Model name: model_name=EAM_Dynamo_ZhouWadleyJohnson_2001NISTretabulation_CuTa__MO_950828638160_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.6149601638317113
cohesive_energy=3.540273359423524
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013696024349082177
Energy: 0.014266646115412751
Energy: 0.33466966044940727
Energy: 0.014266646115412751
Energy: 0.014266646115412751
Energy: 0.5721562413652858
Energy: 0.014266646115412751
Energy: 0.5721562413652858
Energy: 0.33466966044878005
Energy: 0.014266646115412751
Energy: 0.013696024349709405
Energy: 0.014266646115412751
Energy: 0.014266646115412751
Energy: 0.5721562413652858
Energy: 0.014266646115412751
Energy: 0.5721562413652858

minimum gb energy = 0.013696024349082177 eV
minimum distance =  2.48319483279663 Angstroms
sigma value = 1


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

Energy: 0.8153461578511486
Energy: 0.7927837135312268
Energy: 0.8430558350696836
Energy: 0.7927837135312268
Energy: 0.7703450262070055
Energy: 0.8013026182253798
Energy: 0.7706447401656393
Energy: 0.8013026182246191
Energy: 0.7396228035408954
Energy: 0.7853676721695556
Energy: 0.7696281955834668
Energy: 0.7853676721680343
Energy: 0.768729024621189
Energy: 0.8026220519539787
Energy: 0.7545020430589662
Energy: 0.8026220519539787
Energy: 0.7710149552537336
Energy: 0.7935938678696183
Energy: 0.7704986529412952
Energy: 0.793593867870379
Energy: 0.738786280895425
Energy: 0.7914458591737618
Energy: 0.7365303931610588
Energy: 0.7914458591722403
Energy: 0.7716277955238239
Energy: 0.7864324628994397
Energy: 0.739548328567522
Energy: 0.7864324628986791
Energy: 0.7038068265784543
Energy: 0.7930628738629328
Energy: 0.7400685825506564
Energy: 0.7930628738621721
Energy: 0.7555682860024948
Energy: 0.8024419362910308
Energy: 0.7681321585248783
Energy: 0.8024419362910308
Energy: 0.7329883445702398
Energy: 0.7849716796123076
Energy: 0.7050340387159699
Energy: 0.7849716796123076
Energy: 0.7683042801642124
Energy: 0.8051252162473225
Energy: 0.7557745280914505
Energy: 0.8051252162458012
Energy: 0.7853912801155052
Energy: 0.7929392758469171
Energy: 0.7349342771928614
Energy: 0.7929392758476778
Energy: 0.7695296075378185
Energy: 0.7853543529677901
Energy: 0.7718526480962048
Energy: 0.7853543529655082
Energy: 0.7739641356652412
Energy: 0.7925655542383679
Energy: 0.7516073239953559
Energy: 0.7925655542398894
Energy: 0.7786949062614619
Energy: 0.7937102298956533
Energy: 0.768807918166323
Energy: 0.7937102298948926
Energy: 0.7683965376721241
Energy: 0.7940564944444672
Energy: 0.7691243182860252
Energy: 0.794056494445228
Energy: 0.7697219030847621
Energy: 0.7854407259505232
Energy: 0.7237389875696153
Energy: 0.7854407259512839
Energy: 0.7707499596512308
Energy: 0.7854887605091381
Energy: 0.7696071528363393
Energy: 0.7854887605091381
Energy: 0.7148977399163736
Energy: 0.7926826613241095
Energy: 0.7345083208589974
Energy: 0.7926826613248703
Energy: 0.7710009484858183
Energy: 0.7736096747650376
Energy: 0.7583623965172301
Energy: 0.7736096747673198
Energy: 0.7340072997763524
Energy: 0.7849013020541246
Energy: 0.7044117095304612
Energy: 0.7849013020533638
Energy: 0.754700694974526
Energy: 0.8134323929718822
Energy: 0.7685077540325056
Energy: 0.8134323929703607
Energy: 0.770646793228921
Energy: 0.7935543750599217
Energy: 0.7372029348423625
Energy: 0.7935543750614431
Energy: 0.7368488897715566
Energy: 0.7861157559870562
Energy: 0.738424833088363
Energy: 0.7861157559848088
Energy: 0.7396035092487033
Energy: 0.7913546515790539
Energy: 0.7714706031469791
Energy: 0.7913546515805755
Energy: 0.7733277262923536
Energy: 0.7933166000826578
Energy: 0.7355955320349625
Energy: 0.7933166000826578
Energy: 0.7683587757058601
Energy: 0.7913704331676219
Energy: 0.7555271252750092
Energy: 0.7913704331683827
Energy: 0.7423035504552172
Energy: 0.7847401780212945
Energy: 0.806847061214309
Energy: 0.784740178019773
Energy: 0.7690660597401388
Energy: 0.7977579470048012
Energy: 0.768167074706474
Energy: 0.7977579470048012
Energy: 0.8122836939151511
Energy: 0.792720339851038
Energy: 0.7860365870869596
Energy: 0.792720339851038
Energy: 0.7586880868897411
Energy: 0.7910104678044239
Energy: 0.7693222412685047
Energy: 0.7910104678044239
Energy: 0.75518682348403
Energy: 0.7855084172925705
Energy: 0.7739903040000704
Energy: 0.7855084172918098
Energy: 0.7711616873889573
Energy: 0.8032633548211499
Energy: 0.7552328909673721
Energy: 0.8032633548219104

minimum gb energy = 0.7038068265784543 eV
minimum distance =  2.31628074706877 Angstroms
sigma value = 1


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

Energy: 0.8735367534022407
Energy: 0.849222527358755
Energy: 0.9001031475788552
Energy: 0.849222527366561
Energy: 0.8061563905571372
Energy: 0.8421310186558262
Energy: 0.806008362092277
Energy: 0.84213101866103
Energy: 0.7757051208455227
Energy: 0.8496131579409089
Energy: 0.8061089126177876
Energy: 0.8496131579417762
Energy: 0.7793692496414292
Energy: 0.8179065138931764
Energy: 0.7719686581642853
Energy: 0.8179065138957783
Energy: 0.7799730950632943
Energy: 0.8387991154873191
Energy: 0.7695479357057396
Energy: 0.8387991154864518
Energy: 0.8352036559342633
Energy: 0.8385769632664265
Energy: 0.7931676537953986
Energy: 0.8385769632603552
Energy: 0.7787187183005696
Energy: 0.8188917705574694
Energy: 0.771614731141139
Energy: 0.8188917705618061
Energy: 0.7348573043624695
Energy: 0.8494461255037327
Energy: 0.7782794286710335
Energy: 0.8494461255037327
Energy: 0.7795600117477315
Energy: 0.8141969901392381
Energy: 0.8059299466115638
Energy: 0.8141969901331667
Energy: 0.7724597030244901
Energy: 0.8494296515506892
Energy: 0.7495816344801487
Energy: 0.8494296515472199
Energy: 0.7788252199025698
Energy: 0.8521691316715654
Energy: 0.8058270653868237
Energy: 0.8521691316672287
Energy: 0.7572009062427452
Energy: 0.8433426016747207
Energy: 0.8060335916539527
Energy: 0.8433426016764554
Energy: 0.8126161791648489
Energy: 0.8384359743781138
Energy: 0.7930976946600911
Energy: 0.8384359743772466
Energy: 0.8136530516085689
Energy: 0.8384223621079735
Energy: 0.7562969775092345
Energy: 0.8384223621045043
Energy: 0.7571091239114699
Energy: 0.8433033160965687
Energy: 0.8062111071693858
Energy: 0.8433033160930995
Energy: 0.778829454494073
Energy: 0.8521245154116893
Energy: 0.8058065058432854
Energy: 0.8521245154116893
Energy: 0.7724439733736398
Energy: 0.849295990697758
Energy: 0.7580185595503416
Energy: 0.8492959906986253
Energy: 0.779255074633204
Energy: 0.8142134670139071
Energy: 0.8057769971498651
Energy: 0.8142134670130396
Energy: 0.7348498966014995
Energy: 0.849449214790638
Energy: 0.7689883411578327
Energy: 0.8494492147932399
Energy: 0.7792845512281676
Energy: 0.8191930681926409
Energy: 0.773271299635334
Energy: 0.8191930681943755
Energy: 0.8351234288973447
Energy: 0.8385823375821156
Energy: 0.7553092152838156
Energy: 0.8385823375760445
Energy: 0.7797184311053008
Energy: 0.8387182394588082
Energy: 0.798643536088753
Energy: 0.8387182394553389
Energy: 0.7796478602620054
Energy: 0.8179321551565059
Energy: 0.7718694502018614
Energy: 0.8179321551521692
Energy: 0.7755952961150862
Energy: 0.8497072178660564
Energy: 0.8062263426719569
Energy: 0.849707217870393
Energy: 0.8060344096177886
Energy: 0.8421271851308705
Energy: 0.8057434643121009
Energy: 0.8421271851282685
Energy: 0.8735367534031081
Energy: 0.849222527358755
Energy: 0.8621335551951383
Energy: 0.849222527366561
Energy: 0.8061563905571372
Energy: 0.8421310186558262
Energy: 0.806008362092277
Energy: 0.8421310186601629
Energy: 0.7757051208455227
Energy: 0.8496131579409089
Energy: 0.7978925382303125
Energy: 0.8496131579417762
Energy: 0.7793692496414292
Energy: 0.817906513894911
Energy: 0.7651772033252499
Energy: 0.8179065138957783

minimum gb energy = 0.7348498966014995 eV
minimum distance =  2.28386672806555 Angstroms
sigma value = 25


