Model name: model_name=EAM_Dynamo_FarkasCaro_2018_FeNiCrCoCu__MO_803527979660_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.620000052452088
cohesive_energy=3.5402783780697282
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013655873398615738
Energy: 0.013934039385605895
Energy: 0.31558594564752906
Energy: 0.013934039385605895
Energy: 0.01393403938619663
Energy: 0.49128606968149896
Energy: 0.013934039385605895
Energy: 0.49128606968149896
Energy: 0.3155859456469036
Energy: 0.01393403938619663
Energy: 0.013655873398615738
Energy: 0.01393403938619663
Energy: 0.01393403938619663
Energy: 0.49128606968149896
Energy: 0.013934039385605895
Energy: 0.49128606968149896

minimum gb energy = 0.013655873398615738 eV
minimum distance =  2.4602225644311 Angstroms
sigma value = 1


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

Energy: 0.7768323275208818
Energy: 0.8308384026737865
Energy: 0.8965627640166328
Energy: 0.8308384026737865
Energy: 0.7525447910512336
Energy: 0.8723757292250088
Energy: 0.7676843050226009
Energy: 0.8723757292257673
Energy: 0.7583103968919969
Energy: 0.8229539219604483
Energy: 0.7729817046907471
Energy: 0.8229539219604483
Energy: 0.7658688834913248
Energy: 0.8469764760733595
Energy: 0.7640613708628143
Energy: 0.8469764760741181
Energy: 0.7697273188886947
Energy: 0.8475304253430892
Energy: 0.7712218286484587
Energy: 0.8475304253423307
Energy: 0.7508700371305941
Energy: 0.806812212208177
Energy: 0.7187874665116563
Energy: 0.8068122122089356
Energy: 0.7719270436057667
Energy: 0.8470025468403523
Energy: 0.7473751172866484
Energy: 0.8470025468395936
Energy: 0.7207417669331891
Energy: 0.8457084679433512
Energy: 0.7217474548052925
Energy: 0.8457084679448684
Energy: 0.7544352088294692
Energy: 0.842818776768521
Energy: 0.7669426222226762
Energy: 0.842818776768521
Energy: 0.7166456212855554
Energy: 0.8258234137541709
Energy: 0.7226836663488176
Energy: 0.8258234137526538
Energy: 0.7858696566657934
Energy: 0.8718217452323289
Energy: 0.765342436035122
Energy: 0.8718217452338461
Energy: 0.7979637649875643
Energy: 0.8399732821890686
Energy: 0.7205740293216114
Energy: 0.8399732821890686
Energy: 0.7659799915624107
Energy: 0.8750646217703482
Energy: 0.7882486888851467
Energy: 0.8750646217703482
Energy: 0.767990978119711
Energy: 0.8052017951553365
Energy: 0.7462528632414053
Energy: 0.8052017951553365
Energy: 0.7901424971957232
Energy: 0.8671011829845637
Energy: 0.8507578632162536
Energy: 0.8671011829845637
Energy: 0.7821872251395611
Energy: 0.8750892317839892
Energy: 0.768043845036135
Energy: 0.8750892317847477
Energy: 0.7731001893334413
Energy: 0.8254845583249577
Energy: 0.7222978482870144
Energy: 0.8254845583249577
Energy: 0.7674648888900123
Energy: 0.8737462889404685
Energy: 0.7864807717303318
Energy: 0.8737462889404685
Energy: 0.7295594256882139
Energy: 0.8314647020123375
Energy: 0.7195281335645924
Energy: 0.8314647020123375
Energy: 0.766116978940809
Energy: 0.7700311313952037
Energy: 0.7650663169527776
Energy: 0.7700311313914107
Energy: 0.7196971240153499
Energy: 0.8236335661956278
Energy: 0.7205956040576855
Energy: 0.8236335661963864
Energy: 0.775558177021559
Energy: 0.8109994484380406
Energy: 0.7843808898314955
Energy: 0.8109994484372821
Energy: 0.7704303487292589
Energy: 0.8382145497917366
Energy: 0.7462576404388029
Energy: 0.838214549790978
Energy: 0.7191135612601974
Energy: 0.8344236506524634
Energy: 0.7515031950725144
Energy: 0.8344236506532219
Energy: 0.7520648589561432
Energy: 0.8062482372578997
Energy: 0.7847097623246269
Energy: 0.8062482372594169
Energy: 0.7669790397536649
Energy: 0.8382778819821336
Energy: 0.7475484630842111
Energy: 0.8382778819813751
Energy: 0.7890719431441147
Energy: 0.8728839936558259
Energy: 0.7644084113939301
Energy: 0.8728839936550674
Energy: 0.7475827817021407
Energy: 0.8232550256025745
Energy: 0.7697502804264388
Energy: 0.823255025601816
Energy: 0.7528360643873769
Energy: 0.8715035442587464
Energy: 0.7664666614789867
Energy: 0.8715035442572291
Energy: 0.7779028820616009
Energy: 0.8318262157054341
Energy: 0.7987968619293386
Energy: 0.8318262157054341
Energy: 0.7967047276857903
Energy: 0.8438856886266208
Energy: 0.7664685753265585
Energy: 0.8438856886266208
Energy: 0.7642409264964611
Energy: 0.8243439529959684
Energy: 0.7679060439813513
Energy: 0.8243439529959684
Energy: 0.7697974966422267
Energy: 0.8066814047518504
Energy: 0.7651419349137805
Energy: 0.8066814047518504

minimum gb energy = 0.7166456212855554 eV
minimum distance =  2.30901799714386 Angstroms
sigma value = 1


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

Energy: 0.8228529621290384
Energy: 0.8788021109116378
Energy: 0.9518831438977775
Energy: 0.8788021109116378
Energy: 0.7924945422560146
Energy: 0.8896233048508815
Energy: 0.8327815034538533
Energy: 0.8896233048534761
Energy: 0.7923738440864033
Energy: 0.8688817208693829
Energy: 0.8297309913934895
Energy: 0.868881720867653
Energy: 0.7470883874691531
Energy: 0.7857896596790327
Energy: 0.7911065219247098
Energy: 0.7857896596747082
Energy: 0.7464104797041174
Energy: 0.8846800732074168
Energy: 0.7569415884844781
Energy: 0.8846800732022274
Energy: 0.839193496556221
Energy: 0.8754993072740946
Energy: 0.7566561415400983
Energy: 0.8754993072723649
Energy: 0.7483166215358691
Energy: 0.7855479589689581
Energy: 0.7908057071351997
Energy: 0.7855479589646336
Energy: 0.7464184349436774
Energy: 0.8470280816290486
Energy: 0.7567495387759587
Energy: 0.8470280816264539
Energy: 0.7563121455045572
Energy: 0.824676125033877
Energy: 0.8334827027189913
Energy: 0.8246761250356068
Energy: 0.7477517796772166
Energy: 0.8735517955514622
Energy: 0.801182870961738
Energy: 0.8735517955523271
Energy: 0.7495912440562849
Energy: 0.9019850991225864
Energy: 0.833214719557733
Energy: 0.9019850991329261
Energy: 0.7501594269610037
Energy: 0.8680782167757523
Energy: 0.8296334256500009
Energy: 0.868078216777482
Energy: 0.8220899677502492
Energy: 0.8839554338228225
Energy: 0.7527053079350303
Energy: 0.8839554338167681
Energy: 0.8218566308541057
Energy: 0.8841502548161948
Energy: 0.752440503110436
Energy: 0.8841502548213844
Energy: 0.7502209051740163
Energy: 0.8684725615113608
Energy: 0.829700335123908
Energy: 0.8684725615096309
Energy: 0.749685910894966
Energy: 0.9019872996476457
Energy: 0.8332093570380928
Energy: 0.9019872996424562
Energy: 0.7477948320507039
Energy: 0.8715981081252837
Energy: 0.7580449684510362
Energy: 0.8715981081244187
Energy: 0.7562898306135172
Energy: 0.8415599880685165
Energy: 0.8334768368676393
Energy: 0.8415599880693814
Energy: 0.746362691637969
Energy: 0.8471852100470098
Energy: 0.7567286255133207
Energy: 0.8471852100418202
Energy: 0.7484451733837104
Energy: 0.7855082316357083
Energy: 0.7909004063452635
Energy: 0.7855082316357083
Energy: 0.8392514467775888
Energy: 0.8754247955206343
Energy: 0.7566576292876487
Energy: 0.8754247955249589
Energy: 0.7464390663010463
Energy: 0.8846349052323172
Energy: 0.7568157406049818
Energy: 0.8846349052357768
Energy: 0.7474285483030444
Energy: 0.7857448551792275
Energy: 0.7909448514684752
Energy: 0.7857448551809573
Energy: 0.7924489555483469
Energy: 0.8685799626064217
Energy: 0.8297803986136496
Energy: 0.8685799626090164
Energy: 0.7927725641050204
Energy: 0.8899349023298426
Energy: 0.8327574423446711
Energy: 0.8899349023281128
Energy: 0.8228529621290384
Energy: 0.8788021109116378
Energy: 0.9518831438977775
Energy: 0.8788021109107729
Energy: 0.7924945422560146
Energy: 0.8896233048508815
Energy: 0.8327815034547181
Energy: 0.8896233048534761
Energy: 0.7923738440855385
Energy: 0.8688817208693829
Energy: 0.8297309913934895
Energy: 0.868881720867653
Energy: 0.7470883874682882
Energy: 0.7857896596781677
Energy: 0.7911065219247098
Energy: 0.7857896596747082

minimum gb energy = 0.746362691637969 eV
minimum distance =  2.31040849390975 Angstroms
sigma value = 25


