965
Energy: 0.3662371932701678
Energy: 0.35508587153752347
Energy: 0.36623719327093085
Energy: 0.3577118211318937
Energy: 0.3579311491080565
Energy: 0.4572633739086391
Energy: 0.3579311491088197
Energy: 0.3931926787047585
Energy: 0.35726306124240576
Energy: 0.358319979102728
Energy: 0.35726306124469503
Energy: 0.35312710713295786
Energy: 0.3485655341023312
Energy: 0.4480350266015481
Energy: 0.3485655341015681
Energy: 0.3519677543557369
Energy: 0.36955592849509056
Energy: 0.40196869790511996
Energy: 0.3695559284958536
Energy: 0.3518372759114523
Energy: 0.5532346760199256
Energy: 0.6333363326610822
Energy: 0.5532346760206885
Energy: 0.3446369765466013
Energy: 0.3520789951339676
Energy: 0.3697817602203244
Energy: 0.3520789951354938
Energy: 0.3530509063944772
Energy: 0.3493676409952289
Energy: 0.5457630264371588
Energy: 0.34936764099446577
Energy: 0.45728111562431556
Energy: 0.5711553689404206
Energy: 0.40198989867447127
Energy: 0.5711553689388945
Energy: 0.35594937039892915
Energy: 0.36653609387268077
Energy: 0.551728426730602
Energy: 0.3665360938719177
Energy: 0.46814471018907333
Energy: 0.5507233441864187
Energy: 0.35827698834590854
Energy: 0.5507233441848927
Energy: 0.35784201587278297
Energy: 0.34966411732507197
Energy: 0.39306946947492477
Energy: 0.3496641173243089
Energy: 0.5139098969616884
Energy: 0.5707554743655018
Energy: 0.35237683195746167
Energy: 0.5707554743655018
Energy: 0.4036310083160662
Energy: 0.37042368981773877
Energy: 0.39703751775571755
Energy: 0.37042368981773877
Energy: 0.5054515294195875
Energy: 0.4153149976206861
Energy: 0.3515331064118531
Energy: 0.41531499763518465
Energy: 0.42547071956452287
Energy: 0.35587009567484673
Energy: 0.3446653881219633
Energy: 0.3558700956725575
Energy: 0.600345306550475
Energy: 0.5706960486497112
Energy: 0.3525182757621015
Energy: 0.570696048648185
Energy: 0.403924184745104
Energy: 0.5714730745349651
Energy: 0.3512070787807153
Energy: 0.5714730745349651
Energy: 0.40116623384165784
Energy: 0.3662401670593731
Energy: 0.3557263020551194
Energy: 0.36624016705784695
Energy: 0.35782920922129535
Energy: 0.46043201625153546
Energy: 0.4677631511321386
Energy: 0.46043201624772
Energy: 0.3929254752662919
Energy: 0.5674046567393326
Energy: 0.3576436405747917
Energy: 0.5674046567400957
Energy: 0.35224810956903646
Energy: 0.4814893935400317
Energy: 0.5136685837521254
Energy: 0.4814893935415578
Energy: 0.3470485713976131
Energy: 0.46903451078515035
Energy: 0.40121123156424354
Energy: 0.46903451078515035

minimum gb energy = 0.3446369765466013 eV
minimum distance =  2.49181845400532 Angstroms
sigma value = 41


