Model name: model_name=EAM_Dynamo_Zhakhovsky_2009_Au__MO_173248269481_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Au
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.065000019967556
cohesive_energy=3.8102996988617694
mass=196.9665
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[8.761022270038799e-20, 1.501149784166496e-19, 2.04939219784842e-19, 2.53703067817266e-19, 2.9733995062088997e-19, 3.36546815031504e-19, 3.7186039022149796e-19, 4.0371326388205195e-19, 4.3245310834274398e-19, 4.583635088677919e-19, 4.816751788924919e-19, 5.02588390496094e-19, 5.21269770048534e-19, 5.37865115623506e-19, 5.52500999175096e-19, 5.65284766537782e-19, 5.76317354839506e-19, 5.85678872911968e-19, 5.934462252336e-19, 5.99683498869762e-19, 6.044515765325459e-19, 6.07800125697606e-19, 6.09778813840596e-19, 6.10429297554e-19, 6.09719533305138e-19, 6.0740118371574e-19, 6.0314740475247e-19, 5.96557652256828e-19, 5.8714967106198e-19, 5.74325849283444e-19, 5.57352390022848e-19, 5.35317654775446e-19, 5.07082495954464e-19, 4.71217772002374e-19, 4.2590341026295195e-19, 3.6882106114679996e-19, 2.96960234758632e-19, 2.0641642664139e-19, 9.203383238686199e-20, -5.305623945257339e-20, -2.38149137054394e-19, -4.7597463442872e-19, -7.84308721112118e-19, -1.188396894326526e-18, -1.7248873423980599e-18, -2.44827009264906e-18, -3.4419400410558597e-18, -4.83772428106398e-18, -6.85273376834676e-18, -9.862294401185039e-18, -1.455655978644066e-17, -2.23093483224696e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.011621326362040676
Energy: 0.01216506097929741
Energy: 0.4573781286705747
Energy: 0.09281417436432234
Energy: 0.01216506097929741
Energy: 0.515964565369196
Energy: 0.09281417436432234
Energy: 0.5159645653871359
Energy: 0.4573781286705747
Energy: 0.09281417436043672
Energy: 0.011621326362040676
Energy: 0.01216506097929741
Energy: 0.09281417436236575
Energy: 0.5159645653735501
Energy: 0.01216506097929741
Energy: 0.5159645653725855

minimum gb energy = 0.011621326362040676 eV
minimum distance =  2.80701954788153 Angstroms
sigma value = 1


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

Energy: 0.991885159866368
Energy: 0.7146159987414258
Energy: 0.7557458685345464
Energy: 0.7528344979358692
Energy: 0.7039973076840286
Energy: 0.7877256230069111
Energy: 0.7086779881413334
Energy: 0.7877256230063094
Energy: 0.7543640723965118
Energy: 0.7540570989880281
Energy: 0.8365074680237035
Energy: 0.7540570989892312
Energy: 0.7124387039247506
Energy: 0.7094891125636149
Energy: 0.7088718134755925
Energy: 0.7094891125642164
Energy: 0.8108666575184756
Energy: 0.7090547211343049
Energy: 0.7089576815619048
Energy: 0.7090547211337034
Energy: 0.7317585489242765
Energy: 0.7689375412674403
Energy: 0.7106270663041372
Energy: 0.7689375412668388
Energy: 0.7313626370107731
Energy: 0.7464919222205755
Energy: 0.81422314913049
Energy: 0.7464919222217787
Energy: 0.7332690897870472
Energy: 0.7323338074872217
Energy: 0.7620706910719347
Energy: 0.7323338074775962
Energy: 0.7777468984883436
Energy: 0.771443370336059
Energy: 0.7760026547396316
Energy: 0.771443370336059
Energy: 0.7908664103953417
Energy: 0.7727783093025573
Energy: 0.7584384664179704
Energy: 0.7727783093031589
Energy: 0.7532898355178825
Energy: 0.7707539858359097
Energy: 0.8127720817259374
Energy: 0.7707539858347064
Energy: 0.734149231914088
Energy: 0.7702433411432045
Energy: 0.7601028181820869
Energy: 0.770243341142603
Energy: 0.733467091643535
Energy: 0.7450329658682536
Energy: 0.7048378764526009
Energy: 0.7450329658676521
Energy: 0.731048661725107
Energy: 0.7459670281739319
Energy: 0.705428490687033
Energy: 0.7459670281733302
Energy: 0.7047654115115604
Energy: 0.7086965641669711
Energy: 0.7095126102527529
Energy: 0.7086965641663695
Energy: 0.7349849741881594
Energy: 0.7091559491085253
Energy: 0.709404390064487
Energy: 0.7091559491079237
Energy: 0.7552881373802838
Energy: 0.7526650179199195
Energy: 0.7107090557985335
Energy: 0.7526650179217241
Energy: 0.7094685727765488
Energy: 0.7089150702474128
Energy: 0.7047065037925123
Energy: 0.7089150702474128
Energy: 0.7092616727267177
Energy: 0.7543211357207825
Energy: 0.7521915655961947
Energy: 0.7543211357189776
Energy: 0.7712663690434284
Energy: 0.7092528608409299
Energy: 0.7099111434925506
Energy: 0.7092528608415314
Energy: 0.7114210728471365
Energy: 0.7122526106049174
Energy: 0.7289076537842129
Energy: 0.7122526106055189
Energy: 0.7099887674004643
Energy: 0.7091230096085993
Energy: 0.7319862647750649
Energy: 0.7091230096092009
Energy: 0.7321376433430279
Energy: 0.7475111702764335
Energy: 0.7318923627103651
Energy: 0.7475111702776367
Energy: 0.762154170411769
Energy: 0.7465658624228495
Energy: 0.7354731712256358
Energy: 0.7465658624222479
Energy: 0.7598495879954693
Energy: 0.7708521230963796
Energy: 0.8071184766929775
Energy: 0.7708521230969811
Energy: 0.759223483755546
Energy: 0.7757831656945849
Energy: 0.7919832599694265
Energy: 0.7757831656951867
Energy: 0.7636728465929224
Energy: 0.7707615707946208
Energy: 0.7543794769951385
Energy: 0.7707615707946208
Energy: 0.7599499719310187
Energy: 0.7696288637499613
Energy: 0.7348552675120984
Energy: 0.7696288637505628
Energy: 0.7050765652832779
Energy: 0.7445401251214957
Energy: 0.7310873738393787
Energy: 0.7445401251172847
Energy: 0.7059229862956209
Energy: 0.7449346296884876
Energy: 0.7307390212126736
Energy: 0.7449346296896908
Energy: 0.7086822376532476
Energy: 0.7086348918899115
Energy: 0.7040573802341994
Energy: 0.7086348918893098
Energy: 0.7087502766314804
Energy: 0.7093544645174692
Energy: 0.7331413544521834
Energy: 0.7093544645168676
Energy: 0.71084586290425
Energy: 0.7109418863795522
Energy: 0.7561301679927392
Energy: 0.7109418863789506

minimum gb energy = 0.7039973076840286 eV
minimum distance =  2.61930610779546 Angstroms
sigma value = 1


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

Energy: 1.1380418456489496
Energy: 0.7387980890200214
Energy: 0.7828246100649535
Energy: 0.7823468679123187
Energy: 0.7341619984011556
Energy: 0.8165816009240787
Energy: 0.735158038963725
Energy: 0.8165816009316237
Energy: 0.7821956931928545
Energy: 0.7844667876208116
Energy: 0.8644970202876712
Energy: 0.7844667876208116
Energy: 0.7371472863234306
Energy: 0.7356009805027685
Energy: 0.7350707915433621
Energy: 0.7356009804965952
Energy: 0.7363076694024796
Energy: 0.7352541211384294
Energy: 0.7365403574540834
Energy: 0.7352541211391151
Energy: 0.7761171720569078
Energy: 0.7810821353401843
Energy: 0.7344884379880366
Energy: 0.7810821353381266
Energy: 0.7676659345881726
Energy: 0.7816551581258198
Energy: 0.8116696102486902
Energy: 0.7816551581203325
Energy: 0.7708271489990544
Energy: 0.7801947170921872
Energy: 0.7649200148030332
Energy: 0.780194717092873
Energy: 0.7684627000225764
Energy: 0.8090522035314601
Energy: 0.8108442757283437
Energy: 0.809052203532832
Energy: 0.7710749145326785
Energy: 0.8219259070676368
Energy: 0.7703529656551601
Energy: 0.8219259070648931
Energy: 0.7358221705283685
Energy: 0.78077972593872
Energy: 0.7750983045036064
Energy: 0.78077972593872
Energy: 0.7343319711293818
Energy: 0.7819457516778734
Energy: 0.7694298795652441
Energy: 0.7819457516826748
Energy: 0.7361658742011816
Energy: 0.7355923996163578
Energy: 0.7338915348079207
Energy: 0.7355923996122422
Energy: 0.7344447321075009
Energy: 0.7353723008745282
Energy: 0.7345818274501681
Energy: 0.7353723008772719
Energy: 0.7340394249724245
Energy: 0.7824158867458877
Energy: 0.7821558312430449
Energy: 0.7824158867520609
Energy: 0.7351912493213887
Energy: 0.7361711257967692
Energy: 0.7351613407082501
Energy: 0.7361711257967692
Energy: 0.784356972733642
Energy: 0.784166707978906
Energy: 0.7349106972782102
Energy: 0.7841667079761623
Energy: 0.7374307145267336
Energy: 0.7351223177836472
Energy: 0.8132402644104378
Energy: 0.735122317785019
Energy: 0.7345560609061893
Energy: 0.739872014454019
Energy: 0.7368261969877501
Energy: 0.7398720144519613
Energy: 0.7761290253342624
Energy: 0.7357642751424316
Energy: 0.7350789525688668
Energy: 0.7357642751431175
Energy: 0.7678795788946577
Energy: 0.7832209858203739
Energy: 0.8772461427565433
Energy: 0.7832209858203739
Energy: 0.7676728931242653
Energy: 0.7824517863592861
Energy: 0.7650749824536792
Energy: 0.7824517863579143
Energy: 0.7677525874947724
Energy: 0.8092544640381498
Energy: 0.7949975553056468
Energy: 0.8092544640436372
Energy: 0.7716030358366323
Energy: 0.8112298356643379
Energy: 0.7688338695678154
Energy: 0.811229835662966
Energy: 0.7352023200627731
Energy: 0.7804119577724771
Energy: 0.7712823537603858
Energy: 0.7804119577717911
Energy: 0.7342281570573974
Energy: 0.7811264798930581
Energy: 0.7715183551359786
Energy: 0.7811264798944298
Energy: 0.7350412757793436
Energy: 0.7355976454308965
Energy: 0.7338832046417928
Energy: 0.7355976454363837
Energy: 0.7352255739676699
Energy: 0.7352241597353931
Energy: 0.7341262135048909
Energy: 0.7352241597340212
Energy: 0.7339394536052867
Energy: 0.7389133465727085
Energy: 0.7831753589604106
Energy: 0.7389133465788816

minimum gb energy = 0.7338832046417928 eV
minimum distance =  2.6141528321143 Angstroms
sigma value = 25