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

Energy: 0.7956628295729964
Energy: 0.8993283765383164
Energy: 1.0141107703951342
Energy: 0.8993283765393218
Energy: 0.783434008747867
Energy: 0.8724897886243712
Energy: 0.7821532301897185
Energy: 0.8724897886253765
Energy: 0.7907255530910615
Energy: 0.9326078936217489
Energy: 0.7845632801907361
Energy: 0.9326078936217489
Energy: 0.7909937553493962
Energy: 0.8503413361707948
Energy: 0.7841405679897545
Energy: 0.8503413361707948
Energy: 0.8252983142108946
Energy: 0.9089402704052416
Energy: 0.7864039091570342
Energy: 0.9089402704052416
Energy: 0.8802990107010615
Energy: 0.9269691890235887
Energy: 0.7860483454404822
Energy: 0.9269691890225834
Energy: 0.7828135045228529
Energy: 0.7885709750523842
Energy: 0.7965762194126268
Energy: 0.7885709750533896
Energy: 0.9775458497273944
Energy: 0.9212524348366942
Energy: 0.7713085691529262
Energy: 0.9212524348366942
Energy: 0.7967059460242552
Energy: 0.9223249341861993
Energy: 0.7826877568547619
Energy: 0.9223249341872047
Energy: 0.7871883614206556
Energy: 0.9259914051508626
Energy: 0.7794018743644214
Energy: 0.9259914051508626
Energy: 0.7901021154444766
Energy: 0.9199665322162135
Energy: 0.8809742295090328
Energy: 0.9199665322152082
Energy: 0.7898466980816864
Energy: 0.8934946795478862
Energy: 0.8805691075149908
Energy: 0.8934946795478862
Energy: 0.7843964515279938
Energy: 0.85092267046987
Energy: 0.7807283923519319
Energy: 0.8509226704708753
Energy: 0.7965218784219423
Energy: 0.8567655210856627
Energy: 0.7843638152091682
Energy: 0.8567655210846573
Energy: 0.7888042416698335
Energy: 0.9108198923041192
Energy: 0.7692113372377062
Energy: 0.9108198923041192
Energy: 0.7827472226444689
Energy: 0.7915197744452349
Energy: 0.7827139649581558
Energy: 0.7915197744452349
Energy: 0.7704420616212868
Energy: 0.930581623119513
Energy: 0.7697645542066867
Energy: 0.9305816231185076
Energy: 0.7840865397711356
Energy: 0.9082234744543639
Energy: 0.789704882421042
Energy: 0.9082234744563749
Energy: 0.7760313284749936
Energy: 0.8502755129976236
Energy: 0.8251632016365672
Energy: 0.8502755129976236
Energy: 0.7870493176310043
Energy: 0.9287816660359581
Energy: 0.7821387115648292
Energy: 0.9287816660349525
Energy: 0.792058668228533
Energy: 0.8755370569541847
Energy: 0.7821904692747392
Energy: 0.8755370569541847
Energy: 0.796243347769025
Energy: 0.909745146262219
Energy: 0.8869954586743956
Energy: 0.909745146262219
Energy: 0.7827183463694712
Energy: 0.9216639545425811
Energy: 0.7841211114916008
Energy: 0.9216639545425811
Energy: 0.7900954548946693
Energy: 0.9109188286405858
Energy: 0.7864185656601483
Energy: 0.9109188286405858
Energy: 0.7839207463201435
Energy: 0.874648027138383
Energy: 0.7838550072799968
Energy: 0.874648027138383

minimum gb energy = 0.7692113372377062 eV
minimum distance =  2.32368480539738 Angstroms
sigma value = 9


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

Energy: 0.826182826889288
Energy: 0.8268704477494916
Energy: 1.087069931242966
Energy: 0.8268704477494916
Energy: 0.8143806116473438
Energy: 0.9007582957522211
Energy: 0.8526493930120249
Energy: 0.9007582957474235
Energy: 0.7851532443015266
Energy: 0.8230316691022493
Energy: 0.8299208851388061
Energy: 0.8230316691046483
Energy: 0.8224545541442312
Energy: 0.90821115676113
Energy: 0.7895318096467197
Energy: 0.9082111567623294
Energy: 0.9296611359823824
Energy: 0.8975141631767501
Energy: 0.8305535731442186
Energy: 0.8975141631755508
Energy: 0.7850121097859714
Energy: 0.8314892660181749
Energy: 0.7863149248903908
Energy: 0.831489266015776
Energy: 0.8367229883660017
Energy: 0.8832493643528353
Energy: 0.7896840123825742
Energy: 0.883249364349237
Energy: 0.9202180169090273
Energy: 0.8318952922356151
Energy: 0.7865304228721575
Energy: 0.8318952922356151
Energy: 0.8456125410846517
Energy: 0.9008652790932413
Energy: 0.8311752137659105
Energy: 0.9008652790932413
Energy: 0.8264806321065025
Energy: 0.8276994030621052
Energy: 0.794614183051776
Energy: 0.8276994030633047
Energy: 0.8086320995191243
Energy: 0.8970546950089574
Energy: 0.8299939619270131
Energy: 0.8970546950113291
Energy: 0.8265505645349535
Energy: 0.9588764478571692
Energy: 0.7897235828164471
Energy: 0.9588764478559697
Energy: 0.7853893260600615
Energy: 0.8268068671977832
Energy: 0.810860520128849
Energy: 0.8268068671989827
Energy: 0.819644228419886
Energy: 0.8216218528199192
Energy: 0.8438593566041311
Energy: 0.8216218528187199
Energy: 0.7853811290203768
Energy: 0.8269331049308939
Energy: 0.9201169374406015
Energy: 0.8269331049320933
Energy: 0.8265451186147752
Energy: 0.9586555382805055
Energy: 0.7897290124437941
Energy: 0.9586555382829043
Energy: 0.8086360166848493
Energy: 0.8971526270005322
Energy: 0.8299553854094426
Energy: 0.8971526270029039
Energy: 0.8265386887457802
Energy: 0.8272504301063652
Energy: 0.7943740702634158
Energy: 0.8272504301063652
Energy: 0.8454515600177981
Energy: 0.9008474760040441
Energy: 0.8314120220798439
Energy: 0.9008474759992738
Energy: 0.9203296326633091
Energy: 0.832357073717739
Energy: 0.7865327297364579
Energy: 0.8323570737225366
Energy: 0.8365848419343486
Energy: 0.8830596415963504
Energy: 0.7896190196535404
Energy: 0.8830596415975499

minimum gb energy = 0.7850121097859714 eV
minimum distance =  2.36915774246847 Angstroms
sigma value = 25


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

Energy: 0.7929530219190991
Energy: 0.964990353756378
Energy: 1.1621873900790236
Energy: 0.964990353756378
Energy: 0.7823819816741178
Energy: 0.9007153406043278
Energy: 0.7848325299303713
Energy: 0.9007153406028443
Energy: 0.7871213156973225
Energy: 0.9658281107345064
Energy: 0.7875183243006689
Energy: 0.9658281107330231
Energy: 0.7911631870559906
Energy: 0.965820769929565
Energy: 0.9463973223457034
Energy: 0.9658207699280815
Energy: 0.9445897874349658
Energy: 0.7842337566479145
Energy: 0.7855742584029733
Energy: 0.7842337592232815
Energy: 0.7880736851151697
Energy: 0.9644777495093592
Energy: 0.7895161415984197
Energy: 0.9644777495108426
Energy: 0.7849212212975355
Energy: 0.9049343379904348
Energy: 0.7896543209670464
Energy: 0.9049343379904348
Energy: 0.9399221220028934
Energy: 0.9678495335290676
Energy: 0.7935786146987174
Energy: 0.9678495335305509
Energy: 0.7871006477982516
Energy: 0.8787996403115909
Energy: 0.7844317032494518
Energy: 0.8787996403115909
Energy: 0.9518885224190411
Energy: 0.8333739874179023
Energy: 0.7900235885314407
Energy: 0.8333739873912026
Energy: 0.9609777601819655
Energy: 0.8176513893444041
Energy: 1.0985664641635104
Energy: 0.8176513893444041
Energy: 0.7853587620874599
Energy: 0.8022686274233598
Energy: 0.952404533632208
Energy: 0.8022686274322596
Energy: 0.9491378507550361
Energy: 0.8423453943168457
Energy: 0.7872538935161097
Energy: 0.8423453946875052
Energy: 0.7851260246352068
Energy: 0.9039379185961156
Energy: 0.791119583964657
Energy: 0.9039379185975989
Energy: 0.7843714817639935
Energy: 0.7849330044171698
Energy: 0.9414641754006361
Energy: 0.7849330044379024
Energy: 0.7829752513939313
Energy: 0.9759174999386682
Energy: 0.7879555395295341
Energy: 0.9759174999371848
Energy: 0.7862374336817282
Energy: 0.8523455188605737
Energy: 0.9508798772618171
Energy: 0.852345518862057

minimum gb energy = 0.7823819816741178 eV
minimum distance =  2.37869347145118 Angstroms
sigma value = 17


