Model name: model_name=EAM_Dynamo_MendelevKramerBecker_2008_Cu__MO_945691923444_005
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=3.639087498188019
cohesive_energy=3.283374415420919
mass=63.546
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=[1.6525650891392998e-19, 2.0798976409597799e-19, 2.4851361769973997e-19, 2.83413831318162e-19, 3.1394971578556796e-19, 3.3924007395325803e-19, 3.60683606022714e-19, 3.8026060231356e-19, 3.9913904959198197e-19, 4.17573693942786e-19, 4.35237691332636e-19, 4.51512601580808e-19, 4.65839265042036e-19, 4.77964537808148e-19, 4.88035820129472e-19, 4.96532162819574e-19, 5.03874938333196e-19, 5.1016187944501195e-19, 5.1534812520927e-19, 5.19412847329728e-19, 5.224121219885759e-19, 5.2444848849039e-19, 5.256292926696479e-19, 5.260138150618079e-19, 5.25630894846282e-19, 5.24353960068984e-19, 5.21713572976152e-19, 5.1724029581402395e-19, 5.105624236035119e-19, 5.01306649188894e-19, 4.89117289357422e-19, 4.737187697280479e-19, 4.5501015317283e-19, 4.3304591369732395e-19, 4.0780842735855595e-19, 3.7909101337073997e-19, 3.46437051393186e-19, 3.0905186181543e-19, 2.65805910110502e-19, 2.15071384818258e-19, 1.5442339160313898e-19, 8.140178824363799e-20, -7.5836627705439e-21, -1.21445789945517e-19, -2.80119756158658e-19, -5.28636578211666e-19, -9.752625410587739e-19, -1.88686740009546e-18, -3.8359312971228e-18, -7.8321603664773e-18, -1.6872361914990598e-17, -4.06621214472762e-17, -1.182105146684808e-16, -4.6718669559123e-16]
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: 0.012495483893235782
Energy: 0.012693806417624177
Energy: 0.717234772930913
Energy: 0.10667119698671283
Energy: 0.012693806417624177
Energy: 1.0120400965584047
Energy: 0.1066711969860939
Energy: 1.0120400965590237
Energy: 0.7172347729278871
Energy: 0.10667119698729739
Energy: 0.012495483892032287
Energy: 0.012693806417624177
Energy: 0.10667119698550934
Energy: 1.0120400965541752
Energy: 0.012693806417039618
Energy: 1.01204009655053

minimum gb energy = 0.012495483892032287 eV
minimum distance =  2.54997228707432 Angstroms
sigma value = 1


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

Energy: 1.2987541264168254
Energy: 0.8066568411035951
Energy: 0.8463213709643119
Energy: 0.8452856838300432
Energy: 0.8491262195434961
Energy: 0.8918486613188302
Energy: 0.8261709831976355
Energy: 0.8918486613195808
Energy: 0.8445772387929611
Energy: 0.8455415338178995
Energy: 1.4156468879549704
Energy: 0.8455415338201516
Energy: 0.8293988684857232
Energy: 0.826281002305545
Energy: 0.8264027891219333
Energy: 0.8262810023062958
Energy: 1.2030222937651893
Energy: 0.8260780922483866
Energy: 0.8259897734838951
Energy: 0.8260780922491372
Energy: 0.8845889259971157
Energy: 0.9340130087336728
Energy: 0.8265969978350073
Energy: 0.9340130087336728
Energy: 0.8851728952824124
Energy: 0.9323989202102413
Energy: 1.2021959109550253
Energy: 0.9323989202102413
Energy: 0.882277599313789
Energy: 0.8303146342924144
Energy: 0.9079736425380737
Energy: 0.8303146342939155
Energy: 1.028435917479945
Energy: 1.0088445271094861
Energy: 0.9061742777397763
Energy: 1.0088445271109874
Energy: 0.9071829363759707
Energy: 0.9760342655287961
Energy: 0.9056730366350426
Energy: 0.9760342655287961
Energy: 0.9043175076329756
Energy: 1.0105603478632037
Energy: 1.0287059665597313
Energy: 1.010560347862453
Energy: 0.8824677054231803
Energy: 1.0090494351793464
Energy: 0.9074372327016088
Energy: 1.0090494351785957
Energy: 0.9005833656466952
Energy: 0.9324636028956762
Energy: 0.9042838541026463
Energy: 0.9324636028934242
Energy: 0.8849094286153749
Energy: 0.9332105402435521
Energy: 0.8796841636408168
Energy: 0.9332105402450535
Energy: 0.8512324981732315
Energy: 0.8259202947007604
Energy: 0.8265354887907516
Energy: 0.8259202947015111
Energy: 0.8554868939263841
Energy: 0.8263872036305057
Energy: 0.8264670417653035
Energy: 0.8263872036312564
Energy: 0.844779138446201
Energy: 0.8442237738605006
Energy: 0.8047608438566195
Energy: 0.8442237738612514
Energy: 0.8265169982931738
Energy: 0.8305309985698369
Energy: 0.849630776625104
Energy: 0.8305309985720889
Energy: 0.8257590706552713
Energy: 0.8463092946211048
Energy: 0.8456242298177508
Energy: 0.8463092946188527
Energy: 0.8960713646671901
Energy: 0.830356833574636
Energy: 0.8464786653606116
Energy: 0.8303568335753867
Energy: 0.8269187010024914
Energy: 0.8264927751040315
Energy: 0.9042096102158961
Energy: 0.8264927751047821
Energy: 0.8269955176502967
Energy: 0.8272442041316066
Energy: 0.8846239207241725
Energy: 0.827244204130856
Energy: 0.8827736630191989
Energy: 0.932565826999448
Energy: 0.8840234303650043
Energy: 0.9325658270017
Energy: 0.9083384992491149
Energy: 0.9323753459153157
Energy: 0.8846005243483113
Energy: 0.9323753459160665
Energy: 0.9060654781998874
Energy: 1.0091015562710652
Energy: 1.0284787199198733
Energy: 1.0091015562710652
Energy: 0.9071106284480721
Energy: 1.008607119951365
Energy: 0.9084545423969684
Energy: 1.008607119951365
Energy: 1.0293146247661273
Energy: 1.008704799480982
Energy: 0.9045942814726358
Energy: 1.00870479947873
Energy: 0.9086821728034201
Energy: 1.0089697934331778
Energy: 0.9066457413810883
Energy: 1.0089697934331778
Energy: 0.9042092156855487
Energy: 0.932994341842006
Energy: 0.9002456638246406
Energy: 0.9329943418435074
Energy: 0.8799153442771015
Energy: 0.9326919695284525
Energy: 0.8849199627010286
Energy: 0.9326919695299537
Energy: 0.825784119656544
Energy: 0.8257373842921389
Energy: 0.8800766273027351
Energy: 0.8257373842921389
Energy: 0.8263077829798837
Energy: 0.8262482543693664
Energy: 0.8555088449191913
Energy: 0.8262482543693664
Energy: 0.8036708017638193
Energy: 0.843870669926794
Energy: 0.8445091685729659
Energy: 0.843870669926794

minimum gb energy = 0.8036708017638193 eV
minimum distance =  2.26872076901081 Angstroms
sigma value = 1


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

Energy: 1.4824354481578057
Energy: 0.8475098579554021
Energy: 0.8926749269099414
Energy: 0.8915490989858672
Energy: 0.9273662957079762
Energy: 0.9399541497077145
Energy: 0.8721249291910131
Energy: 0.9399541497128497
Energy: 0.8911524074407293
Energy: 0.8917766017046832
Energy: 1.3570309537494682
Energy: 0.8917766017072508
Energy: 0.8764670168689244
Energy: 0.8723185783648112
Energy: 0.8719314723382705
Energy: 0.8723185783690905
Energy: 0.9044834830301974
Energy: 0.8726669755790734
Energy: 0.8726804152883477
Energy: 0.8726669755850645
Energy: 0.9404040127275047
Energy: 0.933077474550313
Energy: 0.8723965665074992
Energy: 0.9330774745545922
Energy: 0.9421887971587226
Energy: 0.9959122056942628
Energy: 1.1301724882112054
Energy: 0.9959122056951185
Energy: 0.9407408467640572
Energy: 0.9968594482264193
Energy: 0.9607692869427674
Energy: 0.9968594482324104
Energy: 0.9614074537108049
Energy: 1.0713081490620908
Energy: 0.9583379479658246
Energy: 1.071308149059523
Energy: 0.9603507655307465
Energy: 1.042626480892847
Energy: 0.9408353910092008
Energy: 1.042626480892847
Energy: 0.956327726830876
Energy: 0.9961008994759349
Energy: 0.9671575951630649
Energy: 0.9961008994750792
Energy: 0.9329488550684509
Energy: 0.9966570590256357
Energy: 0.9404464415043627
Energy: 0.9966570590247799
Energy: 0.873398065367493
Energy: 0.8723686951650805
Energy: 0.9556716609238787
Energy: 0.8723686951599454
Energy: 0.8722707805501582
Energy: 0.8725522479943819
Energy: 0.9029090198181943
Energy: 0.8725522479926703
Energy: 0.8449411669346032
Energy: 0.8907489965276676
Energy: 0.8914121728836674
Energy: 0.8907489965208207
Energy: 0.9006126560363164
Energy: 0.8763998729818047
Energy: 0.8914925822276318
Energy: 0.8763998729766695
Energy: 0.8925472102432448
Energy: 0.892714633706299
Energy: 0.9053329480382577
Energy: 0.892714633705443
Energy: 0.8928206246765635
Energy: 0.8781713622384024
Energy: 0.9487038135534316
Energy: 0.8781713622264203
Energy: 0.8718937750982164
Energy: 0.8724041405754965
Energy: 0.8731427011084165
Energy: 0.8724041405763525
Energy: 0.9406011326474929
Energy: 0.8720235549905466
Energy: 0.8726203683578642
Energy: 0.8720235549862674
Energy: 0.9402845963558917
Energy: 0.996098419478165
Energy: 0.9386380295790266
Energy: 0.9960984194798769
Energy: 0.9410506047860483
Energy: 0.9960193813611539
Energy: 0.9616343530113441
Energy: 0.9960193813611539
Energy: 0.960212324790181
Energy: 1.0721423688072234
Energy: 0.9034782100759955
Energy: 1.072142368802944
Energy: 0.9602260768045843
Energy: 1.0717796740636427
Energy: 0.9605670797853328
Energy: 1.071779674061931
Energy: 0.9557954791614373
Energy: 0.9962509828027205
Energy: 0.9670765446004742
Energy: 0.9962509827967294
Energy: 0.9339035727046009
Energy: 0.9963747435883074
Energy: 0.9403951705832834
Energy: 0.9963747435917307
Energy: 0.8724294394270481
Energy: 0.8721723414600747
Energy: 0.9334107354226817
Energy: 0.8721723414626422
Energy: 0.872348463738023
Energy: 0.8726483754525783
Energy: 0.9030058736189794
Energy: 0.8726483754517224
Energy: 0.843117465079052
Energy: 0.8905617538365836
Energy: 0.8911884049001841
Energy: 0.8905617538382954

minimum gb energy = 0.843117465079052 eV
minimum distance =  2.2596422379487 Angstroms
sigma value = 25


