Model name: model_name=MEAM_LAMMPS_EtesamiAsadi_2018_Cu__MO_227887284491_001
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=3.619999974966049
cohesive_energy=3.54027843854009
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=[1.482639837513894e-19, 2.1870512142417e-19, 2.70541944240606e-19, 3.1307012081350197e-19, 3.4900854489075595e-19, 3.7991453216061596e-19, 4.06783034312796e-19, 4.30306191653184e-19, 4.50985485468222e-19, 4.6920223379680195e-19, 4.85257645846116e-19, 4.9939044593463e-19, 5.117832821986199e-19, 5.22516263469786e-19, 5.31821705360058e-19, 5.398550190029339e-19, 5.467075284665519e-19, 5.5245293387607595e-19, 5.57160128826768e-19, 5.608915982073539e-19, 5.637066225532919e-19, 5.656596758701379e-19, 5.66798823456912e-19, 5.67170528436e-19, 5.66771586454134e-19, 5.65486640793666e-19, 5.631570759678299e-19, 5.596002438403499e-19, 5.54595044035734e-19, 5.4788032176264e-19, 5.39138846047536e-19, 5.27994105381432e-19, 5.139814685404679e-19, 4.96536969349476e-19, 4.7497167185583595e-19, 4.4842520720709e-19, 4.1583212794162794e-19, 3.7584660568689e-19, 3.2676392450429996e-19, 2.6639711328844797e-19, 1.9190230851398397e-19, 9.95546097245214e-20, -1.5625596123710817e-20, -1.60430752892322e-19, -3.4490857488435e-19, -5.8517899380216e-19, -9.087049193291459e-19, -1.3652932164864659e-18, -2.05141094040726e-18, -3.1672789006892398e-18, -5.1613479393656395e-18, -9.12462023535876e-18, -1.7956554843218398e-17, -3.9927042807597e-17]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013617062911950873
Energy: 0.013866480667534192
Energy: 0.6361110998838824
Energy: 0.10369302133975299
Energy: 0.013866480667534192
Energy: 1.3364314467250646
Energy: 0.013866480667534192
Energy: 1.3364314490272662
Energy: 0.6361110998808245
Energy: 0.013866480667534192
Energy: 0.01361706291257636
Energy: 0.013866480667534192
Energy: 0.10369302133975299
Energy: 1.3364314456503772
Energy: 0.013866480667534192
Energy: 1.3364314482594488

minimum gb energy = 0.013617062911950873 eV
minimum distance =  2.48431370242147 Angstroms
sigma value = 1