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

Energy: 0.8486346206083866
Energy: 0.8504890657151372
Energy: 1.1742556439030154
Energy: 0.8504890657159772
Energy: 0.9454701038728421
Energy: 0.8537280211941827
Energy: 0.7949836754360707
Energy: 0.8537280211941827
Energy: 0.9449891539525075
Energy: 0.9381264960653201
Energy: 0.7967461774111103
Energy: 0.93812649606448
Energy: 0.7988868190530334
Energy: 0.9182626885915919
Energy: 0.8754037923750901
Energy: 0.9182626885907518
Energy: 0.9558678787684473
Energy: 0.851630435848503
Energy: 0.7950678692510526
Energy: 0.8516304358476628
Energy: 0.7980725436573002
Energy: 0.806307252156268
Energy: 0.9459190511107974
Energy: 0.8063072521554279
Energy: 0.7944225965214436
Energy: 0.8711845621110077
Energy: 0.7978847027927004
Energy: 0.8711845621101677
Energy: 0.9533943517311759
Energy: 0.8187690948683667
Energy: 0.7990661057891403
Energy: 0.8187690948448827
Energy: 0.8000744360110547
Energy: 0.8510180490091729
Energy: 0.9666434828602908
Energy: 0.8510180490200938
Energy: 1.04673554261325
Energy: 0.8301191452363754
Energy: 0.8055376867553257
Energy: 0.8301191452304949
Energy: 0.7999913121988675
Energy: 0.9090333913823699
Energy: 0.9495318895000237
Energy: 0.9090333913815297
Energy: 0.7954146107438729
Energy: 0.852412266997085
Energy: 0.7963944977208928
Energy: 0.852412266997085
Energy: 0.9420124621220778
Energy: 0.8432967095672171
Energy: 0.8605897839921856
Energy: 0.8432967095663771
Energy: 0.8050510976542271
Energy: 0.8554023507964731
Energy: 0.9459056665373802
Energy: 0.8554023507964731
Energy: 0.8779776943938252
Energy: 0.8902824385127278
Energy: 0.8008311240707555
Energy: 0.8902824385127278
Energy: 0.9467805688776533
Energy: 0.8059650407003975
Energy: 0.9527623634605674
Energy: 0.8059650406953571
Energy: 0.7982583160074717
Energy: 0.8673064150302
Energy: 1.0390129147117908
Energy: 0.8673064150302
Energy: 0.9314237991685775
Energy: 0.8460443894730899
Energy: 0.801482675747513
Energy: 0.8460443894764503
Energy: 0.8005848159451303
Energy: 0.8507250163866195
Energy: 0.859009886955189
Energy: 0.8507250163840993
Energy: 0.8006062813723033
Energy: 0.9352432357260486
Energy: 0.8028805940370931
Energy: 0.9352432357252085
Energy: 0.8759269138147338
Energy: 0.8721706264737268
Energy: 0.9452010048874542
Energy: 0.8721706264745669
Energy: 0.7964664599690192
Energy: 0.9766843387181371
Energy: 1.0503172597474533
Energy: 0.9766843387181371
Energy: 0.9771797336680871
Energy: 0.9098202557788965
Energy: 0.7990735538795838
Energy: 0.9098202557814168
Energy: 0.8004458442269557
Energy: 0.8515657241839886
Energy: 0.9414270243541751
Energy: 0.8515657241856305
Energy: 0.7940507155128187
Energy: 0.8780373900368607
Energy: 0.9425560301433888
Energy: 0.8780373900645451
Energy: 0.9747742222411979
Energy: 0.8498792224198932
Energy: 0.7990940869078828
Energy: 0.8498792224190531
Energy: 0.7951076105058823
Energy: 0.9753989370722581
Energy: 1.0581520245140146
Energy: 0.9753989370730982
Energy: 0.9541368442622132
Energy: 0.8070850714284081
Energy: 0.9461576781432608
Energy: 0.8070850714300883
Energy: 0.9415168522094515
Energy: 0.9363551622247417
Energy: 0.803468547513666
Energy: 0.9363551622222214
Energy: 0.7986781557353266
Energy: 0.851090733435579
Energy: 0.9351448970878073
Energy: 0.851090733434739

minimum gb energy = 0.7940507155128187 eV
minimum distance =  2.36069593897893 Angstroms
sigma value = 53


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

Energy: 0.7241069180523475
Energy: 0.7261978390503713
Energy: 1.2104449053933986
Energy: 0.7261978390484372
Energy: 0.92113782377944
Energy: 0.7918172807305278
Energy: 0.7516914858220857
Energy: 0.7918172807324618
Energy: 0.7245050753513314
Energy: 0.7246207770977817
Energy: 0.7513514407196583
Energy: 0.7246207771016497
Energy: 0.7244354227600399
Energy: 0.7246209458361093
Energy: 0.7514143442652619
Energy: 0.7246209458399773
Energy: 0.9211329212378683
Energy: 0.7934326290518968
Energy: 0.7517885847616115
Energy: 0.7934326290538309
Energy: 0.7241069180523475
Energy: 0.7261978390503713
Energy: 1.2104449053953326
Energy: 0.7261978390503713
Energy: 0.92113782377944
Energy: 0.7918172807305278
Energy: 0.7516914858220857
Energy: 0.7918172807324618
Energy: 0.7245050753513314
Energy: 0.7246207770977817
Energy: 0.9278764326011129
Energy: 0.7246207770997158
Energy: 0.7244354227600399
Energy: 0.7246209458361093
Energy: 0.7514143442633279
Energy: 0.7246209458399773
Energy: 0.9211329212378683
Energy: 0.7934326290518968
Energy: 0.7517885847596775
Energy: 0.7934326290538309
Energy: 0.7241069180523475
Energy: 0.7261978390503713
Energy: 1.121263156835003
Energy: 0.7261978390484372
Energy: 0.92113782377944
Energy: 0.7918172807305278
Energy: 0.7516914858220857
Energy: 0.7918172807324618
Energy: 0.7245050753513314
Energy: 0.7246207770977817
Energy: 0.9278764326011129
Energy: 0.7246207771016497

minimum gb energy = 0.7241069180523475 eV
minimum distance =  2.37726820968651 Angstroms
sigma value = 9


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

Energy: 0.8144301811464153
Energy: 1.0143106232298786
Energy: 1.2126699708373756
Energy: 1.0143106232291628
Energy: 0.9922956224287296
Energy: 0.8579737891587923
Energy: 0.8167213276334879
Energy: 0.8579737891595081
Energy: 0.8297746381748662
Energy: 0.8656533232354265
Energy: 0.8203143526851426
Energy: 0.8656533232354265
Energy: 0.972723214974891
Energy: 0.8932999743532785
Energy: 0.816885396528556
Energy: 0.8932999743546775
Energy: 0.9596610135115347
Energy: 0.8556578010021684
Energy: 0.806432521045176
Energy: 0.8556578010014525
Energy: 0.8105641959557953
Energy: 0.8124010278336928
Energy: 0.9773959223519995
Energy: 0.8124010278336928
Energy: 1.144063411031169
Energy: 0.8594724957425001
Energy: 0.8164302161881274
Energy: 0.8594724957425001
Energy: 0.8188272765077105
Energy: 0.9233894564680573
Energy: 0.9717062303134292
Energy: 0.9233894564680573
Energy: 0.8325759429858464
Energy: 0.9373276978785642
Energy: 0.8023876839331419
Energy: 0.9373276978814274
Energy: 0.8170195974271924
Energy: 0.8543797659912294
Energy: 0.8067168988555814
Energy: 0.8543797659926612
Energy: 0.8256184771870188
Energy: 0.9255087129446395
Energy: 1.154710784400226
Energy: 0.925508712943208
Energy: 0.9743357529916723
Energy: 1.0489647170342271
Energy: 0.8181496675962303
Energy: 1.0489647170363747
Energy: 0.8281171261523257
Energy: 0.9251483458955367
Energy: 1.0553952421764337
Energy: 0.9251483458969684
Energy: 0.9752319883638652
Energy: 1.0239796220378756
Energy: 0.81788026953471
Energy: 1.0239796220378756
Energy: 0.81850438024264
Energy: 0.917129274050011
Energy: 0.9627470419556902
Energy: 0.917129274050011
Energy: 0.8191819075617873
Energy: 1.0424647656584778
Energy: 0.9715408610469803
Energy: 1.0424647656591937
Energy: 0.8839798781614913
Energy: 0.8158915000557054
Energy: 0.8250637197863069
Energy: 0.8158915000564212
Energy: 0.8175394308449914
Energy: 0.8606516688983895
Energy: 0.957945639952748
Energy: 0.8606516689005369
Energy: 0.9610607797445689
Energy: 0.925021435863722
Energy: 0.8116219633723947
Energy: 0.9250214358630062
Energy: 0.8182391892725375
Energy: 0.8600411658444541
Energy: 0.8926640574185044
Energy: 0.8600411658437384
Energy: 0.9690878094913398
Energy: 1.0369404783605836
Energy: 0.9653040030870543
Energy: 1.0369404783591518
Energy: 0.8898441309230973
Energy: 0.8280391019259379
Energy: 0.8229955166597779
Energy: 0.8280391019259379
Energy: 0.8022978305906333
Energy: 0.9175550429724304
Energy: 0.8325272087238604
Energy: 0.9175550429724304
Energy: 1.180256683884516
Energy: 0.9233609100764928
Energy: 0.8201459203334464
Energy: 0.9233609100764928
Energy: 0.8160876861721107
Energy: 1.0782045554070667
Energy: 1.0686588409861535
Energy: 1.0782045554077826
Energy: 0.8934026433094968
Energy: 0.8666273004966941
Energy: 0.8195316255588743
Energy: 0.8666273004966941
Energy: 0.9639768291081158
Energy: 0.9177903420831329
Energy: 0.981179612059504
Energy: 0.917790342082417
Energy: 0.8080409574520004
Energy: 1.0257422392461606
Energy: 0.9840991800284984
Energy: 1.0257422392461606
Energy: 0.892180145910684
Energy: 0.8137310087482459
Energy: 0.8184174322689212
Energy: 0.8137310087482459
Energy: 0.816619486126155
Energy: 1.0780306235773274
Energy: 1.0698548188538908
Energy: 1.078030623578043
Energy: 1.1038340062728977
Energy: 0.9235711273546358
Energy: 0.8152382360407416
Energy: 0.9235711273546358
Energy: 0.8027610077162127
Energy: 0.8567443087950415
Energy: 0.8046952215746466
Energy: 0.8567443087943256
Energy: 0.8042389281779879
Energy: 0.8152092234611512
Energy: 0.8270306426724681
Energy: 0.8152092234597197
Energy: 0.9721192915319731
Energy: 1.017790097810904
Energy: 0.9692721720439395
Energy: 1.0177900978116199
Energy: 0.8176320777053879
Energy: 0.96593623892185
Energy: 1.1447175375948133
Energy: 0.96593623892185

minimum gb energy = 0.8022978305906333 eV
minimum distance =  2.33649842540134 Angstroms
sigma value = 73