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

Energy: 0.8702199695562228
Energy: 0.9018333594686495
Energy: 0.9482127041762165
Energy: 0.9018333594686495
Energy: 0.8401070182245032
Energy: 0.8634899615676486
Energy: 0.8396859620265362
Energy: 0.8634899615686569
Energy: 0.8021686261529525
Energy: 0.9147344890895842
Energy: 0.8396458305567089
Energy: 0.9147344890875678
Energy: 0.840804688028722
Energy: 0.8781730843591636
Energy: 0.798445466277775
Energy: 0.8781730843591636
Energy: 0.823998766922223
Energy: 0.8943197634651858
Energy: 0.826425763930741
Energy: 0.8943197634641775
Energy: 0.8868234432516803
Energy: 0.9148711103350342
Energy: 0.8199535737996019
Energy: 0.9148711103360424
Energy: 0.8200800858794789
Energy: 0.8655462358918196
Energy: 0.8071517471579556
Energy: 0.8655462358928278
Energy: 0.9036345523209901
Energy: 0.8941174172434001
Energy: 0.7844875648284392
Energy: 0.8941174172423918
Energy: 0.8092342000374082
Energy: 0.8860042223176051
Energy: 0.8215873719850342
Energy: 0.8860042223186134
Energy: 0.8382671721174031
Energy: 0.9148080906035192
Energy: 0.8410163126130443
Energy: 0.9148080906035192
Energy: 0.841506214549875
Energy: 0.8942943589097198
Energy: 0.8195279573376635
Energy: 0.8942943589087116
Energy: 0.798748571748217
Energy: 0.9015045034395263
Energy: 0.819407094013933
Energy: 0.9015045034385638
Energy: 0.8395803501134673
Energy: 0.9104164344098512
Energy: 0.8085737574351478
Energy: 0.9104164344108594
Energy: 0.8334318582133974
Energy: 0.8199604002199478
Energy: 0.8215358738729306
Energy: 0.8199604002219643
Energy: 0.8166632471340901
Energy: 0.8939194573609066
Energy: 0.784040836465396
Energy: 0.8939194573609066
Energy: 0.8197254185477266
Energy: 0.8671445424642634
Energy: 0.8291139767942992
Energy: 0.8671445424612387
Energy: 0.7828843415585093
Energy: 0.9151035557076873
Energy: 0.7813276608880384
Energy: 0.9151035557097038
Energy: 0.7979240150231152
Energy: 0.8974820788021485
Energy: 0.8278514557281718
Energy: 0.8974820788001321
Energy: 0.8433507836278867
Energy: 0.901952747012546
Energy: 0.8002957690199499
Energy: 0.901952747008513
Energy: 0.8205153473616733
Energy: 0.914614316273665
Energy: 0.837386014208263
Energy: 0.9146143162746732
Energy: 0.8178346243805003
Energy: 0.8608113635534261
Energy: 0.8377241100956707
Energy: 0.8608113635554426
Energy: 0.847694523830665
Energy: 0.9031344629673964
Energy: 0.9142202051951456
Energy: 0.9031344629684047
Energy: 0.8124454732575909
Energy: 0.8968263191019794
Energy: 0.8379094585746029
Energy: 0.8968263190999629
Energy: 0.8010334056269807
Energy: 0.9146482875127644
Energy: 0.8382702010013863
Energy: 0.9146482875127644
Energy: 0.8196982463148709
Energy: 0.8777695574589855
Energy: 0.7974203595058311
Energy: 0.877769557456969

minimum gb energy = 0.7813276608880384 eV
minimum distance =  2.28885126256837 Angstroms
sigma value = 9


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

Energy: 0.8848672022816081
Energy: 0.8856131135317992
Energy: 1.0512276829579323
Energy: 0.8856131135317992
Energy: 0.8391886560073943
Energy: 0.9356033264623027
Energy: 0.8745630250580038
Energy: 0.9356033264635054
Energy: 0.7914962343916553
Energy: 0.867465650838665
Energy: 0.8802623679899888
Energy: 0.8674656508410705
Energy: 0.8693769322327056
Energy: 0.9421621510892818
Energy: 0.8008625066792262
Energy: 0.942162151088079
Energy: 0.950755203914421
Energy: 0.935232664563626
Energy: 0.863073187933217
Energy: 0.9352326645624232
Energy: 0.791561447670665
Energy: 0.8710574470745749
Energy: 0.7953699192368325
Energy: 0.8710574470757777
Energy: 0.8679670284136132
Energy: 0.8008429246456038
Energy: 0.8007823026918675
Energy: 0.8008429246444011
Energy: 0.909980329237051
Energy: 0.8717544251952284
Energy: 0.7951587393745114
Energy: 0.8717544251964311
Energy: 0.867811208714096
Energy: 0.9353764837547874
Energy: 0.8779618641637248
Energy: 0.9353764837535846
Energy: 0.8711743264875902
Energy: 0.868195826125253
Energy: 0.8008504232410226
Energy: 0.8681958261240502
Energy: 0.8284172557635062
Energy: 0.9407037246714903
Energy: 0.880076580657259
Energy: 0.9407037246702874
Energy: 0.8694351559874398
Energy: 0.9052054866804736
Energy: 0.8019721551605227
Energy: 0.9052054866828793
Energy: 0.7914364144901276
Energy: 0.8860987269941448
Energy: 0.8340689150987619
Energy: 0.8860987269965503
Energy: 0.8254035840506305
Energy: 0.8711770920412334
Energy: 0.8747823785499109
Energy: 0.8711770920436387
Energy: 0.7914469046500209
Energy: 0.8858552567864246
Energy: 0.860611594096751
Energy: 0.885855256785222
Energy: 0.8693413043089716
Energy: 0.9052299166180956
Energy: 0.8020540798770095
Energy: 0.9052299166205011
Energy: 0.8284380766616104
Energy: 0.9406737809013912
Energy: 0.8341774717169431
Energy: 0.9406737809013912
Energy: 0.8713276915073137
Energy: 0.8682459033534603
Energy: 0.8008786371222065
Energy: 0.8682459033534603
Energy: 0.8677404299019028
Energy: 0.9354037704496599
Energy: 0.8346513009593303
Energy: 0.9354037704496599
Energy: 0.9101106231662165
Energy: 0.871691751780059
Energy: 0.7951466460046744
Energy: 0.8716917517788562
Energy: 0.8678487308872227
Energy: 0.8009261855302992
Energy: 0.80078644556725
Energy: 0.8009261855351103

minimum gb energy = 0.7914364144901276 eV
minimum distance =  2.38500677481566 Angstroms
sigma value = 25


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

Energy: 0.8220883442383273
Energy: 1.0135196981925099
Energy: 1.138793971242984
Energy: 1.0135196981910224
Energy: 0.8146915385857204
Energy: 0.8165853705760899
Energy: 0.8124261368362903
Energy: 0.8165853705641903
Energy: 0.8124764017814015
Energy: 0.9444533630839009
Energy: 0.8122401358050754
Energy: 0.9444533630853884
Energy: 0.8242672028332013
Energy: 0.8556771755155458
Energy: 0.9638016003362431
Energy: 0.8556771755170334
Energy: 0.9606005330632237
Energy: 0.816969160683301
Energy: 0.8579612951954624
Energy: 0.816969160683301
Energy: 0.8159160826761276
Energy: 1.0241067584217358
Energy: 0.8148558173331626
Energy: 1.0241067584217358
Energy: 0.8134454448869921
Energy: 0.9405558374731884
Energy: 0.8122678292046595
Energy: 0.9405558374731884
Energy: 0.961610954196067
Energy: 1.0146971188658884
Energy: 0.8242997232546774
Energy: 1.0146971188644007
Energy: 0.8122062042022292
Energy: 0.8341838098106391
Energy: 0.8165465336018634
Energy: 0.8341838098121266
Energy: 0.9772907333667015
Energy: 0.9443710855068282
Energy: 0.815537251134622
Energy: 0.9443710855083157
Energy: 0.8792494433004926
Energy: 1.0114022648869463
Energy: 1.0970970845309551
Energy: 1.0114022648869463
Energy: 0.8132923231900255
Energy: 0.8290122171154277
Energy: 0.9761077218252674
Energy: 0.8290122171139404
Energy: 0.9619704707522208
Energy: 0.8573340606844438
Energy: 0.8121807628444435
Energy: 0.8573340606859313
Energy: 0.8123805910419392
Energy: 0.8554233223864498
Energy: 0.8248452710748602
Energy: 0.8554233223864498
Energy: 0.8359205016389958
Energy: 1.0119705644308787
Energy: 0.9602176497704248
Energy: 1.0119705644308787
Energy: 0.8164255490778537
Energy: 0.8560718121494398
Energy: 0.8158857983074667
Energy: 0.8560718121479524
Energy: 0.812342887857112
Energy: 0.8842939000710036
Energy: 0.9755484791973349
Energy: 0.8842939000710036

minimum gb energy = 0.8121807628444435 eV
minimum distance =  2.36486914946927 Angstroms
sigma value = 17