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

Energy: 0.485659302275888
Energy: 0.3361147369174309
Energy: 0.7207813477472415
Energy: 0.3361147369174309
Energy: 0.5238237597258808
Energy: 0.3283669328343887
Energy: 0.32525314524791754
Energy: 0.32836693283376306
Energy: 0.3330492962372973
Energy: 0.32492657623963617
Energy: 0.44451155885029964
Energy: 0.32492657623963617
Energy: 0.4474710164484912
Energy: 0.328029423893293
Energy: 0.3251622643995718
Energy: 0.3280294238920418
Energy: 0.32202830352786255
Energy: 0.3424937673048059
Energy: 0.37029037319395414
Energy: 0.3424937673035547
Energy: 0.40068417599672684
Energy: 0.32788002873896155
Energy: 0.3250465259910379
Energy: 0.3278800287383359
Energy: 0.32449614568694873
Energy: 0.3276220623176837
Energy: 0.36489882995631484
Energy: 0.3276220623176837
Energy: 0.3193498826038315
Energy: 0.3350774335673878
Energy: 0.3227625090987783
Energy: 0.3350774335673878
Energy: 0.32594869128967013
Energy: 0.5117438571297226
Energy: 0.5365538844168475
Energy: 0.5117438571303482
Energy: 0.32186034009665837
Energy: 0.3243642198447532
Energy: 0.3337334952972875
Energy: 0.3243642198447532
Energy: 0.32445536334307984
Energy: 0.3282159367347025
Energy: 0.5571147732832683
Energy: 0.3282159367347025
Energy: 0.3215471194617653
Energy: 0.33567952791641176
Energy: 0.48633632831808177
Energy: 0.3356795279170374
Energy: 0.32676392837241125
Energy: 0.4379772589236165
Energy: 0.6243897300596927
Energy: 0.4379772589236165
Energy: 0.41405004472752693
Energy: 0.44684412426124204
Energy: 0.3337300530838759
Energy: 0.44684412426186765
Energy: 0.32440010266223107
Energy: 0.3283147359241522
Energy: 0.4799420511708045
Energy: 0.32831473592352667
Energy: 0.4240828265053538
Energy: 0.5114411509045946
Energy: 0.3227470207218286
Energy: 0.5114411509045946
Energy: 0.32693979611524715
Energy: 0.4359236296928673
Energy: 0.450443328254521
Energy: 0.4359236296922417
Energy: 0.4198657769006942
Energy: 0.44695269067066107
Energy: 0.3251826891083351
Energy: 0.4469526906712867
Energy: 0.3244915958552247
Energy: 0.33487516898617253
Energy: 0.3193280339694126
Energy: 0.3348751689867981
Energy: 0.41551410434946584
Energy: 0.5115191391077643
Energy: 0.32689547347186143
Energy: 0.5115191391077643
Energy: 0.33535604552001164
Energy: 0.43552379090223453
Energy: 0.3244409953231811
Energy: 0.4355237909028602
Energy: 0.5574040310811236
Energy: 0.5364550998553737
Energy: 0.3250384199984152
Energy: 0.5364550998547479
Energy: 0.4881923513659253
Energy: 0.3352969419801683
Energy: 0.321545043121839
Energy: 0.3352969419795427
Energy: 0.4870307416103165
Energy: 0.5117326218767727
Energy: 0.32673102648926633
Energy: 0.5117326218761472
Energy: 0.3355627464419272
Energy: 0.4357834136908578
Energy: 0.3270455737413065
Energy: 0.4357834136908578
Energy: 0.4802533430090218
Energy: 0.5326937340234819
Energy: 0.32497255832321825
Energy: 0.5326937340228564
Energy: 0.3244339444244198
Energy: 0.512052852506505
Energy: 0.42399490980818927
Energy: 0.5120528525046282
Energy: 0.32248747342629247
Energy: 0.5114587762017617
Energy: 0.3269863851669265
Energy: 0.5114587762011361
Energy: 0.326747280065517
Energy: 0.4357113379287258
Energy: 0.41996851795382883
Energy: 0.4357113379293515
Energy: 0.3192500490917525
Energy: 0.5308512352794079
Energy: 0.3268078619799657
Energy: 0.5308512352800335
Energy: 0.3250678566580804
Energy: 0.5117087174613242
Energy: 0.4151973066239085
Energy: 0.5117087174606985
Energy: 0.32251467990067817
Energy: 0.5123373637670416
Energy: 0.3378669193348519
Energy: 0.5123373637676674

minimum gb energy = 0.3192500490917525 eV
minimum distance =  2.49095401123805 Angstroms
sigma value = 15