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

Energy: 0.8173173232598756
Energy: 0.8178343716415644
Energy: 1.2196207010751354
Energy: 0.8178343716404287
Energy: 0.8154965674472577
Energy: 0.8922309307249693
Energy: 0.8302653125879842
Energy: 0.892230930726105
Energy: 0.8257507707102403
Energy: 0.9316474947381929
Energy: 0.8255370859877916
Energy: 0.9316474947381929
Energy: 0.8312799525342172
Energy: 0.8871441488178659
Energy: 0.8314526724514204
Energy: 0.8871441488190016
Energy: 0.8132089463711467
Energy: 0.8833237750873278
Energy: 0.8179038023766717
Energy: 0.8833237750884634
Energy: 0.8251776987475226
Energy: 0.8129293175691246
Energy: 1.1377918022809632
Energy: 0.8129293175691246
Energy: 1.1127360237834216
Energy: 1.0387240715077426
Energy: 0.8285800657766632
Energy: 1.0387240715077426
Energy: 0.8357290545682862
Energy: 0.8177513732783895
Energy: 1.1094091085933235
Energy: 0.8177513732783895
Energy: 1.1068803136520593
Energy: 0.8192761827573936
Energy: 0.8084248061721445
Energy: 0.8192761827585292
Energy: 0.8309485770300272
Energy: 0.808060412443588
Energy: 0.807237573929179
Energy: 0.808060412443588
Energy: 0.8349071450769489
Energy: 0.9319308445210065
Energy: 1.1159706770360749
Energy: 0.9319308445210065
Energy: 0.9577213179004634
Energy: 0.8861337496186911
Energy: 0.8353101707964915
Energy: 0.8861337496198266
Energy: 0.8288316920490908
Energy: 0.8846045531719811
Energy: 0.9442782714152501
Energy: 0.8846045531731167
Energy: 1.1695807793853275
Energy: 0.8792857404877432
Energy: 0.8250535552873266
Energy: 0.8792857404877432
Energy: 0.8083678014335828
Energy: 0.8338933927970574
Energy: 0.9590405132249756
Energy: 0.8338933927981932
Energy: 1.1086301756604344
Energy: 0.9313700301645245
Energy: 0.8359950948233816
Energy: 0.9313700301645245
Energy: 0.8079181822732926
Energy: 0.8074041067254872
Energy: 0.8352988591073173
Energy: 0.8074041067254872
Energy: 0.8086198172003678
Energy: 0.8062425477159262
Energy: 0.8242870760995697
Energy: 0.8062425477170618
Energy: 0.8372126812032118
Energy: 0.8172075628668246
Energy: 0.8301697249015104
Energy: 0.8172075628634177
Energy: 0.8295219275600493
Energy: 0.857295226036903
Energy: 1.1113837089709282
Energy: 0.857295226036903
Energy: 1.1850408100603094
Energy: 0.8117618118497021
Energy: 0.8246781835571505
Energy: 0.8117618118508378
Energy: 0.8306509609311793
Energy: 0.8833674269049155
Energy: 0.9440717292104789
Energy: 0.8833674269049155

minimum gb energy = 0.8062425477159262 eV
minimum distance =  2.32254382432357 Angstroms
sigma value = 7


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

Energy: 0.8587762289014613
Energy: 0.857311026840912
Energy: 1.208261396286114
Energy: 0.8573110268401088
Energy: 1.0897946092458832
Energy: 0.9165814372365982
Energy: 0.8507172551358265
Energy: 0.9165814372430227
Energy: 0.8295484924939504
Energy: 0.8609540274987125
Energy: 0.840791075785866
Energy: 0.860954027492288
Energy: 0.882628645664431
Energy: 0.9232161338736784
Energy: 0.8372690520127462
Energy: 0.9232161338728753
Energy: 0.8310274334567104
Energy: 0.9593711482802172
Energy: 0.8460276303623597
Energy: 0.9593711482841959
Energy: 0.8358633454872527
Energy: 0.9613067461706433
Energy: 1.0827332223320236
Energy: 0.9613067461610066
Energy: 0.9684783720011197
Energy: 1.0053442620552648
Energy: 0.8704682555179367
Energy: 1.0053442620496433
Energy: 0.8359883591124659
Energy: 0.852011231178882
Energy: 1.1048786522246345
Energy: 0.85201123118527
Energy: 0.9778909684246744
Energy: 0.9026590249479717
Energy: 0.8379247390575632
Energy: 0.9026590249447595
Energy: 0.8502630577187056
Energy: 0.9116705737839808
Energy: 0.9509799476348949
Energy: 0.9116705737751472
Energy: 0.879037176025489
Energy: 0.855485295697152
Energy: 0.8709278504406798
Energy: 0.8554852956987583
Energy: 0.8560879024686021
Energy: 0.8949397686588147
Energy: 0.8708811953175137
Energy: 0.8949397686596178
Energy: 0.8514121769050476
Energy: 0.8518041190839504
Energy: 0.8771198991926434
Energy: 0.8518041190903748
Energy: 0.869704896894577
Energy: 0.8579942020560394
Energy: 0.8589728524785024
Energy: 0.8579942020552362
Energy: 0.8477810712065155
Energy: 1.048129455254742
Energy: 0.9702057620113863
Energy: 1.0481294552563478
Energy: 1.2050153410833744
Energy: 0.8558468899988853
Energy: 0.8315053742667805
Energy: 0.855846889994067
Energy: 0.8342176451706322
Energy: 0.9560890579195358
Energy: 0.9267876320778927
Energy: 0.9560890579307785
Energy: 0.8365944584187504
Energy: 0.8837976483190603
Energy: 0.8725615851656621
Energy: 0.8837976483134391
Energy: 0.8351136838806895
Energy: 0.9597957322308577
Energy: 0.859541387926276
Energy: 0.9597957322292517
Energy: 0.8391302253735675
Energy: 0.8505382689117644
Energy: 0.8490863368056695
Energy: 0.8505382689133705
Energy: 0.8952203661653401
Energy: 0.955428421514844
Energy: 0.8379792445427077
Energy: 0.9554284215100257
Energy: 0.8355455604997882
Energy: 0.8579057104845631
Energy: 0.962260538330062
Energy: 0.8579057104861693
Energy: 1.0742860237916563
Energy: 0.9027493667827649
Energy: 0.8704078085974293
Energy: 0.9027493667803556
Energy: 0.8532485323856941
Energy: 0.8517050132798282
Energy: 1.0878239484256396
Energy: 0.8517050132822374
Energy: 0.8524646449898012
Energy: 0.8959730948170976
Energy: 0.8637186463803317
Energy: 0.8959730948138854
Energy: 0.8777063715652546
Energy: 0.9601266942208876
Energy: 0.8716940679599997
Energy: 0.9601266942249029
Energy: 0.8406379927320992
Energy: 0.9121626699925357
Energy: 0.9610603468526646
Energy: 0.9121626699917327
Energy: 0.8851237179352772
Energy: 0.9573557439910221
Energy: 0.8371569029132864
Energy: 0.9573557439950372
Energy: 0.8303660267745621
Energy: 0.9614488887102897
Energy: 0.993540651502427
Energy: 0.9614488887175172
Energy: 0.8694696849000593
Energy: 0.9682922400417819
Energy: 0.8507117027751813
Energy: 0.9682922400466002
Energy: 0.8304316345905707
Energy: 0.9615032761070699
Energy: 1.0477972757305951
Energy: 0.9615032761014485

minimum gb energy = 0.8295484924939504 eV
minimum distance =  2.30551800477973 Angstroms
sigma value = 29


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

Energy: 0.8321050396534617
Energy: 0.9102954504238314
Energy: 1.1943324762196286
Energy: 0.9102954504229923
Energy: 0.8401673910732708
Energy: 0.873965108664245
Energy: 0.8325272281151581
Energy: 0.873965108663437
Energy: 0.8496662237211563
Energy: 0.8731114002670327
Energy: 0.930964657388934
Energy: 0.8731114002664733
Energy: 0.8325126163705351
Energy: 0.8779871868552598
Energy: 0.8329793630437216
Energy: 0.8779871868544517
Energy: 0.8325929129953551
Energy: 0.8761630666362663
Energy: 0.9308865556431525
Energy: 0.8761630666359866
Energy: 0.8503291942864643
Energy: 0.9078639611178297
Energy: 0.851468272983162
Energy: 0.9078639611170216
Energy: 0.8494937493115539
Energy: 0.8761966325705299
Energy: 0.8326098960408101
Energy: 0.8761966325710894
Energy: 0.8329568198824991
Energy: 0.8778331736197448
Energy: 0.8326007683753892
Energy: 0.8778331736200246
Energy: 0.9309410335043473
Energy: 0.8731488482533586
Energy: 0.8496901114397243
Energy: 0.8731488482530787

minimum gb energy = 0.8321050396534617 eV
minimum distance =  2.36620391110733 Angstroms
sigma value = 5


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

Energy: 0.8364027899029822
Energy: 0.8726139489589176
Energy: 1.0163792890827155
Energy: 0.8726139489589176
Energy: 0.8353968239767771
Energy: 0.8820505931261666
Energy: 0.8095032884697182
Energy: 0.8820505931269251
Energy: 0.8133104911352244
Energy: 0.932243448084114
Energy: 0.9767956346357323
Energy: 0.9322434480833555
Energy: 0.8282481328861137
Energy: 0.896670287271373
Energy: 0.8152614235662216
Energy: 0.8966702872698558
Energy: 0.8188253035220291
Energy: 0.9034574867578736
Energy: 0.9822744282703653
Energy: 0.9034574867571151
Energy: 0.8845547703582136
Energy: 0.8970750348450242
Energy: 0.809434014092543
Energy: 0.8970750348457827
Energy: 0.8133046985237162
Energy: 0.9019233741330354
Energy: 0.8223196615636417
Energy: 0.9019233741322769
Energy: 0.8108701004286216
Energy: 0.8941536544967892
Energy: 0.8186595471245226
Energy: 0.8941536544929962
Energy: 0.8190757386116291
Energy: 0.9021979829721818
Energy: 0.8275830204613513
Energy: 0.9021979829714231
Energy: 0.817063119027635
Energy: 0.9018952742362092
Energy: 0.8275462501585873
Energy: 0.9018952742354507
Energy: 0.8168463106590966
Energy: 0.9887567172380839
Energy: 0.8169291777761953
Energy: 0.9887567172388425
Energy: 0.8144293371880019
Energy: 0.9211816531052045
Energy: 0.8872625575213228
Energy: 0.9211816531044459
Energy: 0.8932231058530437
Energy: 0.8719555763461498
Energy: 0.8714857735369367
Energy: 0.8719555763446326
Energy: 0.8211723805935087
Energy: 0.898867560106449
Energy: 0.8383777252356207
Energy: 0.8988675601079662
Energy: 0.8503772459282403
Energy: 0.8972039307157901
Energy: 0.8166986634041522
Energy: 0.8972039307157901
Energy: 0.8206521989558379
Energy: 0.8674214037440209
Energy: 0.8692183416273506
Energy: 0.8674214037447795
Energy: 0.8359218353898636
Energy: 0.9311278006977092
Energy: 0.8253964516341408
Energy: 0.9311278006977092
Energy: 0.8204845487997369
Energy: 0.9380072416379911
Energy: 0.9335917985768274
Energy: 0.9380072416387497
Energy: 0.8179170474250139
Energy: 0.9019549893741365
Energy: 0.8093541070080571
Energy: 0.9019549893733779
Energy: 0.8143616257290374
Energy: 0.9806602813228635
Energy: 0.8490228966640935
Energy: 0.9806602813228635
Energy: 0.8247166443891342
Energy: 0.8943174104874383
Energy: 0.8155482904265638
Energy: 0.8943174104866797
Energy: 0.8247998279469758
Energy: 0.9027189993198863
Energy: 0.8224467140988827
Energy: 0.9027189993198863
Energy: 0.810350403784831
Energy: 0.8955820861329205
Energy: 0.8138161000530127
Energy: 0.8955820861336791
Energy: 0.8834198003066217
Energy: 0.8622138248093612
Energy: 0.8192245517999358
Energy: 0.8622138248101198
Energy: 0.8741774069185906
Energy: 0.8492973596813799
Energy: 0.8210333119448554
Energy: 0.8492973596806214
Energy: 0.8501600294917853
Energy: 0.9316887557446959
Energy: 0.8194135666495758
Energy: 0.9316887557439372
Energy: 0.8202158060319804
Energy: 0.8919871447796877
Energy: 0.8422011184896221
Energy: 0.8919871447796877
Energy: 0.8997404481540899
Energy: 0.8837087352164776
Energy: 0.8206770442987003
Energy: 0.8837087352157189
Energy: 0.816979980077189
Energy: 1.0782551544525751
Energy: 0.8404899604824814
Energy: 1.0782551544533336
Energy: 0.9329033830456072
Energy: 0.9385757004569721
Energy: 0.8204184381361698
Energy: 0.9385757004562136
Energy: 0.815009365489675
Energy: 0.839647362945275
Energy: 0.9378475141396432
Energy: 0.839647362945275
Energy: 0.836982425396883
Energy: 0.9879280163772793
Energy: 0.814287482495189
Energy: 0.9879280163795551
Energy: 0.8164750304844044
Energy: 0.8846109591924458
Energy: 0.8169006868473938
Energy: 0.8846109591787914

