Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_Pt__MO_601539325066_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Pt
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.920081198215485
cohesive_energy=5.7704507369468665
mass=195.084
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=[1.64410559651178e-19, 2.75447809093914e-19, 3.64926169749546e-19, 4.42594886435964e-19, 5.132572847019e-19, 5.76338183135748e-19, 6.30349159644522e-19, 6.75786888984762e-19, 7.14102943186872e-19, 7.46684807215896e-19, 7.74617154653052e-19, 7.98734719524654e-19, 8.19686383367472e-19, 8.380056710006279e-19, 8.5412837446857e-19, 8.68386144334536e-19, 8.81008091857188e-19, 8.92112778107442e-19, 9.01719429204906e-19, 9.097623559075859e-19, 9.161438254408078e-19, 9.20756491970094e-19, 9.23531461900182e-19, 9.24455917818e-19, 9.23456159598384e-19, 9.202373867406779e-19, 9.14477561741448e-19, 9.05867464510332e-19, 8.933400454090859e-19, 8.758042221499558e-19, 8.524605085925759e-19, 8.223347813434739e-19, 7.842013752776399e-19, 7.364789420573159e-19, 6.770926629414719e-19, 6.03285191942994e-19, 5.113955554531919e-19, 3.9663004098313793e-19, 2.52752977073304e-19, 7.1582848742169e-20, -1.580398247014038e-19, -4.5201408286725e-19, -8.33550017781474e-19, -1.3356641639939039e-18, -2.0023522918741798e-18, -2.8629134055282597e-18, -3.920718484594079e-18, -5.254450423567379e-18, -6.998916364432919e-18, -9.3752967915144e-18, -1.269082509614766e-17, -1.75577730790158e-17, -2.5328329753915798e-17, -3.91754617485876e-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: 0.01896552081110253
Energy: 0.021488810726095573
Energy: 0.5627479522211298
Energy: 0.1116029351523697
Energy: 0.021488810726095573
Energy: 0.57418883414596
Energy: 0.11160293515183632
Energy: 0.5741888341480342
Energy: 0.5627479522221965
Energy: 0.1116029351580888
Energy: 0.01896552081110253
Energy: 0.02148881072662896
Energy: 0.1116029351586222
Energy: 0.5741888341480342
Energy: 0.021488810726095573
Energy: 0.5741888341448933

minimum gb energy = 0.01896552081110253 eV
minimum distance =  2.6754407883101 Angstroms
sigma value = 1


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

Energy: 1.184309821649416
Energy: 0.8582339303656887
Energy: 0.9228269994679796
Energy: 0.9207996840094127
Energy: 0.84650629450597
Energy: 0.9346524034952167
Energy: 0.84820490769784
Energy: 0.9346524034984511
Energy: 0.922280958251402
Energy: 0.9195298161400247
Energy: 1.2993813289357243
Energy: 0.9195298161380839
Energy: 0.8523080595556927
Energy: 0.8493284159005515
Energy: 0.8485458859439142
Energy: 0.8493284159024922
Energy: 1.1003561402913704
Energy: 0.8496044700674188
Energy: 0.8520084584424974
Energy: 0.8496044700674188
Energy: 0.8679737515789683
Energy: 0.8646145181917086
Energy: 0.849111413771914
Energy: 0.8646145181917086
Energy: 0.8726521225526813
Energy: 0.8613523268398451
Energy: 1.0976413486923355
Energy: 0.8613523268379043
Energy: 0.8690767345867128
Energy: 0.8729570320555897
Energy: 0.9054040365042075
Energy: 0.872957032059471
Energy: 0.9540165214494318
Energy: 0.8653870422419376
Energy: 0.9022698777450742
Energy: 0.8653870422406439
Energy: 0.9198305628067383
Energy: 0.867953228974895
Energy: 0.884428187734501
Energy: 0.8679532289729545
Energy: 0.879930997730482
Energy: 0.8650322024489158
Energy: 0.9551110168453717
Energy: 0.8650322024495626
Energy: 0.8685214162672508
Energy: 0.8636331528860536
Energy: 0.9024846652883984
Energy: 0.8636331528854068
Energy: 0.8703718292561966
Energy: 0.8608275449400383
Energy: 0.8415825702967121
Energy: 0.8608275449393915
Energy: 0.8677034372490454
Energy: 0.863978359537217
Energy: 0.8433277226157099
Energy: 0.8639783595398046
Energy: 0.8410041874974773
Energy: 0.8492492956416257
Energy: 0.8505552612916313
Energy: 0.8492492956396851
Energy: 0.8693932672943888
Energy: 0.8491402802747265
Energy: 0.8482502709697486
Energy: 0.8491402802747265
Energy: 0.9202953047290182
Energy: 0.9191023346505324
Energy: 0.8539422163846884
Energy: 0.9191023346492386
Energy: 0.8490448610398031
Energy: 0.8496804009333911
Energy: 0.8415138931203019
Energy: 0.8496804009340381
Energy: 0.8482116606433345
Energy: 0.9185734384707506
Energy: 0.9213640412709521
Energy: 0.9185734384701038
Energy: 0.8672600038407607
Energy: 0.8489090990455567
Energy: 0.8522661407726523
Energy: 0.8489090990455567
Energy: 0.8533225198617542
Energy: 0.8517685746453193
Energy: 0.8677340186522312
Energy: 0.8517685746433785
Energy: 0.8490556270903342
Energy: 0.8494298308009022
Energy: 0.868123108654531
Energy: 0.8494298307996085
Energy: 0.8668791284766724
Energy: 0.8639593604776342
Energy: 0.875017199296641
Energy: 0.8639593604795749
Energy: 0.906926172357322
Energy: 0.8694451768523639
Energy: 0.872826751901033
Energy: 0.8694451768510703
Energy: 0.9010174315388607
Energy: 0.8658349059377257
Energy: 0.9540756783930119
Energy: 0.8658349059377257
Energy: 0.8870667095444721
Energy: 0.8622222531634953
Energy: 0.9206300515520961
Energy: 0.8622222531641422
Energy: 0.9552510003067437
Energy: 0.862643199918707
Energy: 0.8804588305994647
Energy: 0.8626431999200007
Energy: 0.9004176258061832
Energy: 0.8631691942483406
Energy: 0.868274493836511
Energy: 0.8631691942463999
Energy: 0.8411771064581871
Energy: 0.8612033920052167
Energy: 0.8698416263590384
Energy: 0.8612033920058635
Energy: 0.8436114075545903
Energy: 0.8658599501708769
Energy: 0.8689367003447174
Energy: 0.8658599501689362
Energy: 0.8497114355653813
Energy: 0.8489915684808995
Energy: 0.8409455174630264
Energy: 0.8489915684796057
Energy: 0.8481319798939443
Energy: 0.8493825832117979
Energy: 0.869257442285916
Energy: 0.8493825832105042
Energy: 0.8534603665545422
Energy: 0.8516485997158783
Energy: 0.9193975117250786
Energy: 0.8516485997145845

minimum gb energy = 0.8409455174630264 eV
minimum distance =  2.39562800114768 Angstroms
sigma value = 1


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

Energy: 1.36517281405588
Energy: 0.8788324592796362
Energy: 0.9533685088514557
Energy: 0.9533323492294583
Energy: 0.8693414224236538
Energy: 0.9612312308741636
Energy: 0.8733858959036047
Energy: 0.9612312308814722
Energy: 0.9539388330794761
Energy: 0.9521186911320956
Energy: 1.2403639160186557
Energy: 0.9521186911298829
Energy: 0.8767796230365438
Energy: 0.8729931677865501
Energy: 0.8727599143277365
Energy: 0.8729931677880253
Energy: 0.8714042255534546
Energy: 0.8723619852537032
Energy: 0.8738177253424683
Energy: 0.8723619852522282
Energy: 0.8991847426658933
Energy: 0.9012872031737893
Energy: 0.8721103545326332
Energy: 0.9012872031745268
Energy: 0.9089822366196174
Energy: 0.8951895376160238
Energy: 1.0347433402998703
Energy: 0.8951895376160238
Energy: 0.9013950711967902
Energy: 0.9023660174258092
Energy: 0.936265606280522
Energy: 0.9023660174235966
Energy: 0.8997304432969957
Energy: 0.9005438613402881
Energy: 0.9489734431432817
Energy: 0.9005438613417632
Energy: 0.9346624504332696
Energy: 0.9033681089223795
Energy: 0.9008050527829263
Energy: 0.9033681089245252
Energy: 0.8688454314348829
Energy: 0.8952009988618844
Energy: 0.9113352004535079
Energy: 0.8952009988589342
Energy: 0.8711014245721893
Energy: 0.901765259918376
Energy: 0.8990898254264568
Energy: 0.9017652599213264
Energy: 0.8733266254608528
Energy: 0.8724193068339019
Energy: 0.8700661277301538
Energy: 0.8724193068339019
Energy: 0.872404563576725
Energy: 0.8727300809241582
Energy: 0.8937307225431329
Energy: 0.8727300809285834
Energy: 0.8739195595647091
Energy: 0.95062651246547
Energy: 0.9503056354353799
Energy: 0.9506265124669452
Energy: 0.871021261014442
Energy: 0.8724069383460931
Energy: 0.8729479924213445
Energy: 0.8724069383564189
Energy: 0.9553548474471689
Energy: 0.9510182877625438
Energy: 0.8728715160834347
Energy: 0.9510182877662315
Energy: 0.8767727025599042
Energy: 0.872988832579921
Energy: 0.8984990044995423
Energy: 0.8729888325806585
Energy: 0.8711386289007548
Energy: 0.8764126156420371
Energy: 0.878344174876688
Energy: 0.8764126156435125
Energy: 0.8995005328011567
Energy: 0.8721904809676349
Energy: 0.8722956066784053
Energy: 0.8721904809624718
Energy: 0.9059907865922852
Energy: 0.9001001490578595
Energy: 0.8998865832929951
Energy: 0.9001001490534342
Energy: 0.9032236546053113
Energy: 0.9058289457666708
Energy: 0.9381706921865641
Energy: 0.9058289457674085
Energy: 0.8999963808827647
Energy: 0.9014705622516274
Energy: 0.9437480032476456
Energy: 0.9014705622464645
Energy: 0.9347847306940277
Energy: 0.9010273541291538
Energy: 0.8998564675215207
Energy: 0.9010273541313665
Energy: 0.8688420021099348
Energy: 0.8951948261240612
Energy: 0.9113109374333047
Energy: 0.895194826121111
Energy: 0.8684455304153952
Energy: 0.8978833718809534
Energy: 0.9007943024199999
Energy: 0.8978833718883289
Energy: 0.8723749922588684
Energy: 0.8721982462747261
Energy: 0.8683977070527374
Energy: 0.8721982462821015
Energy: 0.8725554146110859
Energy: 0.8721356540320915
Energy: 0.8741920050478625
Energy: 0.8721356540298789
Energy: 0.8734759875501754
Energy: 0.8764393619195286
Energy: 0.9505049725298818
Energy: 0.8764393619276419

minimum gb energy = 0.8683977070527374 eV
minimum distance =  2.38948935348484 Angstroms
sigma value = 25