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

Energy: 1.4977594772536515
Energy: 0.9218195960032936
Energy: 0.9508212670181992
Energy: 0.950041106487311
Energy: 0.9746289380951739
Energy: 1.0028438328220628
Energy: 0.9463420801266288
Energy: 1.0028438328230578
Energy: 0.9529660897489102
Energy: 0.9526830902030239
Energy: 1.345659264839041
Energy: 0.9526830902030239
Energy: 0.9535179098001304
Energy: 1.003245211239821
Energy: 0.9383644729920756
Energy: 1.0032452112418109
Energy: 0.9081794277369077
Energy: 0.9387874242746357
Energy: 0.9386411646485551
Energy: 0.9387874242746357
Energy: 1.0180247402553457
Energy: 1.008393030768594
Energy: 0.9379872658824627
Energy: 1.0083930307656093
Energy: 0.9816539175229658
Energy: 1.0859446586232564
Energy: 1.0978834190554243
Energy: 1.0859446586232564
Energy: 0.9924542494363177
Energy: 1.086145783646975
Energy: 1.0348745301283833
Energy: 1.0861457836509547
Energy: 1.073498465184349
Energy: 1.1074528300486342
Energy: 0.9827931197284047
Energy: 1.1074528300466444
Energy: 0.9687891499374965
Energy: 1.1084885421563717
Energy: 0.9690788123171119
Energy: 1.1084885421583612
Energy: 0.9167147803785463
Energy: 0.9707179848700294
Energy: 0.97098510352113
Energy: 0.9707179848670444
Energy: 0.9134922239572199
Energy: 0.9699466148708284
Energy: 0.970795943239787
Energy: 0.9699466148688386
Energy: 0.8961157513370137
Energy: 0.8963215947819271
Energy: 0.8862685106277907
Energy: 0.8963215947878965
Energy: 0.8961173517932389
Energy: 0.8856682956639876
Energy: 0.9645491681061051
Energy: 0.8856682956639876
Energy: 0.9088861657336224
Energy: 0.9867774458730804
Energy: 0.9882824159741238
Energy: 0.9867774458740755
Energy: 1.0106907697095222
Energy: 0.9688200703921703
Energy: 0.9869401449508202
Energy: 0.9688200703921703
Energy: 0.9423621319604
Energy: 0.9464197263195969
Energy: 0.9078155137176692
Energy: 0.9464197263146225
Energy: 0.9386971308743604
Energy: 0.9469869651850922
Energy: 1.0131373806173292
Energy: 0.9469869651840973
Energy: 1.0978869893172194
Energy: 1.0649906619507283
Energy: 1.012783457913997
Energy: 1.0649906619467486
Energy: 1.0352362009041824
Energy: 1.065330764927611
Energy: 1.0129510869375187
Energy: 1.0653307649256212
Energy: 1.0010329491354804
Energy: 1.0850846438853432
Energy: 1.0657901956253624
Energy: 1.0850846438813637
Energy: 1.0015256784900515
Energy: 1.0852241294134466
Energy: 1.0177881699787665
Energy: 1.0852241294144414
Energy: 0.9362271141586002
Energy: 0.9365231715747754
Energy: 0.916754663855265
Energy: 0.9365231715747754
Energy: 0.9363736052873818
Energy: 0.9364581525324924
Energy: 0.9517421760430718
Energy: 0.9364581525324924
Energy: 0.9183016552464538
Energy: 0.9497589737369441
Energy: 0.950668265064729
Energy: 0.9497589737359492

minimum gb energy = 0.8856682956639876 eV
minimum distance =  2.24748235981327 Angstroms
sigma value = 9


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

Energy: 1.30989879963561
Energy: 0.9405509150588899
Energy: 0.9970946973367893
Energy: 0.9959851175286005
Energy: 1.0673102143433202
Energy: 1.0474967828440616
Energy: 0.995613742573406
Energy: 1.0474967828428747
Energy: 0.9966245504376345
Energy: 0.9958369620908815
Energy: 1.0154110217405747
Energy: 0.9958369620908815
Energy: 0.997097081199444
Energy: 1.1156286344364956
Energy: 0.9923060347635153
Energy: 1.1156286344400563
Energy: 1.0186221064134164
Energy: 0.9921162297356082
Energy: 0.991968140826735
Energy: 0.9921162297356082
Energy: 1.089953487165829
Energy: 0.9913921144160858
Energy: 0.992420387138646
Energy: 0.9913921144172726
Energy: 1.0497698568084222
Energy: 1.1359330668225374
Energy: 1.0218758617383084
Energy: 1.1359330668237242
Energy: 1.021612137414347
Energy: 1.1376727903559343
Energy: 1.0899745897937707
Energy: 1.1376727903559343
Energy: 0.9914467764012466
Energy: 0.9925913354001065
Energy: 0.9298352202552154
Energy: 0.9925913353989196
Energy: 0.9924461311844371
Energy: 0.9923042285091055
Energy: 1.0144774119648443
Energy: 0.9923042285055448
Energy: 0.9295692650860425
Energy: 0.995152993439201
Energy: 0.9955728888272064
Energy: 0.995152993439201
Energy: 1.0671923144376534
Energy: 0.9983491016436878
Energy: 0.9958426226233742
Energy: 0.9983491016413141
Energy: 0.9953972772111996
Energy: 0.9956289389882672
Energy: 0.9944657403620923
Energy: 0.9956289389858934
Energy: 0.9957127872169277
Energy: 0.9973775753968921
Energy: 1.0830732793697524
Energy: 0.9973775753968921
Energy: 1.0183403982020813
Energy: 0.9918840186279706
Energy: 0.9917783849251915
Energy: 0.9918840186255968
Energy: 1.0899385945279183
Energy: 0.9921850143330402
Energy: 0.9923520127590144
Energy: 0.9921850143318535
Energy: 1.0512223855618783
Energy: 1.136447146967872
Energy: 1.0216949908946609
Energy: 1.1364471469714328
Energy: 1.051759349748763
Energy: 1.135990242127464
Energy: 1.0905398271767144
Energy: 1.1359902421262773
Energy: 0.9903772653692743
Energy: 0.9925633172436573
Energy: 0.9304828219840516
Energy: 0.9925633172424704
Energy: 0.9920719489460114
Energy: 0.9920847414977083
Energy: 0.9297687700570848
Energy: 0.9920847414988953
Energy: 0.9296187783868498
Energy: 0.9962355629661845
Energy: 0.9975373917555064
Energy: 0.9962355629685582

minimum gb energy = 0.9295692650860425 eV
minimum distance =  2.25811878267622 Angstroms
sigma value = 25


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

Energy: 1.1751612675853254
Energy: 0.9923276815139754
Energy: 1.0574243410571758
Energy: 1.0567247492930143
Energy: 1.053200920650632
Energy: 1.0696308580197926
Energy: 1.0567292052173816
Energy: 1.069630858018325
Energy: 1.0571750708962258
Energy: 1.0564309351350543
Energy: 1.0552402465458348
Energy: 1.0564309351350543
Energy: 1.0577017096413752
Energy: 1.0693819038076517
Energy: 1.0110377701008482
Energy: 1.0693819038076517
Energy: 1.074688090182972
Energy: 1.0814796528505328
Energy: 1.076738805453443
Energy: 1.0814796528520008
Energy: 0.9843680029167315
Energy: 1.081746770943143
Energy: 1.010829272727277
Energy: 1.0817467709416753
Energy: 0.9792011525940002
Energy: 1.0769819941799714
Energy: 1.0762223271776235
Energy: 1.0769819941799714
Energy: 0.9794029884197238
Energy: 1.1435117803402317
Energy: 1.0125090161531378
Energy: 1.1435117803402317
Energy: 1.05594258896072
Energy: 1.0557820110032317
Energy: 1.121965929677342
Energy: 1.0557820110032317
Energy: 1.056704200698111
Energy: 0.9845479504951896
Energy: 1.1223300803589251
Energy: 0.9845479504966573
Energy: 1.1449192370335315
Energy: 1.0562487612111862
Energy: 1.0602663933593524
Energy: 1.0562487612097184
Energy: 1.0551689716417798
Energy: 1.05963921090152
Energy: 1.0563987868407025
Energy: 1.05963921090152
Energy: 1.0115400475653453
Energy: 1.1795143198675329
Energy: 1.0745338920910423
Energy: 1.1795143198675329
Energy: 1.077037253507332
Energy: 1.078315222744024
Energy: 1.0568873244945274
Energy: 1.078315222744024
Energy: 1.078847556213102
Energy: 1.0779884160122013
Energy: 1.1592367161234276
Energy: 1.0779884160122013
Energy: 1.0113395040531687
Energy: 1.07773053245864
Energy: 1.1600708801428967
Energy: 1.07773053245864
Energy: 1.1261761981812528
Energy: 1.0624069920294612
Energy: 1.0618402446995334
Energy: 1.0624069920294612

minimum gb energy = 0.9792011525940002 eV
minimum distance =  2.27339836834709 Angstroms
sigma value = 17