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

Energy: 0.9333057908531791
Energy: 0.9029792170808187
Energy: 1.1758247413400034
Energy: 0.9029792170825036
Energy: 0.9682476233855793
Energy: 0.8971462430011371
Energy: 0.8375460403614261
Energy: 0.8971462430407309
Energy: 0.9627149661483033
Energy: 0.8393896992534665
Energy: 0.837463231584603
Energy: 0.8393896992509393
Energy: 0.8387533527411063
Energy: 0.8413823681115352
Energy: 0.9139796726189975
Energy: 0.8413823681123777
Energy: 0.9742579643479881
Energy: 0.9007221829531544
Energy: 0.8668171085884901
Energy: 0.9007221829531544
Energy: 0.8403556648927268
Energy: 0.8615060482895988
Energy: 0.9708906155909726
Energy: 0.8615060482895988
Energy: 0.841474792134363
Energy: 0.8941862273557462
Energy: 0.837596324566797
Energy: 0.8941862273557462
Energy: 0.9658926731236078
Energy: 0.8412960911838819
Energy: 0.8464107174963628
Energy: 0.8412960911846862
Energy: 0.8429446963881837
Energy: 0.9297402982097158
Energy: 1.0029006276606016
Energy: 0.9297402982080312
Energy: 1.0669729675703767
Energy: 0.868334705396192
Energy: 0.8434844315368464
Energy: 0.8683347053970343
Energy: 0.8408610393906603
Energy: 0.8414739785111462
Energy: 0.9634978420684421
Energy: 0.8414739785111462
Energy: 0.8456325096786225
Energy: 0.8951026006258813
Energy: 0.8449474806067241
Energy: 0.8951026006241964
Energy: 0.9683518553650138
Energy: 0.8416757686382221
Energy: 0.8398093091345559
Energy: 0.8416757686356949
Energy: 0.843263198507041
Energy: 0.9321640306175794
Energy: 0.9657742425419098
Energy: 0.9321640306192641
Energy: 0.9157324524432426
Energy: 0.8934780537415428
Energy: 0.8434329309967327
Energy: 0.8934780537415428
Energy: 0.9656006844147376
Energy: 0.8411688006087702
Energy: 0.9658238874231588
Energy: 0.8411688006104548
Energy: 0.8377458891499039
Energy: 0.9237644638714133
Energy: 0.971666929298191
Energy: 0.9237644638714133
Energy: 0.9538414834264518
Energy: 0.8401021600549611
Energy: 0.8403067378339235
Energy: 0.8401021600574883
Energy: 0.8379398137687969
Energy: 0.9422766261479688
Energy: 0.8968864384244154
Energy: 0.9422766261488112
Energy: 0.8376934128974142
Energy: 0.8403876512740426
Energy: 0.8389063331603906
Energy: 0.8403876512732003
Energy: 0.903914479010946
Energy: 0.9331940687072879
Energy: 0.961703838747361
Energy: 0.9331940687081304
Energy: 0.8377243278378779
Energy: 0.9885814960512737
Energy: 1.0615549652258014
Energy: 0.9885814960512737
Energy: 1.0058611804419924
Energy: 0.9040725697991921
Energy: 0.8375047167623788
Energy: 0.904072569800877
Energy: 0.8394267981145066
Energy: 0.893670857947811
Energy: 0.9670467052513612
Energy: 0.8936708579461261
Energy: 0.8398097897118241
Energy: 0.8418865765570377
Energy: 0.9659955149026684
Energy: 0.8418865765519832
Energy: 1.004218436716255
Energy: 0.8410971994449761
Energy: 0.8383446996867161
Energy: 0.8410971994441336
Energy: 0.8524133348878112
Energy: 0.9723439999302299
Energy: 1.0784467789063794
Energy: 0.9723439999302299
Energy: 0.9707189865179852
Energy: 0.8609683736757926
Energy: 0.9619480129070714
Energy: 0.8609683736732654
Energy: 1.006799610915947
Energy: 0.9163513760166943
Energy: 0.8412592868860403
Energy: 0.9163513760166943
Energy: 0.8463316706345319
Energy: 0.9312930635537106
Energy: 0.9544412964421135
Energy: 0.9312930635537106

minimum gb energy = 0.837463231584603 eV
minimum distance =  2.33745453875967 Angstroms
sigma value = 53


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

Energy: 0.7934737551210073
Energy: 0.793169435038474
Energy: 1.2424473839246146
Energy: 0.7931694350404135
Energy: 0.9674607819789264
Energy: 0.8696542430544182
Energy: 0.8380775833004084
Energy: 0.8696542430544182
Energy: 0.7945878139067873
Energy: 0.7938644985520051
Energy: 0.8986102436822052
Energy: 0.7938644985539446
Energy: 0.7948991553849659
Energy: 0.7938120870105436
Energy: 0.8981978411503194
Energy: 0.7938120870105436
Energy: 0.9673259672635772
Energy: 0.8696167828445167
Energy: 0.8380793655707655
Energy: 0.8696167828445167
Energy: 0.7934737551210073
Energy: 0.793169435038474
Energy: 1.0867006649337256
Energy: 0.793169435038474
Energy: 0.9674607819789264
Energy: 0.8696542430563576
Energy: 0.8983774522315522
Energy: 0.8696542430544182
Energy: 0.7945878139067873
Energy: 0.7938644985520051
Energy: 0.9846154700312473
Energy: 0.793864498555884
Energy: 0.7948991553868613
Energy: 0.7938120870105436
Energy: 0.9705537723579245
Energy: 0.7938120870105436
Energy: 0.9673259672635772
Energy: 0.8696167828445167
Energy: 0.900303760214274
Energy: 0.8696167828445167
Energy: 0.7934737551210073
Energy: 0.793169435038474
Energy: 1.1532538939235217
Energy: 0.7931694350404135
Energy: 0.9674607819789264
Energy: 0.8696542430544182
Energy: 0.9708324194225957
Energy: 0.8696542430544182
Energy: 0.7945878139067873
Energy: 0.7938644985539446
Energy: 0.9846154700312473
Energy: 0.7938644985539446

minimum gb energy = 0.793169435038474 eV
minimum distance =  2.33433581808451 Angstroms
sigma value = 9


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

Energy: 0.885146601062151
Energy: 1.0656099483201655
Energy: 1.2466577199019087
Energy: 1.0656099483201655
Energy: 1.0089310598133554
Energy: 0.9211945310053591
Energy: 0.8795747297050249
Energy: 0.9211945310046413
Energy: 0.8734975891993201
Energy: 0.8814520000699912
Energy: 0.880274333147758
Energy: 0.8814520000678379
Energy: 0.9845437251624855
Energy: 1.0667432955270648
Energy: 0.8791813070833995
Energy: 1.0667432955270648
Energy: 0.9978558029255039
Energy: 0.925893767199885
Energy: 0.8803973168832951
Energy: 0.9258937672020385
Energy: 0.8804660376214382
Energy: 0.8806779877842067
Energy: 0.9987141838334871
Energy: 0.8806779877842067
Energy: 1.156304856183598
Energy: 0.9254209748212001
Energy: 0.8777434388936969
Energy: 0.9254209748204822
Energy: 0.8734239070702211
Energy: 0.9470693863483385
Energy: 0.9938200639004777
Energy: 0.947069386349774
Energy: 0.8750431801384082
Energy: 1.0701520017457524
Energy: 0.8799837657251963
Energy: 1.0701520017450346
Energy: 0.874434960572829
Energy: 0.9222581864015688
Energy: 0.8768109522673901
Energy: 0.9222581864015688
Energy: 0.8738929175254924
Energy: 1.0667652441061062
Energy: 1.1537433996127822
Energy: 1.0667652441061062
Energy: 1.0014143586666229
Energy: 1.0136355631437446
Energy: 0.8769208801133409
Energy: 1.0136355631473337
Energy: 0.8745973945138069
Energy: 0.9534396602010627
Energy: 1.066992916005537
Energy: 0.9534396602010627
Energy: 0.9891756813900341
Energy: 1.0644315373359687
Energy: 0.8849004809994475
Energy: 1.0644315373359687
Energy: 0.875081524431971
Energy: 0.9922367674513126
Energy: 0.9852071702205444
Energy: 0.9922367674498771
Energy: 0.8764154682476977
Energy: 1.0690817239102286
Energy: 0.9922683064760259
Energy: 1.0690817239102286
Energy: 0.9333462019301547
Energy: 0.9915160769100305
Energy: 0.8749170569245905
Energy: 0.9915160769093126
Energy: 0.8753428286384037
Energy: 0.9253363096925868
Energy: 0.9948992507563069
Energy: 0.9253363096933046
Energy: 1.0055484999364812
Energy: 0.9863652017448695
Energy: 0.8804044369792268
Energy: 0.9863652017434339
Energy: 0.8776977539088272
Energy: 0.9260013650977535
Energy: 0.9394149846413089
Energy: 0.9260013650963179
Energy: 0.989418213438486
Energy: 1.0648885353338726
Energy: 0.9873797136342067
Energy: 1.064888535333155
Energy: 0.9395442120036298
Energy: 0.8831741036009754
Energy: 0.8745386983149
Energy: 0.8831741035988221
Energy: 0.8800493418465305
Energy: 0.9879799465537425
Energy: 0.8748750877495286
Energy: 0.9879799465537425
Energy: 1.168239872044505
Energy: 0.9477894578435185
Energy: 0.872749276014753
Energy: 0.9477894578420829
Energy: 0.8780672698763287
Energy: 1.0172804295947309
Energy: 1.0892508840803852
Energy: 1.0172804295954487
Energy: 0.9402160641968927
Energy: 0.8808361809911578
Energy: 0.8733761043629878
Energy: 0.8808361809918756
Energy: 0.9896240892643031
Energy: 0.9914677133882288
Energy: 0.9841273875309826
Energy: 0.9914677133882288
Energy: 0.8841153270147929
Energy: 1.0682199583422458
Energy: 0.9845529310171439
Energy: 1.0682199583400926
Energy: 0.9362491668856476
Energy: 0.880725437264534
Energy: 0.8730411004479209
Energy: 0.8807254372659697
Energy: 0.8794285000380636
Energy: 1.0174067358738497
Energy: 1.0812764955345062
Energy: 1.0174067358745675
Energy: 1.0173693864760214
Energy: 0.9482519003266835
Energy: 0.8723024328609853
Energy: 0.9482519003266835
Energy: 0.879468574837642
Energy: 0.9247124564638184
Energy: 0.8739395039534024
Energy: 0.9247124564638184
Energy: 0.8785280842661243
Energy: 0.8805120026003328
Energy: 0.8740197361760419
Energy: 0.8805120026010506
Energy: 0.9931682469683242
Energy: 1.0667442183089741
Energy: 0.9849859107664587
Energy: 1.0667442183082563
Energy: 0.8796470695667066
Energy: 1.0082355661581628
Energy: 1.1551359557807297
Energy: 1.0082355661574451

minimum gb energy = 0.8723024328609853 eV
minimum distance =  2.3005239702776 Angstroms
sigma value = 73