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

Energy: 1.0880072445729216
Energy: 0.7597415409806184
Energy: 0.8124090578200569
Energy: 0.8115298995356168
Energy: 0.7675130039328769
Energy: 0.8439126374950671
Energy: 0.7634207112919358
Energy: 0.8439126374966618
Energy: 0.8111503661816687
Energy: 0.8121049071886572
Energy: 0.8777291333082824
Energy: 0.8121049071902521
Energy: 0.76679912363002
Energy: 0.7642727208168764
Energy: 0.7637792527393872
Energy: 0.7642727208176738
Energy: 0.7610702208587791
Energy: 0.7637774756722943
Energy: 0.7635812060943948
Energy: 0.7637774756722943
Energy: 0.7907275246281872
Energy: 0.7651981679199079
Energy: 0.763325760577692
Energy: 0.7651981679238947
Energy: 0.7978873449111604
Energy: 0.8272294803679895
Energy: 0.7952145725058402
Energy: 0.8272294803687867
Energy: 0.7888808066011792
Energy: 0.8273334440162038
Energy: 0.7738042886580102
Energy: 0.8273334440154065
Energy: 0.7896658880098161
Energy: 0.8260630245055599
Energy: 0.7713019592217162
Energy: 0.8260630245063573
Energy: 0.7902033858797588
Energy: 0.8263834513387255
Energy: 0.7639048932637932
Energy: 0.8263834513387255
Energy: 0.7560962518036022
Energy: 0.7630728791395412
Energy: 0.7634857405033917
Energy: 0.7630728791387438
Energy: 0.7552384148185209
Energy: 0.762966391673303
Energy: 0.763488721888982
Energy: 0.7629663916741003
Energy: 0.8112312683295071
Energy: 0.8115619036791646
Energy: 0.7547205634579004
Energy: 0.8115619036791646
Energy: 0.7633294056147615
Energy: 0.763402103267469
Energy: 0.7679971949674452
Energy: 0.7634021032666717
Energy: 0.759796157050106
Energy: 0.8125399018884123
Energy: 0.8145339385713097
Energy: 0.8125399018868177
Energy: 0.8072105779347035
Energy: 0.7634987149599143
Energy: 0.8127478168305367
Energy: 0.7634987149591168
Energy: 0.7634771312102143
Energy: 0.7720978608915076
Energy: 0.7609664405114468
Energy: 0.7720978608915076
Energy: 0.7631462100811771
Energy: 0.7640596649034144
Energy: 0.7907745050053153
Energy: 0.7640596649026169
Energy: 0.827597862691975
Energy: 0.828683410074147
Energy: 0.799986410665615
Energy: 0.8286834100757418
Energy: 0.7742394489739463
Energy: 0.8267842291546876
Energy: 0.790929224726594
Energy: 0.8267842291554849
Energy: 0.768626162920103
Energy: 0.8257022938756341
Energy: 0.7896895709732092
Energy: 0.8257022938764313
Energy: 0.7678350774508061
Energy: 0.8267570563137722
Energy: 0.7896443232455223
Energy: 0.8267570563129748
Energy: 0.7615231294395453
Energy: 0.7629520099920147
Energy: 0.7550192801653878
Energy: 0.7629520099912175
Energy: 0.7634314483561435
Energy: 0.7643665232482573
Energy: 0.7553488198574532
Energy: 0.764366523249852
Energy: 0.7541002981337465
Energy: 0.7706316563338808
Energy: 0.8127907754190344
Energy: 0.770631656332286

minimum gb energy = 0.7541002981337465 eV
minimum distance =  2.60849441386636 Angstroms
sigma value = 9


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

Energy: 0.975127698608001
Energy: 0.8119439366428826
Energy: 0.8530648680248913
Energy: 0.8519906905073531
Energy: 0.8193916753104704
Energy: 0.8838190301382844
Energy: 0.8342130655703619
Energy: 0.8838190301401869
Energy: 0.8578549504417178
Energy: 0.8572052266626603
Energy: 0.8288440591074157
Energy: 0.8572052266617091
Energy: 0.8143675771222424
Energy: 0.8847577318306654
Energy: 0.8167030326929849
Energy: 0.8847577318306654
Energy: 0.7862975729818087
Energy: 0.8184767278903394
Energy: 0.8199587326681963
Energy: 0.8184767278903394
Energy: 0.8151248087441868
Energy: 0.8178456915910284
Energy: 0.8172373917357559
Energy: 0.8178456915919796
Energy: 0.809254486070195
Energy: 0.8898755356724625
Energy: 0.8337739965931441
Energy: 0.889875535671533
Energy: 0.8334685738121685
Energy: 0.8955577526667564
Energy: 0.8348855675292555
Energy: 0.8955577526677077
Energy: 0.846531708557425
Energy: 0.8437379146344542
Energy: 0.7917328395871613
Energy: 0.8437379146363566
Energy: 0.8414991471770689
Energy: 0.8127106884403903
Energy: 0.790195157225856
Energy: 0.8127106884403903
Energy: 0.7673839901379791
Energy: 0.7852846625963187
Energy: 0.7840738741467558
Energy: 0.7852846625963187
Energy: 0.8120466490307512
Energy: 0.7705038938445135
Energy: 0.7851410261870417
Energy: 0.7705038938445135
Energy: 0.8774862670352906
Energy: 0.8766006075282443
Energy: 0.8527033648927452
Energy: 0.8766006075301466
Energy: 0.8822124671319126
Energy: 0.8287989934384696
Energy: 0.8523640472145335
Energy: 0.8287989934394209
Energy: 0.7865052629955507
Energy: 0.8378515388170444
Energy: 0.8260901473488806
Energy: 0.8378515388170444
Energy: 0.8364039893329775
Energy: 0.8388123696689804
Energy: 0.82576943821214
Energy: 0.8388123696699317
Energy: 0.8083419908563828
Energy: 0.8934956870231254
Energy: 0.826648494515994
Energy: 0.8934956870231254
Energy: 0.8079760595275122
Energy: 0.8993226146607918
Energy: 0.8279980222228739
Energy: 0.8993226146626941
Energy: 0.8134534085083927
Energy: 0.815438900521787
Energy: 0.792080788091599
Energy: 0.815438900521787
Energy: 0.8134348029761134
Energy: 0.8267482672528769
Energy: 0.8089923718551136
Energy: 0.8267482672528769
Energy: 0.8041979060633168
Energy: 0.8355574871298516
Energy: 0.8531296943556657
Energy: 0.8355574871298516

minimum gb energy = 0.7673839901379791 eV
minimum distance =  2.59220506160806 Angstroms
sigma value = 25


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

Energy: 0.8944169981218987
Energy: 0.7887364628475474
Energy: 0.8604640140837704
Energy: 0.8602299042133372
Energy: 0.8663024510015103
Energy: 0.8457575514013498
Energy: 0.8049059277685704
Energy: 0.8457575514013498
Energy: 0.8594008239342615
Energy: 0.8594198132490407
Energy: 0.8547699066032657
Energy: 0.8594198132502171
Energy: 0.7825181912540488
Energy: 0.845944994887662
Energy: 0.8061362002330124
Energy: 0.8459449948864857
Energy: 0.7996169316071257
Energy: 0.8493718499456843
Energy: 0.8073432515009128
Energy: 0.8493718499456843
Energy: 0.7817201293539194
Energy: 0.8024447557305366
Energy: 0.8014892522750507
Energy: 0.8024447557305366
Energy: 0.7784316056678425
Energy: 0.8050448197159666
Energy: 0.8044323056156593
Energy: 0.8050448201004656
Energy: 0.7777258512776116
Energy: 0.8467064437547864
Energy: 0.8043391003165615
Energy: 0.8467064437559627
Energy: 0.8576013834732783
Energy: 0.8599625865093519
Energy: 0.7787434795107032
Energy: 0.8599625865093519
Energy: 0.8060934704092231
Energy: 0.8469477599697339
Energy: 0.7769286445813188
Energy: 0.8469477599720866
Energy: 0.8533143636901626
Energy: 0.8607446557555477
Energy: 0.8595441130629128
Energy: 0.8607446557555477
Energy: 0.8527266543410008
Energy: 0.84783395387445
Energy: 0.8606516426701779
Energy: 0.84783395387445
Energy: 0.8047532415521041
Energy: 0.8045198941825908
Energy: 0.8367655246041839
Energy: 0.8045198943636652
Energy: 0.8041333759563172
Energy: 0.8030395907556974
Energy: 0.7834763546794563
Energy: 0.8030395907674607
Energy: 0.8046540008115642
Energy: 0.8047047830100538
Energy: 0.7774388206382828
Energy: 0.8047047829688823
Energy: 0.8020696394357268
Energy: 0.8810551273054835
Energy: 0.7780170365728994
Energy: 0.8810551273066599
Energy: 0.7777138739524605
Energy: 0.7818893653071974
Energy: 0.8602483643683354
Energy: 0.7818893653083737

minimum gb energy = 0.7769286445813188 eV
minimum distance =  2.68248768055444 Angstroms
sigma value = 17