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

Energy: 1.2968890208166828
Energy: 0.8959512778893071
Energy: 0.9872222531775632
Energy: 0.9867243926952688
Energy: 0.9006051648561431
Energy: 0.9849432620734077
Energy: 0.8952848232831107
Energy: 0.9849432620734077
Energy: 0.9881196760302957
Energy: 0.9856758144557716
Energy: 1.164455647149837
Energy: 0.9856758144549141
Energy: 0.9019108880354049
Energy: 0.8960468759288202
Energy: 0.8951207555642047
Energy: 0.8960468759279627
Energy: 0.8939072029812576
Energy: 0.8953621195609109
Energy: 0.8988357265644986
Energy: 0.8953621195609109
Energy: 0.9372812314912582
Energy: 0.9793401201704727
Energy: 0.8961268380182968
Energy: 0.9793401201704727
Energy: 0.939491429413377
Energy: 0.9418058119757853
Energy: 0.96659383940728
Energy: 0.9418058119766427
Energy: 0.9419484640551259
Energy: 0.946231346985307
Energy: 0.912917650284295
Energy: 0.9462313469861643
Energy: 0.9677054148253907
Energy: 0.940940374179468
Energy: 0.9024771249483198
Energy: 0.9409403741803253
Energy: 0.9377492211678253
Energy: 0.9422261749102885
Energy: 0.8966392675964899
Energy: 0.9422261749111458
Energy: 0.8903049403474496
Energy: 0.8957489364590713
Energy: 0.8957444418225164
Energy: 0.8957489364573565
Energy: 0.8892121815350796
Energy: 0.8962985734102209
Energy: 0.8947628131540127
Energy: 0.8962985734093635
Energy: 0.9832798299910717
Energy: 0.9826601539411414
Energy: 0.8883116843875077
Energy: 0.9826601539411414
Energy: 0.8946471263460054
Energy: 0.8956855377549738
Energy: 0.9009844064541851
Energy: 0.8956855377566888
Energy: 0.8934576817469535
Energy: 0.983766391238215
Energy: 0.9892113639703641
Energy: 0.9837663912390724
Energy: 0.9335831248006213
Energy: 0.8976863472556009
Energy: 0.9010298789557125
Energy: 0.8976863472564584
Energy: 0.8952145591363536
Energy: 0.9019957377567706
Energy: 0.8939290175673275
Energy: 0.901995737757628
Energy: 0.8964271944925843
Energy: 0.8955821672422395
Energy: 0.9371077206230161
Energy: 0.8955821672422395
Energy: 0.9666297529278893
Energy: 0.944078636837811
Energy: 0.9371539649587289
Energy: 0.944078636837811
Energy: 0.9132102736170393
Energy: 0.9443275506186238
Energy: 0.9353527950316678
Energy: 0.9443275506169091
Energy: 0.9040998763158057
Energy: 0.9402957159490354
Energy: 0.9685520795823411
Energy: 0.9402957159498928
Energy: 0.8998294467550954
Energy: 0.9408983805119061
Energy: 0.9377921239814649
Energy: 0.9408983805127634
Energy: 0.894582304003492
Energy: 0.8964009681248296
Energy: 0.8897312917063871
Energy: 0.8964009681239723
Energy: 0.8958485685660141
Energy: 0.8959662857363218
Energy: 0.8889128512618827
Energy: 0.8959662857337497
Energy: 0.8881675677505201
Energy: 0.9022276115975295
Energy: 0.9823858347513807
Energy: 0.9022276115975295

minimum gb energy = 0.8881675677505201 eV
minimum distance =  2.3923305785734 Angstroms
sigma value = 9


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

Energy: 1.1954019998861065
Energy: 0.9015461601588514
Energy: 1.0177276893536045
Energy: 1.0166040108193242
Energy: 0.9620525178899754
Energy: 0.9983283968734464
Energy: 0.921688140136358
Energy: 0.9983283968734464
Energy: 1.0179684507157136
Energy: 1.0149543324113666
Energy: 1.0153204447769106
Energy: 1.0149543324103436
Energy: 0.930202209676274
Energy: 0.9224857541081403
Energy: 0.9225622607103766
Energy: 0.922485754109163
Energy: 0.9193753813314571
Energy: 0.9231970477248773
Energy: 0.9271473478950436
Energy: 0.9231970477248773
Energy: 0.9313932080487258
Energy: 1.012653960945726
Energy: 0.9237737741998251
Energy: 1.0126539609447032
Energy: 0.9523117928415269
Energy: 0.9921079501874674
Energy: 0.9236822741919933
Energy: 0.9921079501874674
Energy: 0.9233300120286551
Energy: 0.992710114576035
Energy: 0.9221252577773604
Energy: 0.992710114575012
Energy: 0.9224681717498221
Energy: 0.9235203419574498
Energy: 0.8938168108192993
Energy: 0.9235203419625638
Energy: 0.9234848447759773
Energy: 0.92387474373748
Energy: 0.8912093844715325
Energy: 0.9238747437364572
Energy: 0.8913081074302459
Energy: 1.0115481411600793
Energy: 1.0126454174198303
Energy: 1.0115481411570109
Energy: 0.9599949692803826
Energy: 0.9246072244326043
Energy: 0.9224459679052167
Energy: 0.9246072244336271
Energy: 1.0204250904909515
Energy: 1.0118772147913009
Energy: 1.014575900368747
Energy: 1.0118772147943693
Energy: 0.9315649192032538
Energy: 0.9222305453755977
Energy: 0.9260234350807447
Energy: 0.9222305453704838
Energy: 0.9201555083445185
Energy: 0.9311584219615784
Energy: 0.9227101498305218
Energy: 0.9311584219656697
Energy: 0.9304811594599096
Energy: 0.923932453915759
Energy: 0.9233193489028954
Energy: 0.9239324539116678
Energy: 0.9592705257835092
Energy: 0.9923944571981806
Energy: 0.9226584509225052
Energy: 0.9923944572022719
Energy: 0.961491861243634
Energy: 0.9933402963362866
Energy: 0.9224753479744857
Energy: 0.9933402963424235
Energy: 0.9213324105223445
Energy: 0.9236213884053565
Energy: 0.8916213382337328
Energy: 0.9236213884084248
Energy: 0.9237046776475829
Energy: 0.9246941766971125
Energy: 0.89158137960236
Energy: 0.924694176699158
Energy: 0.8900702462941085
Energy: 0.9324246434840218
Energy: 1.0109551239129533
Energy: 0.9324246434840218

minimum gb energy = 0.8900702462941085 eV
minimum distance =  2.39280043543757 Angstroms
sigma value = 25


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

Energy: 1.0590403137461697
Energy: 0.898497489992347
Energy: 1.0442966035844028
Energy: 1.0417171379870818
Energy: 0.8880341377497938
Energy: 0.9691428474724512
Energy: 0.9186605633708136
Energy: 0.9691428474737162
Energy: 1.042183530968681
Energy: 1.040273638990979
Energy: 1.0388766312891056
Energy: 1.040273638990979
Energy: 0.8928853804902604
Energy: 0.9695471697492487
Energy: 0.9197858076082178
Energy: 0.9695471697492487
Energy: 0.9715646644181034
Energy: 0.9799228612721678
Energy: 0.9182350246570922
Energy: 0.9799228612709028
Energy: 0.8917944996512396
Energy: 0.9798584198612634
Energy: 0.9185833968873477
Energy: 0.9798584198612634
Energy: 0.8864651525200824
Energy: 0.9825329563831746
Energy: 0.973349061009309
Energy: 0.9825329563844396
Energy: 0.8855396644966039
Energy: 0.9808509876630601
Energy: 0.9230645293369285
Energy: 0.9808509876617951
Energy: 1.0393913810962758
Energy: 1.0374760263033145
Energy: 1.1812420765632499
Energy: 1.0374760263033145
Energy: 0.9218239273109621
Energy: 0.9810515241518204
Energy: 0.8862885098558873
Energy: 0.9810515241530854
Energy: 1.0338876774128434
Energy: 1.0384921302291479
Energy: 1.0468330059899462
Energy: 1.0384921302291479
Energy: 0.8893932333676061
Energy: 0.9721936493269209
Energy: 0.8923405993563228
Energy: 0.9721936493269209
Energy: 0.9199246297298219
Energy: 0.9921764994291319
Energy: 0.9715051164409299
Energy: 0.9921764994303967
Energy: 0.9205542034269902
Energy: 0.9796508672749992
Energy: 0.8941856926536963
Energy: 0.9796508672737342
Energy: 0.9750526622949031
Energy: 0.9828137015682904
Energy: 0.8858130514073509
Energy: 0.9828137015682904
Energy: 0.9197730351769705
Energy: 0.9829316482464544
Energy: 0.886075442379634
Energy: 0.9829316482464544
Energy: 0.8849129637907273
Energy: 0.8922079152258661
Energy: 1.035668860479528
Energy: 0.8922079152246012

minimum gb energy = 0.8849129637907273 eV
minimum distance =  2.48390964563077 Angstroms
sigma value = 17