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

Energy: 0.8860843036210513
Energy: 0.8852188629492054
Energy: 1.2638044331566287
Energy: 0.8852188629492054
Energy: 0.8890215157379666
Energy: 0.9550416370119991
Energy: 0.8806157643666112
Energy: 0.9550416370119991
Energy: 0.8778941320247988
Energy: 0.8777114872808474
Energy: 0.8796039065818163
Energy: 0.8777114872819862
Energy: 0.8802758507311692
Energy: 0.9546760722611657
Energy: 0.8807778724513458
Energy: 0.9546760722623046
Energy: 0.8797138082051561
Energy: 0.9500878398735413
Energy: 0.8834827480995484
Energy: 0.9500878398724023
Energy: 0.8775191932077037
Energy: 0.8773954315830229
Energy: 1.1386175168815218
Energy: 0.8773954315841618
Energy: 1.1299298043317931
Energy: 1.0715626735337347
Energy: 0.8786990634873488
Energy: 1.0715626735348736
Energy: 0.8800450089299464
Energy: 0.884904904979715
Energy: 1.1127088210736322
Energy: 0.8849049049819926
Energy: 1.1187984600322387
Energy: 0.8832543906412178
Energy: 0.8830318934885174
Energy: 0.8832543906412178
Energy: 0.8779830545142886
Energy: 0.9479492087900798
Energy: 0.878163924349629
Energy: 0.9479492087912186
Energy: 0.8825667567276787
Energy: 0.8826440419039581
Energy: 1.1202484010437879
Energy: 0.8826440419039581
Energy: 0.9998623211144472
Energy: 0.9529735622142981
Energy: 0.8809358556347964
Energy: 0.9529735622142981
Energy: 0.8784374136243744
Energy: 0.952046393198738
Energy: 0.996204427556484
Energy: 0.9520463931975992
Energy: 1.1690743024712245
Energy: 0.9528784628078153
Energy: 0.8774194054494004
Energy: 0.9528784628089542
Energy: 0.8834753741311422
Energy: 0.8975217796907513
Energy: 1.000502130326145
Energy: 0.8975217796896124
Energy: 1.116797354846492
Energy: 0.8841741911039599
Energy: 0.8800034112984526
Energy: 0.8841741911050987
Energy: 0.8791252039030908
Energy: 0.879172448241142
Energy: 0.8781282663581885
Energy: 0.879172448241142
Energy: 0.8814068041410645
Energy: 0.8818932203772891
Energy: 0.8775575483624954
Energy: 0.881893220378428
Energy: 0.8985048975566887
Energy: 0.8851998219844661
Energy: 0.8790353080167224
Energy: 0.885199821985605
Energy: 0.8807347233531462
Energy: 0.8974950578258051
Energy: 1.131805493276968
Energy: 0.8974950578258051
Energy: 1.2076374914698114
Energy: 0.878007152620034
Energy: 0.8773407770645728
Energy: 0.878007152620034
Energy: 0.8807365192904417
Energy: 0.9494515908789789
Energy: 0.9975896294374929
Energy: 0.94945159087784

minimum gb energy = 0.8773407770645728 eV
minimum distance =  2.29162011553857 Angstroms
sigma value = 7


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

Energy: 0.9169179365284369
Energy: 0.916484446700546
Energy: 1.1982203623636445
Energy: 0.9164844466973249
Energy: 1.1200934156714817
Energy: 0.9425775746785214
Energy: 0.8883678469518804
Energy: 0.9425775746777162
Energy: 0.8920999798303316
Energy: 0.916766595812568
Energy: 0.9048115349837274
Energy: 0.9167665958117627
Energy: 0.9214109279714656
Energy: 0.9664084058335838
Energy: 0.8885158145571734
Energy: 0.9664084058408314
Energy: 0.8924953953719885
Energy: 0.952114576558678
Energy: 0.9129954522045037
Energy: 0.9521145765627044
Energy: 0.8898215738655495
Energy: 0.9158397875933529
Energy: 1.0937034877242153
Energy: 0.9158397875893263
Energy: 1.0085400557057744
Energy: 0.9866191902427497
Energy: 0.9131513040418762
Energy: 0.9866191902403338
Energy: 0.8896352428369473
Energy: 0.9150005336289787
Energy: 1.1150859857749742
Energy: 0.9150005336289787
Energy: 1.016529441145258
Energy: 0.9636136609412538
Energy: 0.891177888433145
Energy: 0.963613660942059
Energy: 0.8892882528977608
Energy: 0.9684997976608567
Energy: 0.9927910836144708
Energy: 0.9684997976656884
Energy: 0.9223049730257439
Energy: 0.9140141226738361
Energy: 0.9129302696941124
Energy: 0.914014122676252
Energy: 0.9145041209344594
Energy: 0.9524187131332443
Energy: 0.9152700734266516
Energy: 0.9524187131324391
Energy: 0.9140648714229448
Energy: 0.9146181439747425
Energy: 0.9149219312388729
Energy: 0.9146181439771585
Energy: 0.9141884940478942
Energy: 0.9186571690629961
Energy: 0.9153210415757952
Energy: 0.9186571690662173
Energy: 0.8872939794193323
Energy: 1.046824812566287
Energy: 1.012555000019738
Energy: 1.0468248125638708
Energy: 1.2193228994883791
Energy: 0.917297724773946
Energy: 0.8937145682396567
Energy: 0.9172977247747512
Energy: 0.8873164300054849
Energy: 0.9511169877182287
Energy: 0.9378617817711844
Energy: 0.951116987716618
Energy: 0.9012939316235205
Energy: 0.9373163427954064
Energy: 0.9149710849935375
Energy: 0.937316342797017
Energy: 0.8873840779450859
Energy: 0.9139293776757033
Energy: 0.9151194703450654
Energy: 0.9139293776781191
Energy: 0.8888760717926897
Energy: 0.9532303358764264
Energy: 0.9149776341009146
Energy: 0.9532303358683735
Energy: 0.9222520993498025
Energy: 0.9140874664206763
Energy: 0.8910809567806405
Energy: 0.9140874664166498
Energy: 0.8894454921612519
Energy: 0.9155616073340747
Energy: 1.0028241540541365
Energy: 0.9155616073324641
Energy: 1.0942973949134043
Energy: 0.9638829954369112
Energy: 0.9084943013590046
Energy: 0.9638829954320794
Energy: 0.915073208108629
Energy: 0.9148441824322944
Energy: 1.0990131861796673
Energy: 0.9148441824322944
Energy: 0.9118149228316867
Energy: 0.9533651718074311
Energy: 0.902063268197983
Energy: 0.9533651718106522
Energy: 0.9207449585219015
Energy: 0.9149825480537016
Energy: 0.9137065083797846
Energy: 0.9149825480577282
Energy: 0.8922762694527443
Energy: 0.9671545397752718
Energy: 0.9018884007965801
Energy: 0.9671545397752718
Energy: 0.9213191489801489
Energy: 0.9508449277506285
Energy: 0.8883369763920699
Energy: 0.9508449277498232
Energy: 0.8919596956398077
Energy: 0.9176921660199341
Energy: 1.0084988011184555
Energy: 0.9176921660215446
Energy: 1.1489334342794308
Energy: 0.8990257523018965
Energy: 0.888693099490985
Energy: 0.8990257523067284
Energy: 0.8919639684018581
Energy: 0.9176354092505523
Energy: 1.103075212122709
Energy: 0.9176354092465258

minimum gb energy = 0.8872939794193323 eV
minimum distance =  2.2755920737074 Angstroms
sigma value = 29


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

Energy: 0.8800399276257435
Energy: 0.9024627539027334
Energy: 1.2872412025042486
Energy: 0.9024627539030139
Energy: 0.8676146360414755
Energy: 0.8660861491015431
Energy: 0.8826069011328139
Energy: 0.8660861491012625
Energy: 0.9076795870348918
Energy: 0.934340543577164
Energy: 1.0077693671878651
Energy: 0.9343405435768836
Energy: 0.8817236613230239
Energy: 0.8665908816669797
Energy: 0.870056734222017
Energy: 0.8665908816672602
Energy: 0.880841731463423
Energy: 0.9241135425038163
Energy: 0.90131817252512
Energy: 0.9241135425030058
Energy: 0.9022808700400979
Energy: 0.9291770862610759
Energy: 0.9022740681215325
Energy: 0.9291770862599849
Energy: 0.9012918586612533
Energy: 0.9241056519684151
Energy: 0.8808846683961825
Energy: 0.9241056519678541
Energy: 0.8700433824480643
Energy: 0.8664532057696883
Energy: 0.8817988514637719
Energy: 0.8664532057713403
Energy: 1.0077425255437036
Energy: 0.9343181839860158
Energy: 0.9076883619405423
Energy: 0.9343181839857354

minimum gb energy = 0.8660861491012625 eV
minimum distance =  2.32917312015735 Angstroms
sigma value = 5


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

Energy: 0.8522281011150251
Energy: 0.8617690524559436
Energy: 1.2369666214539392
Energy: 0.8617690524589865
Energy: 0.9791556808482085
Energy: 0.9018936833014357
Energy: 0.8209626566983588
Energy: 0.9018936832991536
Energy: 0.8275124523410439
Energy: 0.8709100752346673
Energy: 1.0022150717745797
Energy: 0.8709100752323853
Energy: 0.840103475315814
Energy: 0.8983593227273122
Energy: 0.8393519101259456
Energy: 0.8983593227311157
Energy: 0.8311568113732669
Energy: 0.8989240137341341
Energy: 1.072883889354021
Energy: 0.8989240137341341
Energy: 0.8658404715570903
Energy: 0.8712946881428961
Energy: 0.8348083377490559
Energy: 0.871294688145939
Energy: 0.8423852668864065
Energy: 0.903792669546022
Energy: 0.8432005049700316
Energy: 0.9037926695521076
Energy: 0.839485454643287
Energy: 0.8729374688009327
Energy: 0.8300250949728634
Energy: 0.8729374687994113
Energy: 0.8472840279788423
Energy: 0.8997510613817545
Energy: 0.8330562951431775
Energy: 0.8997510613794725
Energy: 0.8437562575764839
Energy: 0.8920391844695238
Energy: 0.8416195344055568
Energy: 0.8920391844687632
Energy: 0.8286837520258692
Energy: 0.8732950788158375
Energy: 0.8236722775897859
Energy: 0.8732950788089912
Energy: 0.828614388529274
Energy: 0.9300092704808958
Energy: 0.953938814964261
Energy: 0.9300092704824173
Energy: 0.8800212949790247
Energy: 0.8704602981065649
Energy: 0.8722425202705877
Energy: 0.8704602981035221
Energy: 0.8303243281984763
Energy: 0.8707573802556506
Energy: 0.882196815491677
Energy: 0.8707573802541292
Energy: 0.9208694859019356
Energy: 0.900303574269151
Energy: 0.8240268413442622
Energy: 0.9003035742638261
Energy: 0.8400763277658929
Energy: 0.8589799779408782
Energy: 1.0201112978218452
Energy: 0.8589799779408782
Energy: 0.9779496436574172
Energy: 0.9094909419748743
Energy: 0.8209649934794746
Energy: 0.9094909419741138
Energy: 0.833337338661838
Energy: 0.8715953535021614
Energy: 0.9151888544514438
Energy: 0.8715953535044436
Energy: 0.8348960007989756
Energy: 0.9047658265481894
Energy: 0.8366219201523961
Energy: 0.9047658265466679
Energy: 0.8276573752828589
Energy: 0.8980512157039943
Energy: 0.871988562898009
Energy: 0.8980512157047548
Energy: 0.8279928480465389
Energy: 0.9001342999048242
Energy: 0.8410118716166279
Energy: 0.9001342999055849
Energy: 0.8339478889254874
Energy: 0.8932975865252998
Energy: 0.8468094140102261
Energy: 0.893297586522257
Energy: 0.822230974851284
Energy: 0.872025997352339
Energy: 0.8266610966731844
Energy: 0.8720259973500569
Energy: 0.9649638662349512
Energy: 0.8600474904043272
Energy: 0.8273394573694932
Energy: 0.8600474903990022
Energy: 0.9602285758004746
Energy: 0.8462617184880549
Energy: 0.8221979022005843
Energy: 0.8462617184880549
Energy: 0.8561602935923649
Energy: 0.87059253909173
Energy: 0.8300395281233304
Energy: 0.8705925390894479
Energy: 0.8220799332318441
Energy: 0.8956382349456126
Energy: 0.9052582435332595
Energy: 0.8956382349395269
Energy: 0.8814192179259301
Energy: 0.8904397409326685
Energy: 0.8388763432519396
Energy: 0.8904397409273783
Energy: 0.8294435649544137
Energy: 0.9029094921342184
Energy: 0.8959022922407706
Energy: 0.9029094921365005
Energy: 1.008077017332869
Energy: 0.8700707543925251
Energy: 0.8325812002562075
Energy: 0.8700707543970893
Energy: 0.8343214025754595
Energy: 0.8588676295618356
Energy: 0.9241065050673798
Energy: 0.858867629565639
Energy: 0.9902487656282531
Energy: 0.8883722677042344
Energy: 0.8284431197414162
Energy: 0.8883722677027129
Energy: 0.8386458610146682
Energy: 0.8727626855430137
Energy: 0.8293754235002857
Energy: 0.8727626855407314