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

Energy: 1.283911886085655
Energy: 0.8760651938036556
Energy: 0.9194595585148264
Energy: 0.9213093819518825
Energy: 0.8454351319544368
Energy: 0.8569567719471484
Energy: 0.9205091838737216
Energy: 0.8569567719464821
Energy: 0.8377466078888491
Energy: 0.8363590952434756
Energy: 0.9007121303300029
Energy: 0.8363590952434756
Energy: 0.8378221905491411
Energy: 0.8905961390131015
Energy: 0.8502512951592837
Energy: 0.8905961390137678
Energy: 0.8377778166265253
Energy: 0.9077828684563
Energy: 0.7975916170828831
Energy: 0.9077828684549675
Energy: 0.8522094471315417
Energy: 0.8987362711378218
Energy: 0.8530855265059686
Energy: 0.8987362711371557
Energy: 0.8695422245819122
Energy: 0.8358169945048873
Energy: 0.833562401354129
Energy: 0.8358169945048873
Energy: 0.9124328967428732
Energy: 0.8524644732992153
Energy: 0.8355052172205336
Energy: 0.8524644733005478
Energy: 0.9201491387595961
Energy: 0.9212487700875303
Energy: 0.9152599735933927
Energy: 0.9212487700881965
Energy: 0.9224995393813966
Energy: 0.8953779684844712
Energy: 0.8992390941330749
Energy: 0.8953779684844712
Energy: 0.833552340478859
Energy: 0.8172068944453352
Energy: 0.8113776989762331
Energy: 0.8172068944440027
Energy: 0.906666232541833
Energy: 0.8244663451434462
Energy: 0.8156023431832012
Energy: 0.82446634514278
Energy: 0.9027499734181869
Energy: 0.8286055821251284
Energy: 0.824371483500354
Energy: 0.8286055820778574
Energy: 0.8745428832583234
Energy: 0.8519180255299454
Energy: 0.811521302761505
Energy: 0.8519180255299454
Energy: 0.9221791501563241
Energy: 0.8908595103737724
Energy: 0.9113636105593537
Energy: 0.8908595103724399
Energy: 0.9219120447999567
Energy: 0.9238712768010721
Energy: 0.9202404097595891
Energy: 0.9238712768017382
Energy: 0.903221534656711
Energy: 0.8521256223513933
Energy: 0.837989558481052
Energy: 0.8521256223520596
Energy: 0.9024477662597508
Energy: 0.8521115631684517
Energy: 0.8361983435536564
Energy: 0.8521115631671192
Energy: 0.8522208598405765
Energy: 0.9181765091879746
Energy: 0.8398075560321382
Energy: 0.9181765091873083
Energy: 0.8597553747615037
Energy: 0.9049328297059817
Energy: 0.8525557097878812
Energy: 0.9049328297059817
Energy: 0.8374278427662569
Energy: 0.8533546813993407
Energy: 0.9121741114130376
Energy: 0.8533546814000069
Energy: 0.8360206496673525
Energy: 0.836036545257467
Energy: 0.8704515653721381
Energy: 0.8360365452587996
Energy: 0.8584728681601561
Energy: 0.8932323293738297
Energy: 0.8906958191937564
Energy: 0.8932323293738297
Energy: 0.9166184052523805
Energy: 0.9218754505974296
Energy: 0.9179443199967661
Energy: 0.9218754505980958
Energy: 0.8130504965849404
Energy: 0.8525867850924638
Energy: 0.9187073062406752
Energy: 0.8525867850937962
Energy: 0.8180699647998155
Energy: 0.8319453896891438
Energy: 0.8341944454695412
Energy: 0.8319453896898099
Energy: 0.8095067510334294
Energy: 0.811634180263033
Energy: 0.9049467802147522
Energy: 0.8116341802636993
Energy: 0.8162129772760194
Energy: 0.8325291750584292
Energy: 0.8753064241499467
Energy: 0.8325291750597312
Energy: 0.8192262125967029
Energy: 0.8535024922181851
Energy: 0.8715271547565776
Energy: 0.8535024922181851
Energy: 0.9203675608304646
Energy: 0.9209781993250634
Energy: 0.9181550697238975
Energy: 0.9209781992964162

minimum gb energy = 0.7975916170828831 eV
minimum distance =  2.63420674243463 Angstroms
sigma value = 53


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

Energy: 1.1579126205855093
Energy: 0.7355910766955046
Energy: 0.8417510170210728
Energy: 0.8459242055168267
Energy: 1.0101414847921941
Energy: 0.7947691462058578
Energy: 0.8549334275463304
Energy: 0.7947691462058578
Energy: 0.8409564492778806
Energy: 0.8464444610125428
Energy: 0.876380901041842
Energy: 0.8464444610125428
Energy: 0.8562187584626607
Energy: 0.7946864515974509
Energy: 0.9111787406027659
Energy: 0.7946864515974509
Energy: 0.8559411299822397
Energy: 0.809073281224302
Energy: 0.7333875565468885
Energy: 0.809073281224302
Energy: 0.9083932042063291
Energy: 0.7965375488135336
Energy: 0.7325073642069713
Energy: 0.7965375488089325
Energy: 0.9392954956928544
Energy: 0.8505109852799759
Energy: 0.8457077348360451
Energy: 0.8505109852815096
Energy: 0.9400857912167057
Energy: 0.7953361774487293
Energy: 0.8503465696689727
Energy: 0.795336177444128
Energy: 0.842497000987623
Energy: 0.8450568178739545
Energy: 0.842504754979062
Energy: 0.8450568178739545
Energy: 0.8552634846582037
Energy: 0.7956145938151092
Energy: 0.9119471733302514
Energy: 0.7956145938089743
Energy: 0.8536776364605975
Energy: 0.796647697399846
Energy: 0.7329571327795068
Energy: 0.7966476974013796
Energy: 0.9092105688738069
Energy: 0.7951908849710422
Energy: 0.7352723020112454
Energy: 0.795190884972576
Energy: 0.9400114280292973
Energy: 0.7963259708550239
Energy: 0.8528055355313442
Energy: 0.7963259708550239

minimum gb energy = 0.7325073642069713 eV
minimum distance =  2.66518256413075 Angstroms
sigma value = 9


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

Energy: 1.1351409007619324
Energy: 0.8996621790605456
Energy: 0.9463048518958995
Energy: 0.9480047329496715
Energy: 0.8664306116429271
Energy: 0.8176864515606557
Energy: 0.9485220460826632
Energy: 0.8176864515595204
Energy: 0.813116936382257
Energy: 0.8149642190555596
Energy: 0.9454421780648226
Energy: 0.8149642190538566
Energy: 0.8133191240514188
Energy: 0.815956339347633
Energy: 1.023520837832672
Energy: 0.8159563393482007
Energy: 0.8133276678156407
Energy: 0.8213949002479849
Energy: 0.9971043032052542
Energy: 0.821394900249688
Energy: 0.8252991003078971
Energy: 0.819552368395608
Energy: 0.997828803457689
Energy: 0.8195523683848741
Energy: 0.9443538415921372
Energy: 0.9478292628874486
Energy: 0.9530321523946916
Energy: 0.9478292628880163
Energy: 0.9804142105173687
Energy: 0.8166544879905503
Energy: 0.9513714658924209
Energy: 0.8166544879894151
Energy: 0.8628421586506818
Energy: 0.8628082719811748
Energy: 0.8598858883793182
Energy: 0.8628082719811748
Energy: 0.8235110917612856
Energy: 0.8186688785428744
Energy: 0.9905791834732378
Energy: 0.8186688783091001
Energy: 0.8560610940317288
Energy: 0.8599298309554303
Energy: 0.9407642389627103
Energy: 0.859929830955998
Energy: 0.8540397495687538
Energy: 0.8593260273127304
Energy: 0.994305429158106
Energy: 0.8593260273149494
Energy: 0.98295749959191
Energy: 0.8593557485248359
Energy: 0.8540632813892263
Energy: 0.8593557485242682
Energy: 0.9453665198544186
Energy: 0.8544108138581161
Energy: 0.8532243300477425
Energy: 0.8544108138564133
Energy: 0.995502242322056
Energy: 0.8629884949296929
Energy: 0.8698903165310344
Energy: 0.8629884949296929
Energy: 0.8972446571351967
Energy: 0.9012591701898301
Energy: 0.8714020036464464
Energy: 0.9012591701881272
Energy: 0.9505146631425619
Energy: 0.8186201676364357
Energy: 0.8569893902115042
Energy: 0.818620167635868
Energy: 0.9445932168018822
Energy: 0.9479026941899625
Energy: 1.1319727393280663
Energy: 0.9479026941882597
Energy: 0.948282260345788
Energy: 0.8170977789563719
Energy: 0.8663663831132187
Energy: 0.8170977789552366
Energy: 1.0527107226592967
Energy: 0.814609079728594
Energy: 0.8153679247094937
Energy: 0.8146090797291617
Energy: 0.9905482341708773
Energy: 0.8162040325871288
Energy: 0.8144502185512634
Energy: 0.8162040325865612
Energy: 0.9975386969640524
Energy: 0.8205046520223205
Energy: 0.8201076359210435
Energy: 0.8205046520223205
Energy: 0.9974612594898296
Energy: 0.8253991914803617
Energy: 0.823791953745781
Energy: 0.825399191478091
Energy: 0.9507570299666475
Energy: 0.9470276134947602
Energy: 0.9442226650723147
Energy: 0.9470276134964631
Energy: 0.9535213039630057
Energy: 0.8161292319001698
Energy: 0.9799294265005963
Energy: 0.8161292318973316
Energy: 0.8741777360250751
Energy: 0.9079180694749386
Energy: 0.8612152487989383
Energy: 0.9079180694738033
Energy: 0.9924939495322449
Energy: 0.8191070277871713
Energy: 0.8256835610911657
Energy: 0.8191070277900095
Energy: 0.9417785892191324
Energy: 0.8596705393021661
Energy: 0.863337246263879
Energy: 0.8596705393021661
Energy: 0.9953366644504864
Energy: 0.8546792137124377
Energy: 0.8540510077377111
Energy: 0.8546792137141407
Energy: 0.8542959659056183
Energy: 0.8587137031050128
Energy: 0.9902438072674645
Energy: 0.8587137031061481
Energy: 0.8539714229408527
Energy: 0.8535459685717011
Energy: 0.9425973814799546
Energy: 0.8535459685705659
Energy: 0.8720501476356801
Energy: 0.860793252698504
Energy: 0.994950782406403
Energy: 0.8607932526996394
Energy: 0.8732596570251973
Energy: 0.9093399460630724
Energy: 0.8969448757481824
Energy: 0.9093399460625048
Energy: 0.8578597045364218
Energy: 0.8195992764475419
Energy: 0.9249172042835497
Energy: 0.819599276449245
Energy: 0.9929326592972153
Energy: 0.9475979186551683
Energy: 0.9484849323116129
Energy: 0.947597918655736

minimum gb energy = 0.813116936382257 eV
minimum distance =  2.62638952216744 Angstroms
sigma value = 73