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

Energy: 1.4991569361594435
Energy: 1.047119456237114
Energy: 1.1436134752215128
Energy: 1.1409504925260254
Energy: 0.9138799762002991
Energy: 0.9720123092410732
Energy: 0.9751102752107428
Energy: 0.9720123092389241
Energy: 0.9851004366810541
Energy: 0.9758474315388669
Energy: 1.1468172124816627
Energy: 0.9758474315381505
Energy: 0.9782190263831538
Energy: 1.0189487156029142
Energy: 0.9732643615222631
Energy: 1.0189487156036305
Energy: 0.9760277735301299
Energy: 1.0574368490084702
Energy: 1.0104508264164664
Energy: 1.0574368490063213
Energy: 0.9759753936616082
Energy: 1.0600040838247906
Energy: 0.9767798472032277
Energy: 1.060004083825507
Energy: 1.0321422199058767
Energy: 0.97555852771534
Energy: 0.9760060036308735
Energy: 0.975558527713191
Energy: 1.0308554662197134
Energy: 0.9769366918611645
Energy: 0.9661246664254605
Energy: 0.9769366918604481
Energy: 1.148198101371449
Energy: 1.1370676241072522
Energy: 1.1455124167408275
Energy: 1.1370676241065356
Energy: 1.135859887067033
Energy: 1.0415160586282022
Energy: 0.9751552971492755
Energy: 1.0415160586267695
Energy: 1.0457429206335103
Energy: 0.9655667402188151
Energy: 0.9373436062579665
Energy: 0.9655667402195314
Energy: 1.0341630594776905
Energy: 0.9647798017016849
Energy: 0.9647549851042542
Energy: 0.9647798017031176
Energy: 1.033908320192867
Energy: 0.9647774081024953
Energy: 0.9650802361522779
Energy: 0.9647774081010626
Energy: 1.0338878212096496
Energy: 0.965149799898302
Energy: 0.9376770251115178
Energy: 0.965149799898302
Energy: 1.1362360868398365
Energy: 1.0750577824337537
Energy: 1.0291802905802885
Energy: 1.0750577824344703
Energy: 1.1510069414818724
Energy: 1.0352452637425895
Energy: 1.0288535941609989
Energy: 1.035245263741873
Energy: 1.033273960388358
Energy: 0.9737150224492803
Energy: 0.9745091698108832
Energy: 0.9737150224464147
Energy: 1.0368265070378682
Energy: 0.9737744031235992
Energy: 0.973223780919415
Energy: 0.9737744031228828
Energy: 0.9738550503239578
Energy: 1.058093921284435
Energy: 0.9766355922465664
Energy: 1.0580939212858675
Energy: 1.0110433665045402
Energy: 1.0599438167971884
Energy: 0.9759378866151617
Energy: 1.0599438167986213
Energy: 0.9795745427088035
Energy: 0.9677960009328375
Energy: 1.0327091661091115
Energy: 0.9677960009306884
Energy: 0.9744890856613736
Energy: 0.9769071415969823
Energy: 1.033016095198321
Energy: 0.9769071415998478
Energy: 0.9735556513090384
Energy: 1.0201634358464544
Energy: 1.0765845373085825
Energy: 1.0201634358450216
Energy: 1.143111652038326
Energy: 1.1352840371294914
Energy: 1.1402238005555891
Energy: 1.1352840371316404
Energy: 0.9658162795464615
Energy: 0.964767437641561
Energy: 1.0380171894030479
Energy: 0.9647674376429939
Energy: 0.9644512225893992
Energy: 0.9642840976551237
Energy: 0.9765375014923922
Energy: 0.9642840976572727
Energy: 0.9364861144577556
Energy: 0.967074857675163
Energy: 1.0324498102421622
Energy: 0.9670748576737301
Energy: 0.9657170023797779
Energy: 0.9643372294742314
Energy: 1.033671849155157
Energy: 0.9643372294735151
Energy: 0.9655462804638946
Energy: 0.9660471081612341
Energy: 1.036756406983442
Energy: 0.9660471081605176
Energy: 1.234761956217083
Energy: 1.136678172233891
Energy: 1.140937832939565
Energy: 1.136678172233891

minimum gb energy = 0.9138799762002991 eV
minimum distance =  2.48908738441347 Angstroms
sigma value = 53


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

Energy: 1.3601931548558768
Energy: 0.8640334453263157
Energy: 1.0408225704393579
Energy: 1.036653390497032
Energy: 1.1982908444904001
Energy: 0.9163174167394119
Energy: 1.0287129024936976
Energy: 0.9163174167394119
Energy: 1.0383563661775024
Energy: 1.028789823155407
Energy: 1.0356825024320404
Energy: 1.0287898231504593
Energy: 1.0275913647425003
Energy: 0.9166938549541604
Energy: 1.0364290320276854
Energy: 0.9166938549558097
Energy: 1.0343258456312963
Energy: 0.9162955217278558
Energy: 0.8420493569519518
Energy: 0.9162955217245572
Energy: 1.0336042045106457
Energy: 0.9178898484100451
Energy: 0.8424415455936772
Energy: 0.9178898484067466
Energy: 1.1993972670129291
Energy: 1.0247585088276663
Energy: 1.0285951218678933
Energy: 1.0247585088276663
Energy: 1.197801030662266
Energy: 0.9181087695313543
Energy: 1.0240785532062266
Energy: 0.9181087695313543
Energy: 1.0252459818001303
Energy: 1.0264819109211525
Energy: 1.0445064589468893
Energy: 1.0264819109195034
Energy: 1.0247573602178426
Energy: 0.9161566893619575
Energy: 1.0259447965448076
Energy: 0.9161566893570098
Energy: 1.0319266523273984
Energy: 0.9163474840421271
Energy: 0.8619107634593474
Energy: 0.9163474840404779
Energy: 1.027707385128872
Energy: 0.9167508937744486
Energy: 0.8469842676214142
Energy: 0.9167508937744486
Energy: 1.1977675732546238
Energy: 0.9187201886436293
Energy: 1.0226694694397969
Energy: 0.9187201886419799

minimum gb energy = 0.8420493569519518 eV
minimum distance =  2.47026730290407 Angstroms
sigma value = 9


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

Energy: 1.337145707957814
Energy: 1.0844086327731788
Energy: 1.1925358226255187
Energy: 1.1864566564468435
Energy: 1.1012749954448948
Energy: 0.956137415892484
Energy: 1.184229633279873
Energy: 0.9561374158930944
Energy: 0.9684098936459691
Energy: 0.9558493884435496
Energy: 1.1988203333452006
Energy: 0.9558493884429393
Energy: 0.9619855735830882
Energy: 0.9557736566614473
Energy: 1.256244741892192
Energy: 0.9557736566638888
Energy: 0.9595000370262977
Energy: 0.9551070330475725
Energy: 1.2441074956889198
Energy: 0.9551070330512351
Energy: 0.9544498967111599
Energy: 0.9552196546846848
Energy: 1.244675704050025
Energy: 0.9552196546828535
Energy: 1.2722539994841304
Energy: 1.1552838321456993
Energy: 1.176367842312438
Energy: 1.155283832148141
Energy: 1.2435806192645495
Energy: 0.9612551401259416
Energy: 1.1575242564514363
Energy: 0.9612551401265519
Energy: 1.0125879791529482
Energy: 1.071484339414381
Energy: 1.0414337726492768
Energy: 1.071484339414381
Energy: 0.9553494752447657
Energy: 1.0488756035587803
Energy: 1.1597692349912772
Energy: 1.0488756035575595
Energy: 1.0091480959610912
Energy: 1.0045442127337174
Energy: 1.1811521162621452
Energy: 1.0045442127306654
Energy: 1.0245221462479104
Energy: 1.009615352369308
Energy: 1.2416369446054774
Energy: 1.0096153523656457
Energy: 1.1740777773268845
Energy: 1.0091562173026665
Energy: 1.0298748331329322
Energy: 1.0091562173026665
Energy: 1.2581434791356005
Energy: 1.0101021104968029
Energy: 1.0118847907967605
Energy: 1.0101021104968029
Energy: 1.1570199110512116
Energy: 1.0619974745104184
Energy: 1.0240421523939385
Energy: 1.0619974745091976
Energy: 1.1235672349396792
Energy: 1.0646374176171773
Energy: 1.0260688441229842
Energy: 1.0646374176159568
Energy: 1.1593989207300193
Energy: 0.9543525475505021
Energy: 1.0123238743313447
Energy: 0.9543525475523332
Energy: 1.154964384771433
Energy: 1.1558336541991567
Energy: 1.335079876299345
Energy: 1.1558336541985463
Energy: 1.1774429110271496
Energy: 0.9563312739205666
Energy: 0.9606428134040855
Energy: 0.9563312739223979
Energy: 1.2318461849205922
Energy: 0.9569204304417723
Energy: 0.9647506336538222
Energy: 0.9569204304442139
Energy: 1.256419248559079
Energy: 0.9554619118650268
Energy: 0.9580901400889309
Energy: 0.9554619118644163
Energy: 1.2442946408539342
Energy: 0.9542094420684303
Energy: 0.9566204909272449
Energy: 0.9542094420690407
Energy: 1.2443225370923534
Energy: 0.9551632618046717
Energy: 0.9550780682221239
Energy: 0.9551632618040613
Energy: 1.1793697231848195
Energy: 1.1583165363591934
Energy: 1.1739338566145154
Energy: 1.1583165363604142
Energy: 1.1586619411044368
Energy: 1.0648981629248357
Energy: 1.2441032129702867
Energy: 1.0648981629236147
Energy: 1.04235353849823
Energy: 1.058133274640714
Energy: 1.0103818722327171
Energy: 1.0581332746419345
Energy: 1.162910682534045
Energy: 0.955466711888094
Energy: 0.9544804507183006
Energy: 0.9554667118893149
Energy: 1.1032405060857051
Energy: 1.0080409609108911
Energy: 1.0102571164426009
Energy: 1.0080409609108911
Energy: 1.2423679147707596
Energy: 1.02999337954964
Energy: 1.008249530634222
Energy: 1.02999337954964
Energy: 1.028506451392887
Energy: 1.006446206729316
Energy: 1.2436139488192295
Energy: 1.0064462067268745
Energy: 1.0152202159191195
Energy: 1.0107687011338136
Energy: 1.1961922777923555
Energy: 1.0107687011362554
Energy: 1.008343572515001
Energy: 1.0625722689138613
Energy: 1.163521805519522
Energy: 1.0625722689144714
Energy: 1.0275904580173179
Energy: 1.0633845437496752
Energy: 1.1221404688232874
Energy: 1.0633845437496752
Energy: 1.0106887752706912
Energy: 0.9571045968551342
Energy: 1.0730018378141069
Energy: 0.9571045968545238
Energy: 1.247585528311765
Energy: 1.1562625727727498
Energy: 1.1549582192396561
Energy: 1.1562625727733602

minimum gb energy = 0.9542094420684303 eV
minimum distance =  2.48561424787344 Angstroms
sigma value = 73