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

Energy: 1.1786510430146946
Energy: 0.77672581636008
Energy: 0.846238771936254
Energy: 0.8443476182174827
Energy: 0.7931034241488196
Energy: 0.8572273704218959
Energy: 0.7853507844601301
Energy: 0.8572273704211373
Energy: 0.8462346930600166
Energy: 0.8466171876290617
Energy: 1.281787708284081
Energy: 0.8466171876290617
Energy: 0.786857961003011
Energy: 0.7840961854483509
Energy: 0.7838505750957268
Energy: 0.7840961854392479
Energy: 1.0952473089369226
Energy: 0.7843456626797429
Energy: 0.7864077363535247
Energy: 0.7843456626797429
Energy: 0.8313959686772385
Energy: 0.8698967162310067
Energy: 0.7832308542032019
Energy: 0.8698967162294895
Energy: 0.8358331444786883
Energy: 0.8468089860204887
Energy: 0.8325207546886257
Energy: 0.8468089860204887
Energy: 0.8221539208366448
Energy: 0.8358236704244317
Energy: 0.8618915340912159
Energy: 0.8358236704251902
Energy: 0.9435922188472258
Energy: 0.8973959199005034
Energy: 0.8411720114595439
Energy: 0.8973959198997447
Energy: 0.8631479240039843
Energy: 0.8981016240954598
Energy: 0.8405658245718145
Energy: 0.8981016240901497
Energy: 0.8377901866134445
Energy: 0.8968647846457727
Energy: 0.8719657765481068
Energy: 0.8968647846457727
Energy: 0.8213433099115336
Energy: 0.8977237328357922
Energy: 0.865079218219133
Energy: 0.8977237328365507
Energy: 0.835636378254855
Energy: 0.8483510434340654
Energy: 0.7935861637571195
Energy: 0.8483510434333069
Energy: 0.8320528080153239
Energy: 0.8522970906444521
Energy: 0.8289615910275298
Energy: 0.852297090642935
Energy: 0.7927402615995408
Energy: 0.7848718949840535
Energy: 0.7838102647949993
Energy: 0.7848718949810192
Energy: 0.8165679514250922
Energy: 0.7847954886595614
Energy: 0.7848292285914797
Energy: 0.7847954886595614
Energy: 0.8454247794660151
Energy: 0.8441547357137156
Energy: 0.7751085781910824
Energy: 0.8441547357121986
Energy: 0.7853431701483512
Energy: 0.7839096334694833
Energy: 0.7929868661416457
Energy: 0.7839096334687248
Energy: 0.7826318383911146
Energy: 0.845114383027243
Energy: 0.8453412285420875
Energy: 0.8451143830280016
Energy: 0.8314030274307933
Energy: 0.7836391067909098
Energy: 0.7874460973656366
Energy: 0.7836391067909098
Energy: 0.7839896464162535
Energy: 0.7872507616900821
Energy: 0.8318077335406471
Energy: 0.7872507616870822
Energy: 0.7833763812964742
Energy: 0.785846803747679
Energy: 0.8317777941861763
Energy: 0.7858468037643677
Energy: 0.8321252832296117
Energy: 0.8495065199510876
Energy: 0.8209765810579942
Energy: 0.8495065199510876
Energy: 0.8621333087773234
Energy: 0.849957439366586
Energy: 0.8345213443228401
Energy: 0.849957439366586
Energy: 0.8405983555848668
Energy: 0.8987790694679794
Energy: 0.9436952801922367
Energy: 0.8987790694679794
Energy: 0.8424744750181941
Energy: 0.895238011165743
Energy: 0.8647620128415364
Energy: 0.8952380111649844
Energy: 0.9453137227533884
Energy: 0.8970290327299704
Energy: 0.8382340018574497
Energy: 0.8970290327307289
Energy: 0.8625385819752037
Energy: 0.8968656957941465
Energy: 0.8212960991499705
Energy: 0.8968656957941465
Energy: 0.7941552983891669
Energy: 0.848552997669178
Energy: 0.8356504339676328
Energy: 0.848552997669178
Energy: 0.8286173329121073
Energy: 0.8471429371132805
Energy: 0.832073349188288
Energy: 0.8471429371125565
Energy: 0.7829994607715667
Energy: 0.7833471742833247
Energy: 0.8215109308976187
Energy: 0.7833471742840832
Energy: 0.7839028319636907
Energy: 0.7830908748173356
Energy: 0.8165400183287882
Energy: 0.7830908748180941
Energy: 0.7745828459560696
Energy: 0.7862558757623123
Energy: 0.846553018556557
Energy: 0.7862558757152805

minimum gb energy = 0.7745828459560696 eV
minimum distance =  2.27755222640485 Angstroms
sigma value = 1