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

Energy: 1.1584507689214438
Energy: 0.868857503726852
Energy: 0.9208990164404856
Energy: 0.9213114806346597
Energy: 0.8802532388124577
Energy: 0.8359728863955531
Energy: 0.9226768540163192
Energy: 0.8359728884157018
Energy: 0.8341028307904516
Energy: 0.8363345356542706
Energy: 0.9458627646827059
Energy: 0.8363345356524695
Energy: 0.8316336568858341
Energy: 0.8369131122734996
Energy: 1.0625867873355057
Energy: 0.8369131122725989
Energy: 0.8358990597135781
Energy: 0.8459690854062085
Energy: 0.955308765762748
Energy: 0.8459690854035066
Energy: 0.8463236005870638
Energy: 0.8384696975278294
Energy: 0.9553418533426492
Energy: 0.8384696975296307
Energy: 0.8628126954338147
Energy: 0.983881021833883
Energy: 0.951523726088327
Energy: 0.9838810218321021
Energy: 0.895748880768232
Energy: 0.8406666907877322
Energy: 0.9517207397710937
Energy: 0.8406666907886328
Energy: 0.8518270880497547
Energy: 0.8165462926594882
Energy: 0.9478273592201788
Energy: 0.8165462926567862
Energy: 0.8697010417982542
Energy: 0.927837118077572
Energy: 0.9771188398974322
Energy: 0.927837118077572
Energy: 0.8585636543501075
Energy: 0.874606972759657
Energy: 0.8133835873454031
Energy: 0.8746069727587564
Energy: 0.8528654545611585
Energy: 0.8243119356372721
Energy: 0.98598800471918
Energy: 0.8243119356372721
Energy: 0.9861415691247457
Energy: 0.8768283651181238
Energy: 0.8716226433801151
Energy: 0.8768283651172233
Energy: 0.9449916108734238
Energy: 0.8915860181118146
Energy: 0.8722737825846676
Energy: 0.8915860181118146
Energy: 0.9670928467209713
Energy: 0.8819783264831225
Energy: 0.8664239325996298
Energy: 0.8819783264795403
Energy: 0.9557240312470359
Energy: 0.8609782099914286
Energy: 0.8587590806894021
Energy: 0.8609782099914286
Energy: 0.9881206785968176
Energy: 0.8976310858833447
Energy: 0.8708780656458777
Energy: 0.8976310858833447
Energy: 0.9274173187337845
Energy: 0.9241575597117662
Energy: 0.8627895472018846
Energy: 0.9241575597117662
Energy: 0.9314221995033223
Energy: 0.8991319713989491
Energy: 0.895714765541292
Energy: 0.8991319713989491
Energy: 0.9717309458010028
Energy: 0.897867446221677
Energy: 0.9451555421648896
Energy: 0.897867446221677
Energy: 0.9540180664432096
Energy: 0.8971688480880935
Energy: 0.8698028434270852
Energy: 0.8971688480898947
Energy: 0.9501764754638788
Energy: 0.8991099873669565
Energy: 0.9189927888794123
Energy: 0.8991099873696583

minimum gb energy = 0.8133835873454031 eV
minimum distance =  2.60743800588982 Angstroms
sigma value = 7


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

Energy: 1.2689998220930276
Energy: 0.8620942379076586
Energy: 0.92896742908828
Energy: 0.9276138449169142
Energy: 0.9247685401385601
Energy: 0.8379941724851718
Energy: 0.931520464040171
Energy: 0.8379941722782815
Energy: 0.8337582381837187
Energy: 0.8384005009196299
Energy: 0.9352129187136671
Energy: 0.8384005009183563
Energy: 0.8279176446135594
Energy: 0.839079845495635
Energy: 0.9349678834902933
Energy: 0.8390798454943613
Energy: 0.834560685735668
Energy: 0.8348081368982073
Energy: 1.0132760725765861
Energy: 0.8348081368982073
Energy: 0.8362970536366661
Energy: 0.8750588118939534
Energy: 1.0117011306849277
Energy: 0.8750588118907691
Energy: 0.9279104101882273
Energy: 0.8380769764881632
Energy: 0.8394991264140222
Energy: 0.8380769764856157
Energy: 0.9291943767309773
Energy: 0.8739576933932164
Energy: 0.8371859668126359
Energy: 0.8739576933919427
Energy: 0.9341414800239124
Energy: 0.8352549144565787
Energy: 0.8327822962604696
Energy: 0.835254914455305
Energy: 1.0320420332821205
Energy: 0.8721610535848587
Energy: 0.8379661324466791
Energy: 0.8721610535899535
Energy: 0.9363248929674824
Energy: 0.8360910894962249
Energy: 0.8376136694493426
Energy: 0.8360910894974987
Energy: 0.923898754249535
Energy: 0.9202873477305926
Energy: 0.9275418926272413
Energy: 0.920287347728682
Energy: 0.9257434940760078
Energy: 0.8347360422443444
Energy: 0.9396588752430246
Energy: 0.8347360380633477
Energy: 0.9276318367759219
Energy: 0.8888503975222446
Energy: 0.8430199002313307
Energy: 0.8888503975158761
Energy: 0.9393910606631951
Energy: 0.8923528914143912
Energy: 0.8413631508998477
Energy: 0.8923528914137543
Energy: 0.8504005405585228
Energy: 0.9187941932803072
Energy: 0.9239270583691186
Energy: 0.9187941933554268
Energy: 0.8482187679401436
Energy: 0.8367303177140119
Energy: 0.9335953546673572
Energy: 0.8367303177248383
Energy: 0.8385475386116363
Energy: 0.8727388869016681
Energy: 0.941304858308541
Energy: 0.8727388869093103
Energy: 0.8322256489495065
Energy: 0.8341961245618178
Energy: 0.9325065411162142
Energy: 0.834196124560544
Energy: 0.8355865140052742
Energy: 0.8770420973507098
Energy: 0.8498091369599884
Energy: 0.8770420973500729
Energy: 0.8392498789436994
Energy: 0.886616259403523
Energy: 1.0095752427196631
Energy: 0.8866162594067072
Energy: 0.927629435941892
Energy: 0.8320777158898973
Energy: 0.8388121653027193
Energy: 0.8320777158848026
Energy: 0.9282129759011728
Energy: 0.8359285929510939
Energy: 0.8357582694956898
Energy: 0.8359285929517307
Energy: 1.0191858478681117
Energy: 0.8366810221275751
Energy: 0.829524963928386
Energy: 0.8366810221269383
Energy: 1.0273277413298407
Energy: 0.8370936327873254
Energy: 0.834000543679896
Energy: 0.8370936327885992
Energy: 1.0112302943924418
Energy: 0.8377188919391853
Energy: 0.8455739840752519
Energy: 0.8377188919353641
Energy: 0.9282811775921581
Energy: 0.9226961851439561
Energy: 1.1492623078234114
Energy: 0.9226961851452299
Energy: 0.9249017774603774
Energy: 0.8343938590149773
Energy: 0.941070689154711
Energy: 0.8343938590124298
Energy: 0.9289988498045569
Energy: 0.8951918815117264
Energy: 0.9244564350822597
Energy: 0.8951918815136367
Energy: 0.9382986921566313
Energy: 0.9400648995911802
Energy: 0.8427537639970943
Energy: 0.940064899583538
Energy: 0.8461608293283973
Energy: 0.9252265680424177
Energy: 0.9211245011898743
Energy: 0.9252265680417808

minimum gb energy = 0.8279176446135594 eV
minimum distance =  2.6189004253778 Angstroms
sigma value = 29


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

Energy: 0.7783514656589076
Energy: 0.8056070390769458
Energy: 0.8465477163935121
Energy: 0.7947901756646116
Energy: 0.7798680157261091
Energy: 0.8241651208773164
Energy: 0.8241463272101025
Energy: 0.8241651208825173
Energy: 0.8035007624953712
Energy: 0.7926825124829315
Energy: 0.7827977431015773
Energy: 0.7926825124855443
Energy: 0.7901325374195693
Energy: 0.7951052642802577
Energy: 0.7993571066213281
Energy: 0.7951052642815641
Energy: 0.7998432765485406
Energy: 0.7970533703000956
Energy: 0.7781329155593326
Energy: 0.7970533702927257
Energy: 0.7994931352518934
Energy: 0.795568068067304
Energy: 0.7796421295728772
Energy: 0.7955680682734861
Energy: 0.7762056160847353
Energy: 0.7916562750867223
Energy: 0.8005720684251819
Energy: 0.7916562753204366
Energy: 0.8236915644568135
Energy: 0.8006341673187215
Energy: 0.7879314639281808
Energy: 0.8006341673065946
Energy: 0.7799353148531121
Energy: 0.7965413636553933
Energy: 0.7908062115771393
Energy: 0.7965413638112686

minimum gb energy = 0.7762056160847353 eV
minimum distance =  2.64037031343086 Angstroms
sigma value = 5