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

Energy: 1.2585648078557699
Energy: 0.982191972435793
Energy: 1.1297972230573234
Energy: 1.1304723997321484
Energy: 1.0852889536660635
Energy: 0.9608752076747296
Energy: 1.0893551001095305
Energy: 0.9608752076747296
Energy: 0.9707854916653601
Energy: 0.9600612386858202
Energy: 1.0937457392342722
Energy: 0.9600612386858202
Energy: 0.9590769187249649
Energy: 0.9583030360134575
Energy: 1.2147641871536865
Energy: 0.958303036014426
Energy: 0.9606730449476555
Energy: 0.9589085880888877
Energy: 1.2095275968355979
Energy: 0.9589085880879192
Energy: 0.957718459155038
Energy: 0.957375713745898
Energy: 1.209774805704198
Energy: 0.957375713745898
Energy: 1.084943414776206
Energy: 1.0848748088841194
Energy: 1.1199151380516839
Energy: 1.0848748088841194
Energy: 1.0854958768363363
Energy: 1.0320394755288211
Energy: 1.0825461249097388
Energy: 1.0320394755297897
Energy: 1.0865148690700488
Energy: 1.033631575453153
Energy: 1.1045187597100505
Energy: 1.0336315754512162
Energy: 0.9571092655960378
Energy: 1.0522168706006982
Energy: 1.0843365613231648
Energy: 1.0522168705997297
Energy: 1.082001239792456
Energy: 1.0326736446933396
Energy: 1.0852279336733441
Energy: 1.032673644694308
Energy: 1.1184996199444035
Energy: 1.0852734013316705
Energy: 1.2028724631000092
Energy: 1.085273401332639
Energy: 1.0781753203135342
Energy: 0.9577985206721394
Energy: 0.9576906258240144
Energy: 0.9577985206721394
Energy: 1.094069268575129
Energy: 0.9601651785818377
Energy: 0.96443201780838
Energy: 0.9601651785779638
Energy: 1.2135050798871152
Energy: 0.9796461583850333
Energy: 0.9586891582792736
Energy: 0.9796461583840649
Energy: 1.2083344490651176
Energy: 0.9591149872307806
Energy: 0.9580590210529398
Energy: 0.9591149872307806
Energy: 1.210072037671063
Energy: 0.9584457754850264
Energy: 0.9577252323731028
Energy: 0.958445775485995
Energy: 1.1159675075861604
Energy: 1.1140572928839256
Energy: 1.0853210866631335
Energy: 1.1140572928829573
Energy: 1.08485540479681
Energy: 1.0339113633366628
Energy: 1.0851229659476267
Energy: 1.0339113633386001
Energy: 1.1119195238287467
Energy: 1.0487730450279833
Energy: 1.0850238250914943
Energy: 1.0487730450279833
Energy: 1.0841134359219224
Energy: 1.0410167418390024
Energy: 0.9626591354866628
Energy: 1.0410167418738232
Energy: 1.2030786878576658
Energy: 1.087057929349479
Energy: 1.0846129760887022
Energy: 1.0870579293504474

minimum gb energy = 0.9571092655960378 eV
minimum distance =  2.47486748905408 Angstroms
sigma value = 7


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

Energy: 1.847937773789136
Energy: 1.0772090928232074
Energy: 1.1745073632357008
Energy: 1.1732625112890565
Energy: 1.0418363685396312
Energy: 0.996506751811271
Energy: 1.2271527593085643
Energy: 0.9965067518105863
Energy: 1.0072276689872646
Energy: 1.0160446991241767
Energy: 1.165196487623937
Energy: 1.0160446991282854
Energy: 1.0013053854311327
Energy: 0.9982543861170384
Energy: 1.2148871889542054
Energy: 0.9982543861252561
Energy: 1.0018655964665022
Energy: 0.9957630249377223
Energy: 1.1935661135590598
Energy: 0.9957630249384072
Energy: 1.0502355392350171
Energy: 0.9966185490119179
Energy: 1.1894369088749854
Energy: 0.9966185490173963
Energy: 1.1892226734477205
Energy: 1.0011749946965163
Energy: 1.0023609409305165
Energy: 1.0011749946951467
Energy: 1.211794854153015
Energy: 0.9990098182760729
Energy: 0.998468861160604
Energy: 0.9990098182815514
Energy: 1.2023679653279051
Energy: 1.001874812264269
Energy: 1.0005826828389535
Energy: 1.0018748122635843
Energy: 1.2180040000391545
Energy: 1.0024422774185953
Energy: 1.0014607987644073
Energy: 1.0024422774172257
Energy: 1.2108039438771105
Energy: 1.0190357380402724
Energy: 1.0445238065815319
Energy: 1.019035738038218
Energy: 1.1449813120885681
Energy: 1.1374525709970846
Energy: 1.1884273691172598
Energy: 1.1374525710032481
Energy: 1.1386788814425517
Energy: 1.023232197425886
Energy: 1.0593022693848968
Energy: 1.0232321974217773
Energy: 1.1525135490768887
Energy: 1.0498293631277065
Energy: 1.0667868216431875
Energy: 1.0498293631174342
Energy: 1.1383857405599251
Energy: 1.0254673388530462
Energy: 1.0596445612677428
Energy: 1.0254673388530462
Energy: 1.1858922631421687
Energy: 1.0072049535519076
Energy: 1.073092706423406
Energy: 1.0072049535601255
Energy: 1.2279303334425633
Energy: 1.0156991620798663
Energy: 1.1764688877246727
Energy: 1.0156991620819205
Energy: 1.0239181640738326
Energy: 1.057390655884317
Energy: 1.1652039291071383
Energy: 1.057390655887056
Energy: 1.030785614002499
Energy: 0.9684580393507698
Energy: 1.1750117949897247
Energy: 0.9684580393514547
Energy: 1.0206571333367818
Energy: 1.024745981359419
Energy: 1.1502170102823783
Energy: 1.024745981358734
Energy: 1.079608488764917
Energy: 1.0239961037171645
Energy: 1.1953873366217096
Energy: 1.023996103710379
Energy: 1.1823383583768572
Energy: 1.0015895951205072
Energy: 1.170509515766771
Energy: 1.0015895951253009
Energy: 1.1846574845529962
Energy: 1.0010472487599031
Energy: 1.0074684205909206
Energy: 1.001047248757164
Energy: 1.2012818036659976
Energy: 1.0017125450049975
Energy: 1.0043637486978592
Energy: 1.0017125449988344
Energy: 1.2100762992142122
Energy: 1.0182282823118103
Energy: 1.02874020175561
Energy: 1.0182282823070163
Energy: 1.2074159628157428
Energy: 1.000264735877073
Energy: 1.0063510048699975
Energy: 1.0002647358736492
Energy: 1.1810827118613705
Energy: 1.1734428770530612
Energy: 1.5877401635116453
Energy: 1.1734428770564853
Energy: 1.109248246704802
Energy: 1.0739649915032434
Energy: 1.1064966829894596
Energy: 1.0739649914977647
Energy: 1.120772982166816
Energy: 1.0825212898017753
Energy: 1.127646379942306
Energy: 1.0825212898031449
Energy: 1.1084095929865725
Energy: 1.0758196522794405
Energy: 1.0640413482799422
Energy: 1.0758196522856034
Energy: 1.1978795564274773
Energy: 1.106890319562946
Energy: 1.1140913321821426
Energy: 1.1068903195656854

minimum gb energy = 0.9684580393507698 eV
minimum distance =  2.45476699492421 Angstroms
sigma value = 29


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

Energy: 0.9314753721024539
Energy: 0.9347320652004575
Energy: 1.074892976468928
Energy: 1.134495147856717
Energy: 0.9580654800788109
Energy: 1.042844273370374
Energy: 0.9566378934885895
Energy: 1.042844273370374
Energy: 0.9746726433824109
Energy: 1.0148789155845794
Energy: 0.9450723518967122
Energy: 1.0148789155845794
Energy: 0.962348062588439
Energy: 0.9581739974355017
Energy: 0.975250319830554
Energy: 0.9581739974355017
Energy: 0.964753657400986
Energy: 0.9609195454170188
Energy: 0.9591688094513076
Energy: 0.9609195454146865
Energy: 0.9739853015295357
Energy: 1.035112321028137
Energy: 0.9626815815335453
Energy: 1.0351123210304694
Energy: 0.9464137514164354
Energy: 1.0155674520012878
Energy: 0.9747494263614336
Energy: 1.0155674519989555
Energy: 0.9565209279237413
Energy: 0.9580117808262081
Energy: 0.9590647461053848
Energy: 0.9580117808285405
Energy: 0.9575255054343005
Energy: 0.9604680188153766
Energy: 0.9534314815501961
Energy: 0.9604680188223738

minimum gb energy = 0.9314753721024539 eV
minimum distance =  2.44611963819836 Angstroms
sigma value = 5