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

Energy: 1.3362870315082365
Energy: 0.8100997885738184
Energy: 0.8876747948305259
Energy: 0.8882097074025993
Energy: 0.8325374773908512
Energy: 0.8959896569425455
Energy: 0.8193676743675334
Energy: 0.8959896569408157
Energy: 0.8876744148556786
Energy: 0.8892020873377792
Energy: 1.2271411839989417
Energy: 0.8892020873395091
Energy: 0.8240820556368753
Energy: 0.8196026642343351
Energy: 0.8193653191990241
Energy: 0.8196026642343351
Energy: 0.8184164860939208
Energy: 0.8198972257416377
Energy: 0.8198351854105795
Energy: 0.8198972257416377
Energy: 0.8783581131760853
Energy: 0.9147941161704048
Energy: 0.8196073658258334
Energy: 0.9147941161721347
Energy: 0.868848227888795
Energy: 0.8973340717091749
Energy: 1.0297453966746717
Energy: 0.8973340717109047
Energy: 0.8744562524736069
Energy: 0.9028770953324359
Energy: 0.9111962127742339
Energy: 0.9028770953333006
Energy: 1.0291103104874586
Energy: 0.9463474722092716
Energy: 0.9408530324445645
Energy: 0.9463474722084068
Energy: 0.9119939175207359
Energy: 0.951267276023889
Energy: 0.8760094265860244
Energy: 0.9512672760247538
Energy: 0.8340951315326023
Energy: 0.8965074122440814
Energy: 0.8890361965236249
Energy: 0.8965074122449461
Energy: 0.8755550540826369
Energy: 0.8983274450365302
Energy: 0.8774880880504997
Energy: 0.8983274450356652
Energy: 0.8203418967116602
Energy: 0.8205857902102169
Energy: 0.8354356339424515
Energy: 0.820585790215367
Energy: 0.8197061350607147
Energy: 0.8211601087210896
Energy: 0.8566521776773822
Energy: 0.8211601087193597
Energy: 0.807244139320237
Energy: 0.8882328956288947
Energy: 0.8884882956945972
Energy: 0.8882328956288947
Energy: 0.8336547375315183
Energy: 0.8246061481403214
Energy: 0.8197218378982484
Energy: 0.8246061481411863
Energy: 0.8881215780115598
Energy: 0.8886155556938241
Energy: 0.8397178769182836
Energy: 0.8886155556929591
Energy: 0.8239203395551434
Energy: 0.8193744998575624
Energy: 0.8780273908351762
Energy: 0.8193744998550069
Energy: 0.8193697296000543
Energy: 0.8238843796673
Energy: 0.8204095378861618
Energy: 0.8238843796698948
Energy: 0.877857274022972
Energy: 0.820855151826533
Energy: 0.8202305029458024
Energy: 0.820855151826533
Energy: 0.8645547370740064
Energy: 0.9001347299307764
Energy: 0.8651261813000277
Energy: 0.9001347299299114
Energy: 0.8672459477384343
Energy: 0.8999858402127517
Energy: 0.9121329308883159
Energy: 0.8999858402118868
Energy: 1.0298614534965325
Energy: 0.9470631438537985
Energy: 0.8768163140132295
Energy: 0.9470631438555283
Energy: 0.9115370021026978
Energy: 0.9465441008245231
Energy: 0.8657375976902462
Energy: 0.9465441008236583
Energy: 0.8344166989596749
Energy: 0.8965045634463451
Energy: 0.8882186542106147
Energy: 0.8965045634463451
Energy: 0.8758318635429763
Energy: 0.8970737925254394
Energy: 0.8786793975773826
Energy: 0.8970737925245744
Energy: 0.8192629118106403
Energy: 0.8197312580320301
Energy: 0.8317705260873051
Energy: 0.8197312580311652
Energy: 0.8196621904481918
Energy: 0.8203536428533968
Energy: 0.8566564859724978
Energy: 0.8203536428533968
Energy: 0.8064808612761156
Energy: 0.8235042895629444
Energy: 0.8900664226383029
Energy: 0.8235042911000899

minimum gb energy = 0.8064808612761156 eV
minimum distance =  2.28568113593187 Angstroms
sigma value = 25