minimum gb energy = 0.8209626566983588 eV
minimum distance =  2.28284500314635 Angstroms
sigma value = 1


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

Energy: 0.8262297773826693
Energy: 0.8260393326246934
Energy: 1.2474128634459583
Energy: 0.8260393326257452
Energy: 0.8087865346852087
Energy: 0.8391691218284139
Energy: 0.7735663305759238
Energy: 0.8391691218294417
Energy: 0.7772554343028667
Energy: 0.8262969029371598
Energy: 0.9493301727865412
Energy: 0.8262969029361081
Energy: 0.8040775759552677
Energy: 0.8713584481624971
Energy: 0.7736846453733662
Energy: 0.8713584481614453
Energy: 0.7766664305358816
Energy: 0.8981468596696304
Energy: 0.985905097974131
Energy: 0.8981468596685785
Energy: 0.7765292095401055
Energy: 0.8295147809575711
Energy: 0.77372609132872
Energy: 0.829514780958623
Energy: 0.776631321083307
Energy: 0.8978135823548181
Energy: 0.8428483628672582
Energy: 0.8978135823527146
Energy: 0.7765437032180527
Energy: 0.8290775115082425
Energy: 0.8355922614704087
Energy: 0.8290775115082425
Energy: 0.8260816206524871
Energy: 0.8094369167528279
Energy: 0.8308770148067844
Energy: 0.8094369167538797
Energy: 0.8260913951106689
Energy: 0.8095287673659368
Energy: 0.8525304405597085
Energy: 0.8095287673659368
Energy: 0.7765263922239611
Energy: 0.8291036543777124
Energy: 0.8018101395589997
Energy: 0.8291036543798159
Energy: 0.7768040561436305
Energy: 0.8976782943418131
Energy: 0.8430122469402347
Energy: 0.8976782943386578
Energy: 0.7762489816050575
Energy: 0.8295271283620679
Energy: 0.7736884940436383
Energy: 0.8295271283620679
Energy: 0.7769416038485973
Energy: 0.8981250915487108
Energy: 0.9963237883592383
Energy: 0.8981250915424002
Energy: 0.8040671968420936
Energy: 0.8714352489127031
Energy: 0.7736840155098432
Energy: 0.8714352489127031
Energy: 0.7772463994943742
Energy: 0.8263243131967548
Energy: 0.8632943187857259
Energy: 0.8263243131988584
Energy: 0.8088471794296083
Energy: 0.8390823111727426
Energy: 0.7734381837416225
Energy: 0.8390823111675075
Energy: 0.8262297773826693
Energy: 0.8260393326236416
Energy: 0.8593119254222938
Energy: 0.8260393326257452
Energy: 0.808786534684157
Energy: 0.8391691218284139
Energy: 0.7735663305748719
Energy: 0.8391691218294417
Energy: 0.7772554343039185
Energy: 0.8262969029371598
Energy: 1.1444996948554185
Energy: 0.8262969029361081
Energy: 0.8040775759531642
Energy: 0.8713584481624971
Energy: 0.7736846453733662
Energy: 0.8713584481614453
Energy: 0.7766664305369332
Energy: 0.8981468596696304
Energy: 0.9707726867986343
Energy: 0.8981468596685785
Energy: 0.7765292095411572
Energy: 0.8295147809575711
Energy: 0.77372609132872
Energy: 0.8295147809596507
Energy: 0.7766313210822554
Energy: 0.8978135823548181
Energy: 0.8018867192440058
Energy: 0.8978135823527146

minimum gb energy = 0.7734381837416225 eV
minimum distance =  2.29970452356593 Angstroms
sigma value = 17


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

Energy: 0.8151741338815575
Energy: 0.8145536249750728
Energy: 1.2175474975694578
Energy: 0.8145536249718814
Energy: 0.9198281643042514
Energy: 0.7995267949052245
Energy: 0.7768086496207356
Energy: 0.7995267949032742
Energy: 0.7810586866994574
Energy: 0.8102738361404935
Energy: 1.0131947036798723
Energy: 0.8102738361391933
Energy: 0.8274144495520255
Energy: 0.7765366821310513
Energy: 0.7750735396133482
Energy: 0.7765366821317015
Energy: 0.7814127206528412
Energy: 0.8638259663431404
Energy: 0.8052290695852764
Energy: 0.8638259663418402
Energy: 0.7816753556256194
Energy: 0.7808874476946588
Energy: 0.781551305849954
Energy: 0.7808874476985594
Energy: 0.7838072738918977
Energy: 0.8554732870669327
Energy: 0.8237636870764882
Energy: 0.8554732870649825
Energy: 0.7769231919567178
Energy: 0.8413505533313457
Energy: 0.776050929371463
Energy: 0.8413505533293953
Energy: 0.819595627102027
Energy: 0.831358329766654
Energy: 0.814318074066467
Energy: 0.8313583297647037
Energy: 0.8221149889798693
Energy: 0.8305311573869695
Energy: 0.7839760109082998
Energy: 0.8305311573856694
Energy: 0.7808650436073916
Energy: 0.8212062726157384
Energy: 0.7753432760951807
Energy: 0.8212062726176887
Energy: 0.7840859929638211
Energy: 0.8416960975299388
Energy: 0.7834972331963288
Energy: 0.8416960975312391
Energy: 0.7807337964650721
Energy: 0.8255627966069944
Energy: 0.7755424306199962
Energy: 0.8255627966063444
Energy: 0.7860332152827276
Energy: 0.8624056751888275
Energy: 0.8327928993095663
Energy: 0.8624056751888275
Energy: 0.7755980318860204
Energy: 0.7849481215352753
Energy: 0.8214924582354763
Energy: 0.7849481215281243
Energy: 0.7814032829608608
Energy: 0.8106598700664197
Energy: 0.9228051793754944
Energy: 0.81065987006837
Energy: 0.7936012264859053
Energy: 0.7861022486079667
Energy: 0.775382394499454
Energy: 0.7861022486066666
Energy: 0.7755918482806825
Energy: 0.8152856303470437
Energy: 0.7973382898451039
Energy: 0.8152856303457435
Energy: 0.9056702429531986
Energy: 0.8446610798630159
Energy: 0.7834329552732702
Energy: 0.8446610798623658
Energy: 0.7820663219846202
Energy: 0.8106070053936638
Energy: 0.8390545405585181
Energy: 0.8106070053930139
Energy: 0.7794724918079411
Energy: 0.795539535786545
Energy: 0.7754240841301575
Energy: 0.7955395357891455
Energy: 0.7760827221788742
Energy: 0.8169749854704274
Energy: 0.9170624548076283
Energy: 0.816974985468477
Energy: 0.8116195875562061
Energy: 0.7812928568789987
Energy: 0.7828338532589877
Energy: 0.781292856880299
Energy: 0.7813226534689417
Energy: 0.8569680005996998
Energy: 0.9203539923372752
Energy: 0.8569680005990497
Energy: 0.818567840496898
Energy: 0.8160366112383904
Energy: 0.7752674625817628
Energy: 0.8160366112377403
Energy: 0.7751758191363418
Energy: 0.8644728215788318
Energy: 0.7938362010068307
Energy: 0.8644728215788318
Energy: 0.9052078755742589
Energy: 0.8277208455190679
Energy: 0.782382294001158
Energy: 0.8277208455210182
Energy: 0.8251913972431187
Energy: 0.9311442286425894
Energy: 0.7750843360143177
Energy: 0.9311442286432394
Energy: 0.8295139586305682
Energy: 0.8621254341126705
Energy: 0.7824540169490365
Energy: 0.8621254341126705
Energy: 0.7754235516689809
Energy: 0.825174722615875
Energy: 0.8121170628227585
Energy: 0.8251747226145748
Energy: 0.7895494028751628
Energy: 0.862318742786834
Energy: 0.78896747798385
Energy: 0.8623187427835836
Energy: 0.7753349742242076
Energy: 0.8220471251042748
Energy: 0.7783603623201336
Energy: 0.8220471251042748
Energy: 0.7821996682961224
Energy: 0.8307959811137722
Energy: 0.9268241408229906
Energy: 0.8307959811105216
Energy: 0.812704966012052
Energy: 0.9402244066878941
Energy: 0.7846154548838544
Energy: 0.9402244066885442
Energy: 0.7837636773427062
Energy: 0.8173822203226004
Energy: 0.8101668330321614
Energy: 0.8173822203219503
Energy: 0.8129571585221913
Energy: 0.8566107916782764
Energy: 0.7821978555671084
Energy: 0.8566107916776262
Energy: 0.7825502281207305
Energy: 0.7823648729042483
Energy: 0.7833216956387345
Energy: 0.7823648729087989
Energy: 0.7818855241688865
Energy: 0.8647640920321233
Energy: 0.7763725897257636
Energy: 0.8647640920340737

minimum gb energy = 0.7750735396133482 eV
minimum distance =  2.29391638302189 Angstroms
sigma value = 89