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

Energy: 1.4925356211545777
Energy: 0.9368660882387889
Energy: 1.1225490450682971
Energy: 0.9609638433777522
Energy: 1.1076492008026797
Energy: 0.9648924129266441
Energy: 1.1186709203602387
Energy: 0.9648924129305254
Energy: 1.114076939074373
Energy: 1.0482224873311963
Energy: 1.1112563715308053
Energy: 1.0482224873305495
Energy: 1.0692451686594928
Energy: 0.9604781243090642
Energy: 1.126283187672129
Energy: 0.9604781243084173
Energy: 1.0896545746302846
Energy: 0.960552338837578
Energy: 1.0607113398882406
Energy: 0.9605523388304621
Energy: 0.9632306747508154
Energy: 0.9632190772105214
Energy: 1.0603420591075332
Energy: 0.9632190772085807
Energy: 0.9603677464355077
Energy: 0.959829050426725
Energy: 1.1323870697895768
Energy: 0.9598290504228437
Energy: 0.984312194360111
Energy: 0.9673158770645821
Energy: 1.1776775912012156
Energy: 0.9673158770678166
Energy: 1.114293848440758
Energy: 0.9854743300121762
Energy: 1.1615064651774436
Energy: 0.98547433001347
Energy: 1.2738914441215852
Energy: 0.9407155343776585
Energy: 0.9437709040693831
Energy: 0.9407155343744241
Energy: 1.1097482137656935
Energy: 0.9361286655345106
Energy: 0.9378933698703394
Energy: 0.9361286655261599
Energy: 1.1638554121848639
Energy: 0.94325263550477
Energy: 0.943169106620887
Energy: 0.9432526355002416
Energy: 1.1718900806026509
Energy: 0.9377202169501668
Energy: 1.0518418560295506
Energy: 0.9377202170167374
Energy: 1.1043366146332796
Energy: 0.9229368785987555
Energy: 1.1725145221869475
Energy: 0.9229368786065181
Energy: 1.009725681259531
Energy: 0.9195323933962989
Energy: 1.173609705805348
Energy: 0.919532393407296
Energy: 1.0078502475620104
Energy: 0.9226388229594076
Energy: 1.0781185218515228
Energy: 0.9226388229568201
Energy: 0.9982219802507544
Energy: 0.9196424253055336
Energy: 0.98139192311397
Energy: 0.9196424253061805
Energy: 1.1295169614704845
Energy: 0.9235109874220575
Energy: 1.0875671181451598
Energy: 0.9235109874233514
Energy: 1.1190025777771495
Energy: 1.0105112389634516
Energy: 1.0234561273487126
Energy: 1.010511238965392
Energy: 1.1192755022960486
Energy: 1.0737125802524925
Energy: 1.0699073951211155
Energy: 1.0737125802499052
Energy: 1.0726501720424608
Energy: 0.9909141923408272
Energy: 0.9882794291306434
Energy: 0.9909141923440615
Energy: 1.0608604361403062
Energy: 0.9657322581605859
Energy: 0.9672203856544762
Energy: 0.9657322581592922
Energy: 1.1597581533459536
Energy: 0.9661119842551522
Energy: 0.9709023319788368
Energy: 0.9661119842473896
Energy: 1.1318182001630648
Energy: 0.9718260257431557
Energy: 0.9879601259860052
Energy: 0.9718260257399212
Energy: 1.166534927600402
Energy: 1.0414725228238813
Energy: 1.0566970265538254
Energy: 1.0414725228277624
Energy: 0.9365221964668728
Energy: 0.9350558511387786
Energy: 1.2744494267069981
Energy: 0.9350558511510694
Energy: 0.9326648005617331
Energy: 0.9302816256842233
Energy: 1.0649839487753752
Energy: 0.9302816256855171
Energy: 0.9346844222631114
Energy: 0.9332295323872221
Energy: 1.0365754633308095
Energy: 0.9332295323891627
Energy: 1.0064549046028146
Energy: 0.9315728812640838
Energy: 1.1679263290941815
Energy: 0.9315728812595555
Energy: 1.1692205335572885
Energy: 0.9819332732718863
Energy: 1.079316952412541
Energy: 0.9819332732744739
Energy: 1.1734305449543887
Energy: 0.9612345866674555
Energy: 0.9705075108967746
Energy: 0.9612345866693962
Energy: 1.1342783859180454
Energy: 0.9612801214895558
Energy: 0.9709758081012241
Energy: 0.9612801214863215
Energy: 0.9721751961348822
Energy: 0.9584559478230937
Energy: 0.9588357013256661
Energy: 0.9584559478224469

minimum gb energy = 0.9195323933962989 eV
minimum distance =  2.41457846470116 Angstroms
sigma value = 1


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

Energy: 1.4766088936662654
Energy: 0.8639209536976143
Energy: 1.0853361382638123
Energy: 0.904604034415131
Energy: 0.9313522738066997
Energy: 0.9088400186427592
Energy: 1.105957180576754
Energy: 0.9088400186409703
Energy: 1.1070378798205467
Energy: 1.0154739386072278
Energy: 1.1053629438337307
Energy: 1.015473938609911
Energy: 0.9342550193729122
Energy: 0.9084592184377109
Energy: 1.0863661707781647
Energy: 0.9084592184386053
Energy: 1.0827343480705174
Energy: 0.901762313798513
Energy: 1.0976918361721455
Energy: 0.9017623138020906
Energy: 0.9022569176380323
Energy: 0.901632834912292
Energy: 1.0988435955899556
Energy: 0.901632834912292
Energy: 0.9019637564764291
Energy: 0.9031203753571548
Energy: 1.1604786508801825
Energy: 0.9031203753616269
Energy: 0.9227561344173337
Energy: 0.9091631867194642
Energy: 1.2281152063311644
Energy: 0.9091631867266197
Energy: 1.112384607978044
Energy: 0.9402663128046228
Energy: 1.2266866584410254
Energy: 0.9402663128046228
Energy: 1.0971011430168305
Energy: 0.9111348392237624
Energy: 0.9297498350576584
Energy: 0.9111348392237624
Energy: 1.0847689580848345
Energy: 0.902411166538806
Energy: 0.9001857644178665
Energy: 0.9024111665423838
Energy: 1.2227587282547843
Energy: 0.9192031771729762
Energy: 0.9049193516965088
Energy: 0.9192031771809852
Energy: 1.2225701960315114
Energy: 0.9023984464265868
Energy: 0.9016015043359201
Energy: 0.9023984464256926
Energy: 1.1598987137872034
Energy: 0.906464702372809
Energy: 1.1023159143418648
Energy: 0.9064647023683369
Energy: 0.9389698635635703
Energy: 1.0141537081295033
Energy: 1.104105413464311
Energy: 1.0141537081348697
Energy: 0.9318233630704444
Energy: 0.9068255022093081
Energy: 1.1171969523904313
Energy: 0.9068255022075192
Energy: 0.9063769454847079
Energy: 0.9024214081337325
Energy: 1.1000659335297789
Energy: 0.9024214081364159
Energy: 0.9242993903634262
Energy: 0.9115831884459622
Energy: 1.1094509717722725
Energy: 0.911583188447751
Energy: 0.9014152355979737
Energy: 0.9026570404345722
Energy: 1.2389418008736157
Energy: 0.9026570404354666
Energy: 0.9102834363822201
Energy: 0.9078249867849397
Energy: 1.2273846790260412
Energy: 0.9078249867849397
Energy: 1.0970999285022454
Energy: 0.9391173300825136
Energy: 1.1159124221813224
Energy: 0.9391173300798303
Energy: 1.0986895365407694
Energy: 0.9074130015211168
Energy: 0.9160912014941949
Energy: 0.9074130015211168
Energy: 1.1598693127494366
Energy: 0.9020965100594527
Energy: 0.9052315996941449
Energy: 0.9020965100648192
Energy: 1.2233183284219877
Energy: 0.9027310107622966
Energy: 0.9020044836533546
Energy: 0.902731010758719

minimum gb energy = 0.8639209536976143 eV
minimum distance =  2.41886521967888 Angstroms
sigma value = 17


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

Energy: 1.6013812235239702
Energy: 0.8798482809704442
Energy: 1.098703746079904
Energy: 0.9074433761288871
Energy: 0.9321836806535997
Energy: 0.9057953297713888
Energy: 1.0335754376756252
Energy: 0.9057953297713888
Energy: 1.116091926292139
Energy: 0.902361167335273
Energy: 1.030139487166556
Energy: 0.9023611673336649
Energy: 1.130536944198793
Energy: 0.9556015128649501
Energy: 1.017153724887671
Energy: 0.9556015128665584
Energy: 0.9961219644503979
Energy: 0.8806558410657251
Energy: 1.1255455334215216
Energy: 0.8806558410657251
Energy: 0.8807179799835948
Energy: 0.8810025705530111
Energy: 1.1492191947034673
Energy: 0.8810025705513025
Energy: 0.8840677007107206
Energy: 0.8803899132798811
Energy: 0.9287063984948063
Energy: 0.880389913279278
Energy: 0.8909877721331063
Energy: 0.8842609083580283
Energy: 1.138349826839984
Energy: 0.8842609083618479
Energy: 1.1384248389564637
Energy: 0.8848876496160141
Energy: 1.1146654798373874
Energy: 0.8848876496144058
Energy: 1.0608777859183103
Energy: 0.9605087515899524
Energy: 1.04153317112881
Energy: 0.9605087515926662
Energy: 1.133019139758372
Energy: 0.9034493019825922
Energy: 0.9227628155043616
Energy: 0.9034493019792753
Energy: 1.1444879804214507
Energy: 0.9118512903077836
Energy: 1.0194017496863335
Energy: 0.9118512903088892
Energy: 1.1478179482663131
Energy: 0.9025909602006397
Energy: 0.9029402189734808
Energy: 0.9025909602022479
Energy: 1.0359994208875476
Energy: 0.9030192246143262
Energy: 0.9070016579431771
Energy: 0.9030192246165374
Energy: 1.1248102535142523
Energy: 0.9045215153227779
Energy: 0.9119136433371577
Energy: 0.9045215153210691
Energy: 1.139393943798807
Energy: 0.9264915532987587
Energy: 1.040252366121062
Energy: 0.9264915533047895
Energy: 0.9023911644723643
Energy: 0.9110596855075246
Energy: 1.1281810774936631
Energy: 0.9110596855069214
Energy: 0.9042810153593026
Energy: 0.9018344919551704
Energy: 1.137773202158298
Energy: 0.9018344919551704
Energy: 0.9384239326061337
Energy: 0.9110751994976466
Energy: 1.111028067305572
Energy: 0.9110751994981492
Energy: 0.9047289346128877
Energy: 0.9023420369448124
Energy: 1.1382030524284559
Energy: 0.9023420369420987
Energy: 1.0286920484102373
Energy: 0.9043935580287695
Energy: 0.9031896022974489
Energy: 0.9043935580298751
Energy: 1.0298759578410253
Energy: 0.9021240256554225
Energy: 1.1191867651002367
Energy: 0.9021240256543167
Energy: 0.9283755231275095
Energy: 0.9532159747105002
Energy: 1.1240943479739554
Energy: 0.9532159747105002
Energy: 1.171481616965542
Energy: 0.882122095025677
Energy: 0.9957027773449062
Energy: 0.8821220950245712
Energy: 1.1254382352462349
Energy: 0.8802304001352985
Energy: 0.8791434078807125
Energy: 0.8802304001352985
Energy: 0.9311113016397843
Energy: 0.8816761743840832
Energy: 0.8884484827390017
Energy: 0.8816761743807663
Energy: 1.1382927302861034
Energy: 0.8816336275775659
Energy: 0.8814160423101303
Energy: 0.8816336275748521
Energy: 1.1106365238430809
Energy: 0.8826228654863975
Energy: 1.1453799957862096
Energy: 0.8826228654870004
Energy: 1.0355079231382662
Energy: 0.9564132493302312
Energy: 1.0570161057859568
Energy: 0.9564132493269143
Energy: 0.9246817005166769
Energy: 0.9031156710061927
Energy: 1.1294432673203922
Energy: 0.9031156710012677
Energy: 1.0175045206958493
Energy: 0.902961739441693
Energy: 1.1452881343539618
Energy: 0.9029617394438038
Energy: 0.901858439943888
Energy: 0.9031704560832777
Energy: 1.1473340740330822
Energy: 0.9031704560821721
Energy: 0.9035817443573142
Energy: 0.9023722192287045
Energy: 1.0374728740511867
Energy: 0.9023722192275989
Energy: 0.9280351749429836
Energy: 0.9068707239203267
Energy: 1.1275235547887184
Energy: 0.9068707239231413
Energy: 1.0409709186234732
Energy: 0.9245685117974999
Energy: 1.1383562095334554
Energy: 0.9245685117974999
Energy: 1.14093696477708
Energy: 0.9132732011106387
Energy: 0.9284362778104477
Energy: 0.9132732011123473
Energy: 1.1333436776199537
Energy: 0.9021227888762684
Energy: 0.9029916269565589
Energy: 0.9021227888740571
Energy: 1.1158827182279403
Energy: 0.9114041508995382
Energy: 0.9057844316691293
Energy: 0.911404150900644

minimum gb energy = 0.8791434078807125 eV
minimum distance =  2.41472062833068 Angstroms
sigma value = 89