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

Energy: 1.2700032566149042
Energy: 0.8429638464827046
Energy: 0.9348079396806803
Energy: 0.9344875753496048
Energy: 0.8795034196388045
Energy: 0.9358640580556944
Energy: 0.8589613326103379
Energy: 0.9358640580566998
Energy: 0.9341553231969635
Energy: 0.9351138844966735
Energy: 1.1525400760526356
Energy: 0.9351138844966735
Energy: 0.86518294049459
Energy: 0.8616882597850374
Energy: 0.8585945537565222
Energy: 0.8616882597870484
Energy: 0.8581554664011488
Energy: 0.8587101657535807
Energy: 0.8599145808343225
Energy: 0.8587101657545861
Energy: 0.9340599531697573
Energy: 0.9610718633091091
Energy: 0.85885685493583
Energy: 0.9610718633101144
Energy: 0.9141373759576538
Energy: 0.9573034238254208
Energy: 0.9561845145462251
Energy: 0.9573034238254208
Energy: 0.9170407116789914
Energy: 0.9613354086212809
Energy: 0.9651886857173956
Energy: 0.9613354086202756
Energy: 0.9574822228760654
Energy: 0.9570217648897923
Energy: 0.9116413959566257
Energy: 0.9570217648887869
Energy: 0.9339579984131484
Energy: 0.9574359099722352
Energy: 0.8584571447729992
Energy: 0.9574359099722352
Energy: 0.8381543149995164
Energy: 0.8586258591606499
Energy: 0.8581809575854719
Energy: 0.8586258591606499
Energy: 0.9009611635915947
Energy: 0.8586405404474371
Energy: 0.8588664437308825
Energy: 0.8586405404474371
Energy: 0.9340562008873087
Energy: 0.9358461175373395
Energy: 0.8370325550216597
Energy: 0.9358461175383449
Energy: 0.8583584945821978
Energy: 0.8653608520473876
Energy: 0.8792141055660934
Energy: 0.8653608520473876
Energy: 0.8782590739255802
Energy: 0.9356382263046912
Energy: 0.9359984026035664
Energy: 0.9356382263046912
Energy: 0.9396334804743285
Energy: 0.8579705221873258
Energy: 0.864359077693427
Energy: 0.8579705221892912
Energy: 0.8606104441742239
Energy: 0.8653717950784369
Energy: 0.8599530724494998
Energy: 0.8653717950794423
Energy: 0.8581400999881477
Energy: 0.8584307877253392
Energy: 0.9348059024420046
Energy: 0.8584307877253392
Energy: 0.9563092522744756
Energy: 0.9610954167350036
Energy: 0.9140019125493525
Energy: 0.9610954167360092
Energy: 0.9665457923913265
Energy: 0.960856466568826
Energy: 0.913525656460014
Energy: 0.960856466568826
Energy: 0.9113833752070402
Energy: 0.9568041773880016
Energy: 0.9577126781445547
Energy: 0.9568041773890071
Energy: 0.881953795115805
Energy: 0.9570464174219617
Energy: 0.9341081011487564
Energy: 0.9570464174219617
Energy: 0.8590753536663203
Energy: 0.8589409926315169
Energy: 0.8373874592505841
Energy: 0.8589409926315169
Energy: 0.8580238099319305
Energy: 0.8587371280817143
Energy: 0.9010348708301538
Energy: 0.8587371280817143
Energy: 0.8370472949840073
Energy: 0.8643982568187625
Energy: 0.9353825186192983
Energy: 0.8643982568167518

minimum gb energy = 0.8370325550216597 eV
minimum distance =  2.27960907260292 Angstroms
sigma value = 9


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

Energy: 1.1703929643369708
Energy: 0.8715691188652496
Energy: 0.9833072117236795
Energy: 0.9824095914940196
Energy: 0.9593051165175788
Energy: 0.9698340173385736
Energy: 0.902846256955288
Energy: 0.969834017339773
Energy: 0.9830613085410168
Energy: 0.9831208317235981
Energy: 0.9093658624936453
Energy: 0.9831208317223986
Energy: 0.9129570156151314
Energy: 1.0331624606226064
Energy: 0.9023598424502858
Energy: 1.0331624606226064
Energy: 0.9334653238817294
Energy: 0.9018222103245832
Energy: 0.9020713653291602
Energy: 0.9018222103245832
Energy: 0.9951581411317336
Energy: 0.9015584847679184
Energy: 0.9224157775304818
Energy: 0.9015584847679184
Energy: 0.943944408042649
Energy: 1.0089285866713091
Energy: 0.9355033687083185
Energy: 1.0089285866725084
Energy: 0.9225631800946396
Energy: 1.0104673800175537
Energy: 0.9952474919035911
Energy: 1.0104673800175537
Energy: 0.9014557046685159
Energy: 0.9023043562141833
Energy: 0.8623508089118703
Energy: 0.9023043562153826
Energy: 0.9223678671537774
Energy: 0.9024997154763834
Energy: 0.8612179765763184
Energy: 0.9024997154775555
Energy: 0.8614759106207441
Energy: 0.9119314307503121
Energy: 0.9822715544990418
Energy: 0.9119314307503121
Energy: 0.9592832028324666
Energy: 0.9113925823066945
Energy: 0.9224325265919654
Energy: 0.9113925823054951
Energy: 0.9831576106527293
Energy: 0.9836521384988199
Energy: 0.9097430755564697
Energy: 0.9836521384976206
Energy: 0.9120876965796466
Energy: 0.9019427390294265
Energy: 0.9911160337724609
Energy: 0.9019427390294265
Energy: 0.9340270821939212
Energy: 0.912574770785477
Energy: 0.9021676897712996
Energy: 0.9125747707842776
Energy: 0.996057070489767
Energy: 0.9022935996950979
Energy: 0.9021233887395695
Energy: 0.9022935996950979
Energy: 0.9401391270075408
Energy: 1.010679977432322
Energy: 0.9355872943987975
Energy: 1.0106799774335213
Energy: 0.9411827799170671
Energy: 1.0092150280522316
Energy: 0.9953404508179522
Energy: 1.0092150280510324
Energy: 0.9003757419259452
Energy: 0.9017812555126001
Energy: 0.861751416821203
Energy: 0.9017812555126001
Energy: 0.9223399271536701
Energy: 0.9028791689386259
Energy: 0.8613121297299363
Energy: 0.9028791689386259
Energy: 0.8612763326863114
Energy: 0.9113591287246936
Energy: 0.9837476004199774
Energy: 0.9113591287234941