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

Energy: 0.7168342717658425
Energy: 0.717071402704696
Energy: 1.041754497691646
Energy: 0.7170714027029951
Energy: 0.718590635257452
Energy: 0.7303273822907441
Energy: 0.7265568832645091
Energy: 0.7303273822907441
Energy: 0.724864720843651
Energy: 0.8291407748994738
Energy: 1.0996389953947703
Energy: 0.8291407749011748
Energy: 0.7311177037951494
Energy: 0.730310102720124
Energy: 0.7268416511943798
Energy: 0.730310102720124
Energy: 0.7174241478618394
Energy: 0.7933880626623805
Energy: 0.7337428951056585
Energy: 0.7933880626623805
Energy: 0.7187491153251955
Energy: 0.7180025722553457
Energy: 0.7209649397089088
Energy: 0.7180025722553457
Energy: 0.7251223404470435
Energy: 0.8305281303039317
Energy: 0.7280394629896175
Energy: 0.8305281303039317
Energy: 0.7473482498720637
Energy: 0.9185942158447364
Energy: 0.7266918568507869
Energy: 0.9185942158447364
Energy: 0.7175041104263706
Energy: 0.7926756158753585
Energy: 0.7257275178200842
Energy: 0.7926756158736576
Energy: 0.7315756966434961
Energy: 0.7177731036586411
Energy: 0.7197215742836216
Energy: 0.7177731036569402
Energy: 0.716985354503188
Energy: 0.7312189348639766
Energy: 0.7279363588427439
Energy: 0.7312189348639766
Energy: 0.7171100775497361
Energy: 0.8278218476706961
Energy: 0.7275131954615137
Energy: 0.8278218476706961
Energy: 0.7176568726262141
Energy: 0.7193611063231299
Energy: 0.745518160771626
Energy: 0.7193611063231299
Energy: 0.7198921478220051
Energy: 0.7903365603625213
Energy: 0.7199078061657292
Energy: 0.7903365603625213
Energy: 0.72631939861007
Energy: 0.7193333192787198
Energy: 0.7175976124103391
Energy: 0.7193333192787198

minimum gb energy = 0.7168342717658425 eV
minimum distance =  2.31394863344447 Angstroms
sigma value = 13


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

Energy: 0.7035488990230176
Energy: 0.6808048831075659
Energy: 1.1521162561841185
Energy: 0.6808048831082788
Energy: 0.8320392510811647
Energy: 0.6921795422560193
Energy: 0.6838850037610315
Energy: 0.6921795422531675
Energy: 0.6815437965351109
Energy: 0.6812245252915624
Energy: 0.833982588676352
Energy: 0.6812245252908494
Energy: 0.6926891049508938
Energy: 0.6924777700974489
Energy: 0.6800692534236655
Energy: 0.6924777701010136
Energy: 0.6822744455345898
Energy: 0.7380800343373415
Energy: 0.6937888858768206
Energy: 0.7380800343316379
Energy: 0.6929923687190082
Energy: 0.6930544445056959
Energy: 0.693875711867828
Energy: 0.6930544445092606
Energy: 0.6820845903911098
Energy: 0.7341844655381442
Energy: 0.8276333185887946
Energy: 0.7341844655331536
Energy: 0.6859103359773909
Energy: 0.6920289171109096
Energy: 0.6938955133253036
Energy: 0.6920289171080579
Energy: 0.6822402883435993
Energy: 0.7341725005970853
Energy: 0.8892668816270914
Energy: 0.7341725005970853
Energy: 0.8568141021608414
Energy: 0.7462371170181121
Energy: 0.6801522607185985
Energy: 0.7462371170181121
Energy: 0.6823185499118988
Energy: 0.7473919920336634
Energy: 0.6936484759130682
Energy: 0.7473919920300987
Energy: 0.7007427457255596
Energy: 0.7464415094966099
Energy: 0.6787888392767552
Energy: 0.746441509497323
Energy: 0.7116947919276185
Energy: 0.6919129168096984
Energy: 0.6908477645521243
Energy: 0.6919129168111242
Energy: 0.9541537375818875
Energy: 0.7467057675405835
Energy: 0.6788070755127502
Energy: 0.7467057675469999
Energy: 0.6823586137612969
Energy: 0.6811504875941877
Energy: 0.6874709305237382
Energy: 0.6811504875949007
Energy: 0.6979040390291424
Energy: 0.7471520585567594
Energy: 0.6828062485010312
Energy: 0.7471520585610372
Energy: 0.6890702063029327
Energy: 0.7342679141830095
Energy: 0.6827244946659735
Energy: 0.7342679141808707
Energy: 0.6978993602411552
Energy: 0.7322408087845631
Energy: 0.7026526468705748
Energy: 0.7322408087831372
Energy: 0.7011601768011262
Energy: 0.6936435334179705
Energy: 0.7025031816531646
Energy: 0.6936435334165446
Energy: 0.7010154152286476
Energy: 0.6934905574562845
Energy: 0.7024938634315827
Energy: 0.6934905574584233
Energy: 0.6979153768148347
Energy: 0.7322838604536411
Energy: 0.7026442841557546
Energy: 0.7322838604522154
Energy: 0.6888423730495792
Energy: 0.734391665448951
Energy: 0.6828190745151992
Energy: 0.7343916654510898
Energy: 0.6978319699107575
Energy: 0.746960148406922
Energy: 0.682875198394651
Energy: 0.7469601484147643
Energy: 0.682316862781721
Energy: 0.6809527302321372
Energy: 0.6939704410039002
Energy: 0.6809527302335632
Energy: 0.9542536718910752
Energy: 0.7467352108007085
Energy: 0.6787037389999574
Energy: 0.7467352108049861
Energy: 0.7116729548819913
Energy: 0.6921986903805649
Energy: 0.6936876466635054
Energy: 0.6921986903834166
Energy: 0.7007240388263768
Energy: 0.746274910592033
Energy: 0.6788961401012311
Energy: 0.746274910593459
Energy: 0.6823747016091881
Energy: 0.747328034984257
Energy: 0.6937277123835212
Energy: 0.7473280349828311
Energy: 0.8571352489072889
Energy: 0.7463148523709624
Energy: 0.6798607841912973
Energy: 0.7463148523731011
Energy: 0.6822781380534826
Energy: 0.7343801220696041
Energy: 0.9524800540155983
Energy: 0.7343801220696041
Energy: 0.6810281001708923
Energy: 0.6919140633239381
Energy: 0.6939024029519715
Energy: 0.6919140633267897
Energy: 0.6823895361910582
Energy: 0.7341367295924994
Energy: 0.8274925472773581
Energy: 0.7341367295882217
Energy: 0.6925981001417318
Energy: 0.6930891375211679
Energy: 0.6938742522981315
Energy: 0.6930891375261585
Energy: 0.6824197156089445
Energy: 0.7379822346683652
Energy: 0.6941804629979402
Energy: 0.7379822346683652
Energy: 0.6921363210104204
Energy: 0.6923714099429282
Energy: 0.6800860319036113
Energy: 0.692371409943641

minimum gb energy = 0.6787037389999574 eV
minimum distance =  2.33287643206093 Angstroms
sigma value = 37


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

Energy: 0.6346761514010506
Energy: 0.6347060137257399
Energy: 1.14301900259434
Energy: 0.6347060137269666
Energy: 0.6342666586035796
Energy: 0.7132459164761541
Energy: 0.6242432457004747
Energy: 0.7132459164761541
Energy: 0.6186564387158423
Energy: 0.652640154568482
Energy: 0.6291631224481056
Energy: 0.652640154568482
Energy: 0.6197672573251658
Energy: 0.7131140140678992
Energy: 0.6246721602875661
Energy: 0.7131140140691258
Energy: 0.6237566698066981
Energy: 0.6347327010361433
Energy: 0.640004148465126
Energy: 0.6347327010361433
Energy: 0.62677081456788
Energy: 0.7135713034069814
Energy: 0.6207300239680441
Energy: 0.7135713034069814
Energy: 0.6195840076532899
Energy: 0.7382162468535408
Energy: 0.6344993029432731
Energy: 0.7382162468523142
Energy: 0.6194615572477981
Energy: 0.6354696481747651
Energy: 0.6371369068215239
Energy: 0.6354696481735385
Energy: 0.6233989108383733
Energy: 0.6362743875443522
Energy: 0.7601078071049833
Energy: 0.6362743875443522
Energy: 0.946145103624386
Energy: 0.6360860702402589
Energy: 0.6207562390744483
Energy: 0.6360860702414854
Energy: 0.6247215297382478
Energy: 0.6579282542506812
Energy: 0.6214373807468535
Energy: 0.6579282542506812
Energy: 0.914148530594911
Energy: 0.6349150729205124
Energy: 0.6243943733891847
Energy: 0.6349150729205124
Energy: 0.6237236081149381
Energy: 0.7128225335328995
Energy: 0.6436470664034903
Energy: 0.7128225335328995
Energy: 0.869515134458701
Energy: 0.7371032507082964
Energy: 0.6200384257905636
Energy: 0.7371032507070698
Energy: 0.6395049862419444
Energy: 0.6563272967177254
Energy: 0.6211628480771122
Energy: 0.656327296718952
Energy: 0.640772198703467
Energy: 0.6350856894255282
Energy: 0.6245713102550619
Energy: 0.6350856894255282
Energy: 0.6234018985580078
Energy: 0.7137606941842074
Energy: 0.6269789887648134
Energy: 0.7137606941829808
Energy: 0.6200873792326973
Energy: 0.656951091786786
Energy: 0.6201041293084603
Energy: 0.6569510917880126
Energy: 0.6257414460887085
Energy: 0.6362125723342797
Energy: 0.619062257464043
Energy: 0.6362125723355063
Energy: 0.6193089496062331
Energy: 0.63523812041941
Energy: 0.6189714674012784
Energy: 0.63523812041941

minimum gb energy = 0.6186564387158423 eV
minimum distance =  2.33214758680443 Angstroms
sigma value = 25