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

Energy: 1.044663972100311
Energy: 0.8220252993582797
Energy: 0.8084530909727234
Energy: 0.8042397918821533
Energy: 0.774635659188051
Energy: 0.8042851488331946
Energy: 0.9169120274461982
Energy: 0.8042851488331946
Energy: 0.917815529210791
Energy: 0.8741828685301773
Energy: 0.9233354379786578
Energy: 0.8741828685301773
Energy: 0.8285735935483898
Energy: 0.8032657767604903
Energy: 0.8311342715770155
Energy: 0.8032657767604903
Energy: 0.8321095100127228
Energy: 0.8199192501236885
Energy: 0.9145487093638359
Energy: 0.8199192501236885
Energy: 0.8215711524207364
Energy: 0.809418527933667
Energy: 0.9139638867784466
Energy: 0.809418527933667
Energy: 0.801899134923656
Energy: 0.803644256889195
Energy: 0.8661251591067625
Energy: 0.803644256889195
Energy: 0.8091924359396085
Energy: 0.8045084972682471
Energy: 0.7754882242386469
Energy: 0.8045084972676456
Energy: 0.8121197910677537
Energy: 0.8285797312724703
Energy: 0.7785447747107348
Energy: 0.8285797312724703
Energy: 0.9347637863064032
Energy: 0.7843572212435357
Energy: 0.7819585853851778
Energy: 0.7843572212441373
Energy: 0.8133161899164941
Energy: 0.7758026814104184
Energy: 0.7757207715249654
Energy: 0.77580268141102
Energy: 0.7746097265077315
Energy: 0.7780111181042934
Energy: 0.7746674843532534
Energy: 0.7780111181036918
Energy: 0.7857135144015991
Energy: 0.7753696883048421
Energy: 0.7805243911907656
Energy: 0.7753696882940136
Energy: 0.8036214690878959
Energy: 0.820565688806299
Energy: 0.9192037872813715
Energy: 0.820565688806299
Energy: 0.8021887555237187
Energy: 0.8056167561952686
Energy: 0.9162316518519862
Energy: 0.8056167561958701
Energy: 0.804693653571352
Energy: 0.8036584072621142
Energy: 0.8844084448819962
Energy: 0.8036584072615127
Energy: 0.8054003046480573
Energy: 0.8160995268785438
Energy: 0.8291339340142219
Energy: 0.8160995268779422
Energy: 0.8302047369831627
Energy: 0.8048904557004609
Energy: 0.7819319271438656
Energy: 0.804890455701664
Energy: 0.9345011831799376
Energy: 0.8755501777874392
Energy: 0.9171450887729943
Energy: 0.8755501777874392
Energy: 0.8320389330116316
Energy: 0.8798035868891088
Energy: 0.8269786663179172
Energy: 0.8798035868879056
Energy: 0.9138502666360794
Energy: 0.8069506521081479
Energy: 0.862193566452074
Energy: 0.8069506521069447
Energy: 0.914775875689022
Energy: 0.8209387914473086
Energy: 0.8224759189469356
Energy: 0.8209387914467071
Energy: 0.8300562249996686
Energy: 0.8033303212465573
Energy: 0.8024903168765795
Energy: 0.8033303212459556
Energy: 0.7880368900372637
Energy: 0.8034804347671067
Energy: 0.8065477636918166
Energy: 0.8034804347683099
Energy: 0.7773077111293281
Energy: 0.8261734078352077
Energy: 0.8141758796284181
Energy: 0.8261734078340044
Energy: 0.776352973945503
Energy: 0.7787879653914356
Energy: 0.934825432389477
Energy: 0.7787879653920371
Energy: 0.7791895942782198
Energy: 0.7762025062095252
Energy: 0.8119061219793741
Energy: 0.7762025062089236
Energy: 0.7849756923826754
Energy: 0.777061928993803
Energy: 0.8404370195401435
Energy: 0.777061928993803
Energy: 0.7783850327993581
Energy: 0.7849846742009465
Energy: 0.7733671740717035
Energy: 0.784984674200345
Energy: 0.9174492880263942
Energy: 0.8275804744671896
Energy: 0.8079312893470167
Energy: 0.8275804744677913
Energy: 0.9176102717383049
Energy: 0.8034058912892725
Energy: 0.8040281599946266
Energy: 0.8034058912904756
Energy: 0.9469180895603428
Energy: 0.8034977262459924
Energy: 0.8022318730984549
Energy: 0.8034977262441877
Energy: 0.8291357913876258
Energy: 0.8157049514078321
Energy: 0.804842781482733
Energy: 0.8157049514078321

minimum gb energy = 0.7733671740717035 eV
minimum distance =  2.62294591009951 Angstroms
sigma value = 1


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

Energy: 1.1735788534411506
Energy: 0.7782049704905282
Energy: 0.8813192582630947
Energy: 0.7864299784618065
Energy: 0.7840713945540849
Energy: 0.7816169864765511
Energy: 0.8014338173625355
Energy: 0.7816169864782148
Energy: 0.8273172526722947
Energy: 0.8713367858902632
Energy: 0.8019369647350052
Energy: 0.871336785891095
Energy: 0.8692447756176576
Energy: 0.8734145168691543
Energy: 0.8184868452543778
Energy: 0.8734145168699861
Energy: 0.8254252722746842
Energy: 0.8660392869817745
Energy: 0.8796731650421492
Energy: 0.8660392869826062
Energy: 0.8028921575619108
Energy: 0.7945534293073341
Energy: 0.8775516138177187
Energy: 0.7945534293056705
Energy: 0.787288762466229
Energy: 0.7884127131002621
Energy: 0.8188165952752954
Energy: 0.7884127131027573
Energy: 0.7909974940498802
Energy: 0.7908272727896073
Energy: 0.8647903160205321
Energy: 0.7908272727887755
Energy: 0.7955556652476291
Energy: 0.8275026782163863
Energy: 0.8567549858946493
Energy: 0.827502678213891
Energy: 1.0197041046219677
Energy: 0.7376051250985061
Energy: 0.8228390587841798
Energy: 0.7376051250968425
Energy: 0.7965020587436092
Energy: 0.7411815458304705
Energy: 0.8239535688733243
Energy: 0.7411815458296387
Energy: 0.7330106741424828
Energy: 0.7397423525401456
Energy: 0.8095962568709484
Energy: 0.739742352542641
Energy: 0.7377383462486199
Energy: 0.7364590912016632
Energy: 0.824360109147792
Energy: 0.7364590911999996
Energy: 0.7965596095293344
Energy: 0.7375013345170561
Energy: 0.8271493098934122
Energy: 0.7375013345162243
Energy: 0.8705627489443852
Energy: 0.8278468805860273
Energy: 0.8138784878634676
Energy: 0.8278468805860273
Energy: 0.8705342966435898
Energy: 0.7915521910503905
Energy: 0.7804671153444788
Energy: 0.7915521910503905
Energy: 0.8413610157160155
Energy: 0.8136340296246395
Energy: 0.8775165905510298
Energy: 0.8136340296229759
Energy: 0.7982194075300854
Energy: 0.7916199760642365
Energy: 0.8763078648203295
Energy: 0.7916199760659001
Energy: 0.790829185830903
Energy: 0.7893861405218346
Energy: 0.8565732924876298
Energy: 0.789386140521003
Energy: 0.7918387545262123
Energy: 0.789382711521568
Energy: 0.8648882132728809
Energy: 0.7893827115199045
Energy: 0.8587088247847342
Energy: 0.8292544421294801
Energy: 0.7812802341246301
Energy: 0.8292544421294801
Energy: 0.8441237940445608
Energy: 0.7813668602951203
Energy: 0.7843346780396485
Energy: 0.7813668602951203
Energy: 0.8875063502887469
Energy: 0.7796559969213995
Energy: 0.7800353239677684
Energy: 0.7796559969189042
Energy: 0.8799719336223016
Energy: 0.7890374860615134
Energy: 0.7871947174994771
Energy: 0.7890374860565226

minimum gb energy = 0.7330106741424828 eV
minimum distance =  2.60136493189329 Angstroms
sigma value = 17


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

Energy: 1.1591641772287193
Energy: 0.7575640062697981
Energy: 0.8783997307402309
Energy: 0.791082800278959
Energy: 0.7833485723488159
Energy: 0.7676498595142348
Energy: 0.8761339555797913
Energy: 0.7676498595162913
Energy: 0.9531326746677974
Energy: 0.809586087915502
Energy: 0.8736793480139632
Energy: 0.809586087915502
Energy: 0.960943072574994
Energy: 0.8665587585838882
Energy: 0.897793118086007
Energy: 0.866558758597255
Energy: 0.8691418015676845
Energy: 0.7552251197105191
Energy: 0.8717697869176125
Energy: 0.7552251197110331
Energy: 0.7586937642544935
Energy: 0.755809006901733
Energy: 0.8674715860191993
Energy: 0.755809006901733
Energy: 0.7472438115158903
Energy: 0.7466809079525021
Energy: 0.8176473330229417
Energy: 0.746680907951988
Energy: 0.7527104771161284
Energy: 0.7480441982289224
Energy: 0.758662383634567
Energy: 0.7480441982268659
Energy: 0.8744872802603083
Energy: 0.7485508724606345
Energy: 0.9526609000697674
Energy: 0.7485508724606345
Energy: 0.8723499077732719
Energy: 0.7682364654510332
Energy: 0.8776002248440674
Energy: 0.7682364618014428
Energy: 0.8707867305737453
Energy: 0.8130161507047452
Energy: 0.7814087677637798
Energy: 0.8130161508085492
Energy: 0.8728483291612338
Energy: 0.7687063834751273
Energy: 0.886174583248449
Energy: 0.7687063834761555
Energy: 0.8750155427203046
Energy: 0.7789639319380736
Energy: 0.7888560294222157
Energy: 0.7789639319385876
Energy: 0.7670003798246969
Energy: 0.7655258444068621
Energy: 0.7670521367822019
Energy: 0.7655258444078903
Energy: 0.9578754201930807
Energy: 0.7671753616798024
Energy: 0.7732258911748595
Energy: 0.7671753616803164
Energy: 0.7688143682748779
Energy: 0.7927224105621771
Energy: 0.767434424418072
Energy: 0.7927224105601206
Energy: 0.7684467861817341
Energy: 0.7714935528339888
Energy: 0.8869885217680245
Energy: 0.7714935528283334
Energy: 0.7698471983775569
Energy: 0.7659041277912982
Energy: 0.8736060393548305
Energy: 0.7659041277912982
Energy: 0.775692654891168
Energy: 0.7671491118598748
Energy: 0.8931038930603044
Energy: 0.7671491118603888
Energy: 0.7923617818293395
Energy: 0.7947257132938313
Energy: 0.7584779106948766
Energy: 0.794725713010649
Energy: 0.8750378111177715
Energy: 0.7668839649113685
Energy: 0.7663902831760976
Energy: 0.7668839649098261
Energy: 0.8743412229545159
Energy: 0.81037356847035
Energy: 0.9551352026713084
Energy: 0.8103735684693217
Energy: 0.8227467505566073
Energy: 0.807660353366354
Energy: 0.9594242772618445
Energy: 0.807660353366354
Energy: 0.8760907942277512
Energy: 0.7565182735725284
Energy: 0.8636174352781083
Energy: 0.7565182735715003
Energy: 0.8731980059291077
Energy: 0.749733342222488
Energy: 0.755438710579856
Energy: 0.749733342221974
Energy: 0.8266190742742664
Energy: 0.7471480038878806
Energy: 0.7495495470464953
Energy: 0.7471480038868523
Energy: 0.7586730126566145
Energy: 0.7487100372577958
Energy: 0.7552864057051325
Energy: 0.7487100372963075
Energy: 0.9663587599854851
Energy: 0.747791823566167
Energy: 0.868720704653892
Energy: 0.7477918235671952
Energy: 0.8745591969645666
Energy: 0.7680303374567686
Energy: 0.872045928142438
Energy: 0.7680303374552262
Energy: 0.7825342884052181
Energy: 0.7688231629440486
Energy: 0.8679018452093861
Energy: 0.7688231629435344
Energy: 0.8876781832885525
Energy: 0.7805064150488928
Energy: 0.8741054843476911
Energy: 0.7805064150504352
Energy: 0.784899022844169
Energy: 0.7816979850979002
Energy: 0.8654410258407708
Energy: 0.7816979850958438
Energy: 0.7654734557043729
Energy: 0.765011581240283
Energy: 0.7669854459218514
Energy: 0.765011581240283
Energy: 0.772936504513013
Energy: 0.7680155750612052
Energy: 0.9591011171220053
Energy: 0.7680155750612052
Energy: 0.7695570567865487
Energy: 0.789892299239947
Energy: 0.7742846076222103
Energy: 0.7898922992378905
Energy: 1.0618008124543217
Energy: 0.7704545761202625
Energy: 0.7904491878964754
Energy: 0.7704545761176919
Energy: 0.8687790530879993
Energy: 0.7659463288474067
Energy: 0.7665986519230461
Energy: 0.7659463288474067
Energy: 0.9508447691795846
Energy: 0.768280765961179
Energy: 0.7901318676404795
Energy: 0.7682807659622071

minimum gb energy = 0.746680907951988 eV
minimum distance =  2.6019520588 Angstroms
sigma value = 89