minimum gb energy = 0.8612179765763184 eV
minimum distance =  2.2867381138751 Angstroms
sigma value = 25


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

Energy: 1.0306507186185108
Energy: 0.8929871725135379
Energy: 1.0343406464394276
Energy: 1.03350863256761
Energy: 0.8844673654596885
Energy: 0.9630741201762508
Energy: 0.9111595611118815
Energy: 0.9630741201762508
Energy: 1.033582831928634
Energy: 1.034357217258777
Energy: 0.96245340820337
Energy: 1.034357217258777
Energy: 0.8851666746764324
Energy: 0.9634436799978845
Energy: 0.9111350089973765
Energy: 0.9634436799993679
Energy: 0.9563630624942864
Energy: 1.0195553237077097
Energy: 0.9624974723248402
Energy: 1.0195553237077097
Energy: 0.8854820607380975
Energy: 0.9655147349002798
Energy: 0.9100246671218393
Energy: 0.9655147349002798
Energy: 1.0340844483448524
Energy: 0.9627114035633385
Energy: 0.9583259832365759
Energy: 0.9627114035440555
Energy: 0.8806678130633401
Energy: 1.0180223650965128
Energy: 0.9125368023082178
Energy: 1.0180223650965128
Energy: 1.0330111324768276
Energy: 1.0340783454948126
Energy: 0.882301083855108
Energy: 1.0340783454948126
Energy: 0.912145274392778
Energy: 0.8857781771845548
Energy: 0.883282115938746
Energy: 0.8857781771830716
Energy: 0.9596781453372895
Energy: 1.035008870859874
Energy: 1.0358816737408163
Energy: 1.0350088708583907
Energy: 0.8837323704106147
Energy: 1.0175512319224242
Energy: 0.8855702333181501
Energy: 1.0175512319224242
Energy: 0.9122574771784374
Energy: 1.02253805395534
Energy: 0.956316943935302
Energy: 1.02253805395534
Energy: 0.9626435261574582
Energy: 0.9617988085888023
Energy: 0.8860819588762944
Energy: 0.9617988085902857
Energy: 0.9573310923013605
Energy: 0.9613319882911208
Energy: 1.0334375719057858
Energy: 0.9613319882911208
Energy: 0.9108155542434424
Energy: 1.0172052529051716
Energy: 1.0341640568697548
Energy: 1.0172052529066549
Energy: 0.8798227285586729
Energy: 0.8865272214534622
Energy: 1.0466268584804037
Energy: 0.8865272214534622

minimum gb energy = 0.8798227285586729 eV
minimum distance =  2.35221072577959 Angstroms
sigma value = 17