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

Energy: 1.7091897709001191
Energy: 0.8694806989522859
Energy: 0.8185456165429135
Energy: 0.8196149426478023
Energy: 0.8175484145053621
Energy: 0.9025774662508859
Energy: 0.8153952810442696
Energy: 0.9025774662508859
Energy: 0.8082905588860467
Energy: 0.9043258823448895
Energy: 0.8468627411217197
Energy: 0.9043258823260852
Energy: 0.8117244318048037
Energy: 0.9094357308320637
Energy: 0.8181724838514445
Energy: 0.9094357308335101
Energy: 0.8176450306155916
Energy: 0.8167283907005619
Energy: 0.839577686507875
Energy: 0.8167283907005619
Energy: 0.8175813546186346
Energy: 0.8163576897257669
Energy: 0.8397883017173037
Energy: 0.8163576897243205
Energy: 0.8170555966114216
Energy: 0.8168531663637172
Energy: 0.8188679966498731
Energy: 0.8168531663622708
Energy: 0.8156258015290955
Energy: 0.8209849348284177
Energy: 0.8081508144606497
Energy: 0.8209849348298642
Energy: 0.8199382169185272
Energy: 0.8177460085035111
Energy: 0.8082276381541738
Energy: 0.8177460085020646
Energy: 0.8463801474590198
Energy: 0.9131573939141946
Energy: 0.820515146827709
Energy: 0.9131573939141946
Energy: 0.8204036921910505
Energy: 0.889232775190031
Energy: 0.8081966860565105
Energy: 0.889232775190031
Energy: 0.839187207064845
Energy: 0.8157627160527382
Energy: 0.8200878427401266
Energy: 0.8157627160527382
Energy: 0.8394384153759551
Energy: 0.8193526205967212
Energy: 0.8395660728952297
Energy: 0.8193526205967212
Energy: 0.8180048879936314
Energy: 0.8164423714337495
Energy: 0.81709918937642
Energy: 0.8164423714337495
Energy: 0.8084949518842895
Energy: 0.8179961361319894
Energy: 0.8194702817167608
Energy: 0.8179961361319894

minimum gb energy = 0.8081508144606497 eV
minimum distance =  2.4525516192114 Angstroms
sigma value = 13


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

Energy: 1.6020461603542182
Energy: 0.8011132727105342
Energy: 1.0377092361588234
Energy: 0.808323086815716
Energy: 0.8665237005707549
Energy: 0.8042892541579686
Energy: 0.9438660613899694
Energy: 0.8042892541640314
Energy: 0.9497273765053541
Energy: 0.80293283228792
Energy: 0.9582229411318602
Energy: 0.802932832294589
Energy: 1.0233899291224193
Energy: 0.8056782672379466
Energy: 0.9369091839112573
Energy: 0.8056782672464343
Energy: 1.0781860461146535
Energy: 0.9311038242637739
Energy: 0.8935073322247351
Energy: 0.9311038242607427
Energy: 0.957809630021418
Energy: 0.8064211896721707
Energy: 0.8934595149495179
Energy: 0.8064211896703518
Energy: 0.9556329360112511
Energy: 0.8064000079018127
Energy: 0.9323713726014641
Energy: 0.8064000078951438
Energy: 0.9111126293319667
Energy: 0.8095956746831177
Energy: 0.9837603390625778
Energy: 0.8095956746819051
Energy: 0.8057227202808178
Energy: 0.8139464553510606
Energy: 0.9021267678025815
Energy: 0.8139464553413602
Energy: 0.8109946907643107
Energy: 0.8055145337400949
Energy: 1.0786315890590799
Energy: 0.8055145337370635
Energy: 0.8089694304092873
Energy: 0.8073281471983573
Energy: 1.6026011993299525
Energy: 0.8073281471486429
Energy: 0.8315891269480223
Energy: 0.80517055466634
Energy: 1.080962057676924
Energy: 0.805170554670584
Energy: 0.8333137073852868
Energy: 0.9278843370778005
Energy: 0.948271136789195
Energy: 0.9278843370771943
Energy: 1.0191529087287088
Energy: 0.9272704365146591
Energy: 1.0203749361263263
Energy: 0.9272704365116828
Energy: 0.9841684111358051
Energy: 0.7887850648308615
Energy: 0.9322721921993741
Energy: 0.7887850648308615
Energy: 0.9836033348382957
Energy: 0.7867390402614709
Energy: 0.8669607810862412
Energy: 0.7867390402541957
Energy: 1.084974333882457
Energy: 0.7853247299220162
Energy: 0.8635104265274275
Energy: 0.7853247299208037
Energy: 0.8370488745219534
Energy: 0.7879574940897917
Energy: 0.85522732433493
Energy: 0.7879574940976731
Energy: 1.040800385253357
Energy: 0.7901740288505719
Energy: 0.9785981593743432
Energy: 0.7901740288463279
Energy: 0.8065720490550595
Energy: 0.7865382927508814
Energy: 1.0205521121747503
Energy: 0.7865382927527003
Energy: 1.2159211816918813
Energy: 0.7868878470878157
Energy: 0.9824815118547918
Energy: 0.7868878470702337
Energy: 0.8064764105486945
Energy: 0.930139259384211
Energy: 0.8929888665646406
Energy: 0.9301392593890613
Energy: 0.8257998778773687
Energy: 0.8063147374775814
Energy: 0.8934626009503702
Energy: 0.8063147374794003
Energy: 0.8859670330408894
Energy: 0.9158385922258899
Energy: 0.9370686339109009
Energy: 0.9158385922277088
Energy: 0.8815422258993637
Energy: 0.8057604365100689
Energy: 0.9838675437908062
Energy: 0.80576043650825
Energy: 0.806699508210299
Energy: 0.8061347689417901
Energy: 0.9839653680182596
Energy: 0.8061347689369399
Energy: 0.8053620760185837
Energy: 0.8044714747740668
Energy: 0.9377741582999827
Energy: 0.8044714747764918
Energy: 0.8295656084247963
Energy: 0.8138959822910086
Energy: 0.9711663049735211
Energy: 0.8138959822982837
Energy: 0.9310306940796322
Energy: 0.8097812470569997
Energy: 1.035582479543364
Energy: 0.809781247053362
Energy: 1.042027791004365
Energy: 0.8536585306900069
Energy: 1.0673097254999124
Energy: 0.8536585306918256
Energy: 1.0705550808584794
Energy: 0.8481246641390217
Energy: 1.2162296873816119
Energy: 0.8481246641426593
Energy: 0.9842177821355622
Energy: 0.8035317273341449
Energy: 1.0662281909965003
Energy: 0.8035317273341449
Energy: 0.983942451660184
Energy: 0.8057964780848235
Energy: 0.8138430044071461
Energy: 0.8057964780872485
Energy: 1.0739209449078058
Energy: 0.8016776298165499
Energy: 0.8017133245184157
Energy: 0.8016776298135185
Energy: 1.0191325877398738
Energy: 0.8024811349589787
Energy: 0.8098131607940682
Energy: 0.8024811349650415

minimum gb energy = 0.7853247299208037 eV
minimum distance =  2.44209308029955 Angstroms
sigma value = 37


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

Energy: 1.4623867063221352
Energy: 0.7482439404301835
Energy: 0.7606733256662432
Energy: 0.7610720022287285
Energy: 1.0740277200284387
Energy: 0.7608622244278187
Energy: 0.9955914836678507
Energy: 0.7608622244267756
Energy: 1.0742616325747874
Energy: 0.7612038640133807
Energy: 0.9881574755413068
Energy: 0.7612038640154669
Energy: 1.0744783050933202
Energy: 0.8514751543697614
Energy: 0.9629053569809727
Energy: 0.8514751543687183
Energy: 1.1885603300109506
Energy: 0.7345405259433776
Energy: 1.0850050505867341
Energy: 0.7345405259444207
Energy: 0.8704608037774988
Energy: 0.7343630090197376
Energy: 0.8484664300663123
Energy: 0.7343630090155653
Energy: 0.8688998694132343
Energy: 0.740115028700115
Energy: 1.1736364742854177
Energy: 0.7401150287032444
Energy: 0.9605013465748705
Energy: 0.7294299114570892
Energy: 0.8534786347539143
Energy: 0.7294299114560462
Energy: 0.8466632521447313
Energy: 0.7361012373437807
Energy: 1.090738669418027
Energy: 0.7361012373448239
Energy: 0.8454804463515336
Energy: 0.7281984148530046
Energy: 1.168364821741814
Energy: 0.7281984148530046
Energy: 0.8884728234936533
Energy: 0.8879077617664866
Energy: 1.2819748045619122
Energy: 0.8879077617675295
Energy: 1.0675319736913502
Energy: 0.7278632453578092
Energy: 0.9641322738487755
Energy: 0.7278632453567662
Energy: 1.0651497419454103
Energy: 0.7283848166636008
Energy: 1.0740219760438772
Energy: 0.7283848166625577
Energy: 1.1890643115919368
Energy: 0.812658808298426
Energy: 1.074655466051728
Energy: 0.8126588082994691
Energy: 1.0850050505867341
Energy: 0.8124866171576953
Energy: 1.1737362542972634
Energy: 0.8124866171566522
Energy: 0.8484664300642261
Energy: 0.8117959604734872
Energy: 0.8555862658144795
Energy: 0.8117959604745304
Energy: 1.1892588491211855
Energy: 0.8108008747638303
Energy: 0.8689243468619163
Energy: 0.8108008747638303
Energy: 0.8534785269273562
Energy: 0.7701275669126142
Energy: 0.7292050643941783
Energy: 0.7701275669126142
Energy: 1.0907386694065533
Energy: 0.7626147397333527
Energy: 0.7606470753341305
Energy: 0.7626147397343959
Energy: 1.0817530057995965
Energy: 0.7626961066194479
Energy: 0.7739031388849472
Energy: 0.7626961066194479

minimum gb energy = 0.7278632453567662 eV
minimum distance =  2.45014937044064 Angstroms
sigma value = 25