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

Energy: 1.1964761862466475
Energy: 0.7313872657471459
Energy: 0.7028399233613702
Energy: 0.7057099090808219
Energy: 0.6983330779791087
Energy: 0.7748009761116297
Energy: 0.7217426615162672
Energy: 0.7748009761116297
Energy: 0.6965983169867564
Energy: 0.7751813414363383
Energy: 0.7232672557417038
Energy: 0.7751813414376834
Energy: 0.6978810822578496
Energy: 0.7768031276784003
Energy: 0.7049157774914492
Energy: 0.7768031276784003
Energy: 0.7219623025105784
Energy: 0.7095734072036551
Energy: 0.7139747270306224
Energy: 0.7095734072036551
Energy: 0.7055201808252789
Energy: 0.7041496771310088
Energy: 0.7139611124631019
Energy: 0.7041496771310088
Energy: 0.7029995025066751
Energy: 0.7020833426336339
Energy: 0.7052078204688875
Energy: 0.7020833426322888
Energy: 0.7059589126335716
Energy: 0.7065404078861816
Energy: 0.6959944637808243
Energy: 0.7065404078861816
Energy: 0.7050389548218944
Energy: 0.706723993078633
Energy: 0.7016482378128558
Energy: 0.7067239930705618
Energy: 0.7245490091729492
Energy: 0.7764046031465701
Energy: 0.7235116908167104
Energy: 0.7764046031465701
Energy: 0.7050305583203738
Energy: 0.7771750961909731
Energy: 0.6948066973939211
Energy: 0.7771750961923183
Energy: 0.7149479185200933
Energy: 0.7061914817372688
Energy: 0.722685326521361
Energy: 0.7061914817372688
Energy: 0.7146369569874014
Energy: 0.703795291576376
Energy: 0.7054919072885835
Energy: 0.7037952915777211
Energy: 0.7049014907170916
Energy: 0.701756072677229
Energy: 0.7012234808140019
Energy: 0.701756072677229
Energy: 0.696468093796662
Energy: 0.7037774923821245
Energy: 0.7045228012115614
Energy: 0.7037774923821245

minimum gb energy = 0.6948066973939211 eV
minimum distance =  2.625456244414 Angstroms
sigma value = 13


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

Energy: 1.0682663081735837
Energy: 0.6878284511826528
Energy: 0.8339948081203816
Energy: 0.6828331538738414
Energy: 0.69411223683352
Energy: 0.6805528437261062
Energy: 0.7805680802218115
Energy: 0.6805528437221596
Energy: 0.694861036559566
Energy: 0.6786054408194686
Energy: 0.7776711634906225
Energy: 0.6786054408160859
Energy: 0.8603172808937218
Energy: 0.7691692432060542
Energy: 0.7888625790059187
Energy: 0.7691692432009799
Energy: 0.7872632837004419
Energy: 0.7601968258532347
Energy: 0.7893908453420131
Energy: 0.7601968258498519
Energy: 0.779244845389648
Energy: 0.6797877219515209
Energy: 0.7874274405044032
Energy: 0.6797877219594144
Energy: 0.7756439862999545
Energy: 0.6795946493577949
Energy: 0.781620124907083
Energy: 0.6795946493600501
Energy: 0.6952831741707061
Energy: 0.680761970259425
Energy: 0.7692430623689319
Energy: 0.6807619702588612
Energy: 0.686823359136651
Energy: 0.6811685943556491
Energy: 0.7789911736917656
Energy: 0.6811685943618512
Energy: 0.6839421773568619
Energy: 0.6798625140240966
Energy: 0.7792953921581801
Energy: 0.6798625140257881
Energy: 0.6791278488955478
Energy: 0.6854778353158337
Energy: 1.0688334207781325
Energy: 0.6854778353186529
Energy: 0.7898781233468553
Energy: 0.6789744060341908
Energy: 0.7783552868144732
Energy: 0.6789744060437758
Energy: 0.7917977979911217
Energy: 0.7196870963321913
Energy: 0.7883081172447783
Energy: 0.7196870963310636
Energy: 0.788279804725669
Energy: 0.7221221625896462
Energy: 0.8617981022746372
Energy: 0.7221221625947205
Energy: 0.7643191873329078
Energy: 0.6812830823733732
Energy: 0.7871437420320656
Energy: 0.6812830823739371
Energy: 0.7735340740904542
Energy: 0.6786769232238721
Energy: 0.6834142592074917
Energy: 0.6786769232312018
Energy: 0.7875680340962133
Energy: 0.6801953668614332
Energy: 0.6796425742723161
Energy: 0.6801953668665075
Energy: 1.0605018081525959
Energy: 0.6814629947691063
Energy: 0.6869927477865654
Energy: 0.6814629947803826
Energy: 0.865563914295662
Energy: 0.6816413819894115
Energy: 0.7921457832462123
Energy: 0.6816413819871562
Energy: 0.7791917436374475
Energy: 0.6785203378444936
Energy: 0.7737256957487302
Energy: 0.6785203378439297
Energy: 0.8595308733192902
Energy: 0.6825884739006015
Energy: 0.7830213854065899
Energy: 0.6825884738994739
Energy: 0.7790552111024508
Energy: 0.731272454625959
Energy: 0.7884863993636766
Energy: 0.7312724546231401
Energy: 0.7848564968053221
Energy: 0.6818141455182228
Energy: 0.7903732687097392
Energy: 0.6818141455131485
Energy: 0.6848305152497138
Energy: 0.6784373400693249
Energy: 0.7890192904080614
Energy: 0.6784373400710163
Energy: 0.7796857597085438
Energy: 0.6821482654761055
Energy: 0.7817153204223585
Energy: 0.6821482654755417
Energy: 0.6948814014294261
Energy: 0.6837293021029727
Energy: 0.7742414748985229
Energy: 0.6837293021069195
Energy: 0.6792732370142364
Energy: 0.6792073534780055
Energy: 0.7900532147074512
Energy: 0.6792073534678569
Energy: 0.6956984954566842
Energy: 0.6826933082645079
Energy: 0.6821802882862573
Energy: 0.6826933082583059
Energy: 0.7870754660078128
Energy: 0.6798154703551333
Energy: 0.8487074131865189
Energy: 0.6798154703523143
Energy: 0.7724526706077491
Energy: 0.7228401817598641
Energy: 0.7876811572113894
Energy: 0.7228401817643745
Energy: 0.7873915297051418
Energy: 0.7267062410984748
Energy: 0.8605238007530512
Energy: 0.7267062410945281
Energy: 0.7750684294412402
Energy: 0.6824525167123627
Energy: 0.7870091469363687
Energy: 0.6824525167106714
Energy: 0.7643287588498416
Energy: 0.6816426432556536
Energy: 0.689867322148819
Energy: 0.6816426432556536
Energy: 0.7930779478160443
Energy: 0.6790861897335971
Energy: 0.6798190052353046
Energy: 0.6790861897262677
Energy: 0.8631578552198914
Energy: 0.6796431235874445
Energy: 0.6824657727502691
Energy: 0.6796431235846253

minimum gb energy = 0.6784373400693249 eV
minimum distance =  2.61639618250874 Angstroms
sigma value = 37


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

Energy: 1.0305437176753407
Energy: 0.6378367213476361
Energy: 0.646906703236576
Energy: 0.6469088867762859
Energy: 0.7432762998239119
Energy: 0.6473737889766781
Energy: 0.803462007858304
Energy: 0.6473737889786183
Energy: 0.8637145438817158
Energy: 0.7230596583598017
Energy: 0.8025790404146006
Energy: 0.7230596583607717
Energy: 0.7073253340402995
Energy: 0.7125430880014197
Energy: 0.6592356377365565
Energy: 0.7125430880023897
Energy: 0.7948070772153706
Energy: 0.7238221383781689
Energy: 0.8558304643655033
Energy: 0.7238221383762288
Energy: 0.7988325548570608
Energy: 0.6297964067246391
Energy: 0.7075138865443197
Energy: 0.629796406722699
Energy: 0.7048732625937143
Energy: 0.6332217018485923
Energy: 0.9297960654278844
Energy: 0.6332217018485923
Energy: 0.7189698552777148
Energy: 0.6237572455540694
Energy: 0.7144647693170383
Energy: 0.6237572455550395
Energy: 0.7084303206134711
Energy: 0.6279103683305806
Energy: 0.7147272520716821
Energy: 0.6279103683305806
Energy: 0.7029340830277055
Energy: 0.6234566927909498
Energy: 0.6226182714294883
Energy: 0.6234566927899797
Energy: 0.7509520664101096
Energy: 0.7503752723018483
Energy: 0.9308803353455517
Energy: 0.7503752723018483
Energy: 0.8560602699073713
Energy: 0.6231850147624485
Energy: 0.6228362793147321
Energy: 0.6231850147614783
Energy: 0.8564211144547137
Energy: 0.6984226356366507
Energy: 0.8643733456610307
Energy: 0.6984226356356809
Energy: 0.7183638042371078
Energy: 0.624245308032837
Energy: 0.8653089852325918
Energy: 0.624245308034777
Energy: 0.8558304643664733
Energy: 0.7112708390011703
Energy: 0.7845667744480828
Energy: 0.7112708390011703
Energy: 0.7075138865278513
Energy: 0.6985511122357325
Energy: 0.80171376656324
Energy: 0.6985511122367025
Energy: 0.9276448278182657
Energy: 0.6461131487942819
Energy: 0.7050444740111959
Energy: 0.6461131487942819
Energy: 0.7144647693141283
Energy: 0.7128894148451925
Energy: 0.6572787813704009
Energy: 0.7128894148461625
Energy: 0.7147272520416335
Energy: 0.6487178170102526
Energy: 0.6468681896550421
Energy: 0.6487178170102526
Energy: 0.7940317166122937
Energy: 0.6476921108529091
Energy: 0.6473336123716485
Energy: 0.6476921108538792

minimum gb energy = 0.6226182714294883 eV
minimum distance =  2.61044178667872 Angstroms
sigma value = 25