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

Energy: 1.4412785860656478
Energy: 1.0689525714589216
Energy: 1.1546038729463135
Energy: 1.1540827376798746
Energy: 0.8985534708657364
Energy: 0.9650059953639508
Energy: 0.9619607728035173
Energy: 0.9650059953639508
Energy: 0.9796616148210727
Energy: 0.9796143152860713
Energy: 1.0250458299304228
Energy: 0.9796143152860713
Energy: 0.9630063232169855
Energy: 0.9633014329826212
Energy: 0.9619172141919988
Energy: 0.9633014329834613
Energy: 1.0792769894631837
Energy: 1.0393851064467003
Energy: 0.9921450870129186
Energy: 1.0393851064467003
Energy: 0.9643498343130827
Energy: 1.0413824975242005
Energy: 1.022644415531466
Energy: 1.0413824975242005
Energy: 1.0226418127898318
Energy: 0.9789350933853226
Energy: 0.9794639139262389
Energy: 0.9789350933844826
Energy: 1.025106488766194
Energy: 0.9627993553442282
Energy: 0.9246237289002308
Energy: 0.9627993553433882
Energy: 1.1558249560361598
Energy: 1.155637203636534
Energy: 1.026314212195832
Energy: 1.155637203636534
Energy: 1.0407368118895084
Energy: 1.0286152037701934
Energy: 0.9623049969983912
Energy: 1.0286152037701934
Energy: 1.0787826354073908
Energy: 0.9442450621457128
Energy: 0.9603484657606179
Energy: 0.944245062149073
Energy: 1.0266026779309783
Energy: 0.9440872295714249
Energy: 0.943853425677999
Energy: 0.9440872295697447
Energy: 1.0233972710404975
Energy: 0.9436024077586393
Energy: 0.9433114925254231
Energy: 0.9436024077586393
Energy: 1.0227698004849157
Energy: 1.007826121295489
Energy: 0.9209457318583175
Energy: 1.007826121296329
Energy: 1.1580132905028455
Energy: 1.0254560596774722
Energy: 1.022408723571836
Energy: 1.0254560596774722
Energy: 1.1541951478775763
Energy: 1.141784858192401
Energy: 1.0223059252236026
Energy: 1.141784858191561
Energy: 1.024734321151401
Energy: 0.9788010316180911
Energy: 0.9797715945567346
Energy: 0.9788010316172511
Energy: 1.0244404934148403
Energy: 0.979446127262461
Energy: 0.9788857985296903
Energy: 0.979446127262461
Energy: 0.9649214146693202
Energy: 1.0410264789227874
Energy: 1.0287326336086022
Energy: 1.041026478921947
Energy: 0.9829066440810351
Energy: 1.0413016505836445
Energy: 1.022834694231064
Energy: 1.0413016505836445
Energy: 0.9632813967122479
Energy: 0.9629664555631933
Energy: 1.0231027547163727
Energy: 0.9629664555631933
Energy: 0.9796456166084659
Energy: 0.9803111480569232
Energy: 1.1722929824586712
Energy: 0.9803111480569232
Energy: 0.9613447387649441
Energy: 1.0290768992017838
Energy: 0.961964446681638
Energy: 1.0290768992017838
Energy: 1.0235798636519269
Energy: 1.1537674716812505
Energy: 1.1523565180013702
Energy: 1.1537674716812505
Energy: 0.921180191607616
Energy: 0.9432780059370911
Energy: 1.0275804168434413
Energy: 0.9432780059387712
Energy: 0.9451831360980116
Energy: 0.9447972777446135
Energy: 1.073096059916121
Energy: 0.9447972777454537
Energy: 0.9609412899311811
Energy: 1.0016437644791627
Energy: 1.024906767423377
Energy: 1.001643764480003
Energy: 0.9451634733053327
Energy: 0.9454018046948222
Energy: 1.1714005197777873
Energy: 0.9454018046948222
Energy: 0.943723197958238
Energy: 0.9442069059204399
Energy: 1.0234522843469542
Energy: 0.94420690592128
Energy: 1.0222063962067311
Energy: 1.1538702368234164
Energy: 1.1529520714678472
Energy: 1.1538702368234164

minimum gb energy = 0.8985534708657364 eV
minimum distance =  2.30076501906954 Angstroms
sigma value = 53