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

Energy: 1.5770963880130704
Energy: 0.6845155567763747
Energy: 0.9412325851228113
Energy: 0.6727813658343713
Energy: 1.0477275438033729
Energy: 0.6719244511992031
Energy: 0.8563364096467895
Energy: 0.6719244512008321
Energy: 1.3582815717601309
Energy: 0.6716299593058326
Energy: 0.8612276715003204
Energy: 0.671629959305018
Energy: 1.0727279935457856
Energy: 0.6731326725472939
Energy: 1.0610368630005218
Energy: 0.6731326725481084
Energy: 1.061737098062864
Energy: 0.7424725223201886
Energy: 1.200005387568084
Energy: 0.7424725223193741
Energy: 1.037257960168092
Energy: 0.7398180518454298
Energy: 1.2025787247537914
Energy: 0.7398180518454298
Energy: 1.0430406225459345
Energy: 0.741638729724868
Energy: 1.0624962349552212
Energy: 0.7416387297240535
Energy: 1.0611924800485892
Energy: 0.6729582852486078
Energy: 1.1966759379815737
Energy: 0.6729582852486078
Energy: 0.8605974433265183
Energy: 0.6719064407466352
Energy: 1.2000430507692605
Energy: 0.6719064407458206
Energy: 0.8628713503409245
Energy: 0.6718319243479358
Energy: 1.2009791171972255
Energy: 0.6718319243471214
Energy: 0.6738002896123516
Energy: 0.6764217655181519
Energy: 1.3263413404737645
Energy: 0.6764217655132649
Energy: 0.679347931693112
Energy: 0.6731852691219458
Energy: 1.2014475729093317
Energy: 0.6731852691235747
Energy: 0.6759856869285656
Energy: 0.6721593665812922
Energy: 1.0431101880857592
Energy: 0.6721593665812922
Energy: 0.8560743971742707
Energy: 0.6768892868161751
Energy: 1.3497164637516805
Energy: 0.6768892868169897
Energy: 0.8608258479471521
Energy: 0.6716225843507265
Energy: 1.0649054415943093
Energy: 0.6716225843523556
Energy: 0.86402228589498
Energy: 0.6722981981078286
Energy: 1.351150092114191
Energy: 0.6722981981078286
Energy: 1.0646698230856588
Energy: 0.6721928180425137
Energy: 1.3512857423101645
Energy: 0.6721928180416993
Energy: 0.8586125557841876
Energy: 0.7446659375718421
Energy: 1.0624498537645677
Energy: 0.7446659375734711
Energy: 1.1993692820112192
Energy: 0.7405179870835418
Energy: 1.0410962224034976
Energy: 0.7405179870827273
Energy: 1.2009410512269945
Energy: 0.7399097761725785
Energy: 1.0381336107150327
Energy: 0.7399097761733929
Energy: 1.3280231610825557
Energy: 0.6725565546922705
Energy: 0.855683100357604
Energy: 0.6725565546922705
Energy: 1.2013805281367502
Energy: 0.6711560568363132
Energy: 0.6728483767579184
Energy: 0.6711560568371276
Energy: 1.196824240565964
Energy: 0.6735289989037955
Energy: 0.8558148067707988
Energy: 0.6735289989046099
Energy: 1.1959617376662608
Energy: 0.6727116523578952
Energy: 0.6737147170742979
Energy: 0.6727116523578952
Energy: 1.064589790336836
Energy: 0.6722264548281357
Energy: 0.6729528277331421
Energy: 0.6722264548281357
Energy: 1.3492192559630907
Energy: 0.6739071396201752
Energy: 0.6812084754563835
Energy: 0.6739071396193979

minimum gb energy = 0.6711560568363132 eV
minimum distance =  2.46841035299683 Angstroms
sigma value = 41


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

Energy: 1.7702069381841041
Energy: 0.642813858756299
Energy: 0.9087421730619029
Energy: 0.6287038442412416
Energy: 1.212542527080631
Energy: 0.6249787299789251
Energy: 0.7795463644335644
Energy: 0.6249787299789251
Energy: 1.2094824297800897
Energy: 0.6236557011839651
Energy: 0.7837497479238833
Energy: 0.6236557011853004
Energy: 1.2081271620640854
Energy: 0.6267814096346738
Energy: 0.9618351624972424
Energy: 0.6267814096353416
Energy: 1.2228332299038005
Energy: 0.6246245366497122
Energy: 1.0790070762450443
Energy: 0.6246245366550541
Energy: 1.2135483422455562
Energy: 0.774911500178686
Energy: 1.0750516827709216
Energy: 0.774911500176015
Energy: 1.219368555265554
Energy: 0.7774948185941094
Energy: 1.222990275255847
Energy: 0.7774948185901028
Energy: 1.0756188351720466
Energy: 0.6813238306069017
Energy: 1.0803154816733116
Energy: 0.6813238306977168
Energy: 0.9353872640047717
Energy: 0.6238267555713171
Energy: 1.347118183220105
Energy: 0.6238267555733203
Energy: 0.9353100607524065
Energy: 0.6243016983470407
Energy: 1.2245154252674328
Energy: 0.6243016983470407
Energy: 0.7801471284934361
Energy: 0.6270945058257742
Energy: 1.2200712720239089
Energy: 0.627094505823771
Energy: 0.7821222970909689
Energy: 0.62315977924464
Energy: 1.2260982423856839
Energy: 0.6231597792473111
Energy: 0.7812279780530698
Energy: 0.6263142688125867
Energy: 1.3435079588174794
Energy: 0.6263142688132545
Energy: 0.6247258596411935
Energy: 0.6270805398737926
Energy: 1.2194517697568392
Energy: 0.6270805398737926
Energy: 0.6247747154841967
Energy: 0.6243724894703078
Energy: 1.2221018271585358
Energy: 0.6243724894716433
Energy: 0.6343608941446539
Energy: 0.6259788635554642
Energy: 1.208549927543182
Energy: 0.6259788635554642
Energy: 0.7791811373604837
Energy: 0.628188845734253
Energy: 1.2081674582256394
Energy: 0.6281888457349207
Energy: 0.7867565270217237
Energy: 0.6242130238751983
Energy: 1.2210444263916762
Energy: 0.6242130238765338
Energy: 0.7835789119293478
Energy: 0.6250372579294493
Energy: 1.2168502837151298
Energy: 0.6250372579307848
Energy: 1.0774985481771402
Energy: 0.6287775094232809
Energy: 1.212793511811525
Energy: 0.6287775094252843
Energy: 1.0908913990310756
Energy: 0.6253933403438512
Energy: 1.2234333082450046
Energy: 0.6253933403378414
Energy: 1.078730683146434
Energy: 0.6259508681800064
Energy: 1.2228603949835082
Energy: 0.6259508681826775
Energy: 1.347437435679583
Energy: 0.8850004088531795
Energy: 1.2105926843840316
Energy: 0.8850004088531795
Energy: 1.0821772746874572
Energy: 0.775561092869146
Energy: 1.0802746350386183
Energy: 0.775561092869146
Energy: 1.225573937213053
Energy: 0.6247219178847864
Energy: 0.947178094690071
Energy: 0.6247219178861217
Energy: 1.3515712860544613
Energy: 0.6270587331199542
Energy: 1.0766232287279403
Energy: 0.6270587331159476
Energy: 1.2186641565575798
Energy: 0.6252925770422094
Energy: 0.8009155201154727
Energy: 0.6252925770415416
Energy: 1.2221451172096818
Energy: 0.6237219035636411
Energy: 0.7849696096645448
Energy: 0.6237219035616379
Energy: 1.2202319209358012
Energy: 0.6275516143413337
Energy: 0.7930551416627107
Energy: 0.6275516143440046
Energy: 1.3508080412594603
Energy: 0.6266792521259975
Energy: 0.6360903207097579
Energy: 0.6266792521259975
Energy: 1.2219307219861208
Energy: 0.6244281426905377
Energy: 0.6240004342546269
Energy: 0.6244281426912055
Energy: 1.2086499860587503
Energy: 0.6256856702762281
Energy: 0.6256768119318
Energy: 0.6256856702788992

minimum gb energy = 0.62315977924464 eV
minimum distance =  2.46998481836604 Angstroms
sigma value = 15