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

Energy: 1.5437042700891817
Energy: 1.095762005600685
Energy: 1.138023578411183
Energy: 1.1388687114059994
Energy: 1.0898254155225504
Energy: 1.0593754129641824
Energy: 1.1573505591247746
Energy: 1.0593754129650135
Energy: 1.059761223185116
Energy: 1.0590887947132983
Energy: 1.1436287712383078
Energy: 1.0590887947124672
Energy: 1.0599683426700774
Energy: 1.0592995313498001
Energy: 1.0938516604978596
Energy: 1.0592995313481375
Energy: 1.1178357342715213
Energy: 1.1885530956451171
Energy: 1.127348579418014
Energy: 1.1885530956451171
Energy: 1.0578863391845166
Energy: 1.1902232189777038
Energy: 1.117085501447652
Energy: 1.1902232189777038
Energy: 1.0906049731376495
Energy: 1.058240426280095
Energy: 1.0596459849741477
Energy: 1.0582404262792637
Energy: 1.1992091680258947
Energy: 1.0580430268262733
Energy: 1.0591069872439063
Energy: 1.0580430268262733
Energy: 1.1412284128918535
Energy: 1.1395326285570344
Energy: 1.140674941045942
Energy: 1.1395326285578655
Energy: 1.1469806914466285
Energy: 1.1474492029175956
Energy: 1.159497785120799
Energy: 1.147449202918427
Energy: 1.1166190573536903
Energy: 1.0782384730309733
Energy: 1.0485356803237555
Energy: 1.078238473033467
Energy: 1.1512057299946616
Energy: 1.0777455903466968
Energy: 1.076605448676354
Energy: 1.0777455903483595
Energy: 1.0896167356791397
Energy: 1.077323616988755
Energy: 1.076476813587008
Energy: 1.0773236169895863
Energy: 1.0893623227039761
Energy: 1.0771792796952773
Energy: 1.0459549171760114
Energy: 1.0771792796936146
Energy: 1.150754641868118
Energy: 1.1415959636816368
Energy: 1.181841460528547
Energy: 1.1415959636832615
Energy: 1.138601612421483
Energy: 1.1392992690883905
Energy: 1.1824418881754346
Energy: 1.1392992690883905
Energy: 1.1388381952757525
Energy: 1.0585059471569656
Energy: 1.0577916528570586
Energy: 1.0585059471561342
Energy: 1.1386705840823033
Energy: 1.0589217911389268
Energy: 1.0570363220778647
Energy: 1.0589217911414206
Energy: 1.0601692080640583
Energy: 1.1888537217918729
Energy: 1.1203520808660814
Energy: 1.1888537217902104
Energy: 1.126085190207001
Energy: 1.1894410872534977
Energy: 1.118094382080529
Energy: 1.1894410872543288
Energy: 1.0584383409747755
Energy: 1.0583540688111337
Energy: 1.1819761453739532
Energy: 1.0583540688111337
Energy: 1.0591628489760545
Energy: 1.0599249860713316
Energy: 1.0901759454768536
Energy: 1.0599249860696691
Energy: 1.156528111814915
Energy: 1.1491793721127017
Energy: 1.137923950351085
Energy: 1.1491793721118704
Energy: 1.1414217237345812
Energy: 1.1390346645848608
Energy: 1.1375065837651823
Energy: 1.139034664585692
Energy: 1.0455631329724961
Energy: 1.076865196703596
Energy: 1.1506414064696435
Energy: 1.076865196702765
Energy: 1.0765583856513854
Energy: 1.0776617715977763
Energy: 1.1179555660949456
Energy: 1.0776617715977763
Energy: 1.0448780883765305
Energy: 1.1356704201360914
Energy: 1.0908492512170023
Energy: 1.1356704201360914
Energy: 1.0774957859225274
Energy: 1.0779844567902523
Energy: 1.0894136294029269
Energy: 1.0779844567902523
Energy: 1.0460035375406844
Energy: 1.0594025429345921
Energy: 1.0954974530511865
Energy: 1.0594025429337608
Energy: 1.1817895264969902
Energy: 1.1380203573825978
Energy: 1.1372511967666643
Energy: 1.1380203573825978

minimum gb energy = 1.0448780883765305 eV
minimum distance =  2.22872104079122 Angstroms
sigma value = 53


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

Energy: 1.400791014039659
Energy: 1.0132846118346175
Energy: 1.10316110957655
Energy: 1.1023857491872553
Energy: 1.1878712203702013
Energy: 1.1060646743053857
Energy: 1.1031374893588393
Energy: 1.106064674303472
Energy: 1.1020510683781395
Energy: 1.1020359629115453
Energy: 1.0982440543503977
Energy: 1.1020359629096312
Energy: 1.101735874897141
Energy: 1.0753376443061302
Energy: 1.1048723880236824
Energy: 1.0753376443061302
Energy: 1.1014171809869517
Energy: 1.0740903996025382
Energy: 0.996533501954836
Energy: 1.0740903996025382
Energy: 1.1049220199583745
Energy: 1.0753458552323472
Energy: 0.9964722185008079
Energy: 1.0753458552304334
Energy: 1.1884201543747552
Energy: 1.1023267970367683
Energy: 1.1030373880522892
Energy: 1.1023267970329407
Energy: 1.1889688823140903
Energy: 1.1048069464792662
Energy: 1.104658901563967
Energy: 1.1048069464773527
Energy: 1.1020510775716175
Energy: 1.101927110849507
Energy: 1.0992224319053296
Energy: 1.1019271108437658
Energy: 1.10458351416102
Energy: 1.1054766404555396
Energy: 1.1022233175498415
Energy: 1.1054766404555396
Energy: 1.1025016086594586
Energy: 1.0765955572931254
Energy: 0.9965080973214823
Energy: 1.0765955572931254
Energy: 1.1034108090207515
Energy: 1.0739211670525155
Energy: 0.9964386378308714
Energy: 1.073921167048688
Energy: 1.1886505712858824
Energy: 1.105075167333291
Energy: 1.1037198111213042
Energy: 1.105075167331377

minimum gb energy = 0.9964386378308714 eV
minimum distance =  2.29132477435871 Angstroms
sigma value = 9


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

Energy: 1.3671433910569535
Energy: 1.152988594478952
Energy: 1.2049779409217096
Energy: 1.2031853163624235
Energy: 1.0752568570447274
Energy: 1.0709127492550359
Energy: 1.2513099145816948
Energy: 1.0709127492543276
Energy: 1.0723387124052912
Energy: 1.0720234506882025
Energy: 1.2880631670140295
Energy: 1.0720234506867858
Energy: 1.0741593589519933
Energy: 1.0717852887954609
Energy: 1.2060538414452777
Energy: 1.0717852887954609
Energy: 1.0734707029649102
Energy: 1.0707980800969217
Energy: 1.243238505274989
Energy: 1.0707980800962134
Energy: 1.0719641843802044
Energy: 1.0704188901731306
Energy: 1.2428605317486112
Energy: 1.0704188901780887
Energy: 1.2071574246949919
Energy: 1.1910972865393388
Energy: 1.2080463647690693
Energy: 1.1910972865400473
Energy: 1.205694883977519
Energy: 1.190255922033653
Energy: 1.1905095924051994
Energy: 1.1902559220322364
Energy: 1.102440628329564
Energy: 1.206456642910586
Energy: 1.1435920076870378
Energy: 1.2064566429112944
Energy: 1.0762328658789557
Energy: 1.1444522855620043
Energy: 1.1934934676767623
Energy: 1.1444522855591714
Energy: 1.0989748975635367
Energy: 1.098992050131392
Energy: 1.199502566352025
Energy: 1.0989920501335169
Energy: 1.1004236245715389
Energy: 1.1547978421858862
Energy: 1.243128676168573
Energy: 1.1547978421858862
Energy: 1.205138933175889
Energy: 1.0996764565407002
Energy: 1.1198299182780058
Energy: 1.0996764565385753
Energy: 1.205463484407419
Energy: 1.100421449070558
Energy: 1.101872488597179
Energy: 1.100421449072683
Energy: 1.1911316874175348
Energy: 1.1206709190727953
Energy: 1.1176753493900966
Energy: 1.1206709190713786
Energy: 1.2097708646949332
Energy: 1.2009722852118343
Energy: 1.118315004799617
Energy: 1.2009722852111258
Energy: 1.1913120825023282
Energy: 1.1645721222624348
Energy: 1.1016022176591023
Energy: 1.1645721222603098
Energy: 1.2029479527985907
Energy: 1.2010074158163646
Energy: 1.3667049912090752
Energy: 1.2010074158163646
Energy: 1.250858091244976
Energy: 1.1899431942325798
Energy: 1.0794738031365532
Energy: 1.1899431942332879
Energy: 1.2885143167648243
Energy: 1.0724795761329748
Energy: 1.0722308117419006
Energy: 1.0724795761351
Energy: 1.2054670321459486
Energy: 1.0712600260017549
Energy: 1.0718355798338464
Energy: 1.071260026002463
Energy: 1.2429146487441227
Energy: 1.0703400752853265
Energy: 1.0712995920000148
Energy: 1.0703400752881598
Energy: 1.2432924912043364
Energy: 1.0706655263634501
Energy: 1.0722102459796459
Energy: 1.0706655263634501
Energy: 1.2086569807042777
Energy: 1.190484716031093
Energy: 1.2055513352517404
Energy: 1.1904847160325096
Energy: 1.1909224371621272
Energy: 1.1903527686360782
Energy: 1.2050400270536492
Energy: 1.19035276863537
Energy: 1.1449282188122998
Energy: 1.2016772689245878
Energy: 1.1007762155203067
Energy: 1.2016772689267128
Energy: 1.191233016648107
Energy: 1.1460340470719572
Energy: 1.0755880188148457
Energy: 1.1460340470740822
Energy: 1.1995117637517878
Energy: 1.099336184835975
Energy: 1.1001187616880088
Energy: 1.0993361848345584
Energy: 1.3652380541232485
Energy: 1.1038111677712448
Energy: 1.1006015416959212
Energy: 1.1038111677747862
Energy: 1.1204844334971367
Energy: 1.09973030877226
Energy: 1.2049171288956795
Energy: 1.09973030877226
Energy: 1.1040399543395971
Energy: 1.1012121205523377
Energy: 1.2374487168628767
Energy: 1.1012121205509213
Energy: 1.1006166083817508
Energy: 1.1003810723639376
Energy: 1.1919157859124487
Energy: 1.1003810723639376
Energy: 1.1199448990833247
Energy: 1.2043759727737389
Energy: 1.210565098960735
Energy: 1.204375972775864
Energy: 1.1004987288068437
Energy: 1.1654854932057719
Energy: 1.1353526345691753
Energy: 1.1654854932050638
Energy: 1.364156439713562
Energy: 1.1921618533762732
Energy: 1.2011951508142076
Energy: 1.1921618533762732

minimum gb energy = 1.0703400752853265 eV
minimum distance =  2.28448330445437 Angstroms
sigma value = 73