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

Energy: 1.2962816413525207
Energy: 0.8660159796184117
Energy: 1.066404090375004
Energy: 1.06556121946227
Energy: 1.207327308292706
Energy: 0.9204439032721544
Energy: 1.0319703046535682
Energy: 0.9204439032721544
Energy: 1.0656964993233897
Energy: 1.0656613664789207
Energy: 1.0687647789900985
Energy: 1.0656613664789207
Energy: 1.031218619060155
Energy: 0.9217831651227754
Energy: 1.029717214555297
Energy: 0.9217831651227754
Energy: 1.05164166664707
Energy: 0.9206796981606261
Energy: 0.848182112160099
Energy: 0.9206796981606261
Energy: 1.0290673914059296
Energy: 0.9221905461989254
Energy: 0.8484124581810124
Energy: 0.9221905462008594
Energy: 1.2068248100217767
Energy: 1.0676309091129443
Energy: 1.0681956420412257
Energy: 1.0676309091129443
Energy: 1.205144078735032
Energy: 0.9233720929519202
Energy: 1.066567737135082
Energy: 0.9233720929461181
Energy: 1.0654846891635135
Energy: 1.0690978399174325
Energy: 1.054855036626769
Energy: 1.0690978399174325
Energy: 1.0663393158778633
Energy: 0.9239467504783951
Energy: 1.0318186111599714
Energy: 0.9239467504764611
Energy: 1.0516580672733364
Energy: 0.9227874656573922
Energy: 0.8485284091184863
Energy: 0.9227874656573922
Energy: 1.032422441045233
Energy: 0.9230328623380278
Energy: 0.8513680390614025
Energy: 0.9230328623399618
Energy: 1.2055249440173672
Energy: 1.0314676248411196
Energy: 1.0657047871886187
Energy: 1.0314676248411196

minimum gb energy = 0.848182112160099 eV
minimum distance =  2.29728216608402 Angstroms
sigma value = 9


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

Energy: 1.3432066027310734
Energy: 1.1402749774533747
Energy: 1.2273698134786506
Energy: 1.2200602535368437
Energy: 0.9861619242545971
Energy: 0.9479500039272941
Energy: 1.2486167743620178
Energy: 0.9479500039251467
Energy: 0.9460179744314539
Energy: 0.9483923094461167
Energy: 1.2158946596764193
Energy: 0.9483923094475485
Energy: 0.9506422945499202
Energy: 0.9478916325584892
Energy: 1.257746187853614
Energy: 0.9478916325584892
Energy: 0.9484054076033973
Energy: 0.9462252155749058
Energy: 1.256553297288269
Energy: 0.9462252155741899
Energy: 0.9458633136033309
Energy: 0.9468153867395199
Energy: 1.256395988195534
Energy: 0.9468153867416674
Energy: 1.2372287757126315
Energy: 1.1869839022679611
Energy: 1.1999345191457194
Energy: 1.1869839022708242
Energy: 1.2379271005069807
Energy: 1.1757881894738835
Energy: 1.190076021229545
Energy: 1.1757881894717364
Energy: 1.0303980382028768
Energy: 1.0375863684082156
Energy: 1.044934788882167
Energy: 1.037586368408931
Energy: 0.9696153908860095
Energy: 1.0166143624362554
Energy: 1.188472323652102
Energy: 1.0166143624376867
Energy: 1.031637671114818
Energy: 1.0318722107658673
Energy: 1.2158355097515599
Energy: 1.0318722107651515
Energy: 1.0434297171500295
Energy: 1.031751597647521
Energy: 1.2626299615623113
Energy: 1.0317515976468048
Energy: 1.2364776939889057
Energy: 1.0515486437904982
Energy: 1.0696479230179052
Energy: 1.0515486437883508
Energy: 1.2368965174373034
Energy: 1.0526850927429714
Energy: 1.0561462035310516
Energy: 1.0526850927422555
Energy: 1.1402150679005958
Energy: 1.052913209346575
Energy: 1.0561287448489964
Energy: 1.0529132093480067
Energy: 1.127693215940577
Energy: 1.0983191037931472
Energy: 1.0543993106779352
Energy: 1.0983191037931472
Energy: 1.128991204017613
Energy: 1.0718208754138574
Energy: 1.0595810874425635
Energy: 1.0718208754124257
Energy: 1.1236190528263608
Energy: 1.1104826329964086
Energy: 1.258607257594781
Energy: 1.1104826329964086
Energy: 1.1992183652894568
Energy: 1.0711415168647036
Energy: 0.9791032195505063
Energy: 1.0711415168632719
Energy: 1.2159518058116974
Energy: 0.9905349169285731
Energy: 0.9842284738955892
Energy: 0.990534916821918
Energy: 1.2210992503917282
Energy: 0.9846124666134106
Energy: 0.9883791361577458
Energy: 0.9846124666162739
Energy: 1.2575709559227903
Energy: 0.9717843789160991
Energy: 0.9720820595642182
Energy: 0.9717843789160991
Energy: 1.2564355026907892
Energy: 0.9728804558623154
Energy: 0.9965011575083774
Energy: 0.9728804558630312
Energy: 1.179638575823766
Energy: 1.1969656610347295
Energy: 1.237853501766147
Energy: 1.196965661035445
Energy: 1.1932220620203984
Energy: 1.176420012536546
Energy: 1.2374011292913214
Energy: 1.1764200125372617
Energy: 1.0469773342128679
Energy: 1.0705351241466379
Energy: 1.0293958291868972
Energy: 1.0705351241452061
Energy: 1.1884799627540281
Energy: 0.9831014174487828
Energy: 0.9689119598896433
Energy: 0.9831014174487828
Energy: 1.2183213239700321
Energy: 1.0202107829494378
Energy: 1.0255100602414051
Energy: 1.0202107829487221
Energy: 1.268281577357756
Energy: 1.0298548322852936
Energy: 1.0275744431026035
Energy: 1.0298548322852936
Energy: 1.0687047573175668
Energy: 1.0251411987225263
Energy: 1.2386778077568903
Energy: 1.0251411987239578
Energy: 1.0304488333782749
Energy: 1.0269756351107477
Energy: 1.2147543493232615
Energy: 1.0269756351107477
Energy: 1.0310114870592333
Energy: 1.013833999558896
Energy: 1.1809635994520216
Energy: 1.013833999558896
Energy: 1.0186158697631256
Energy: 1.063245317592049
Energy: 1.1297949134177403
Energy: 1.0632453175913334
Energy: 1.031822457609432
Energy: 1.0631023739608643
Energy: 1.1392364189662307
Energy: 1.063102373959433
Energy: 1.2587882736210196
Energy: 1.1878596972327522
Energy: 1.1807373510765573
Energy: 1.1878596972334683