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

Energy: 0.5818598320151761
Energy: 0.5608049556499322
Energy: 0.5972339985247856
Energy: 0.5608049556508901
Energy: 0.7588420187064687
Energy: 0.5688110309358623
Energy: 0.5636745227088756
Energy: 0.5688110309368201
Energy: 0.5584669216596809
Energy: 0.5586607972496876
Energy: 0.5592894834272929
Energy: 0.5586607972496876
Energy: 0.567746369176394
Energy: 0.569162000321049
Energy: 0.5638839623644111
Energy: 0.5691620003200912
Energy: 0.562876718302722
Energy: 0.5690859823105198
Energy: 0.5741919535985628
Energy: 0.569085982309562
Energy: 0.553898214156477
Energy: 0.5694331931530293
Energy: 0.5638740428944112
Energy: 0.5694331931530293
Energy: 0.5636476763377455
Energy: 0.5587202754825039
Energy: 0.5682560675791637
Energy: 0.5587202754834617
Energy: 0.5587924294037083
Energy: 0.5820786888918549
Energy: 0.5596448352469827
Energy: 0.5820786888908972
Energy: 0.5627363251032796
Energy: 0.569087150741461
Energy: 0.8579485881201121
Energy: 0.5690871507405033
Energy: 0.5539971344360459
Energy: 0.5611007105098612
Energy: 0.5835473047492353
Energy: 0.5611007105108191
Energy: 0.5635361246753907
Energy: 0.5589572077147068
Energy: 0.9428893252929186
Energy: 0.5589572077147068
Energy: 0.8199018193433458
Energy: 0.7612722148069907
Energy: 0.5596828487677122
Energy: 0.7612722148069907
Energy: 0.562873069232152
Energy: 0.5693235410291875
Energy: 0.8544122433719422
Energy: 0.5693235410291875
Energy: 0.8052739735389889
Energy: 0.7375185217980048
Energy: 0.5638375988713126
Energy: 0.7375185217970471
Energy: 0.563492489369551
Energy: 0.5587718144303149
Energy: 0.5540179870548457
Energy: 0.5587718144312726
Energy: 0.5698564168932404
Energy: 0.6482355777282847
Energy: 0.5597429790585338
Energy: 0.6482355777282847
Energy: 0.5628664020005569
Energy: 0.5819755885659308
Energy: 0.5589088113820792
Energy: 0.5819755885659308
Energy: 0.7572293380092392
Energy: 0.568678301437093
Energy: 0.5638355257232577
Energy: 0.568678301437093
Energy: 0.5864657718143046
Energy: 0.559146142848394
Energy: 0.5542326286087117
Energy: 0.5591461428503097
Energy: 0.9404737559360958
Energy: 0.6468195034312584
Energy: 0.566237214241758
Energy: 0.6468195034312584
Energy: 0.5628977903500785
Energy: 0.5818758468447192
Energy: 0.5764873178480426
Energy: 0.5818758468447192
Energy: 0.5624505411799073
Energy: 0.5692493395947709
Energy: 0.563969903584456
Energy: 0.5692493395957285
Energy: 0.5637990608753051
Energy: 0.5594391367615766
Energy: 0.8020879574966744
Energy: 0.5594391367625345
Energy: 0.5582662376016397
Energy: 0.6463936048118483
Energy: 0.5661939037926164
Energy: 0.6463936048118483
Energy: 0.5615750206000286
Energy: 0.6472766933347384
Energy: 0.7864662867606688
Energy: 0.6472766933337806
Energy: 0.5542638756084247
Energy: 0.5820297197536242
Energy: 0.5640513165079025
Energy: 0.5820297197526663

minimum gb energy = 0.553898214156477 eV
minimum distance =  2.33652703502828 Angstroms
sigma value = 41


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

Energy: 0.9360083841946493
Energy: 0.526677748941273
Energy: 1.0159928144222858
Energy: 0.5266777489397025
Energy: 0.9123458845211361
Energy: 0.5135643476652014
Energy: 0.508335078802329
Energy: 0.5135643476589195
Energy: 0.6031659926158199
Energy: 0.5119526036139208
Energy: 0.5260013955882066
Energy: 0.5119526036162766
Energy: 0.751702961009679
Energy: 0.5165298923944004
Energy: 0.5088888134177701
Energy: 0.5165298923951855
Energy: 0.5902103281674951
Energy: 0.5286572382632381
Energy: 0.6000404520492947
Energy: 0.5286572382577414
Energy: 0.5992728820794095
Energy: 0.5154342418302016
Energy: 0.5122850993424757
Energy: 0.5154342418341278
Energy: 0.51106643870241
Energy: 0.510890938502822
Energy: 0.5993631632979501
Energy: 0.510890938502822
Energy: 0.5988217011653124
Energy: 0.5214422429400751
Energy: 0.590824209312358
Energy: 0.5214422429392899
Energy: 0.5103745977963146
Energy: 0.5198009421507624
Energy: 0.832862693304354
Energy: 0.5198009421539035
Energy: 0.5126554127729817
Energy: 0.5120969403242474
Energy: 0.6038666427073196
Energy: 0.5120969403218916
Energy: 0.5076207526472402
Energy: 0.5137540984211983
Energy: 0.912635313996721
Energy: 0.5137540984196279
Energy: 0.5043103068197563
Energy: 0.5190477969551949
Energy: 0.8452166771925066
Energy: 0.5190477969599063
Energy: 0.5103474660586365
Energy: 0.5242436828030388
Energy: 0.9120168240994708
Energy: 0.5242436828022534
Energy: 0.6660710157921753
Energy: 0.584148339107974
Energy: 0.603981314665546
Energy: 0.5841483391103298
Energy: 0.5095467914764069
Energy: 0.5161995930358235
Energy: 0.9077957018178808
Energy: 0.5161995930303267
Energy: 0.7182583927366156
Energy: 0.5197454061261331
Energy: 0.5908279363352059
Energy: 0.5197454061198512
Energy: 0.514817426030402
Energy: 0.6826003392876003
Energy: 0.8408932153347523
Energy: 0.6826003392868152
Energy: 0.6012151507862296
Energy: 0.5213815971343689
Energy: 0.5122861759319466
Energy: 0.5213815971335837
Energy: 0.5926882283856941
Energy: 0.5179941939105956
Energy: 0.5958649958879731
Energy: 0.5179941939050988
Energy: 0.7860404172482248
Energy: 0.5191453108817183
Energy: 0.5152340774755149
Energy: 0.5191453109241214
Energy: 0.605897119802243
Energy: 0.683336979848163
Energy: 0.5234388387239144
Energy: 0.6833369798505187
Energy: 1.0447143007210917
Energy: 0.5307719122082493
Energy: 0.5083405180814196
Energy: 0.5307719122066787
Energy: 0.9186735066966409
Energy: 0.5249058937488612
Energy: 0.5148103186904976
Energy: 0.5249058937480761
Energy: 0.9141161026265119
Energy: 0.5178969287128711
Energy: 0.5132554919976865
Energy: 0.5178969287089449
Energy: 0.6058277152265161
Energy: 0.5708158600325348
Energy: 0.5156015143037442
Energy: 0.570815860029394
Energy: 0.9057910665589582
Energy: 0.5389674419330621
Energy: 0.5115417339316704
Energy: 0.5389674419330621
Energy: 0.592781399106785
Energy: 0.5183620102013521
Energy: 0.7159342568279549
Energy: 0.5183620102005668
Energy: 0.5986682656321883
Energy: 0.5185813199940631
Energy: 0.515059613182203
Energy: 0.5185813199964188
Energy: 0.5149006020590957
Energy: 0.5752426808092774
Energy: 0.787068279693167
Energy: 0.5752426808069218
Energy: 0.5935623514437836
Energy: 0.5411051905350139
Energy: 0.5958343973067536
Energy: 0.5411051905334434
Energy: 0.5076958032894224
Energy: 0.5178179339007026
Energy: 0.7822486305235639
Energy: 0.5178179339007026
Energy: 0.5128663153938631
Energy: 0.5189277750125826
Energy: 0.6085568221858492
Energy: 0.5189277750125826

minimum gb energy = 0.5043103068197563 eV
minimum distance =  2.32864011802559 Angstroms
sigma value = 15