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

Energy: 1.5202920025366808
Energy: 0.6084765665249259
Energy: 0.880625936041442
Energy: 0.5934854311906322
Energy: 1.3352586421736725
Energy: 0.5870682964069157
Energy: 0.7311123114773105
Energy: 0.5870682964080473
Energy: 1.349877022256167
Energy: 0.589919390952807
Energy: 0.7256144354040419
Energy: 0.5899193909516757
Energy: 1.3323897108537401
Energy: 0.5871474345243627
Energy: 0.9913829287540384
Energy: 0.5871474345226656
Energy: 1.3464877429400737
Energy: 0.5927823099305065
Energy: 0.9800129694312129
Energy: 0.5927823099282437
Energy: 1.3415770259535194
Energy: 0.5925169417604638
Energy: 0.9780067378728854
Energy: 0.5925169417593323
Energy: 1.1015754953283168
Energy: 0.5905678853248428
Energy: 1.2213208312525963
Energy: 0.590567885329934
Energy: 1.2284208898894102
Energy: 0.6389860984583803
Energy: 0.9817746620275378
Energy: 0.6389860984583803
Energy: 1.0988454891539203
Energy: 0.8366795596810325
Energy: 1.2171586017779261
Energy: 0.8366795596804668
Energy: 1.0972677439882363
Energy: 0.8352062468385428
Energy: 1.4515885394250416
Energy: 0.8352062468391085
Energy: 0.9932012165669104
Energy: 0.585847444955025
Energy: 1.2149594991409902
Energy: 0.5858474449510653
Energy: 0.8578603829574764
Energy: 0.5927945921652359
Energy: 1.451455434604733
Energy: 0.5927945921720241
Energy: 0.9786335743293921
Energy: 0.593848386778182
Energy: 1.455678729812171
Energy: 0.5938483867753535
Energy: 0.734993911490063
Energy: 0.586958891129625
Energy: 1.2267338716004028
Energy: 0.5869588911284935
Energy: 0.7220610846704129
Energy: 0.5875441463384188
Energy: 1.3460267021904744
Energy: 0.5875441463406815
Energy: 0.727402052076032
Energy: 0.5871295330045483
Energy: 1.3462089128270736
Energy: 0.5871295330056796
Energy: 0.5994304338805014
Energy: 0.5888883038785144
Energy: 1.3379333366453963
Energy: 0.5888883038802115
Energy: 0.5861675709002998
Energy: 0.5847181023710083
Energy: 1.3446123694816001
Energy: 0.5847181023693627
Energy: 0.6025812666165062
Energy: 0.58839958396717
Energy: 1.343437273581851
Energy: 0.5883995839677355
Energy: 0.7295052202709954
Energy: 0.5874447162792041
Energy: 1.3328084661458175
Energy: 0.5874447162786385
Energy: 0.7209248369569695
Energy: 0.5854425728107624
Energy: 1.3452683825471132
Energy: 0.585442572811328
Energy: 0.733266990998414
Energy: 0.5875294928481684
Energy: 1.3494490839182807
Energy: 0.5875294928521282
Energy: 0.9793626247982594
Energy: 0.5946772451387231
Energy: 1.3382280665131483
Energy: 0.5946772451415514
Energy: 0.9802081790902002
Energy: 0.5850464247811034
Energy: 1.3461400771519347
Energy: 0.5850464247873258
Energy: 0.9891516973151208
Energy: 0.5864898659008362
Energy: 1.1063128872795591
Energy: 0.5864898658991392
Energy: 1.2206832213744134
Energy: 0.8345150718346838
Energy: 1.349727622426684
Energy: 0.8345150718346838
Energy: 0.9771570714506339
Energy: 0.8317207542692554
Energy: 1.217998427365999
Energy: 0.8317207542652955
Energy: 1.2266483560556132
Energy: 0.6384960910351063
Energy: 1.1113154111262982
Energy: 0.6384960910345405
Energy: 1.222920099640842
Energy: 0.5883976976858554
Energy: 1.2182819661361144
Energy: 0.5883976976869867
Energy: 1.2188816236249373
Energy: 0.5898060758741321
Energy: 0.9783175592423573
Energy: 0.5898060758809203
Energy: 1.3445585120080683
Energy: 0.5923607871365313
Energy: 0.8577093978867455
Energy: 0.5923607871365313
Energy: 1.225956436790837
Energy: 0.5873185945322438
Energy: 0.9908269454682984
Energy: 0.5873185945339409
Energy: 1.3442427987977479
Energy: 0.5852650563188898
Energy: 0.7248150557309141
Energy: 0.5852650563200212
Energy: 1.3458480098135293
Energy: 0.5874978538277887
Energy: 0.7248516291349374
Energy: 0.5874978538243947
Energy: 1.3435204761570798
Energy: 0.5895074016459692
Energy: 0.6130020900967909
Energy: 0.5895074016561515
Energy: 1.3461109575178878
Energy: 0.5870676847608455
Energy: 0.5927519241821783
Energy: 0.5870676847602798
Energy: 1.3334314237505893
Energy: 0.5879270986909937
Energy: 0.5901579225658771
Energy: 0.5879270986938221

minimum gb energy = 0.5847181023693627 eV
minimum distance =  2.47470594619467 Angstroms
sigma value = 85


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

Energy: 1.6376542732024992
Energy: 0.5693499234124866
Energy: 0.5347066677341373
Energy: 0.5326489647074836
Energy: 1.404393169993494
Energy: 0.5324056793834357
Energy: 0.6620816400646048
Energy: 0.532405679384417
Energy: 1.4057818438998577
Energy: 0.5318089331665634
Energy: 0.6568705739396477
Energy: 0.5318089331685257
Energy: 1.1908908094187707
Energy: 0.5320425549015783
Energy: 0.8755727344785244
Energy: 0.5320425549010876
Energy: 1.4127889481074958
Energy: 0.5335043263480501
Energy: 0.8773400387194613
Energy: 0.5335043263490313
Energy: 1.1937889096062235
Energy: 0.5309902384600669
Energy: 0.8786577841400304
Energy: 0.5309902384576582
Energy: 1.1915233047029299
Energy: 0.5309109877880193
Energy: 1.0892717772115736
Energy: 0.5309109877894911
Energy: 1.3013351766147834
Energy: 0.5310098296253306
Energy: 0.8764350275451249
Energy: 0.5310098296321994
Energy: 1.1935533849771816
Energy: 0.5336420103982344
Energy: 1.0905922692887113
Energy: 0.5336420096238585
Energy: 1.1989646920470152
Energy: 0.7756585071603285
Energy: 1.300394538409815
Energy: 0.7756585071613098
Energy: 1.089168727664454
Energy: 0.6145281977543051
Energy: 1.0866523484350645
Energy: 0.6145281977547957
Energy: 0.9862393426994387
Energy: 0.5311593884190556
Energy: 1.3011356112070438
Energy: 0.5311593884180744
Energy: 1.0889001571971508
Energy: 0.5309549200124307
Energy: 1.2999235701041743
Energy: 0.5309549200148838
Energy: 0.8762595523363952
Energy: 0.5314675841834678
Energy: 1.085707303403605
Energy: 0.5314675841844491
Energy: 0.7632080571362033
Energy: 0.5312275102181295
Energy: 1.4118469795854733
Energy: 0.5312275102210732
Energy: 0.876136532743624
Energy: 0.5335731404903876
Energy: 1.2973123952569678
Energy: 0.5335731404903876
Energy: 0.6508187686996698
Energy: 0.5321913931539948
Energy: 1.297098755186679
Energy: 0.5321913931584104
Energy: 0.6484195938055201
Energy: 0.5312886482262777
Energy: 1.4114153413367894
Energy: 0.5312886482262777
Energy: 0.6503225036746504
Energy: 0.5342730384579631
Energy: 1.4060634411666841
Energy: 0.5342730384564912
Energy: 0.5314589213546869
Energy: 0.5350926465592019
Energy: 1.4067786013354207
Energy: 0.5350926465606737
Energy: 0.5335470836725208
Energy: 0.5315552990730856
Energy: 1.4119399455914947
Energy: 0.5315552990740668
Energy: 0.5316086880366133
Energy: 0.534514990177271
Energy: 1.4003256996654492
Energy: 0.534514990179724
Energy: 0.650599063792898
Energy: 0.5326288882583672
Energy: 1.4073877897844584
Energy: 0.5326288882573859
Energy: 0.6514435075744739
Energy: 0.531373075767493
Energy: 1.4137764832029478
Energy: 0.5313730757670024
Energy: 0.6508198158382292
Energy: 0.5336531008806324
Energy: 1.190848182893776
Energy: 0.5336531008816137
Energy: 0.8765569129195458
Energy: 0.5338671876587884
Energy: 1.4041964085182712
Energy: 0.533867187657807
Energy: 0.8759642222761858
Energy: 0.5310221387093353
Energy: 1.4052325293579315
Energy: 0.5310221387117884
Energy: 1.0138833871152144
Energy: 0.5314356831917135
Energy: 1.1916017747192635
Energy: 0.5314356831922041
Energy: 1.089084569958488
Energy: 0.531072443405661
Energy: 1.4127288417863357
Energy: 0.531072443405661
Energy: 1.0898486726470025
Energy: 0.5322858522512454
Energy: 1.1936523135307344
Energy: 0.5322858522566422
Energy: 1.3054204850688012
Energy: 0.6148855795607047
Energy: 0.9825930913229326
Energy: 0.6148855795616859
Energy: 1.0867783865287401
Energy: 0.6147171001289583
Energy: 1.210996877428785
Energy: 0.6147171001289583
Energy: 1.3030520028955512
Energy: 0.5312734821453302
Energy: 0.9795278567527977
Energy: 0.5312734821468021
Energy: 1.4150848755416452
Energy: 0.5308842066654801
Energy: 0.9810822034615896
Energy: 0.530884206663027
Energy: 1.0861485421516215
Energy: 0.5334743212983337
Energy: 0.8768474304506628
Energy: 0.533474321299315
Energy: 1.413277815301311
Energy: 0.5312159729077074
Energy: 0.8765904939171478
Energy: 0.5312159729072167
Energy: 1.4088689382831017
Energy: 0.5328083960469675
Energy: 0.8773860070294583
Energy: 0.5328083960459862
Energy: 1.2971149577939074
Energy: 0.5333949030270461
Energy: 0.6509195644493726
Energy: 0.5333949030270461
Energy: 1.413235439617275
Energy: 0.5313919453933945
Energy: 0.6510496284526343
Energy: 0.5313919453924133
Energy: 1.407622454244241
Energy: 0.5330321406906781
Energy: 0.6502298529571897
Energy: 0.5330321406901876
Energy: 1.2967711326893836
Energy: 0.5335941099231808
Energy: 0.5319819736508675
Energy: 0.5335941099202371
Energy: 1.4118133917658964
Energy: 0.5318439497695059
Energy: 0.5327748401392908
Energy: 0.531843949770487
Energy: 1.4003992123929934
Energy: 0.5358753507244945
Energy: 0.5318670094919749
Energy: 0.5358753507249852

minimum gb energy = 0.530884206663027 eV
minimum distance =  2.48717814707934 Angstroms
sigma value = 113


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

Energy: 0.021458851183913632
Energy: 0.0231308457805742
Energy: 1.2339174958575818
Energy: 0.4372321527229317
Energy: 0.022976429659711865
Energy: 0.1308811150350408
Energy: 0.9211797637800355
Energy: 0.13088111503835145
Energy: 0.022899585699367012
Energy: 0.1296620087510694
Energy: 0.9197237737309062
Energy: 0.12966200875622394
Energy: 0.024851505142059794
Energy: 0.1293082550933773
Energy: 0.9181360351295714
Energy: 0.12930825509300012
Energy: 0.919214868800733
Energy: 0.12924852075776416
Energy: 0.9182749980712832
Energy: 0.129248520757387
Energy: 0.02272858437035545
Energy: 0.12898278839215652
Energy: 0.9194947670712856
Energy: 0.12898278839655675

minimum gb energy = 0.021458851183913632 eV
minimum distance =  2.73837749640513 Angstroms
sigma value = 1