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

Energy: 0.4451210605194639
Energy: 0.48131530979358533
Energy: 0.44407777447253777
Energy: 0.48131530979411535
Energy: 0.5225688328674357
Energy: 0.46585009638159397
Energy: 0.31008306879567477
Energy: 0.46585009638265396
Energy: 0.3194396733184307
Energy: 0.3096566275353672
Energy: 0.4108939012051887
Energy: 0.30965662753483725
Energy: 0.5001322137901224
Energy: 0.3994512868818648
Energy: 0.31007456444498444
Energy: 0.3994512868813348
Energy: 0.30800410799221856
Energy: 0.4830219802526608
Energy: 0.3427344327197291
Energy: 0.4830219802531908
Energy: 0.500033600645869
Energy: 0.3993107969534056
Energy: 0.3100692265630077
Energy: 0.3993107969544656
Energy: 0.3095968572708137
Energy: 0.3140513490080557
Energy: 0.3385391113951227
Energy: 0.31405134900752574
Energy: 0.36875020891752497
Energy: 0.3139494862367541
Energy: 0.3101051607622196
Energy: 0.3139494862367541
Energy: 0.3111715346870495
Energy: 0.48233980039986946
Energy: 0.48795407635781607
Energy: 0.48233980039986946
Energy: 0.3005231948543674
Energy: 0.466692724641893
Energy: 0.30845560485349016
Energy: 0.46669272464295297
Energy: 0.30956834372081765
Energy: 0.466525835262024
Energy: 0.5136447215039838
Energy: 0.466525835262554
Energy: 0.3021776343155623
Energy: 0.30958689510057524
Energy: 0.31983729811240164
Energy: 0.3095868951000453
Energy: 0.31143654819326505
Energy: 0.48556331680760406
Energy: 0.6026960403508189
Energy: 0.48556331680654413
Energy: 0.3018764753614896
Energy: 0.4808980443178569
Energy: 0.4455092143964859
Energy: 0.4808980443162669
Energy: 0.3095902980606494
Energy: 0.4658703271060321
Energy: 0.5649444556040244
Energy: 0.46587032710704385
Energy: 0.3787656899789568
Energy: 0.3094620788326661
Energy: 0.31973789002475594
Energy: 0.3094620788316061
Energy: 0.3112413304161199
Energy: 0.4852679753471934
Energy: 0.5344030712647083
Energy: 0.4852679753456035
Energy: 0.39147121485264263
Energy: 0.48352822641433235
Energy: 0.30840813808339157
Energy: 0.4835282264132724
Energy: 0.3096295372727697
Energy: 0.46570765111243784
Energy: 0.43429179415680086
Energy: 0.4657076511113779
Energy: 0.3882277941620242
Energy: 0.46661698656342626
Energy: 0.3101288000433549
Energy: 0.4666169865639563
Energy: 0.31137918140670207
Energy: 0.47704268034104413
Energy: 0.40593736562707594
Energy: 0.47704268034157404
Energy: 0.3815697398375059
Energy: 0.48610617571144893
Energy: 0.3129970803254462
Energy: 0.48610617571197895
Energy: 0.30954942530830676
Energy: 0.46559732131372833
Energy: 0.3003609264248868
Energy: 0.46559732131319836
Energy: 0.5176215930680874
Energy: 0.46565489350809186
Energy: 0.3100783446347067
Energy: 0.4656548935091518
Energy: 0.3210178440332127
Energy: 0.47812481412449737
Energy: 0.3021687447906711
Energy: 0.47812481412449737
Energy: 0.5044769154901377
Energy: 0.4856770603020252
Energy: 0.31310613542001065
Energy: 0.4856770603020252
Energy: 0.4466731225919661
Energy: 0.4789134047029942
Energy: 0.30197398132713804
Energy: 0.4789134047029942
Energy: 0.5631719336588467
Energy: 0.46581642241742754
Energy: 0.30998960149207455
Energy: 0.4658164224163676
Energy: 0.3210663179295005
Energy: 0.49603066365540566
Energy: 0.3055429143635968
Energy: 0.49603066365540566
Energy: 0.43742732076521856
Energy: 0.4851687468828068
Energy: 0.3131269131882096
Energy: 0.4851687468828068
Energy: 0.3096804423110706
Energy: 0.48322028028230857
Energy: 0.39095899265969636
Energy: 0.48322028028177855
Energy: 0.4339783052387643
Energy: 0.4662935291644122
Energy: 0.31011518779415903
Energy: 0.4662935291638822
Energy: 0.31124114941015835
Energy: 0.4958734938719981
Energy: 0.38841470855654187
Energy: 0.49587349387146806
Energy: 0.30191109154842094
Energy: 0.4777247140284203
Energy: 0.31316356915232546
Energy: 0.4777247140289503
Energy: 0.30821911726291573
Energy: 0.48320467055913646
Energy: 0.38164231738928056
Energy: 0.4832046705580765
Energy: 0.30073480162592336
Energy: 0.4662599909638108
Energy: 0.3114638685923998
Energy: 0.4662599909648708
Energy: 0.3111951843828988
Energy: 0.495939476813313
Energy: 0.5170455157600907
Energy: 0.495939476813313