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

Energy: 1.4401823285911177
Energy: 1.127536714162934
Energy: 1.1543759327522416
Energy: 1.1524246686729105
Energy: 1.0821260797841283
Energy: 1.2400295578513236
Energy: 1.1786857045134418
Energy: 1.2400295578524474
Energy: 1.0856716200607186
Energy: 1.0865656372207715
Energy: 1.251167735351713
Energy: 1.0865656372207715
Energy: 1.0856907434086334
Energy: 1.086249127043171
Energy: 1.1785539826829414
Energy: 1.0862491270442947
Energy: 1.0898342560930971
Energy: 1.089763523735748
Energy: 1.2388729450281335
Energy: 1.0897635237346242
Energy: 1.1347174325036977
Energy: 1.2492404249323823
Energy: 1.209625560137256
Energy: 1.2492404249323823
Energy: 1.1018353585484189
Energy: 1.18505617841369
Energy: 1.2092488702270756
Energy: 1.18505617841369
Energy: 1.1690465683282318
Energy: 1.1838658351363394
Energy: 1.1821813546782802
Energy: 1.1838658351374631
Energy: 1.1142751576069314
Energy: 1.2484275199733428
Energy: 1.1826023394891336
Energy: 1.2484275199733428
Energy: 1.1381169949847438
Energy: 1.2573199534893766
Energy: 1.1828278190910313
Energy: 1.2573199534893766
Energy: 1.1147317101627299
Energy: 1.058352806066885
Energy: 1.058526134568545
Energy: 1.058352806066885
Energy: 1.116008577394148
Energy: 1.058804924864167
Energy: 1.3045909693577098
Energy: 1.0588049248607956
Energy: 1.1821736499345348
Energy: 1.121727821138502
Energy: 1.1158832949062483
Energy: 1.1217278211373782
Energy: 1.1821132727081674
Energy: 1.121538653633313
Energy: 1.1176068221300774
Energy: 1.121538653633313
Energy: 1.195004311895319
Energy: 1.1116654975749518
Energy: 1.1129219757542919
Energy: 1.1116654975749518
Energy: 1.2395443856667
Energy: 1.1141496080175526
Energy: 1.1124281174214345
Energy: 1.1141496080186764
Energy: 1.2102845472545027
Energy: 1.2703571967959781
Energy: 1.1139464752428891
Energy: 1.2703571967982257
Energy: 1.18878125633234
Energy: 1.1887873225661238
Energy: 1.1012209477576234
Energy: 1.1887873225661238
Energy: 1.1608661483028822
Energy: 1.1643352391571649
Energy: 1.1013429427390111
Energy: 1.1643352391560413
Energy: 1.2093340348215396
Energy: 1.1842997861231366
Energy: 1.1532447780995827
Energy: 1.1842997861242603
Energy: 1.1604812188497182
Energy: 1.2774718771285845
Energy: 1.1409150027458832
Energy: 1.2774718771263371
Energy: 1.2111488058831679
Energy: 1.1525608293886653
Energy: 1.1523616802724193
Energy: 1.1525608293875413

minimum gb energy = 1.058352806066885 eV
minimum distance =  2.27418358526311 Angstroms
sigma value = 7


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

Energy: 1.6453320926394672
Energy: 1.1070924818398018
Energy: 1.1896472203944282
Energy: 1.1895738884914495
Energy: 1.071395852086693
Energy: 1.1469231661611596
Energy: 1.2276628901036846
Energy: 1.1469231661611596
Energy: 1.0955812071650406
Energy: 1.2355053693707687
Energy: 1.1838338101759336
Energy: 1.2355053693691793
Energy: 1.0906559898714419
Energy: 1.0895723905306363
Energy: 1.2270061777275605
Energy: 1.089572390536199
Energy: 1.0814308669625894
Energy: 1.0804461013039306
Energy: 1.2041958925030112
Energy: 1.080446101303136
Energy: 1.0912240857634823
Energy: 1.079796405477226
Energy: 1.2041957521652338
Energy: 1.0797964054851723
Energy: 1.2254900490264653
Energy: 1.080894194418561
Energy: 1.091462816459061
Energy: 1.080894194418561
Energy: 1.2257993394307292
Energy: 1.0797302451757376
Energy: 1.0781271477910408
Energy: 1.0797302451773267
Energy: 1.2281619592248811
Energy: 1.088500581408285
Energy: 1.0891078374191532
Energy: 1.088500581420205
Energy: 1.264398322089339
Energy: 1.2349990226929117
Energy: 1.08245858549743
Energy: 1.2349990226873853
Energy: 1.2271797342376303
Energy: 1.1477254198721547
Energy: 1.1576445143238796
Energy: 1.1477254198697706
Energy: 1.1492986803774679
Energy: 1.149666203409686
Energy: 1.1667743090862492
Energy: 1.1496662034080967
Energy: 1.1487874674617318
Energy: 1.1502268693506976
Energy: 1.1477395550276535
Energy: 1.1502268693546707
Energy: 1.1646763021091537
Energy: 1.1679627420565941
Energy: 1.1065607733964817
Energy: 1.1679627420494425
Energy: 1.148375632394686
Energy: 1.1523085922609244
Energy: 1.0860317908723927
Energy: 1.1523085922569511
Energy: 1.084294029957775
Energy: 1.148276778402366
Energy: 1.1472477825007332
Energy: 1.148276778402366
Energy: 1.088444340066991
Energy: 1.1464976209711362
Energy: 1.2273473649889628
Energy: 1.1464976209695472
Energy: 1.0823348760333775
Energy: 1.240461538619981
Energy: 1.1827597338702045
Energy: 1.2404615386255435
Energy: 1.0870731409475094
Energy: 1.088869189192939
Energy: 1.2283399604201832
Energy: 1.0888691891905549
Energy: 1.0799768772060028
Energy: 1.0794562984089622
Energy: 1.0854526309961472
Energy: 1.0794562984049891
Energy: 1.0915358882166668
Energy: 1.080861327684017
Energy: 1.2038855886828284
Energy: 1.080861327684017
Energy: 1.2258954784942482
Energy: 1.080018827988962
Energy: 1.1581290773934012
Energy: 1.080018827984989
Energy: 1.2257574079920477
Energy: 1.0806201823805335
Energy: 1.081489374047575
Energy: 1.080620182383712
Energy: 1.2275219173745262
Energy: 1.0896585048619207
Energy: 1.0901225010496427
Energy: 1.0896585048587424
Energy: 1.265816043265959
Energy: 1.0910216471764793
Energy: 1.0958649483761937
Energy: 1.0910216471740954
Energy: 1.2067384789315867
Energy: 1.1467685488225356
Energy: 1.0801934660099148
Energy: 1.1467685488265087
Energy: 1.147695260546796
Energy: 1.1481590080571182
Energy: 1.4535681585873157
Energy: 1.148159008049208
Energy: 1.146262930119281
Energy: 1.1476217113148754
Energy: 1.0807260915567927
Energy: 1.1476217113109022
Energy: 1.186294406546638
Energy: 1.1701786328351582
Energy: 1.1480063835187428
Energy: 1.1701786328407209
Energy: 1.146689540873141
Energy: 1.1880574918667075
Energy: 1.1064192934458763
Energy: 1.188057491862734
Energy: 1.0843025026414084
Energy: 1.1471264920847217
Energy: 1.1490867150547814
Energy: 1.1471264920807487

minimum gb energy = 1.071395852086693 eV
minimum distance =  2.27872020195906 Angstroms
sigma value = 29


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

Energy: 1.018347211320648
Energy: 1.0197581496337769
Energy: 1.1113601972687426
Energy: 1.1989462948718537
Energy: 1.016470337552892
Energy: 1.1040829116682689
Energy: 1.0291201470690032
Energy: 1.1040829116682689
Energy: 1.028288579102265
Energy: 1.113075323083522
Energy: 1.0186842057294183
Energy: 1.1130753230840753
Energy: 1.0165025207426972
Energy: 1.0305392270069391
Energy: 1.0273697169777674
Energy: 1.0305392270077696
Energy: 1.0267265787739435
Energy: 1.027191447508076
Energy: 1.0165914804055942
Energy: 1.0271914475094295
Energy: 1.0269016413892524
Energy: 1.1070962520090695
Energy: 1.0165537451847475
Energy: 1.1070962520085468
Energy: 1.0193721455541003
Energy: 1.1123035625118496
Energy: 1.0272784631843466
Energy: 1.112303562511296
Energy: 1.0290646291877732
Energy: 1.0258097161731434
Energy: 1.016773343310635
Energy: 1.0258097161723438
Energy: 1.0159962251903925
Energy: 1.0256094735060113
Energy: 1.0244741702464184
Energy: 1.0256094735060113

minimum gb energy = 1.0159962251903925 eV
minimum distance =  2.25075513332806 Angstroms
sigma value = 5