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

Energy: 0.7572022061067856
Energy: 0.47553228109221846
Energy: 0.7364342481680881
Energy: 0.47553228109155327
Energy: 0.8800729294600957
Energy: 0.4734708322392719
Energy: 0.4739757535526305
Energy: 0.4734708322399371
Energy: 0.4853252824658126
Energy: 0.4728858826876557
Energy: 0.48154459658976695
Energy: 0.47288588268699044
Energy: 0.7587218514696293
Energy: 0.4741221153550369
Energy: 0.4739194020499125
Energy: 0.4741221153557021
Energy: 0.4720574863855307
Energy: 0.5254208797576542
Energy: 0.4817191157521852
Energy: 0.525420879756989
Energy: 0.6184128837100045
Energy: 0.4728450843574885
Energy: 0.4739484219079697
Energy: 0.47284508435549294
Energy: 0.4736670192080329
Energy: 0.47953198226707855
Energy: 0.48001085153873135
Energy: 0.4795319822690742
Energy: 0.4793625587089059
Energy: 0.47908474755258307
Energy: 0.4741835642795311
Energy: 0.47908474755391345
Energy: 0.47546728478118294
Energy: 0.4803523405910107
Energy: 0.6900807909260346
Energy: 0.4803523405916759
Energy: 0.4801032687847966
Energy: 0.4733843722956147
Energy: 0.4724087703932535
Energy: 0.4733843722962799
Energy: 0.47364459055527774
Energy: 0.4740236432575727
Energy: 0.7594937251310725
Energy: 0.4740236432535815
Energy: 0.4837142253269644
Energy: 0.4731292019736064
Energy: 0.48589753345069464
Energy: 0.4731292019709456
Energy: 0.47526313624138755
Energy: 0.48052025207841553
Energy: 0.9402550066263099
Energy: 0.4805202520824068
Energy: 0.4830780716389124
Energy: 0.4766376493015914
Energy: 0.7576946805083106
Energy: 0.4766376493029218
Energy: 0.47356633074081284
Energy: 0.4736820581102666
Energy: 0.9974708169478523
Energy: 0.4736820581587663
Energy: 0.6106446293832448
Energy: 0.4730463664267511
Energy: 0.48577506425191114
Energy: 0.47304636642542064
Energy: 0.47511981859875196
Energy: 0.4824663616497053
Energy: 0.9384601656080009
Energy: 0.48246636164305323
Energy: 0.6382750140743567
Energy: 0.5275279800781519
Energy: 0.4723613762299906
Energy: 0.5275279800828084
Energy: 0.4734940360183456
Energy: 0.47290114571072867
Energy: 0.7563223880857788
Energy: 0.4729011457100635
Energy: 0.6445612953486772
Energy: 0.47356340283303006
Energy: 0.4739366064793043
Energy: 0.4735634028403474
Energy: 0.47521347602208436
Energy: 0.48600136444234254
Energy: 0.6897906312766587
Energy: 0.486001364440347
Energy: 0.6407056679547626
Energy: 0.479015190153174
Energy: 0.47725728422143276
Energy: 0.47901519015184363
Energy: 0.4737881787895408
Energy: 0.47315584486550016
Energy: 0.4781243247436583
Energy: 0.47315584486616535
Energy: 0.7593520203379633
Energy: 0.47450694650759706
Energy: 0.4740803214280729
Energy: 0.47450694650693187
Energy: 0.48723588560907727
Energy: 0.48670303428062933
Energy: 0.4764152413027511
Energy: 0.48670303427796846
Energy: 0.8799528930212193
Energy: 0.48014520923296483
Energy: 0.47711777211720746
Energy: 0.48014520923296483
Energy: 0.7586731619241257
Energy: 0.4739904535433787
Energy: 0.47829829911781574
Energy: 0.4739904535447091
Energy: 0.9952401768315918
Energy: 0.4744410571153823
Energy: 0.47401923564316073
Energy: 0.4744410571180431
Energy: 0.48688174029259623
Energy: 0.533159002310809
Energy: 0.4859601259787816
Energy: 0.533159002326774
Energy: 0.7585030267079467
Energy: 0.4822753437491039
Energy: 0.4773012706850689
Energy: 0.4822753437477734
Energy: 0.4737898529500485
Energy: 0.5198596794058533
Energy: 0.6489503246340347
Energy: 0.5198596794065186
Energy: 0.7542191853096825
Energy: 0.4729091608671358
Energy: 0.4741164251520335
Energy: 0.472909160867801
Energy: 0.4752004735607937
Energy: 0.48881271551605027
Energy: 0.6426282625300506
Energy: 0.4888127155133894
Energy: 0.4792230859923305
Energy: 0.4858901895240161
Energy: 0.47732827224362345
Energy: 0.48589018952268564
Energy: 0.47253841714207095
Energy: 0.6272028510482721
Energy: 0.6383947172873439
Energy: 0.6272028510469417
Energy: 0.4752491788825594
Energy: 0.4731567358362154
Energy: 0.47581443269094237
Energy: 0.47315673583821105
Energy: 0.475431875280844
Energy: 0.5326312518477393
Energy: 0.9057667695814313
Energy: 0.5326312518497349

minimum gb energy = 0.4720574863855307 eV
minimum distance =  2.33698597041812 Angstroms
sigma value = 85


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

Energy: 0.6887941392348482
Energy: 0.44541019259075815
Energy: 0.5813514885668443
Energy: 0.44541019259018116
Energy: 0.892156650222097
Energy: 0.4435587518381234
Energy: 0.4266705808466443
Energy: 0.44355875183754645
Energy: 0.6709865370746629
Energy: 0.44276955414939945
Energy: 0.4230588070979153
Energy: 0.44276955414939945
Energy: 0.7875217018745839
Energy: 0.4436946288629979
Energy: 0.42663068977368374
Energy: 0.4436946288629979
Energy: 0.44158560559070903
Energy: 0.4259215114690556
Energy: 0.42796127336032586
Energy: 0.4259215114702095
Energy: 0.6825060258350669
Energy: 0.44328459845263085
Energy: 0.4266859794380741
Energy: 0.44328459845205387
Energy: 0.42462682935193896
Energy: 0.4534598743039282
Energy: 0.440066700775954
Energy: 0.4534598743039282
Energy: 0.5609260026239133
Energy: 0.44274006364551294
Energy: 0.4266047065362821
Energy: 0.44274006364608987
Energy: 0.42615779333703546
Energy: 0.4336149197736345
Energy: 0.5610368966124778
Energy: 0.43361491977478833
Energy: 0.5391684336100777
Energy: 0.45321717453348875
Energy: 0.4249541842882652
Energy: 0.4532171745340657
Energy: 0.4277142449640349
Energy: 0.4431878594734312
Energy: 0.6825844269264464
Energy: 0.4431878594717003
Energy: 0.4175236432736392
Energy: 0.4424508383262378
Energy: 0.44198047725785494
Energy: 0.44245083832681475
Energy: 0.4262537279528892
Energy: 0.43294311481667774
Energy: 0.8385632323970962
Energy: 0.43294311481667774
Energy: 0.42279308149712647
Energy: 0.4428014324461587
Energy: 0.671403155745129
Energy: 0.4428014324461587
Energy: 0.4276851763086775
Energy: 0.44295561774922027
Energy: 0.8928885644426162
Energy: 0.44295561774864334
Energy: 0.4180761044910264
Energy: 0.4456884371423839
Energy: 0.6893044610403402
Energy: 0.44568843714296075
Energy: 0.426303568004145
Energy: 0.4328870082738018
Energy: 0.9441440100427309
Energy: 0.43288700827322485
Energy: 0.538165533491928
Energy: 0.4427349005750107
Energy: 0.6714336129663199
Energy: 0.4427349005755876
Energy: 0.4276866269587382
Energy: 0.44317725068529473
Energy: 0.8777506885164674
Energy: 0.44317725068529473
Energy: 0.565891823197586
Energy: 0.44596912646579984
Energy: 0.4419905478891624
Energy: 0.44596912646118436
Energy: 0.42624567021868554
Energy: 0.4328736828483728
Energy: 0.7702377372047717
Energy: 0.4328736828489497
Energy: 0.5634960416907214
Energy: 0.442830926315551
Energy: 0.424992537969254
Energy: 0.442830926315551
Energy: 0.42765679696147174
Energy: 0.44382892745180835
Energy: 0.6614966847099072
Energy: 0.44382892745065444
Energy: 0.5598847816908991
Energy: 0.45474321895073777
Energy: 0.4266508756304116
Energy: 0.45474321895073777
Energy: 0.42644013472820297
Energy: 0.44229399368888206
Energy: 0.5393526543256099
Energy: 0.44229399368830513
Energy: 0.6829433799437149
Energy: 0.44294934788981266
Energy: 0.4290876702650093
Energy: 0.44294934789096646
Energy: 0.44334400380822103
Energy: 0.44195502898824013
Energy: 0.41733902467585565
Energy: 0.44195502898477856
Energy: 0.8020780398596641
Energy: 0.45480670822301955
Energy: 0.42664463930553526
Energy: 0.4548067082235965
Energy: 0.6725884665124722
Energy: 0.44307143835094287
Energy: 0.4213130660441881
Energy: 0.44307143835094287
Energy: 0.9900678737715622
Energy: 0.44302611723568325
Energy: 0.4291004134694912
Energy: 0.44302611723510626
Energy: 0.6904747646575611
Energy: 0.4421987425636684
Energy: 0.41785294887121244
Energy: 0.4421987425636684
Energy: 0.8840293781656646
Energy: 0.45303468263778207
Energy: 0.42664226348681933
Energy: 0.45303468263662816
Energy: 0.6726920534055496
Energy: 0.4431771506497211
Energy: 0.4293316672460047
Energy: 0.44317715064914415
Energy: 0.8775706210789889
Energy: 0.44296316674245617
Energy: 0.42897303169167
Energy: 0.44296316674707165
Energy: 0.44339731375016167
Energy: 0.4423177086670736
Energy: 0.5642681304784855
Energy: 0.4423177086682275
Energy: 0.6648879861204076
Energy: 0.4532698472518603
Energy: 0.4267067446738655
Energy: 0.4532698472518603
Energy: 0.4263157567951734
Energy: 0.443206054842234
Energy: 0.5632150176678733
Energy: 0.44320605483877235
Energy: 0.6613787315516458
Energy: 0.4426238131367715
Energy: 0.4289526873534067
Energy: 0.44262381313850224
Energy: 0.42782117359905836
Energy: 0.44225713083698276
Energy: 0.5599158784020225
Energy: 0.44225713083698276
Energy: 0.41617348581992664
Energy: 0.46626609212172804
Energy: 0.4282239848951348
Energy: 0.46626609212172804
Energy: 0.42940044795713056
Energy: 0.44338360100841534
Energy: 0.8018786657135509
Energy: 0.44338360100899227
Energy: 0.41637728748080416
Energy: 0.44194896157530555
Energy: 0.44551946270894255
Energy: 0.44194896157530555
Energy: 0.4277792255527077
Energy: 0.44321584684474524
Energy: 0.8010160346002437
Energy: 0.44321584684474524

minimum gb energy = 0.41617348581992664 eV
minimum distance =  2.3398225934435 Angstroms
sigma value = 113


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

Energy: 0.015489591727032192
Energy: 0.016542885679118862
Energy: 0.8567202133525752
Energy: 0.01654288568042478
Energy: 0.5816669508375786
Energy: 0.21524306936273166
Energy: 0.21532682689720622
Energy: 0.21524306936228818
Energy: 0.015489591727475707
Energy: 0.016542885679118862
Energy: 0.8567202133477949
Energy: 0.01654288568042478
Energy: 0.5816669508371349
Energy: 0.21524306936228818
Energy: 0.21532682689245072
Energy: 0.21524306936228818
Energy: 0.015489591727475707
Energy: 0.016542885679118862
Energy: 0.8567202133629731
Energy: 0.01654288568042478
Energy: 0.5816669508371349
Energy: 0.21524306936228818
Energy: 0.21532682689200722
Energy: 0.21524306936228818

minimum gb energy = 0.015489591727032192 eV
minimum distance =  2.54575198032026 Angstroms
sigma value = 1