minimum gb energy = 0.3003609264248868 eV
minimum distance =  2.56531809765817 Angstroms
sigma value = 85


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

Energy: 0.44883730961379076
Energy: 0.4600830215528248
Energy: 0.4064608403062381
Energy: 0.4600830215532845
Energy: 0.5530034611329651
Energy: 0.4340753245523835
Energy: 0.2841568724217224
Energy: 0.4340753245510046
Energy: 0.4321985262282442
Energy: 0.4287046936154516
Energy: 0.3408763563215922
Energy: 0.42870469361361296
Energy: 0.5274061998827706
Energy: 0.43094810160267155
Energy: 0.28416272338870946
Energy: 0.43094810160448926
Energy: 0.32624154862210786
Energy: 0.32968850088159485
Energy: 0.37035723229199424
Energy: 0.3296885008825141
Energy: 0.4731751242315682
Energy: 0.42836976128588883
Energy: 0.2841896088793667
Energy: 0.4283697612845099
Energy: 0.31189986762464716
Energy: 0.42326678235228693
Energy: 0.36568983154322193
Energy: 0.42326678235228693
Energy: 0.4769223599780478
Energy: 0.43033218476418483
Energy: 0.28767100288665953
Energy: 0.430332184760048
Energy: 0.287042510986557
Energy: 0.2887182805652264
Energy: 0.4708522085732698
Energy: 0.28871828056750376
Energy: 0.3582235722847512
Energy: 0.4200783065954784
Energy: 0.312378204016357
Energy: 0.4200783065940995
Energy: 0.2846624020512506
Energy: 0.43184482688904546
Energy: 0.4872380550544431
Energy: 0.43184482688904546
Energy: 0.30204048441886544
Energy: 0.4427353446278707
Energy: 0.32662937203956194
Energy: 0.44273534462741104
Energy: 0.28377925403662724
Energy: 0.2888915650491525
Energy: 0.5705026987035459
Energy: 0.2888915650463947
Energy: 0.27630152416487697
Energy: 0.4285569144789291
Energy: 0.43266847992995866
Energy: 0.4285569144803079
Energy: 0.2844667561269121
Energy: 0.4312307964370493
Energy: 0.5872517782864053
Energy: 0.43123079643613
Energy: 0.2743437137085559
Energy: 0.44988360215261164
Energy: 0.41741580692233043
Energy: 0.44988360215445017
Energy: 0.2837867161361565
Energy: 0.2907132468131708
Energy: 0.5855294496488654
Energy: 0.29071324681041294
Energy: 0.340798090978787
Energy: 0.4285615412428389
Energy: 0.43265193057292484
Energy: 0.42856154124421786
Energy: 0.2850042475065613
Energy: 0.4309735989029428
Energy: 0.5297959388500552
Energy: 0.4309735989047814
Energy: 0.352888920799689
Energy: 0.4577031609232534
Energy: 0.3266373693249728
Energy: 0.457703160923713
Energy: 0.2846310151530857
Energy: 0.3827611324062929
Energy: 0.49736307084676357
Energy: 0.3827611324062929
Energy: 0.3787492935028982
Energy: 0.4313966469775296
Energy: 0.3123361707279412
Energy: 0.43139664697569097
Energy: 0.2878405867389865
Energy: 0.4303688427042302
Energy: 0.41785612787774057
Energy: 0.4303688427065285
Energy: 0.37502818342561295
Energy: 0.45509574160889116
Energy: 0.28765797806991417
Energy: 0.4550957416084315
Energy: 0.3135961206852096
Energy: 0.3870895129613424
Energy: 0.3580969565894619
Energy: 0.387089512961802