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

Energy: 1.1520054362151655
Energy: 0.5817919174001397
Energy: 0.5825144547536414
Energy: 0.5815141202690136
Energy: 0.8672693459734069
Energy: 0.578124275312428
Energy: 0.7020534080424965
Energy: 0.5781242753154578
Energy: 0.759690690196428
Energy: 0.5771896491158061
Energy: 0.6963709750886081
Energy: 0.5771896491180786
Energy: 0.8613088866094515
Energy: 0.6338073501419567
Energy: 0.6999678877705954
Energy: 0.6338073501404416
Energy: 0.8163276119072164
Energy: 0.6899482476022012
Energy: 0.8355165185267908
Energy: 0.6899482476022012
Energy: 0.8629203784083921
Energy: 0.638563911509387
Energy: 0.835332324815906
Energy: 0.6385639115078722
Energy: 0.86007529116688
Energy: 0.6393525062729352
Energy: 0.8078683474879559
Energy: 0.6393525062721777
Energy: 0.690460812035425
Energy: 0.6864719046275529
Energy: 0.8801708102390647
Energy: 0.6864719045927096
Energy: 0.6985292576987304
Energy: 0.5719432937646101
Energy: 0.8179257419241623
Energy: 0.5719432937661251
Energy: 0.7010350690043732
Energy: 0.5727190447195066
Energy: 0.8061679226982948
Energy: 0.5727190447195066
Energy: 0.6250645085612588
Energy: 0.5685216505598083
Energy: 1.000153451211531
Energy: 0.5685216505598083
Energy: 0.6321119587507881
Energy: 0.5736594672010341
Energy: 0.8058962250393166
Energy: 0.5736594672033065
Energy: 0.6298944968222615
Energy: 0.5678277303427759
Energy: 0.807533808974793
Energy: 0.5678277303442564
Energy: 0.6471624299828095
Energy: 0.746032889014383
Energy: 0.8030814172866434
Energy: 0.7460328890158979
Energy: 0.7420848455687872
Energy: 0.5658146801507633
Energy: 0.8103204030518134
Energy: 0.5658146801462186
Energy: 0.7453229289188925
Energy: 0.5665319216114816
Energy: 0.75994637796148
Energy: 0.5665319216114816
Energy: 0.8149731626466877
Energy: 0.5672728395481008
Energy: 0.8592564189619483
Energy: 0.5672728395503731
Energy: 0.7373849901629322
Energy: 0.6369850662161264
Energy: 0.8116324379243832
Energy: 0.636985066212339
Energy: 0.8174154353692425
Energy: 0.633991848399281
Energy: 0.8600777319282382
Energy: 0.633991848399281
Energy: 0.81327737855914
Energy: 0.6373493245684066
Energy: 0.860862592944386
Energy: 0.6373493245699215
Energy: 1.0021677171299255
Energy: 0.5797327929305952
Energy: 0.6957527470542243
Energy: 0.5797327929366549
Energy: 0.8141371031537327
Energy: 0.5765697458662031
Energy: 0.6256070856330704
Energy: 0.5765697458662031
Energy: 0.8751746489822714
Energy: 0.5792937113622578
Energy: 0.6944966302872032
Energy: 0.5792937113599854
Energy: 0.8744120618523641
Energy: 0.5861346782195836
Energy: 0.5809938286064784
Energy: 0.5861346782165539
Energy: 0.8145231427443592
Energy: 0.5779625913065868
Energy: 0.5784997926992321
Energy: 0.5779625913050719
Energy: 0.7633573033863652
Energy: 0.5848630158231023
Energy: 0.5775653988040329
Energy: 0.5848630158261321

minimum gb energy = 0.5658146801462186 eV
minimum distance =  2.62272521342901 Angstroms
sigma value = 41


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

Energy: 1.157277463480269
Energy: 0.5317914902761736
Energy: 0.7202923157030763
Energy: 0.524411366017917
Energy: 0.8982030365395292
Energy: 0.5217607784865782
Energy: 0.6219502038271149
Energy: 0.5217607784871993
Energy: 0.9019582634963011
Energy: 0.5211680762389468
Energy: 0.6163145158474918
Energy: 0.5211680762401887
Energy: 0.9040129129757688
Energy: 0.5235625120514791
Energy: 0.73143534776481
Energy: 0.5235625120576891
Energy: 0.8991625262090353
Energy: 0.5200408634323173
Energy: 0.8026408382550209
Energy: 0.5200408634316962
Energy: 0.8976194623412328
Energy: 0.521754563884103
Energy: 0.8074374544700708
Energy: 0.5217545638828611
Energy: 0.8994192591766803
Energy: 0.57489079054327
Energy: 0.9101000052917054
Energy: 0.5748907905426489
Energy: 0.8141272092199432
Energy: 0.5721405472683916
Energy: 0.806519416085159
Energy: 0.5721405472683916
Energy: 0.7076348254400613
Energy: 0.5713441091144338
Energy: 0.8988611420270174
Energy: 0.571344109102635
Energy: 0.7083800145204425
Energy: 0.5205936784775541
Energy: 0.8977388575266307
Energy: 0.520593678476933
Energy: 0.6251743089751886
Energy: 0.5259190676428022
Energy: 1.0370793079243095
Energy: 0.5259190676428022
Energy: 0.6121304759786985
Energy: 0.5209030941144442
Energy: 0.9651745239846696
Energy: 0.5209030941132023
Energy: 0.6255733267950847
Energy: 0.5233759518097406
Energy: 0.9040065870816071
Energy: 0.5233759518091196
Energy: 0.5315940674148874
Energy: 0.5260660933990713
Energy: 0.9027543901049959
Energy: 0.5260660933990713
Energy: 0.521042693553287
Energy: 0.5205733776176008
Energy: 0.89568202512385
Energy: 0.5205733776182218
Energy: 0.5291704510124793
Energy: 0.5230937720676281
Energy: 0.895436638227974
Energy: 0.5230937720676281
Energy: 0.6131505588110365
Energy: 0.5260232023891921
Energy: 0.894617231768808
Energy: 0.5260232023898129
Energy: 0.6115905832688978
Energy: 0.6113197165740653
Energy: 0.8985276246607067
Energy: 0.6113197165734441
Energy: 0.6213662553418839
Energy: 0.5243187919951231
Energy: 0.8969460494784337
Energy: 0.5243187919951231
Energy: 0.8087688304453
Energy: 0.5226142623409847
Energy: 0.896427144615355
Energy: 0.5226142623385008
Energy: 0.8094048592801798
Energy: 0.579446848226701
Energy: 0.8996520001312399
Energy: 0.579446848225459
Energy: 0.8092937579552675
Energy: 0.5217674950455726
Energy: 0.903571815412984
Energy: 0.5217674950449517
Energy: 0.9109047436558795
Energy: 0.5712608436113706
Energy: 0.8967921496877419
Energy: 0.5712608436107496
Energy: 0.8029079471876619
Energy: 0.5220391272810455
Energy: 0.8058206430244835
Energy: 0.5220391272766985
Energy: 0.9007271650586693
Energy: 0.5740419871157811
Energy: 0.700107952087389
Energy: 0.5740419871176442
Energy: 0.9087687879607299
Energy: 0.5221949272139117
Energy: 0.8069426745941457
Energy: 0.5221949272151536
Energy: 0.9087700926420575
Energy: 0.5253607427468058
Energy: 0.6204102376451894
Energy: 0.5253607427474267
Energy: 0.9007946355060427
Energy: 0.6113803572029086
Energy: 0.6104799342143259
Energy: 0.6113803572029086
Energy: 0.9053586520037589
Energy: 0.5277083601563122
Energy: 0.6252446850167135
Energy: 0.5277083601563122
Energy: 0.907191705615525
Energy: 0.5258643034367207
Energy: 0.5212435844626115
Energy: 0.5258643034373418
Energy: 0.8934705832950437
Energy: 0.5224267796364281
Energy: 0.5208202036351263
Energy: 0.5224267796364281
Energy: 0.9087446290889244
Energy: 0.522816483167606
Energy: 0.5292349987450364
Energy: 0.5228164831688479

minimum gb energy = 0.5200408634316962 eV
minimum distance =  2.62478875270366 Angstroms
sigma value = 15