minimum gb energy = 0.8093541070080571 eV
minimum distance =  2.29991263562342 Angstroms
sigma value = 1


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

Energy: 0.834432240384048
Energy: 0.8349418582828506
Energy: 1.137873951976685
Energy: 0.8349418582870459
Energy: 0.8216306087376913
Energy: 0.8419358337655954
Energy: 0.7739723038175627
Energy: 0.8419358337666443
Energy: 0.7722075877796203
Energy: 0.9104703417859165
Energy: 0.9180854712102117
Energy: 0.9104703417859165
Energy: 0.8003551744821636
Energy: 0.8774183840480905
Energy: 0.7742813899354
Energy: 0.8774183840470416
Energy: 0.7714896374216125
Energy: 0.9147075981470649
Energy: 0.8166962527937633
Energy: 0.9147075981470649
Energy: 0.7710736856504183
Energy: 0.8576349086046507
Energy: 0.7743092685660187
Energy: 0.8576349086077973
Energy: 0.7713825577762463
Energy: 0.913254898097336
Energy: 0.8316024711324916
Energy: 0.913254898097336
Energy: 0.7716692953143829
Energy: 0.9662508731501943
Energy: 0.8408308587189918
Energy: 0.9662508731512431
Energy: 0.8432240613851294
Energy: 0.8174070500134049
Energy: 0.8403003608638856
Energy: 0.8174070500186493
Energy: 0.8348608003561315
Energy: 0.8173542900866305
Energy: 0.840361414603244
Energy: 0.8173542900887281
Energy: 0.7714876287702426
Energy: 0.9662748883740232
Energy: 0.8408413809672611
Energy: 0.9662748883750484
Energy: 0.7713600518378076
Energy: 0.9143744037950134
Energy: 0.8315921975350743
Energy: 0.9143744037939646
Energy: 0.7713507314479124
Energy: 0.8572274116857052
Energy: 0.7740242398090822
Energy: 0.8572274116825586
Energy: 0.7715146224721041
Energy: 0.9147533462736362
Energy: 0.816545843977057
Energy: 0.9147533462757101
Energy: 0.8000284362928254
Energy: 0.877428727266242
Energy: 0.7740709118583825
Energy: 0.8774287272641441
Energy: 0.7722123557096613
Energy: 0.9103954830227284
Energy: 0.918405313064229
Energy: 0.9103954830206308
Energy: 0.8214666664176387
Energy: 0.8420977504985012
Energy: 0.7740029099783584
Energy: 0.8420977504964036
Energy: 0.834432240384048
Energy: 0.8349418582838996
Energy: 1.1378739519777337
Energy: 0.8349418582880949
Energy: 0.8216306087376913
Energy: 0.8419358337676931
Energy: 0.7739723038175627
Energy: 0.8419358337666443
Energy: 0.7722075877796203
Energy: 0.9104703417859165
Energy: 0.9180854712102117
Energy: 0.9104703417859165
Energy: 0.8003551744832125
Energy: 0.8774183840480905
Energy: 0.7742813899354
Energy: 0.8774183840470416
Energy: 0.7714896374216125
Energy: 0.9147075981470649
Energy: 0.8166962527916655
Energy: 0.914707598146016
Energy: 0.7710736856514673
Energy: 0.8576349086046507
Energy: 0.7743092685660187
Energy: 0.8576349086088462
Energy: 0.7713825577762463
Energy: 0.913254898096287
Energy: 0.8316024711324916
Energy: 0.913254898097336

minimum gb energy = 0.7710736856504183 eV
minimum distance =  2.31306738703786 Angstroms
sigma value = 17


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

Energy: 0.8305764102532721
Energy: 0.8306227330372326
Energy: 0.9708475716766053
Energy: 0.8306227330346393
Energy: 0.8140659303023884
Energy: 0.8140872775207032
Energy: 0.7861110174305284
Energy: 0.8140872775155169
Energy: 0.7867013674354334
Energy: 0.8224480706990638
Energy: 0.9941293114025532
Energy: 0.8224480707003604
Energy: 0.8347327789237218
Energy: 0.8339365597732576
Energy: 0.7816958695636758
Energy: 0.8339365597732576
Energy: 0.7835158405636838
Energy: 0.8862448627506756
Energy: 0.8080977078543752
Energy: 0.8862448627500272
Energy: 0.7841290521210007
Energy: 0.8066312792967641
Energy: 0.7917233070159206
Energy: 0.8066312792954675
Energy: 0.7881872838970188
Energy: 0.8701666823541646
Energy: 0.8406591400012554
Energy: 0.8701666823548128
Energy: 0.7814421382167858
Energy: 0.852967615731848
Energy: 0.782826985168252
Energy: 0.8529676157324962
Energy: 0.8326995979481823
Energy: 0.8987450575218474
Energy: 0.8321456233801622
Energy: 0.8987450575218474
Energy: 0.8363672710591713
Energy: 0.8442685947081848
Energy: 0.7887746299725307
Energy: 0.8442685947068882
Energy: 0.7867464569928995
Energy: 0.8284978263230612
Energy: 0.7802392577152979
Energy: 0.8284978263230612
Energy: 0.7892076464657592
Energy: 0.856183501955506
Energy: 0.789263753542641
Energy: 0.856183501955506
Energy: 0.782889675140377
Energy: 0.8085071998048838
Energy: 0.7821913470037558
Energy: 0.8085071998068287
Energy: 0.7864518072362414
Energy: 0.881911058348063
Energy: 0.8459699353095211
Energy: 0.881911058348063
Energy: 0.779889047220727
Energy: 0.8895468947205579
Energy: 0.8361274745812375
Energy: 0.889546894718613
Energy: 0.7860750165441944
Energy: 0.9078713152909766
Energy: 0.796481526629872
Energy: 0.9078713152916249
Energy: 0.8021836147237762
Energy: 0.8358536932278497
Energy: 0.7819216204946761
Energy: 0.835853693228498
Energy: 0.7828672210534131
Energy: 0.831160815949188
Energy: 0.9762023241373854
Energy: 0.8311608159511329
Energy: 0.7967287621397425
Energy: 0.9421881811774482
Energy: 0.7880052796982794
Energy: 0.9421881811787448
Energy: 0.7924713804399001
Energy: 0.8221308632382844
Energy: 0.8422742317425101
Energy: 0.8221308632395808
Energy: 0.7864262107206561
Energy: 0.8069803030814585
Energy: 0.7819250119889403
Energy: 0.8069803030814585
Energy: 0.7837330267005937
Energy: 0.9148932372929464
Energy: 0.8908786251622658
Energy: 0.9148932372942428
Energy: 0.8151815708327433
Energy: 0.84242419290683
Energy: 0.7919019037707263
Energy: 0.8424241929094232
Energy: 0.7872843618750414
Energy: 0.8744342951194823
Energy: 0.9481723022278367
Energy: 0.8744342951207787
Energy: 0.824573879997475
Energy: 0.8317993903422906
Energy: 0.7823393396435795
Energy: 0.8317993903416423
Energy: 0.7824943206547026
Energy: 0.8833743561773706
Energy: 0.8019425381752904
Energy: 0.8833743561793155
Energy: 0.9256882028561497
Energy: 0.9606734888145626
Energy: 0.7873770445994315
Energy: 0.9606734888145626
Energy: 0.838848699857121
Energy: 0.8892481408166115
Energy: 0.7800400715486061
Energy: 0.8892481408133703
Energy: 0.8499244175359245
Energy: 0.8816620804169405
Energy: 0.7843285929509266
Energy: 0.8816620804182371
Energy: 0.7824221583298839
Energy: 0.9032407831450504
Energy: 0.8211780269673221
Energy: 0.903240783146347
Energy: 0.78914393446356
Energy: 0.8813909417203885
Energy: 0.7923662520906003
Energy: 0.8813909417210368
Energy: 0.780077543476842
Energy: 0.8271720770338108
Energy: 0.7842406707716059
Energy: 0.8271720770331625
Energy: 0.7874424034941266
Energy: 0.8442271478122876
Energy: 0.9600511906809981
Energy: 0.8442271478129358
Energy: 0.8351091018924849
Energy: 0.8986057745696727
Energy: 0.7943523183936563
Energy: 0.8986057745722659
Energy: 0.7854975783666202
Energy: 0.9162626136576968
Energy: 0.8150482670210625
Energy: 0.9162626136596417
Energy: 0.8394405893349718
Energy: 0.8710634118294214
Energy: 0.7872970234663496
Energy: 0.8710634118313662
Energy: 0.7919487456876809
Energy: 0.9030189367171926
Energy: 0.7865022741646005
Energy: 0.9030189367145994
Energy: 0.7900280718142079
Energy: 0.8855340560516753
Energy: 0.7845679485655477
Energy: 0.8855340560523236

minimum gb energy = 0.779889047220727 eV
minimum distance =  2.30080822135772 Angstroms
sigma value = 89