Energy: 0.4873167972154403
Energy: 0.43166836719527724
Energy: 0.284132161555355
Energy: 0.4316683671961965
Energy: 0.32782279390770963
Energy: 0.4428767930364673
Energy: 0.30226474192560016
Energy: 0.44287679303508837
Energy: 0.49214723343677025
Energy: 0.4562559909795614
Energy: 0.28417321200700496
Energy: 0.4562559909814
Energy: 0.43399531646583434
Energy: 0.4293193674655694
Energy: 0.3041480382586411
Energy: 0.42931936746467103
Energy: 0.5878418204851157
Energy: 0.43122977473915614
Energy: 0.28405285926666574
Energy: 0.4312297747377981
Energy: 0.45046107694697374
Energy: 0.4600972642314341
Energy: 0.2742944702329699
Energy: 0.4600972642309744
Energy: 0.5373399380356331
Energy: 0.4582746124114411
Energy: 0.2841569777895594
Energy: 0.45827461241282
Energy: 0.4339753557413725
Energy: 0.4287917071745451
Energy: 0.2773873141039885
Energy: 0.4287917071736258
Energy: 0.5294220840026619
Energy: 0.43116591297389745
Energy: 0.2839744149449189
Energy: 0.431165912977115
Energy: 0.3278626844250728
Energy: 0.45809847324832026
Energy: 0.352657981377063
Energy: 0.4580984732464817
Energy: 0.4232866667768105
Energy: 0.4527376994583073
Energy: 0.2855888546609349
Energy: 0.45273769945508974
Energy: 0.3136352145625934
Energy: 0.4315636449117966
Energy: 0.37883111358428895
Energy: 0.4315636449108773
Energy: 0.4181419099716088
Energy: 0.4305034486191665
Energy: 0.28694344986249515
Energy: 0.43050344862054546
Energy: 0.2876740428717185
Energy: 0.4585540232332985
Energy: 0.3751581355030258
Energy: 0.45855402323191957
Energy: 0.30447046233083574
Energy: 0.44926898939710475
Energy: 0.3121308984521682
Energy: 0.4492689893961855
Energy: 0.283886584125119
Energy: 0.4315444125462191
Energy: 0.487261244817125
Energy: 0.4315444125480577
Energy: 0.3020708372730055
Energy: 0.4383265483326802
Energy: 0.32650270874133924
Energy: 0.43832654833313983
Energy: 0.2841676454419334
Energy: 0.45783092288899285
Energy: 0.492404034410543
Energy: 0.4578309228885332

minimum gb energy = 0.2742944702329699 eV
minimum distance =  2.56460937958624 Angstroms
sigma value = 113


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

Energy: 0.011686180163245026
Energy: 0.012272423578147854
Energy: 0.796231606801652
Energy: 0.012272423578501206
Energy: 0.599228509679453
Energy: 0.17556085783606612
Energy: 0.17487542100845305
Energy: 0.17556085783537906
Energy: 0.011686180163245026
Energy: 0.012272423578501206
Energy: 0.7962316068013183
Energy: 0.012272423578501206
Energy: 0.5992285096804933
Energy: 0.17556085783641948
Energy: 0.17487542100776599
Energy: 0.17556085783537906
Energy: 0.011686180163245026
Energy: 0.012272423578147854
Energy: 1.0431027902305245
Energy: 0.012272423578501206
Energy: 0.5992285096808271
Energy: 0.17556085783606612
Energy: 0.1748754210070789
Energy: 0.1755608578357324

minimum gb energy = 0.011686180163245026 eV
minimum distance =  2.83799243692042 Angstroms
sigma value = 1