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

Energy: 1.3050333537102152
Energy: 0.9679799435166
Energy: 1.1359765250473242
Energy: 0.9897080331765191
Energy: 1.0095493029117244
Energy: 1.008583743258344
Energy: 1.1413500666187772
Energy: 1.0085837432598452
Energy: 1.138643916080806
Energy: 1.075528635354285
Energy: 1.1300550220166936
Energy: 1.0755286353527838
Energy: 1.0088740318522742
Energy: 0.9892153283720794
Energy: 1.1378280132460739
Energy: 0.9892153283720794
Energy: 1.1348738200684427
Energy: 0.9948307119072012
Energy: 1.125192237028086
Energy: 0.9948307119072012
Energy: 1.0046508197806454
Energy: 1.0052284810823893
Energy: 1.1259406192915369
Energy: 1.0052284810816385
Energy: 0.9889935240818124
Energy: 0.9889366110888542
Energy: 1.1381715306244613
Energy: 0.9889366110903556
Energy: 1.009234530677968
Energy: 0.9969527766115435
Energy: 1.234520350924417
Energy: 0.9969527766107928
Energy: 1.0254629814501286
Energy: 1.0296215015926522
Energy: 1.2360908644224384
Energy: 1.0296215015926522
Energy: 1.1559175419125443
Energy: 0.97172176912402
Energy: 0.9711129008185982
Energy: 0.9717217691232695
Energy: 1.0235255079421093
Energy: 0.9717701001214248
Energy: 0.970813766588717
Energy: 0.9717701001214248
Energy: 1.2376486776950548
Energy: 0.9715950209253218
Energy: 0.9736012624713893
Energy: 0.97159502092307
Energy: 1.2310458892297422
Energy: 0.9717207894752429
Energy: 0.9735594925079551
Energy: 0.9717207894752429
Energy: 0.994489537025989
Energy: 1.0313535582409055
Energy: 1.127013750265337
Energy: 1.031353558242407
Energy: 1.006140542887326
Energy: 0.9890415214419213
Energy: 1.1373055925587492
Energy: 0.9890415214411705
Energy: 1.0087594800807387
Energy: 1.0051619632228637
Energy: 1.1231516995391924
Energy: 1.0051619632258662
Energy: 0.9878031456333993
Energy: 0.9894322332450037
Energy: 1.0081195062346386
Energy: 0.9894322332472556
Energy: 1.1404798240987797
Energy: 1.0091705556268595
Energy: 1.0087231803854317
Energy: 1.0091705556253585
Energy: 1.1319129365367893
Energy: 1.0733860804920057
Energy: 1.1390985726533054
Energy: 1.0733860804905042
Energy: 1.1380066782523768
Energy: 0.9886127192193861
Energy: 1.0075751321652835
Energy: 0.9886106755834527
Energy: 1.126446479146622
Energy: 1.00684432688746
Energy: 1.135266799562204
Energy: 1.00684432688746
Energy: 1.1252720175212014
Energy: 0.9942760010972067
Energy: 0.9910068377942008
Energy: 0.9942760010979574
Energy: 1.138441687139111
Energy: 0.9894209707369663
Energy: 0.9923394206666661
Energy: 0.9894209707362156
Energy: 1.2330077238067922
Energy: 0.9964921223064191
Energy: 1.0073686976672582
Energy: 0.9964921223079203
Energy: 1.2366617326649856
Energy: 1.0286605569799876
Energy: 1.0235546579851167
Energy: 1.0286605569814888
Energy: 0.9718517222255172
Energy: 0.9710922257156961
Energy: 1.155795047790474
Energy: 0.9710922257134442
Energy: 0.971508087341389
Energy: 0.9718547390936088
Energy: 1.024882433738624
Energy: 0.9718547390928581
Energy: 0.9715327569473257
Energy: 0.9707642331258022
Energy: 1.0439145154914609
Energy: 0.9707642331258022
Energy: 0.9732040800022762
Energy: 0.9711440174169064
Energy: 1.2321341664125784
Energy: 0.9711440174184077
Energy: 1.1372933197316153
Energy: 1.030120833730472
Energy: 1.0113021389806032
Energy: 1.03012083372822
Energy: 1.1269065705521308
Energy: 0.9931743297187684
Energy: 1.0073661763926949
Energy: 0.9931743297172672
Energy: 1.1242337577032961
Energy: 0.9944279598034685
Energy: 1.0079533474880116
Energy: 0.9944279598064711
Energy: 1.0108186621468598
Energy: 0.9893151811751
Energy: 0.9882886860361187
Energy: 0.9893151811751

minimum gb energy = 0.9679799435166 eV
minimum distance =  2.21460008072596 Angstroms
sigma value = 1


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

Energy: 1.3700139389683683
Energy: 0.9180539258470769
Energy: 1.1061308544791713
Energy: 0.9394644037511506
Energy: 0.955609201538365
Energy: 0.9556086622267764
Energy: 1.1423972180311044
Energy: 0.9556086622288522
Energy: 1.1396719718390105
Energy: 1.050331602447882
Energy: 1.1278324450129997
Energy: 1.050331602445806
Energy: 0.9567481202971253
Energy: 1.0457032754012985
Energy: 1.1202832155940647
Energy: 1.0457032754044122
Energy: 0.9399709487850119
Energy: 0.9398819789493954
Energy: 1.1230995171119127
Energy: 0.9398819789504332
Energy: 0.939636060909356
Energy: 0.9416388155062909
Energy: 1.123821087799092
Energy: 0.9416388155021393
Energy: 0.9366327920444599
Energy: 0.9371793664518758
Energy: 1.1215466743447697
Energy: 0.9371793664518758
Energy: 0.959506099270798
Energy: 0.9530166256387982
Energy: 1.2759805615419624
Energy: 0.9530166256419118
Energy: 1.1386804571042042
Energy: 0.9963671034165011
Energy: 1.2749158027297594
Energy: 0.9963671034206528
Energy: 1.1627852093047784
Energy: 0.9591834414614887
Energy: 0.9557122102673831
Energy: 0.9591834414625268
Energy: 1.1351054396133389
Energy: 0.9370556410743348
Energy: 0.9358454157316712
Energy: 0.9370556410753726
Energy: 1.2716077330855406
Energy: 0.9427583870707358
Energy: 0.94195339536991
Energy: 0.9427583870655463
Energy: 1.272336657039436
Energy: 0.9383823237626664
Energy: 0.9412073496867996
Energy: 0.9383823237647423
Energy: 1.1196188136655842
Energy: 0.9404977300369523
Energy: 1.1276758069219985
Energy: 0.9404977300400659
Energy: 0.9558492288811724
Energy: 1.0452378316451767
Energy: 1.1415520790356857
Energy: 1.0452378316462145
Energy: 0.956795670066645
Energy: 0.9413505400427881
Energy: 1.1217353606751546
Energy: 0.9413505400427881
Energy: 0.9404726294081828
Energy: 0.938197237533755
Energy: 1.1226362856881877
Energy: 0.9381972375347929
Energy: 0.9598356727297016
Energy: 0.9567941319613642
Energy: 1.1163660895091256
Energy: 0.9567941319634401
Energy: 0.9365444020839475
Energy: 0.9372856443538561
Energy: 1.2757296725050902
Energy: 0.9372856443507422
Energy: 0.9419475186343697
Energy: 1.2099185700096262
Energy: 1.2754114727044363
Energy: 1.2099153046790838
Energy: 1.1229209420383837
Energy: 0.9975764126565744
Energy: 1.1218220635703955
Energy: 0.9975764126576123
Energy: 1.1227640556873517
Energy: 0.9419638994686066
Energy: 0.957858034660065
Energy: 0.9419638994654929
Energy: 1.1215680411936038
Energy: 0.9396148179685355
Energy: 0.9419885823178916
Energy: 0.9396148179643841
Energy: 1.2722569131996744
Energy: 0.938332247789803
Energy: 0.9376837641179837
Energy: 0.9383322477887651

minimum gb energy = 0.9180539258470769 eV
minimum distance =  2.22085953646769 Angstroms
sigma value = 17


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

Energy: 1.44641262711169
Energy: 0.9070559822186315
Energy: 1.104105372291485
Energy: 0.922175896239966
Energy: 0.9322780941821772
Energy: 0.9254564945119942
Energy: 1.0406000789786927
Energy: 0.9254564945107113
Energy: 1.1413835970849364
Energy: 0.9181963892237054
Energy: 1.0437903060395946
Energy: 0.9181963892249884
Energy: 1.1369219090922402
Energy: 0.9749708779162181
Energy: 1.0334420304550223
Energy: 0.9749708779162181
Energy: 1.020631492780313
Energy: 0.9062926256785477
Energy: 1.2402463685217857
Energy: 0.9062926256779064
Energy: 0.9089826556545735
Energy: 0.9058082127024986
Energy: 1.2425388393232417
Energy: 0.9058082126992911
Energy: 0.9108041142463323
Energy: 0.9065952646774516
Energy: 1.0338075313831032
Energy: 0.9065952646768101
Energy: 0.9146374748284293
Energy: 0.9112259864241045
Energy: 1.332533361686916
Energy: 0.9112259864215383
Energy: 1.2397874000193918
Energy: 0.9063251273205283
Energy: 1.1418600134820656
Energy: 0.9063251273218113
Energy: 1.0549329687001003
Energy: 0.9768312246851991
Energy: 1.0355878455718015
Energy: 0.976831224686482
Energy: 1.2381602125164908
Energy: 1.1519472261492403
Energy: 0.928211198594384
Energy: 1.1519472251021432
Energy: 1.2394892246684666
Energy: 0.9198116487087327
Energy: 1.0342954081036082
Energy: 0.9198116487106571
Energy: 1.2335619020389834
Energy: 0.9173779453977399
Energy: 0.9170058909738025
Energy: 0.9173779453990228
Energy: 1.0701722851565416
Energy: 0.9190831399783929
Energy: 0.9186198216267851
Energy: 0.9190831399783929
Energy: 1.1645255343244418
Energy: 0.922533159144783
Energy: 0.9283935258191842
Energy: 0.9225331591435
Energy: 1.338649829835015
Energy: 0.9184255659270157
Energy: 1.0734371326704948
Energy: 0.9184255659282988
Energy: 0.9180012104980321
Energy: 0.9267715746700823
Energy: 1.234450182829112
Energy: 0.9267710780985691
Energy: 0.9181429931910291
Energy: 0.9175896192479259
Energy: 1.238451486532485
Energy: 0.9175896192447184
Energy: 0.9214889811448627
Energy: 0.930253090255001
Energy: 1.1383027636440675
Energy: 0.9302530902543594
Energy: 0.920364569715369
Energy: 0.9177986180091751
Energy: 1.3322275849096483
Energy: 0.9177986180110995
Energy: 1.040335360379099
Energy: 0.9213145021573323
Energy: 1.0228475529857635
Energy: 0.9213145021592567
Energy: 1.0423609529764237
Energy: 0.9181444921280698
Energy: 1.1431227282132475
Energy: 0.9181444921299944
Energy: 1.0342095175938237
Energy: 0.9727659580676753
Energy: 1.1485947258729423
Energy: 0.9727659580657508
Energy: 1.2334905510169532
Energy: 0.9098586672282898
Energy: 1.0206840921436653
Energy: 0.9098586672282898
Energy: 1.2399889289041996
Energy: 0.9049956503795081
Energy: 0.9052067359463678
Energy: 0.9049956503763006
Energy: 1.0343238933274426
Energy: 0.9083994652652593
Energy: 0.9124103031231418
Energy: 0.9083994652639764
Energy: 1.3326698279554179
Energy: 0.9111678237673616
Energy: 0.9093348839551344
Energy: 0.9111678237647955
Energy: 1.139075976441544
Energy: 0.9110265972689368
Energy: 1.242461820105794
Energy: 0.9110265972708613
Energy: 1.0402510830318317
Energy: 0.9749981020155537
Energy: 1.0430235474783736
Energy: 0.9749981020142706
Energy: 0.9294088693913825
Energy: 1.158532946361733
Energy: 1.236691722411041
Energy: 1.1585329454839328
Energy: 1.0329613901033239
Energy: 0.9183033156614261
Energy: 1.241908704488419
Energy: 0.9183033156595017
Energy: 0.9167969514675102
Energy: 0.9182585183693611
Energy: 1.2432784469879055
Energy: 0.9182585183680781
Energy: 0.9179711646993911
Energy: 0.9175695265312169
Energy: 1.133810116236877
Energy: 0.9175695265350658
Energy: 0.9271472761915952
Energy: 0.9273599560776591
Energy: 1.1354897738633745
Energy: 0.927359956075093
Energy: 1.1789875536657903
Energy: 0.9175409591188155
Energy: 1.3387172996333154
Energy: 0.9175409591194569
Energy: 1.3143628484873908
Energy: 0.9254532734167296
Energy: 0.9193626657811672
Energy: 0.9254532734154466
Energy: 1.2375110457650278
Energy: 0.9172559053353903
Energy: 0.9175879856506601
Energy: 0.9172559053347488
Energy: 1.1408462163789859
Energy: 0.9205515932020617
Energy: 0.9193004456976345
Energy: 0.9205515932039862

minimum gb energy = 0.9049956503763006 eV
minimum distance =  2.22172004931838 Angstroms
sigma value = 89