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

Energy: 0.7328751936941855
Energy: 0.7323852832286059
Energy: 0.9851298649258312
Energy: 0.7323852832286059
Energy: 0.7339545729010677
Energy: 0.7546926606551857
Energy: 0.7431361180433174
Energy: 0.7546926606551857
Energy: 0.7414713326787592
Energy: 0.8803308326617328
Energy: 1.2072813593006222
Energy: 0.8803308326617328
Energy: 0.7379768581484144
Energy: 0.7548747631164118
Energy: 0.7430716740466806
Energy: 0.7548747631164118
Energy: 0.7339465185438429
Energy: 0.8390184205362807
Energy: 0.7450702376274123
Energy: 0.8390184205362807
Energy: 0.7335293477242977
Energy: 0.7337906903295115
Energy: 0.736994537073831
Energy: 0.7337906903312078
Energy: 0.7415148306008768
Energy: 0.8711978611995695
Energy: 0.7364680335829935
Energy: 0.8711978611978733
Energy: 0.7489497366479857
Energy: 0.8889831719226959
Energy: 0.7431113232105627
Energy: 0.8889831719226959
Energy: 0.7339057247652688
Energy: 0.8107871143339397
Energy: 0.7329471359324915
Energy: 0.8107871143339397
Energy: 0.7603416563964517
Energy: 0.8387052824215674
Energy: 0.7352421366911971
Energy: 0.8387052824215674
Energy: 0.7337158773192033
Energy: 0.7561802781729162
Energy: 0.7339661822290484
Energy: 0.7561802781729162
Energy: 0.7413131002121408
Energy: 0.8685205598227487
Energy: 0.7445648015871577
Energy: 0.8685205598227487
Energy: 0.7339347585267832
Energy: 0.839885124862862
Energy: 0.7480065653625897
Energy: 0.839885124862862
Energy: 0.7353333768439471
Energy: 0.8089199164570783
Energy: 0.7352864141183901
Energy: 0.8089199164570783
Energy: 0.7345014906249561
Energy: 0.8398195727925029
Energy: 0.7338826931614445
Energy: 0.8398195727925029

minimum gb energy = 0.7323852832286059 eV
minimum distance =  2.32255037273148 Angstroms
sigma value = 13


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

Energy: 0.8152569130768029
Energy: 0.7693168389034497
Energy: 0.8714543677356881
Energy: 0.769316838899895
Energy: 0.7858131278810075
Energy: 0.7236859823661946
Energy: 0.6989930172617951
Energy: 0.7236859823647728
Energy: 0.7145075376308937
Energy: 0.7075456858226044
Energy: 0.8121788324050383
Energy: 0.7075456858204716
Energy: 0.7238806755960362
Energy: 0.7245795678023998
Energy: 0.7051037716650553
Energy: 0.7245795678038218
Energy: 0.7104086516156584
Energy: 0.767063885780354
Energy: 0.7733699743477995
Energy: 0.7670638857817758
Energy: 0.7059875517238741
Energy: 0.7244382654140754
Energy: 0.7990817034851032
Energy: 0.7244382654119426
Energy: 0.7096822509972893
Energy: 0.7630272406610292
Energy: 0.781515082726488
Energy: 0.7630272406560527
Energy: 0.6989292340402471
Energy: 0.7229921582964689
Energy: 0.7992662094772307
Energy: 0.72299215829718
Energy: 0.7098609075414551
Energy: 0.7720309081726084
Energy: 0.7136858123957666
Energy: 0.7720309081775851
Energy: 0.8623586432010338
Energy: 0.7835557382221563
Energy: 0.7050856661904631
Energy: 0.7835557382214453
Energy: 0.7182452109875894
Energy: 0.7794991623514085
Energy: 0.7167196932608481
Energy: 0.7794991623542522
Energy: 0.7946871381638687
Energy: 0.8528629874404544
Energy: 0.6985227028490152
Energy: 0.8528629874397435
Energy: 0.747139424613142
Energy: 0.7150349143364235
Energy: 0.7118534104676666
Energy: 0.7150349143371345
Energy: 0.9647170363669292
Energy: 0.7824144428338652
Energy: 0.7005311846053216
Energy: 0.7824144428317323
Energy: 0.7181707419626022
Energy: 0.7075101102546356
Energy: 0.7102571879396785
Energy: 0.7075101102539245
Energy: 0.7761117477564475
Energy: 0.7829921423232256
Energy: 0.7086201469300405
Energy: 0.7829921423225148
Energy: 0.7150130555287341
Energy: 0.8356940753007117
Energy: 0.7104005167373088
Energy: 0.8356940753035556
Energy: 0.7157790956081403
Energy: 0.7687404541608183
Energy: 0.8056309421325486
Energy: 0.7687404541622401
Energy: 0.7159487194776959
Energy: 0.7222141666296756
Energy: 0.8049678830586219
Energy: 0.7222141666296756
Energy: 0.7165387974281414
Energy: 0.8364611499657582
Energy: 0.8056026455719805
Energy: 0.8364611499636253
Energy: 0.7182881101518901
Energy: 0.7737274506305799
Energy: 0.8045536946498907
Energy: 0.7737274506312909
Energy: 0.7148430179116201
Energy: 0.8331361889506246
Energy: 0.7089659014280105
Energy: 0.8331361889477807
Energy: 0.780994942488783
Energy: 0.7822816126820231
Energy: 0.70999057644028
Energy: 0.7822816126734917
Energy: 0.7191748922411803
Energy: 0.706806454887066
Energy: 0.7093154161292794
Energy: 0.706806454887066
Energy: 0.9378346110975678
Energy: 0.7820930326880391
Energy: 0.6994199056191951
Energy: 0.782093032689461
Energy: 0.8226695214067523
Energy: 0.8473733380678902
Energy: 0.7057200361097776
Energy: 0.8473733380664683
Energy: 0.7333602420433231
Energy: 0.7836824303374351
Energy: 0.6984077869420318
Energy: 0.7836824303374351
Energy: 0.7169260658016553
Energy: 0.7813251196011677
Energy: 0.7102876990785669
Energy: 0.7813251195997457
Energy: 0.7837938969761514
Energy: 0.8493739561772962
Energy: 0.7043770375039174
Energy: 0.8493739561765852
Energy: 0.7077301872986261
Energy: 0.7625457949948686
Energy: 0.8798605981340104
Energy: 0.7625457949934465
Energy: 0.7017187564178438
Energy: 0.7229831293299979
Energy: 0.7991966295783689
Energy: 0.7229831293314196
Energy: 0.7098283208271472
Energy: 0.7670497927173993
Energy: 0.833337909470926
Energy: 0.7670497927166884
Energy: 0.7211186104304872
Energy: 0.7236612190469306
Energy: 0.7990346296825828
Energy: 0.7236612190440868
Energy: 0.7081896333080445
Energy: 0.7674998944793859
Energy: 0.7960653958324754
Energy: 0.7674998944822298
Energy: 0.7672315372519947
Energy: 0.7239494375367042
Energy: 0.7043039157963104
Energy: 0.7239494375317275

minimum gb energy = 0.6984077869420318 eV
minimum distance =  2.33356684798703 Angstroms
sigma value = 37


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

Energy: 0.8107208370231932
Energy: 0.6971906952240398
Energy: 0.8167319247990944
Energy: 0.6971906952228166
Energy: 0.7822020502719282
Energy: 0.7605375486117778
Energy: 0.6482751945376882
Energy: 0.7605375486130009
Energy: 0.7767089373725795
Energy: 0.6891512254016693
Energy: 0.9187778036136012
Energy: 0.6891512254004462
Energy: 0.7504958382462761
Energy: 0.8009338147199624
Energy: 0.6575990991071655
Energy: 0.8009338147199624
Energy: 0.6577122946320441
Energy: 0.6761176442038751
Energy: 0.7613654283750358
Energy: 0.6761176442038751
Energy: 0.6712691957161085
Energy: 0.8620478317094461
Energy: 0.7780564540514823
Energy: 0.8620478317106695
Energy: 0.6486702349490676
Energy: 0.7107724773227243
Energy: 0.7732511073603346
Energy: 0.7107724773227243
Energy: 0.644441811715217
Energy: 0.6770020690528299
Energy: 0.6790947915778359
Energy: 0.6770020690540531
Energy: 0.6499447884282011
Energy: 0.7601907490558132
Energy: 0.7726627112752413
Energy: 0.7601907490570365
Energy: 0.9151741861240229
Energy: 0.6979958073236407
Energy: 0.7781793480285152
Energy: 0.6979958073248639
Energy: 0.6569322225092497
Energy: 0.8173878005376664
Energy: 0.7521214419841853
Energy: 0.8173878005388895
Energy: 0.9160571705321051
Energy: 0.6767120398270811
Energy: 0.6576156085272213
Energy: 0.6767120398295274
Energy: 0.7769952478924976
Energy: 0.7600669362571202
Energy: 0.7564352021169168
Energy: 0.760066936255897
Energy: 0.7736671490676718
Energy: 0.826775988058858
Energy: 0.6459585892895259
Energy: 0.826775988058858
Energy: 0.8063264351144193
Energy: 0.7083934903842962
Energy: 0.6470401368765449
Energy: 0.7083934903818497
Energy: 0.7875874564392569
Energy: 0.7959658287040278
Energy: 0.653218176411988
Energy: 0.7959658287040278
Energy: 0.7769727554592797
Energy: 0.8114741361166714
Energy: 0.6573013933982387
Energy: 0.8114741361166714
Energy: 0.7506479451695495
Energy: 0.846147388327601
Energy: 0.653992467961876
Energy: 0.846147388327601
Energy: 0.6596575067348209
Energy: 0.6780096205863725
Energy: 0.6558585933926027
Energy: 0.6780096205851494
Energy: 0.6574189001901887
Energy: 0.7960655463699158
Energy: 0.7653745750162403
Energy: 0.7960655463711389

minimum gb energy = 0.644441811715217 eV
minimum distance =  2.3320831016666 Angstroms
sigma value = 25