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

Energy: 1.0556558403832896
Energy: 0.49868321423001216
Energy: 0.6969098353117584
Energy: 0.498230261904229
Energy: 0.94919711273595
Energy: 0.4881620783867474
Energy: 0.5687866318874887
Energy: 0.48816207838148673
Energy: 1.0071565854512616
Energy: 0.4889104399389923
Energy: 0.5668322324927112
Energy: 0.4889104399405705
Energy: 0.9826633414685639
Energy: 0.5307727066934593
Energy: 0.7418405633151465
Energy: 0.5307727066897769
Energy: 0.9429008018567802
Energy: 0.5227585660306063
Energy: 0.7269916581763602
Energy: 0.5227585660237675
Energy: 0.977355405937085
Energy: 0.48636792837235054
Energy: 0.7325272683614584
Energy: 0.48636792837445486
Energy: 0.8459415805346198
Energy: 0.49390928721168453
Energy: 0.8816235157571466
Energy: 0.4939092872122106
Energy: 0.8919457183368679
Energy: 0.5330939038661539
Energy: 0.7653845931159915
Energy: 0.5330939038703625
Energy: 0.845131383538698
Energy: 0.5299771914376559
Energy: 0.8798565807056726
Energy: 0.529977191438708
Energy: 0.8442068511539772
Energy: 0.48875505422834314
Energy: 0.9514314523221103
Energy: 0.4887550547273445
Energy: 0.7379842118069857
Energy: 0.4882979312432138
Energy: 0.9560251427045694
Energy: 0.4882979312416355
Energy: 0.6807568436154021
Energy: 0.4882863858109591
Energy: 0.9963159807470177
Energy: 0.4882863858156937
Energy: 0.731910548723713
Energy: 0.4870473455357647
Energy: 0.9516007127921836
Energy: 0.487047345530504
Energy: 0.5743148484509223
Energy: 0.48627395620076114
Energy: 0.9209179348751511
Energy: 0.48627395620391756
Energy: 0.5667815803083903
Energy: 0.48615227834143054
Energy: 0.9414698376792302
Energy: 0.48615227834143054
Energy: 0.5687928465468404
Energy: 0.4861853715103728
Energy: 0.8486997918077837
Energy: 0.48618537151247704
Energy: 0.5339315191931702
Energy: 0.48659462726702507
Energy: 0.8863147575012462
Energy: 0.48659462727333785
Energy: 0.5211249272983794
Energy: 0.5215708886387942
Energy: 0.9417955584040502
Energy: 0.5215708886445809
Energy: 0.5330851691473776
Energy: 0.48674348965598113
Energy: 0.9470542287450646
Energy: 0.4867434896528247
Energy: 0.6090256916611415
Energy: 0.48741269657442876
Energy: 0.8320078769888919
Energy: 0.4874126965681159
Energy: 0.5963182409739927
Energy: 0.48498437363365077
Energy: 0.9418604290937502
Energy: 0.4849843736325986
Energy: 0.6176037984074149
Energy: 0.4877805303665445
Energy: 0.9824339618440541
Energy: 0.4877805303702271
Energy: 0.7365419473900281
Energy: 0.48716601441603824
Energy: 0.9719317187462422
Energy: 0.4871660144197208
Energy: 0.7299479136737143
Energy: 0.4856631308054683
Energy: 0.9423278964994068
Energy: 0.4856631308044161
Energy: 0.7395267014309316
Energy: 0.4868046969882909
Energy: 0.8573380964492284
Energy: 0.48680469698039985
Energy: 0.8802092400111171
Energy: 0.5316291381889677
Energy: 0.9415231184519506
Energy: 0.5316291381905459
Energy: 0.7666445671554049
Energy: 0.5303736706978075
Energy: 0.8761844678187335
Energy: 0.5303736706951773
Energy: 0.880961813209928
Energy: 0.5321140723646188
Energy: 0.8502242159006783
Energy: 0.5321140723672492
Energy: 0.915270081728545
Energy: 0.5352778794005454
Energy: 0.8577397943075469
Energy: 0.53527787940528
Energy: 0.9124426062641492
Energy: 0.48647361614312684
Energy: 0.7326634813565104
Energy: 0.48647361614107043
Energy: 0.9478654207551961
Energy: 0.5628952096636922
Energy: 0.6808753287610614
Energy: 0.562895209662114
Energy: 0.9186309676763209
Energy: 0.4926516419191852
Energy: 0.7403048811029321
Energy: 0.4926516419165549
Energy: 0.9581806968782137
Energy: 0.4884375123904742
Energy: 0.5689049605568068
Energy: 0.4884375123894221
Energy: 0.9449365656296693
Energy: 0.5249312278673309
Energy: 0.5669021264623789
Energy: 0.5249312278625963
Energy: 0.9168570833928479
Energy: 0.5716614823064108
Energy: 0.5046637562266704
Energy: 0.5716614823242973
Energy: 0.9470683020122029
Energy: 0.4893744897201884
Energy: 0.4929639325479943
Energy: 0.48937448971387554
Energy: 0.9512662380791664
Energy: 0.48891880875656335
Energy: 0.4928166217085244
Energy: 0.4889188087628762

minimum gb energy = 0.4849843736325986 eV
minimum distance =  2.62088088057516 Angstroms
sigma value = 85


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

Energy: 1.1022409978554324
Energy: 0.4610373970830103
Energy: 0.4438153402592068
Energy: 0.44420818144044405
Energy: 0.960839737004141
Energy: 0.44226759753730777
Energy: 0.5059252214124901
Energy: 0.4422675975381995
Energy: 0.9641552696586114
Energy: 0.44209007101961234
Energy: 0.5056732290172576
Energy: 0.44209007101961234
Energy: 0.8761695869051808
Energy: 0.47716113596388005
Energy: 0.6585479327778486
Energy: 0.47716113596479254
Energy: 0.9602938646712229
Energy: 0.47264064696434027
Energy: 0.6510044095077381
Energy: 0.4726406469278601
Energy: 0.8794297726605159
Energy: 0.4410898889805328
Energy: 0.6582478931500931
Energy: 0.4410898889819016
Energy: 0.8778851534877294
Energy: 0.4414869539494527
Energy: 0.7863446313208937
Energy: 0.4414869539471714
Energy: 0.9077046488123021
Energy: 0.4407207411235495
Energy: 0.6811544652890091
Energy: 0.4407207408284727
Energy: 0.874614100774509
Energy: 0.44153333148178453
Energy: 0.7933324935099458
Energy: 0.4415333314804158
Energy: 0.8747449922945245
Energy: 0.5164109662085687
Energy: 0.9107021365142693
Energy: 0.5164109662081127
Energy: 0.7902109624983392
Energy: 0.440147699578348
Energy: 0.8422821939714616
Energy: 0.4401476995792605
Energy: 0.7592040373769121
Energy: 0.4400297542680938
Energy: 0.9027374792400303
Energy: 0.4400297542680938
Energy: 0.7901810807761029
Energy: 0.44030005120089477
Energy: 0.937560703979423
Energy: 0.4403000512013511
Energy: 0.6562712554029968
Energy: 0.4415788119771519
Energy: 0.8177908269380261
Energy: 0.44157881197669563
Energy: 0.6057955583788406
Energy: 0.4404087310318839
Energy: 0.9586403962483783
Energy: 0.44040873102960265
Energy: 0.6494366203356102
Energy: 0.4417284114047823
Energy: 0.9337381769497551
Energy: 0.4417284114047823
Energy: 0.5141391426969489
Energy: 0.4418504975447103
Energy: 0.93379476303471
Energy: 0.44185049754379774
Energy: 0.5099162147765585
Energy: 0.4411936021156457
Energy: 0.9572036902637459
Energy: 0.44119360211610187
Energy: 0.5143515562732548
Energy: 0.43934452358165976
Energy: 0.9648345820851992
Energy: 0.43934452358302856
Energy: 0.473343424808073
Energy: 0.4413391298457671
Energy: 0.9632760965813841
Energy: 0.4413391298453109
Energy: 0.4714264475756916
Energy: 0.47209331228606066
Energy: 0.9567480918422335
Energy: 0.47209331228562523
Energy: 0.478284900796108
Energy: 0.43907335028504146
Energy: 0.96128660074642
Energy: 0.43907335028549777
Energy: 0.5366116272185718
Energy: 0.44112120779606717
Energy: 0.9538287340858363
Energy: 0.4411212077942421
Energy: 0.5398664405713031
Energy: 0.4400766976482482
Energy: 0.9590811951459923
Energy: 0.4400766976477919
Energy: 0.5475530975999817
Energy: 0.44192249936081557
Energy: 0.876192778927146
Energy: 0.4419224993585342
Energy: 0.6597183861645634
Energy: 0.44018660867512943
Energy: 0.9636742285786971
Energy: 0.4401866086774107
Energy: 0.6569314917252067
Energy: 0.4397048518942691
Energy: 0.9613423609903703
Energy: 0.4397048518924441
Energy: 0.7403213541618885
Energy: 0.47579201688791145
Energy: 0.8785579034099483
Energy: 0.47579201688836775
Energy: 0.7900048523426533
Energy: 0.43977965609731406
Energy: 0.9541931038823791
Energy: 0.43977965609594527
Energy: 0.7891489087367974
Energy: 0.43978696389747246
Energy: 0.8802168982624423
Energy: 0.4397869638979287
Energy: 0.8547373718889167
Energy: 0.5167179136112272
Energy: 0.7555688838763696
Energy: 0.5167179136043833
Energy: 0.8193320388363237
Energy: 0.5586087461863434
Energy: 0.8812882937436158
Energy: 0.5586087461867995
Energy: 0.9045641485407575
Energy: 0.5617908830480638
Energy: 0.7571610976065816
Energy: 0.5617908830462387
Energy: 0.9610574240426364
Energy: 0.4414073840028921
Energy: 0.7573094109242594
Energy: 0.44140738399878565
Energy: 0.8399498949464929
Energy: 0.44320745053167615
Energy: 0.657338274112788
Energy: 0.44320745053258875
Energy: 1.0131881976852157
Energy: 0.44061567784232486
Energy: 0.6516806756253111
Energy: 0.4406156778400436
Energy: 0.9642132184291963
Energy: 0.4412754678306017
Energy: 0.6575698812287993
Energy: 0.4412754678296891
Energy: 0.9347470309962969
Energy: 0.44253789510678015
Energy: 0.5132592794854521
Energy: 0.4425378951049551
Energy: 0.9607288131935292
Energy: 0.4407628472095467
Energy: 0.5075782271001272
Energy: 0.4407628472109156
Energy: 0.9640454850520292
Energy: 0.4416058464567771
Energy: 0.507564864071617
Energy: 0.4416058464595146
Energy: 0.9324651642872848
Energy: 0.44222084514959453
Energy: 0.44525778885426137
Energy: 0.44222084514822574
Energy: 0.960437225130752
Energy: 0.4412159733938564
Energy: 0.44140666691723385
Energy: 0.4412159733943127
Energy: 0.935557559438437
Energy: 0.44197232306610834
Energy: 0.4413929589581252
Energy: 0.44197232306337075

minimum gb energy = 0.43907335028504146 eV
minimum distance =  2.62340140657279 Angstroms
sigma value = 113


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

Energy: 0.013148029879054056
Energy: 0.013822817542886617
Energy: 0.7660354919678439
Energy: 0.34529289346080977
Energy: 0.015213257416636745
Energy: 0.10145021248942429
Energy: 0.5196538545397223
Energy: 0.10145021248975554
Energy: 0.013847911066388276
Energy: 0.10040113545717966
Energy: 0.5183850411963407
Energy: 0.10040113545717966
Energy: 0.014856815150317395
Energy: 0.09998887008288146
Energy: 0.518544022453417
Energy: 0.09998887008321272
Energy: 0.5210676342490458
Energy: 0.10262935439662978
Energy: 0.5203731314462294
Energy: 0.10262935439594778
Energy: 0.013561413426847684
Energy: 0.10027018671040969
Energy: 0.5176871337082207
Energy: 0.10027018670972766

minimum gb energy = 0.013148029879054056 eV
minimum distance =  2.84072110692493 Angstroms
sigma value = 1