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

Energy: 1.7005461892911915
Energy: 0.8558649934771128
Energy: 0.8820132702144478
Energy: 0.8809961213565601
Energy: 0.9807577934739524
Energy: 0.9713223661915431
Energy: 0.9021555111325312
Energy: 0.9713223661898647
Energy: 0.9887809423080167
Energy: 0.9721213879885943
Energy: 1.1641946272408266
Energy: 0.9721213879885943
Energy: 0.9969633716664595
Energy: 0.9735595850509126
Energy: 0.8254304466066853
Energy: 0.9735595850509126
Energy: 0.9747857673105709
Energy: 0.8222644270295024
Energy: 1.2559958589626028
Energy: 0.8222644270278239
Energy: 0.9678999850317807
Energy: 0.8223995257968145
Energy: 1.2557386696888138
Energy: 0.822399525795136
Energy: 0.9684391298073005
Energy: 0.8219454568370259
Energy: 0.826886662901098
Energy: 0.8219454568387043
Energy: 0.974528133705834
Energy: 0.8226525879377696
Energy: 0.824218818781096
Energy: 0.8226525879377696
Energy: 0.9749579295421832
Energy: 0.82336135906451
Energy: 0.8286043793381375
Energy: 0.8233613590661695
Energy: 0.9751025079041338
Energy: 1.1349941610754375
Energy: 0.8260351516399163
Energy: 1.1349941567233732
Energy: 0.9743764429647886
Energy: 0.9098746223942711
Energy: 0.9939509208554768
Energy: 0.9098746223959497
Energy: 1.255704735660772
Energy: 0.8802568122090934
Energy: 0.8238206266440342
Energy: 0.8802568122107719
Energy: 1.2557392731970292
Energy: 0.883039481795566
Energy: 0.8821017229280363
Energy: 0.8830394817972446
Energy: 1.1119111175031857
Energy: 0.8797576999288046
Energy: 0.8795839674819289
Energy: 0.8797576999288046
Energy: 0.9998180922417904
Energy: 0.8812632663776104
Energy: 0.884660242842128
Energy: 0.8812632663792889

minimum gb energy = 0.8219454568370259 eV
minimum distance =  2.21021698618659 Angstroms
sigma value = 13


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

Energy: 1.3296115188174156
Energy: 0.7824657116340848
Energy: 1.0190071112574512
Energy: 0.7840602804499123
Energy: 1.267097108703412
Energy: 0.782921018669829
Energy: 0.9219085720380039
Energy: 0.7829210186642328
Energy: 1.2637713563009523
Energy: 0.7819940772662871
Energy: 0.9159149892787887
Energy: 0.7819940772768399
Energy: 1.0471498168978364
Energy: 0.7853098824266671
Energy: 0.9090254790191022
Energy: 0.7853098824322632
Energy: 1.0760260385715827
Energy: 0.7835989391028653
Energy: 1.1558725222672128
Energy: 0.7835989391049758
Energy: 0.9077727190165629
Energy: 0.7833888457604653
Energy: 1.1551403207910393
Energy: 0.7833888457625757
Energy: 0.9159099980657347
Energy: 0.7823965067427988
Energy: 1.0726581292103827
Energy: 0.7823965067252109
Energy: 0.9078541636361881
Energy: 0.7856296579938147
Energy: 1.147340693401124
Energy: 0.785629657990297
Energy: 0.8032912489705263
Energy: 0.7853167305129307
Energy: 1.150162558587616
Energy: 0.7853167305220764
Energy: 0.781425461707592
Energy: 0.7826348341433907
Energy: 1.1512003246764273
Energy: 0.7826348341405767
Energy: 0.7842603413628262
Energy: 0.7883253430907528
Energy: 1.330114504184302
Energy: 0.788325343101977
Energy: 1.1447165547482203
Energy: 0.8365076471016129
Energy: 1.072613412924059
Energy: 0.836507647107241
Energy: 1.1583522622549824
Energy: 0.835424006080252
Energy: 1.1431293416480668
Energy: 0.8354240060823627
Energy: 1.1498925993013844
Energy: 0.838085208489677
Energy: 1.044860794384255
Energy: 0.8380852084784208
Energy: 1.159140041149138
Energy: 0.7843123451639127
Energy: 1.0737176540301026
Energy: 0.7843123451709478
Energy: 1.1565132577107111
Energy: 0.7826910589060005
Energy: 0.7856755920090183
Energy: 0.7826910589137392
Energy: 1.1484778487834066
Energy: 0.7827168011651522
Energy: 0.7830389019215787
Energy: 0.7827168011560066
Energy: 1.2696375743777348
Energy: 0.7841326904345934
Energy: 0.788606142275987
Energy: 0.7841326904282938
Energy: 1.0204061375380657
Energy: 0.8020329991484216
Energy: 0.9026216645060726
Energy: 0.802032999150532
Energy: 1.151188600826083
Energy: 0.7813919084682741
Energy: 0.9154436592252922
Energy: 0.7813919084570179
Energy: 1.0436313271715205
Energy: 0.7855722724321913
Energy: 0.9053660627837855
Energy: 0.7855722724371159
Energy: 1.0796596390651985
Energy: 0.7820886178968629
Energy: 1.1547148375021863
Energy: 0.7820886178968629
Energy: 0.9221251188807214
Energy: 0.7847667828618549
Energy: 1.1563031276583267
Energy: 0.7847667828632618
Energy: 0.7850328531039759
Energy: 0.7815436943609867
Energy: 1.0751833119768663
Energy: 0.7815436943539517
Energy: 0.9060905243440737
Energy: 0.7829855395738909
Energy: 1.361043090794244
Energy: 0.7829855395774085
Energy: 0.7834957081569907
Energy: 0.7814403916996965
Energy: 1.3585374946597049
Energy: 0.7814403917018071
Energy: 0.7820504682505101
Energy: 0.7815015184762557
Energy: 1.0788273092122926
Energy: 0.7815015184720345
Energy: 0.8040222749676643
Energy: 0.7856563781841484
Energy: 1.2696501080455767
Energy: 0.7856563781897765
Energy: 1.1436315970538502
Energy: 0.7819692541266445
Energy: 1.0205275041314845
Energy: 0.7819692541224234
Energy: 0.9151551120110147
Energy: 0.8388437885101514
Energy: 1.1448872341893874
Energy: 0.8388437885045235
Energy: 1.1480132041654427
Energy: 1.2191179063337276
Energy: 1.0439918591790434
Energy: 1.2191179060236053
Energy: 1.156043009897243
Energy: 0.7827165392763503
Energy: 1.0740034026349354
Energy: 0.7827165392728328
Energy: 1.1500048200055937
Energy: 0.7848035233106108
Energy: 0.8047853227941492
Energy: 0.784803523321867
Energy: 1.0739430058065922
Energy: 0.7816771682017712
Energy: 0.7825331460816235
Energy: 0.7816771682017712
Energy: 1.0195134356826752
Energy: 0.783357824674891
Energy: 0.7844446023882979
Energy: 0.7833578246727804

minimum gb energy = 0.7813919084570179 eV
minimum distance =  2.25543116888257 Angstroms
sigma value = 37


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

Energy: 1.1585205541620909
Energy: 0.713137897203248
Energy: 0.7106281269410322
Energy: 0.7120472220590105
Energy: 1.1307247654776
Energy: 0.7108865878522922
Energy: 0.9214149279689225
Energy: 0.7108865878510818
Energy: 1.1316353325619017
Energy: 0.71026446300261
Energy: 0.9248491422675593
Energy: 0.71026446300261
Energy: 1.130416221863048
Energy: 0.8073361484864083
Energy: 0.9225783995132435
Energy: 0.8073361484851979
Energy: 1.1521205262943166
Energy: 0.8055539465096356
Energy: 0.9207649911163085
Energy: 0.8055539465084252
Energy: 0.9256576174916058
Energy: 0.7101840256557952
Energy: 1.093159614275968
Energy: 0.7101840256557952
Energy: 0.7067613505897326
Energy: 0.7099556722077801
Energy: 1.1529682074427507
Energy: 0.7099556722077801
Energy: 0.7210759706233695
Energy: 0.7104781501621678
Energy: 1.1444441097664604
Energy: 0.7104781501609574
Energy: 0.7106807976831941
Energy: 0.7103399546557565
Energy: 1.2939769835765191
Energy: 0.7103399546545461
Energy: 0.7095085010086363
Energy: 0.7124767497823977
Energy: 1.1502279144646335
Energy: 0.7124767497811874
Energy: 0.7106281269507151
Energy: 0.7120472220565897
Energy: 1.1585205541620909
Energy: 0.713137897203248
Energy: 0.9214149279689225
Energy: 0.7108865878522922
Energy: 1.13072476547639
Energy: 0.7108865878522922
Energy: 0.9248491422675593
Energy: 0.71026446300261
Energy: 1.1316353325619017
Energy: 0.71026446300261
Energy: 0.9225783995132435
Energy: 0.8073361484839875
Energy: 1.1304162218618372
Energy: 0.8073361484839875
Energy: 0.9207649911163085
Energy: 0.8055539465096356
Energy: 1.1521205262943166
Energy: 0.805553946510846
Energy: 1.093159614275968
Energy: 0.7101840256557952
Energy: 0.9256576174916058
Energy: 0.7101840256545848
Energy: 1.1529682074451715
Energy: 0.7099556722089905
Energy: 0.7067613505897326
Energy: 0.7099556722089905
Energy: 1.1444441097664604
Energy: 0.7104781501609574
Energy: 0.7210759706233695
Energy: 0.7104781501609574
Energy: 1.2939769835777295
Energy: 0.7103399546545461
Energy: 0.7106807976819838
Energy: 0.7103399546545461
Energy: 1.1502279144682643
Energy: 0.7124767497811874
Energy: 0.7095085010086363
Energy: 0.7124767497811874

minimum gb energy = 0.7067613505897326 eV
minimum distance =  2.2658949726132 Angstroms
sigma value = 25