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

Energy: 0.6336839733882498
Energy: 0.5994941043252543
Energy: 0.7706059747113335
Energy: 0.5994941043262094
Energy: 0.7749580559650053
Energy: 0.6148647538639751
Energy: 0.5968178272019933
Energy: 0.6148647538639751
Energy: 0.5967999788702855
Energy: 0.5971495878821649
Energy: 0.5829614948968459
Energy: 0.59714958788312
Energy: 0.6023571751532875
Energy: 0.6129484434676974
Energy: 0.5966050859769075
Energy: 0.6129484434667423
Energy: 0.6007912723785737
Energy: 0.746451649634125
Energy: 0.5927287650297666
Energy: 0.746451649628394
Energy: 0.5832000525545563
Energy: 0.6133797238349885
Energy: 0.5963541531776975
Energy: 0.6133797238359436
Energy: 0.5975639382386737
Energy: 0.6001861194180451
Energy: 0.6028180054036826
Energy: 0.6001861194170899
Energy: 0.5852705453491768
Energy: 0.6341014512531864
Energy: 0.5979183594795057
Energy: 0.6341014512531864
Energy: 0.6012145751599292
Energy: 0.6136246951100144
Energy: 0.8537916029633508
Energy: 0.613624695108104
Energy: 0.5853685478772713
Energy: 0.5998798930369085
Energy: 0.6347175279787748
Energy: 0.5998798930378636
Energy: 0.5971504246029369
Energy: 0.5971591470310588
Energy: 0.7701085108103801
Energy: 0.5971591470310588
Energy: 0.7893781602929318
Energy: 0.7066727889986877
Energy: 0.5981182100482972
Energy: 0.7066727890005979
Energy: 0.6012832794945132
Energy: 0.6149769389039402
Energy: 0.6882594351153284
Energy: 0.6149769389020734
Energy: 0.7930639481062796
Energy: 0.5973420404552252
Energy: 0.5963303756732076
Energy: 0.5973420404523598
Energy: 0.5971526664368045
Energy: 0.5971944593227665
Energy: 0.5842568044111336
Energy: 0.5971944593218114
Energy: 0.6069458530932361
Energy: 0.7050237166261307
Energy: 0.6004305689450609
Energy: 0.705023716628041
Energy: 0.6012417217798542
Energy: 0.6335477656661429
Energy: 0.5846196022232725
Energy: 0.6335477656642325
Energy: 0.6392484801247131
Energy: 0.6144750972420897
Energy: 0.6015151000240141
Energy: 0.6144750972411345
Energy: 0.6381908105391775
Energy: 0.7371335596753326
Energy: 0.587132907360873
Energy: 0.7371335596762877
Energy: 0.7709315069082765
Energy: 0.638174469150146
Energy: 0.6000142630936932
Energy: 0.6381744689916802
Energy: 0.601091797951109
Energy: 0.9161999286077602
Energy: 0.5902532563101887
Energy: 0.9161999286087154
Energy: 0.6014263767787595
Energy: 0.614649329646154
Energy: 0.6014255845637955
Energy: 0.6146493296471093
Energy: 0.59747580494893
Energy: 0.5986199672773658
Energy: 0.7965839981636559
Energy: 0.5986199672773658
Energy: 0.5835143160393047
Energy: 0.7004456483234275
Energy: 0.5995698387364652
Energy: 0.7004456483043248
Energy: 0.604638814611767
Energy: 0.9146642787591229
Energy: 0.5964337409951
Energy: 0.9146642787572128
Energy: 0.584151253184214
Energy: 0.6335618111884542
Energy: 0.594857081076452
Energy: 0.6335618111884542

minimum gb energy = 0.5829614948968459 eV
minimum distance =  2.33707651640844 Angstroms
sigma value = 41


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

Energy: 0.94182249159863
Energy: 0.5692371414840869
Energy: 0.8826629688608131
Energy: 0.5692371414809547
Energy: 0.9007793288558126
Energy: 0.548045432613809
Energy: 0.5384960884825374
Energy: 0.548045432613809
Energy: 0.6407800605672725
Energy: 0.5464026303300704
Energy: 0.5420133778788981
Energy: 0.5464026303332026
Energy: 0.7585282151361548
Energy: 0.5560297930923713
Energy: 0.5395082864858607
Energy: 0.5560297930931544
Energy: 0.6194981570141462
Energy: 0.5773316173614992
Energy: 0.6157660728017251
Energy: 0.5773316173646316
Energy: 0.6230928840738235
Energy: 0.545240560127769
Energy: 0.5445961071096593
Energy: 0.5452405601254198
Energy: 0.5470221092423425
Energy: 0.5474603521550933
Energy: 0.6182958221489941
Energy: 0.547460352180151
Energy: 0.6152662279842889
Energy: 0.5589854428246739
Energy: 0.61997052134517
Energy: 0.5589854428207587
Energy: 0.5391513988213376
Energy: 0.6162334489636808
Energy: 0.8281888521185294
Energy: 0.6162334489660299
Energy: 0.5397188374131358
Energy: 0.5473004875571713
Energy: 0.6413261948159974
Energy: 0.5473004875571713
Energy: 0.5417892166984327
Energy: 0.5472105014798802
Energy: 0.901754321966454
Energy: 0.5472105014830123
Energy: 0.534569151894344
Energy: 0.5619980155407542
Energy: 0.8590461979911121
Energy: 0.5619980155399711
Energy: 0.5388326764874004
Energy: 0.6173734687088903
Energy: 0.8989052989002743
Energy: 0.6173734687112394
Energy: 0.6782285567548776
Energy: 0.5624121191853069
Energy: 0.6416124858254831
Energy: 0.5624121191853069
Energy: 0.5407580855354772
Energy: 0.5551905396185037
Energy: 0.7554239861155575
Energy: 0.5551905396200698
Energy: 0.7074789743699201
Energy: 0.562224062423848
Energy: 0.6198991567559031
Energy: 0.562224062423065
Energy: 0.5455764480856854
Energy: 0.6191125099809874
Energy: 0.6896419282519632
Energy: 0.6191125099833366
Energy: 0.619102566321183
Energy: 0.5627669909330717
Energy: 0.5447939151109277
Energy: 0.5627669909299395
Energy: 0.6213696207245427
Energy: 0.5598599748223934
Energy: 0.6128457024895518
Energy: 0.5598599748208273
Energy: 0.646294405122772
Energy: 0.7054669161063485
Energy: 0.5407063389275008
Energy: 0.7054669161071315
Energy: 0.6433139237874523
Energy: 0.6154456343350485
Energy: 0.7060382985326525
Energy: 0.6154456343326994
Energy: 0.903819382944332
Energy: 0.7480784912188346
Energy: 0.5419600261612074
Energy: 0.7480784912219669
Energy: 0.938891684831219
Energy: 0.5695596296203824
Energy: 0.534475531896873
Energy: 0.5695596296180333
Energy: 0.779309857106146
Energy: 0.6155167873961845
Energy: 0.5406235714918833
Energy: 0.6155167873930523
Energy: 0.643129644273088
Energy: 0.728640118881834
Energy: 0.5355790921901346
Energy: 0.728640118881834
Energy: 0.7505072027450378
Energy: 0.6415810645296472
Energy: 0.5381701099902066
Energy: 0.6415810645327794
Energy: 0.6213805114245412
Energy: 0.55976197099629
Energy: 0.7140192178977165
Energy: 0.5597619709978561
Energy: 0.6187967660492225
Energy: 0.6171575753010843
Energy: 0.5470443729566213
Energy: 0.6171575752995182
Energy: 0.5455307982998856
Energy: 0.5559525507982825
Energy: 0.6196190974367382
Energy: 0.5559525508006316
Energy: 0.6090877943174766
Energy: 0.6493883471469337
Energy: 0.6165912523797394
Energy: 0.6493883471492828
Energy: 0.5437867431676568
Energy: 0.7057560201140396
Energy: 0.6425308087830535
Energy: 0.7057560201140396
Energy: 0.5399624069434613
Energy: 0.6173170212148947
Energy: 0.6368682592031696
Energy: 0.61731702121881

minimum gb energy = 0.534475531896873 eV
minimum distance =  2.33302732128351 Angstroms
sigma value = 15