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

Energy: 1.3619608565588288
Energy: 0.6630465713105053
Energy: 0.6332438534037018
Energy: 0.6330982221722258
Energy: 1.2393055341764274
Energy: 0.6312652397013355
Energy: 0.8029855395192079
Energy: 0.6312652397022808
Energy: 1.2394688385353183
Energy: 0.630589617488691
Energy: 0.8008264816426003
Energy: 0.6305896174877458
Energy: 0.968015597857351
Energy: 0.6302448919894446
Energy: 0.7985454050612527
Energy: 0.6302448919903898
Energy: 1.2473762359692566
Energy: 0.909771686048764
Energy: 1.1075409391820707
Energy: 0.9097716860478189
Energy: 0.9661531568134492
Energy: 0.7042268099710376
Energy: 1.1043352812884184
Energy: 0.7042268099719827
Energy: 0.9662083604995496
Energy: 0.9097451997867989
Energy: 1.1059186954769233
Energy: 0.909745199787744
Energy: 0.9846135233679398
Energy: 0.6302481858353137
Energy: 1.1027813823506225
Energy: 0.6302481858343685
Energy: 0.800593355783045
Energy: 0.6305491700757471
Energy: 1.24852842978243
Energy: 0.6305491700757471
Energy: 0.80286032818523
Energy: 0.6312473859032501
Energy: 1.2487908903696805
Energy: 0.6312473859051404
Energy: 0.63044594222919
Energy: 0.630268172740869
Energy: 1.1630610755480775
Energy: 0.6302681727427593
Energy: 0.6347902049282403
Energy: 0.6314595199046098
Energy: 1.2492548288056036
Energy: 0.6314595199074452
Energy: 0.6323284680050094
Energy: 0.6341586658384281
Energy: 1.2393257091233898
Energy: 0.6341586658374829
Energy: 0.79842496397643
Energy: 0.6298456847518048
Energy: 1.237100517660087
Energy: 0.6298456847508597
Energy: 0.8001902574287848
Energy: 0.6299743577691793
Energy: 1.2480311826329653
Energy: 0.6299743577691793
Energy: 0.8038109475149354
Energy: 0.6318922239274001
Energy: 1.2408171398316916
Energy: 0.6318922239283453
Energy: 1.105442234347559
Energy: 0.6301840326174684
Energy: 1.238495556608935
Energy: 0.6301840326174684
Energy: 0.7981772355639976
Energy: 0.9105909590771214
Energy: 1.1053231975497244
Energy: 0.9105909590752311
Energy: 1.104655404670461
Energy: 0.9096260020393767
Energy: 0.9655913796132685
Energy: 0.9096260020374864
Energy: 1.248079348738043
Energy: 0.9094531582440004
Energy: 0.9656454511586587
Energy: 0.9094531582440004
Energy: 1.164241701537974
Energy: 0.630309931767269
Energy: 0.7988461469821689
Energy: 0.6303099317653788
Energy: 1.2494567096418576
Energy: 0.6296552888451754
Energy: 0.6308643699233357
Energy: 0.6296552888461205
Energy: 1.2438846590437145
Energy: 0.6332254579857084
Energy: 0.8007373775357011
Energy: 0.6332254579838182
Energy: 1.1071090153720522
Energy: 0.6305174524662112
Energy: 0.6301736299254223
Energy: 0.6305174524643209
Energy: 1.247500447350097
Energy: 0.6298886917985281
Energy: 0.6310191008202352
Energy: 0.6298886917985281
Energy: 1.2396452060083867
Energy: 0.6322896994598467
Energy: 0.6309136309783718
Energy: 0.6322896994598467

minimum gb energy = 0.6296552888451754 eV
minimum distance =  2.27342707483185 Angstroms
sigma value = 41


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

Energy: 1.49147250034345
Energy: 0.5978078917900205
Energy: 0.5751767534110519
Energy: 0.5729013755064973
Energy: 1.3171912290484142
Energy: 0.571535178058339
Energy: 0.7125077015653717
Energy: 0.5715351780598535
Energy: 1.317250535586446
Energy: 0.5708799242389763
Energy: 0.7115411421498279
Energy: 0.5708799242374265
Energy: 1.0872271390794648
Energy: 0.5738623529684952
Energy: 0.9663190448328678
Energy: 0.573862352970045
Energy: 1.3220815203973266
Energy: 0.8135738963333106
Energy: 0.9685835659675889
Energy: 0.8135738963348603
Energy: 1.0814874637276883
Energy: 1.0489540194904001
Energy: 0.9673760602654818
Energy: 1.048954019491175
Energy: 1.0870767149919753
Energy: 1.0461413624060427
Energy: 1.2020578515302272
Energy: 1.0461413624075926
Energy: 1.0895881990209935
Energy: 1.050559692862781
Energy: 0.9642949498345242
Energy: 1.0505596928635559
Energy: 0.8478361808056731
Energy: 0.5715823216108163
Energy: 1.2003096038001586
Energy: 0.5715823216108163
Energy: 0.8485948742090631
Energy: 0.8132664553562431
Energy: 1.324650242117231
Energy: 0.8132664553554682
Energy: 0.709873753995612
Energy: 0.5738286031885116
Energy: 1.1982461601086385
Energy: 0.5738286031885116
Energy: 0.70945807011685
Energy: 0.570073008497535
Energy: 1.3240698448318802
Energy: 0.5700730084983099
Energy: 0.7163561523700426
Energy: 0.5732944278081651
Energy: 1.3243894801729894
Energy: 0.5732944278081651
Energy: 0.5701144106999256
Energy: 0.5765771378963188
Energy: 1.1978629521648012
Energy: 0.576577137894769
Energy: 0.572856798642446
Energy: 0.5711939098936849
Energy: 1.321934447691413
Energy: 0.5711939098936849
Energy: 0.5760942559409978
Energy: 0.5734513884372816
Energy: 1.3175119646276743
Energy: 0.5734513884380564
Energy: 0.7092722271911599
Energy: 0.5752643433180188
Energy: 1.3140140709994585
Energy: 0.5752643433203435
Energy: 0.7072753694650613
Energy: 0.7102642340044544
Energy: 1.3212574059237772
Energy: 0.7102642338843861
Energy: 0.7134249329660636
Energy: 0.5744091209423319
Energy: 1.0839746504407972
Energy: 0.5744091209423319
Energy: 0.9694779067932044
Energy: 0.5725696592598533
Energy: 1.0821007115419436
Energy: 0.572569659261403
Energy: 0.9663138472221201
Energy: 0.8149029067070714
Energy: 1.2025503965755175
Energy: 0.8149029067070714
Energy: 0.9700437423432622
Energy: 1.048745096925994
Energy: 1.0865281773689113
Energy: 1.048745096925994
Energy: 1.200383871909784
Energy: 1.0422474778937239
Energy: 1.0807086228945324
Energy: 1.0422474778952737
Energy: 0.9682017943445113
Energy: 1.049920688017722
Energy: 0.9710349946522701
Energy: 1.049920688017722
Energy: 1.2025717826939464
Energy: 0.5714612679253944
Energy: 0.8394191864522085
Energy: 0.5714612679246196
Energy: 1.2010979722071389
Energy: 0.5722369636207448
Energy: 0.9685631820566207
Energy: 0.5722369636230693
Energy: 1.2032723726143622
Energy: 0.5728427452680983
Energy: 0.7106386261727737
Energy: 0.5728427452688732
Energy: 1.3212697304969352
Energy: 0.7107214221964736
Energy: 0.7062429097750894
Energy: 0.7107136351899745
Energy: 1.2026196795488293
Energy: 0.5777894761874842
Energy: 0.7095712843547105
Energy: 0.5777894761874842
Energy: 1.2005819784860383
Energy: 0.576096508158944
Energy: 0.5705001613892762
Energy: 0.5760965081597189
Energy: 1.322013107065194
Energy: 0.5713317694347582
Energy: 0.5724066870653458
Energy: 0.5713317694347582
Energy: 1.3140040354640596
Energy: 0.5773461714661455
Energy: 0.5712656706762022
Energy: 0.5773461714645959

minimum gb energy = 0.570073008497535 eV
minimum distance =  2.27861275536206 Angstroms
sigma value = 15


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

Energy: 1.2852869614714544
Energy: 0.5472376472935676
Energy: 0.8331322697376947
Energy: 0.5274641254454349
Energy: 1.3791385885901744
Energy: 0.5259360463483634
Energy: 0.6472736619895265
Energy: 0.5259360463477071
Energy: 1.3710019627843355
Energy: 0.5248319903354781
Energy: 0.6465657896082043
Energy: 0.5248319903354781
Energy: 1.1737127647299916
Energy: 0.5283741240877274
Energy: 0.8623585227789601
Energy: 0.5283741240851018
Energy: 1.2760715301394743
Energy: 0.5254204897176894
Energy: 0.8633605358158075
Energy: 0.525420489717033
Energy: 1.1677347142066967
Energy: 0.5241208704405342
Energy: 0.8636936802913141
Energy: 0.5241208704392214
Energy: 0.965749639346377
Energy: 0.764151796926873
Energy: 1.0710889632147338
Energy: 0.7641517969242472
Energy: 1.0731963729537208
Energy: 0.9627978224906608
Energy: 0.858873517741798
Energy: 0.9627978224867223
Energy: 0.9639332938559181
Energy: 0.9594468635420774
Energy: 1.065762304239538
Energy: 0.9594468635414211
Energy: 0.9629359723788352
Energy: 0.9582811930753905
Energy: 1.269076761985377
Energy: 0.9582811930734212
Energy: 0.8726364466948949
Energy: 0.7651527365444861
Energy: 1.0733046565881388
Energy: 0.7651527365398912
Energy: 0.7589050336567476
Energy: 0.5251131167659954
Energy: 1.2691950311315614
Energy: 0.5251131167627133
Energy: 0.8654858768130809
Energy: 0.5268087245141714
Energy: 1.268240363686144
Energy: 0.526808724510233
Energy: 0.6433623697975418
Energy: 0.5282821650538168
Energy: 1.0713240684795127
Energy: 0.5282821650465962
Energy: 0.6378601182476717
Energy: 0.5239122971319751
Energy: 1.3757347549521048
Energy: 0.5239122971319751
Energy: 0.6521066760355128
Energy: 0.528207802195599
Energy: 1.2701988738136123
Energy: 0.5282078021942862
Energy: 0.5243528514413518
Energy: 0.530780687198297
Energy: 1.2735655606365366
Energy: 0.5307806872002663
Energy: 0.5239806252158188
Energy: 0.524081565587554
Energy: 1.375514407350553
Energy: 0.5240815655862412
Energy: 0.533170594911929
Energy: 0.5279584446944127
Energy: 1.1707009356524516
Energy: 0.5279584446924434
Energy: 0.6483288917548011
Energy: 0.529029454889684
Energy: 1.3725779979660337
Energy: 0.5290294548903404
Energy: 0.635903930731764
Energy: 0.5241626153812509
Energy: 1.3764702005894507
Energy: 0.5241626153871586
Energy: 0.6498075779875181
Energy: 0.5277420127718058
Energy: 1.1721159346349266
Energy: 0.5277420127718058
Energy: 0.8656130007310923
Energy: 0.5277010665850517
Energy: 1.1658955071355144
Energy: 0.5277010665863645
Energy: 0.8649720514781677
Energy: 0.5263897363899799
Energy: 1.271713940230642
Energy: 0.5263897363893234
Energy: 0.8712621955165797
Energy: 0.764943798257724
Energy: 0.9706081519207688
Energy: 0.7649437982570676
Energy: 1.0661921455603869
Energy: 0.9594401797337084
Energy: 1.2713508328471033
Energy: 0.9594401797356777
Energy: 0.8628628459742161
Energy: 0.5778216390913162
Energy: 1.0678988309197546
Energy: 0.577821639089347
Energy: 1.0728059363212434
Energy: 0.964142836536034
Energy: 0.9697270934473681
Energy: 0.9641428365347213
Energy: 1.0681911324194322
Energy: 0.7640018801322449
Energy: 1.067423274051059
Energy: 0.7640018801302757
Energy: 1.065655655399371
Energy: 0.7629708793931546
Energy: 0.8652015804616486
Energy: 0.762970879393811
Energy: 1.275731229357333
Energy: 0.525390952426394
Energy: 0.7588987205060791
Energy: 0.5253909524237684
Energy: 1.070453225839627
Energy: 0.5277896442176697
Energy: 0.8730753071128726
Energy: 0.5277896442196389
Energy: 1.2686994575214523
Energy: 0.5276725073923748
Energy: 0.6450381298992499
Energy: 0.5276725073923748
Energy: 1.3745863795199222
Energy: 0.5254857254444425
Energy: 0.6463337665615613
Energy: 0.5254857254431298
Energy: 1.2669916284880482
Energy: 0.5303018069500669
Energy: 0.5373871871737144
Energy: 0.5303018069494105
Energy: 1.3752714932111152
Energy: 0.5264296582055623
Energy: 0.5278178027959302
Energy: 0.526429658208188
Energy: 1.3687763257144085
Energy: 0.5269295497182688
Energy: 0.5291135791787726
Energy: 0.5269295497156431

minimum gb energy = 0.5239122971319751 eV
minimum distance =  2.28079099723805 Angstroms
sigma value = 85


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

Energy: 1.4354440975763159
Energy: 0.508705377555397
Energy: 0.4991536037235742
Energy: 0.4989432882164302
Energy: 1.402018567248274
Energy: 0.47379350259675546
Energy: 0.5747372763792651
Energy: 0.4737935025956168
Energy: 1.2624751918091077
Energy: 0.4733360850395621
Energy: 0.5745393943490584
Energy: 0.47333608504127
Energy: 1.078305555190918
Energy: 0.4717525188279529
Energy: 0.7702200308654843
Energy: 0.4717525188251063
Energy: 1.3108880873880266
Energy: 0.4718497483533938
Energy: 0.7701263747921739
Energy: 0.4718497483539631
Energy: 1.082424352924681
Energy: 0.4724427350181963
Energy: 0.7721336815330901
Energy: 0.4724427350199042
Energy: 1.0812181454781218
Energy: 0.697499970799235
Energy: 0.9504101385319607
Energy: 0.6974999707998043
Energy: 1.1316521173974983
Energy: 0.6969296651419638
Energy: 0.8140455430022271
Energy: 0.6969296651413944
Energy: 1.0838006577926222
Energy: 0.8839620641403544
Energy: 0.9514267316609508
Energy: 0.8839620641420624
Energy: 1.0860917336406912
Energy: 0.891030604594953
Energy: 1.130988717710295
Energy: 0.8910306045955223
Energy: 0.9517502070460933
Energy: 0.8905129669521119
Energy: 0.9923640788693133
Energy: 0.8905129669532506
Energy: 0.9059955226216639
Energy: 0.4720348790913424
Energy: 1.1316981869955316
Energy: 0.4720348790828028
Energy: 0.9516203073511437
Energy: 0.4721036227987667
Energy: 1.173511118867146
Energy: 0.472103622801044
Energy: 0.7720398247874671
Energy: 0.4729491954409966
Energy: 0.9892319546774494
Energy: 0.4729491954398579
Energy: 0.7185526471883508
Energy: 0.47246217524134876
Energy: 1.3105554244147726
Energy: 0.47246217524419537
Energy: 0.772268131877471
Energy: 0.47299816713099596
Energy: 1.1726064221347987
Energy: 0.47299816713213466
Energy: 0.5722765692988891
Energy: 0.4733567714780173
Energy: 1.1705903804794684
Energy: 0.47335677147630933
Energy: 0.5729753713625074
Energy: 0.4723118812553122
Energy: 1.3619519833136664
Energy: 0.47231188125360435
Energy: 0.5722652873202803
Energy: 0.47210076891627917
Energy: 1.3496972835942285
Energy: 0.47210076891343267
Energy: 0.5197009704114703
Energy: 0.472980927630408
Energy: 1.3496844546920044
Energy: 0.47298092763097727
Energy: 0.5209399780426534
Energy: 0.46977619622484984
Energy: 1.3973450160704894
Energy: 0.4697761962265578
Energy: 0.5209204142557979
Energy: 0.4698281408688874
Energy: 1.2147024416550314
Energy: 0.46982814086945673
Energy: 0.6242826503754829
Energy: 0.46959846049959547
Energy: 1.3949306814774143
Energy: 0.46959846049845694
Energy: 0.620596721052026
Energy: 0.47203794906930857
Energy: 1.397441970889083
Energy: 0.47203794906873925
Energy: 0.6237028525357191
Energy: 0.46930179218363954
Energy: 1.07837103112407
Energy: 0.46930179218534745
Energy: 0.7672600857072516
Energy: 0.4722202672879667
Energy: 1.401464700613753
Energy: 0.47222026728739736
Energy: 0.7665665644728366
Energy: 0.4717632493283626
Energy: 1.263538579228672
Energy: 0.47176324932950126
Energy: 0.8788174358173626
Energy: 0.4719225118746382
Energy: 1.081250393373588
Energy: 0.47192251187236095
Energy: 0.9545668721784575
Energy: 0.8018699911086398
Energy: 1.2723523682365423
Energy: 0.8018699911131942
Energy: 0.9529152908794117
Energy: 0.8075060996461915
Energy: 1.0838292822060545
Energy: 0.8075060996496074
Energy: 1.1320734700277675
Energy: 0.8872058141750373
Energy: 0.903203404852715
Energy: 0.8872058141756066
Energy: 0.9921925637464576
Energy: 0.8872469693266599
Energy: 1.1020627766515392
Energy: 0.8872469693260906
Energy: 1.1320672426308431
Energy: 0.7041390761418039
Energy: 0.9035534010268703
Energy: 0.7041390761418039
Energy: 1.311106293896049
Energy: 0.6953924184897229
Energy: 0.9046298685383349
Energy: 0.6953924184874457
Energy: 0.989355525845724
Energy: 0.4717701383471198
Energy: 0.7698112566024709
Energy: 0.47177013834882775
Energy: 1.310119203049161
Energy: 0.47172183752159585
Energy: 0.7702957831662807
Energy: 0.47172183752159585
Energy: 1.3519163924805522
Energy: 0.47236848679597765
Energy: 0.7714910431480012
Energy: 0.4723684867954084
Energy: 1.170529473698138
Energy: 0.47180508831386814
Energy: 0.5755708708006521
Energy: 0.47180508831557605
Energy: 1.4024916327518349
Energy: 0.4718080725062187
Energy: 0.5737566046645366
Energy: 0.4718080725090653
Energy: 1.3497146610881592
Energy: 0.4718014438841728
Energy: 0.5757240373194584
Energy: 0.4718014438847421
Energy: 1.167721206798635
Energy: 0.471978152964292
Energy: 0.47478403134824504
Energy: 0.4719781529603069
Energy: 1.403186217593442
Energy: 0.47186450904668964
Energy: 0.47246703074750995
Energy: 0.4718645090472589
Energy: 1.2594004881723138
Energy: 0.47211849443402626
Energy: 0.4736035606402148
Energy: 0.47211849443345694

minimum gb energy = 0.46930179218363954 eV
minimum distance =  2.27307690031677 Angstroms
sigma value = 113


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

Energy: 0.01413702625016087
Energy: 0.015418603610363906
Energy: 1.1055644153323432
Energy: 0.4502159701450679
Energy: 0.01479969485569247
Energy: 0.11169830205236726
Energy: 0.764408954414075
Energy: 0.11169830205195391
Energy: 0.014754941857239086
Energy: 0.11023264856275766
Energy: 0.7626493799728591
Energy: 0.11023264856317103
Energy: 0.015706914185996845
Energy: 0.10954343748978193
Energy: 0.761142440536513
Energy: 0.1095434374902196
Energy: 0.7638241729379369
Energy: 0.11141778441484726
Energy: 0.7623070012289674
Energy: 0.11141778441613592
Energy: 0.014744842482559889
Energy: 0.11006405210866925
Energy: 0.7624884869340437
Energy: 0.11006405210866925

minimum gb energy = 0.01413702625016087 eV
minimum distance =  2.54014754861986 Angstroms
sigma value = 1