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

Energy: 0.8466590782384091
Energy: 0.5657930036909119
Energy: 0.6658999873795494
Energy: 0.5657930036829515
Energy: 0.9177672352215457
Energy: 0.5109783984493033
Energy: 0.5090066390890965
Energy: 0.5109783984552735
Energy: 0.596884150383883
Energy: 0.5155522310283688
Energy: 0.5012247447881906
Energy: 0.5155522310283688
Energy: 0.8163883196156677
Energy: 0.5162659118688809
Energy: 0.5104808352787196
Energy: 0.5162659118688809
Energy: 0.57651296988993
Energy: 0.7687161664652457
Energy: 0.5661900836168311
Energy: 0.7687161664652457
Energy: 0.6870878462524741
Energy: 0.5107868454317447
Energy: 0.5084328865368686
Energy: 0.5107868454317447
Energy: 0.5157982716179399
Energy: 0.5167652860046978
Energy: 0.5658099868871843
Energy: 0.5167652859974009
Energy: 0.5662012354308578
Energy: 0.5150386512286078
Energy: 0.5163101951357654
Energy: 0.5150386512080438
Energy: 0.5077121044523715
Energy: 0.6632544540792835
Energy: 0.7514340057544023
Energy: 0.6632544540666798
Energy: 0.56449150437522
Energy: 0.510803538074719
Energy: 0.5767211746971174
Energy: 0.5108035380720656
Energy: 0.5103798565161172
Energy: 0.6570651613524456
Energy: 0.8177194872367174
Energy: 0.6570651613464753
Energy: 0.49995910258518944
Energy: 0.5167185337576585
Energy: 0.5974474218028498
Energy: 0.5167185337689355
Energy: 0.507753635098107
Energy: 0.5190662798345599
Energy: 0.9693365307641691
Energy: 0.5190662798405301
Energy: 0.4956619336554423
Energy: 0.5140977242956285
Energy: 0.7767794711005445
Energy: 0.5140977242989452
Energy: 0.5104816955437627
Energy: 0.5106015410647955
Energy: 0.8678997072064533
Energy: 0.5106015410614788
Energy: 0.6271147077783695
Energy: 0.5167353697236341
Energy: 0.5972340357244357
Energy: 0.5167353697229706
Energy: 0.5076997870627749
Energy: 0.5269685758102444
Energy: 0.8658989148696518
Energy: 0.526968575809581
Energy: 0.6460284648880088
Energy: 0.7990897801910172
Energy: 0.5761955206952918
Energy: 0.7990897801890272
Energy: 0.511290333243935
Energy: 0.5107933309515883
Energy: 0.6884899581250006
Energy: 0.5107933308626985
Energy: 0.5661583119466977
Energy: 0.5104429783685244
Energy: 0.5167571467736094
Energy: 0.5104429783645442
Energy: 0.5137566765531748
Energy: 0.5319449713379497
Energy: 0.6297352942390733
Energy: 0.5319449713617703
Energy: 0.5851427486635655
Energy: 0.6642066843281256
Energy: 0.5089755862241343
Energy: 0.6642066843181752
Energy: 0.5774601140156654
Energy: 0.5118669191432589
Energy: 0.5639265149510863
Energy: 0.5118669191392788
Energy: 0.8194965113352444
Energy: 0.5090408658183482
Energy: 0.5104289857618785
Energy: 0.5090408658249818
Energy: 0.5979801635652585
Energy: 0.6726925896301142
Energy: 0.6599368288796037
Energy: 0.672692589635421
Energy: 0.8309026016135089
Energy: 0.5192015662048731
Energy: 0.508706316780629
Energy: 0.5192015662042099
Energy: 0.8471687617025138
Energy: 0.5665543752331974
Energy: 0.4972784814801872
Energy: 0.5665543752391676
Energy: 0.9221029470843225
Energy: 0.5118491107730051
Energy: 0.5073408118977439
Energy: 0.5118491107749952
Energy: 0.5985163200714276
Energy: 0.8169133963173019
Energy: 0.496688007261412
Energy: 0.8169133963179652
Energy: 0.7045916712394934
Energy: 0.5257358079198114
Energy: 0.5086642608552467
Energy: 0.5257358079118513
Energy: 0.5772810726181357
Energy: 0.8001444630538862
Energy: 0.6544108356475927
Energy: 0.8001444630505694
Energy: 0.6839371922116388
Energy: 0.5112276714888359
Energy: 0.5068756204188012
Energy: 0.5112276714749056
Energy: 0.5135506494850031
Energy: 0.8169042958705425
Energy: 0.5672768367761303
Energy: 0.8169042958645724
Energy: 0.5683996528143972
Energy: 0.6822839868832528
Energy: 0.5149901626023071
Energy: 0.6822839868859062
Energy: 0.49893077676832964
Energy: 0.6661501444106691
Energy: 0.5836536175257105
Energy: 0.6661501444100058
Energy: 0.561779193996848
Energy: 0.6629412716722201
Energy: 0.5732033069612946
Energy: 0.6629412716682399
Energy: 0.5079984227621157
Energy: 0.804101609109728
Energy: 0.8221705547288665
Energy: 0.8041016091110548

minimum gb energy = 0.4956619336554423 eV
minimum distance =  2.33836779430283 Angstroms
sigma value = 85


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

Energy: 0.7268285669409734
Energy: 0.7043922499064001
Energy: 0.8225543543398292
Energy: 0.7043922499058248
Energy: 0.878352022056876
Energy: 0.49562796280038934
Energy: 0.4690545061134206
Energy: 0.49562796280038934
Energy: 0.6986033244085725
Energy: 0.49583070646631977
Energy: 0.43813694450692514
Energy: 0.4958307064657444
Energy: 0.7868894868328705
Energy: 0.4956699018360904
Energy: 0.4690105867899815
Energy: 0.4956699018343643
Energy: 0.4948523201554068
Energy: 0.46788768645796236
Energy: 0.4322255162092559
Energy: 0.467887686457387
Energy: 0.6955088414265739
Energy: 0.49582437062331997
Energy: 0.4646910227768607
Energy: 0.49582437062331997
Energy: 0.46702346680812756
Energy: 0.5120597536032716
Energy: 0.44886589967642626
Energy: 0.5120597536038469
Energy: 0.5870490684761945
Energy: 0.49499506859381387
Energy: 0.46888284317559403
Energy: 0.49499506859266323
Energy: 0.46843172258283816
Energy: 0.4809275501048906
Energy: 0.6378748346818456
Energy: 0.48092755010661653
Energy: 0.4568682981174327
Energy: 0.5116840327188928
Energy: 0.4674369672196596
Energy: 0.5116840327188928
Energy: 0.4650842613355606
Energy: 0.6345433182594943
Energy: 0.6952050349020263
Energy: 0.6345433182594943
Energy: 0.43826944685341435
Energy: 0.495806307401214
Energy: 0.4951791664538603
Energy: 0.4958063074000634
Energy: 0.4688135405670105
Energy: 0.4801647240057341
Energy: 0.8646232831133099
Energy: 0.4801647240068848
Energy: 0.4425629699031063
Energy: 0.4958402761221218
Energy: 0.698753798678149
Energy: 0.49584027612154646
Energy: 0.46974161129171105
Energy: 0.49595456571363067
Energy: 0.8779481714195215
Energy: 0.49595456571248003
Energy: 0.43790801970292137
Energy: 0.4984932154998652
Energy: 0.7272603193075344
Energy: 0.49849321549813913
Energy: 0.4688415307572063
Energy: 0.4803543087695421
Energy: 0.9175551596793339
Energy: 0.4803543087695421
Energy: 0.5467957104479468
Energy: 0.49592905507339385
Energy: 0.6988645215156948
Energy: 0.49592905507339385
Energy: 0.46489429291411577
Energy: 0.4956020880550883
Energy: 0.7874257619819582
Energy: 0.4956020880545129
Energy: 0.5747107674137043
Energy: 0.7496560980345683
Energy: 0.49540271051708595
Energy: 0.7496560980345683
Energy: 0.4687690657866774
Energy: 0.48062954725817614
Energy: 0.7765614104394584
Energy: 0.4806295472587514
Energy: 0.45685478878092184
Energy: 0.49568416418119665
Energy: 0.4674550653068779
Energy: 0.49568416418062133
Energy: 0.46998373439169394
Energy: 0.4953102564365365
Energy: 0.5766622245370546
Energy: 0.4953102564353858
Energy: 0.49464287392818046
Energy: 0.5126115742871987
Energy: 0.46871513658186714
Energy: 0.5126115742866234
Energy: 0.46879183477758474
Energy: 0.49450434159559525
Energy: 0.5622534827563448
Energy: 0.49450434159674583
Energy: 0.6957930140934943
Energy: 0.49604765343947577
Energy: 0.4663684949895194
Energy: 0.4960476534383251
Energy: 0.49656096794396054
Energy: 0.49466688136804693
Energy: 0.4397536596727673
Energy: 0.49466688132434794
Energy: 0.7149768214174567
Energy: 0.7172766286880723
Energy: 0.46906794448044364
Energy: 0.7172766286892228
Energy: 0.7000888265082698
Energy: 0.4958589372836692
Energy: 0.4424287867032055
Energy: 0.4958589372836692
Energy: 0.8781826783040368
Energy: 0.4958256341788359
Energy: 0.46580587988826994
Energy: 0.4958256341799866
Energy: 0.7281111408542865
Energy: 0.6372944651920783
Energy: 0.4394183706079086
Energy: 0.6372944651932289
Energy: 0.8075130823015886
Energy: 0.7173763542089969
Energy: 0.4690707798498109
Energy: 0.7173763542084216
Energy: 0.7001564120331734
Energy: 0.4961423245284457
Energy: 0.4392545319363625
Energy: 0.4961423245278704
Energy: 0.7874648328661131
Energy: 0.4956841332588016
Energy: 0.4655505012033289
Energy: 0.4956841332582263
Energy: 0.4963688978834474
Energy: 0.7504703843699597
Energy: 0.573332449809737
Energy: 0.7504703843699597
Energy: 0.6038906549052921
Energy: 0.7142496809504455
Energy: 0.4688282098620563
Energy: 0.7142496809510207
Energy: 0.46885405815157094
Energy: 0.49560166775650144
Energy: 0.45727048352106375
Energy: 0.4956016677570768
Energy: 0.57651116062635
Energy: 0.4952866138994829
Energy: 0.4656580561478275
Energy: 0.4952866138994829
Energy: 0.46985521525509266
Energy: 0.7506507570265837
Energy: 0.4948737791717837
Energy: 0.7506507570260083
Energy: 0.4447307535713184
Energy: 0.6347033397403204
Energy: 0.47036523658804297
Energy: 0.6347033397408957
Energy: 0.46850895609227383
Energy: 0.49209845414409564
Energy: 0.6972934003514399
Energy: 0.49209845414294495
Energy: 0.44050854999328426
Energy: 0.494730585600783
Energy: 0.4980794477356673
Energy: 0.49473058560135835
Energy: 0.4701219088151377
Energy: 0.7496986084498677
Energy: 0.7159257332082427
Energy: 0.7496986084504431

minimum gb energy = 0.4322255162092559 eV
minimum distance =  2.34583464476396 Angstroms
sigma value = 113


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

Energy: 0.015446385293514886
Energy: 0.016964223042523673
Energy: 0.8088176031522992
Energy: 0.01696422304208139
Energy: 0.4475078098181333
Energy: 0.2744371937055002
Energy: 0.27483725029671935
Energy: 0.27443719370161795
Energy: 0.015446385293514886
Energy: 0.016964223042941387
Energy: 0.8088176031536015
Energy: 0.016964223042523673
Energy: 0.4475078098181333
Energy: 0.2744371937059425
Energy: 0.2748372502954171
Energy: 0.2744371937059425
Energy: 0.015446385293514886
Energy: 0.016964223042523673
Energy: 0.8088176031575083
Energy: 0.016964223042523673
Energy: 0.4475078098181333
Energy: 0.2744371937029202
Energy: 0.2748372502962771
Energy: 0.27443719370161795

minimum gb energy = 0.015446385293514886 eV
minimum distance =  2.54614316708041 Angstroms
sigma value = 1