minimum gb energy = 0.9458633136033309 eV
minimum distance =  2.29272935480115 Angstroms
sigma value = 73


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

Energy: 1.3265886473633524
Energy: 1.0416827034431222
Energy: 1.123547245413778
Energy: 1.1719031449922954
Energy: 1.0218043232824332
Energy: 0.9690325350674117
Energy: 1.0924324527994445
Energy: 0.9690325350674117
Energy: 0.9690343971130277
Energy: 0.96990686512482
Energy: 1.1312837934901134
Energy: 0.9699068651259558
Energy: 0.9690522099887592
Energy: 0.9692407197144872
Energy: 1.2414479951773842
Energy: 0.9692407197144872
Energy: 0.9751277653886317
Energy: 0.9750528412034151
Energy: 1.2284919603239344
Energy: 0.9750528412034151
Energy: 1.028373323829517
Energy: 1.1699668158555008
Energy: 1.2271145834630106
Energy: 1.1699668158555008
Energy: 1.2267243818269356
Energy: 1.1438504951812751
Energy: 1.1983889373347962
Energy: 1.1438504951824107
Energy: 1.2267908717579774
Energy: 1.1444255724274497
Energy: 1.158765368632249
Energy: 1.1444255724285857
Energy: 1.0354011884579692
Energy: 1.085458531482728
Energy: 1.139250739490862
Energy: 1.0854585314838636
Energy: 1.0021987944945308
Energy: 0.967954416417776
Energy: 1.150583183143418
Energy: 0.9679544164189118
Energy: 1.0260662166772763
Energy: 0.9682597320080041
Energy: 1.1487076788876156
Energy: 0.9682597320080041
Energy: 1.0246635724851727
Energy: 0.9943777400143681
Energy: 1.1940768468145695
Energy: 0.9943777400143681
Energy: 1.1459297599119547
Energy: 1.0474705949521066
Energy: 1.0066801451726235
Energy: 1.0474705949521066
Energy: 1.1344861236024082
Energy: 1.0264583888470937
Energy: 1.0253549794077423
Energy: 1.0264583888470937
Energy: 1.1551032023965897
Energy: 1.008250031747229
Energy: 1.008406525753133
Energy: 1.0082500317483647
Energy: 1.2261531841282207
Energy: 1.006654310183897
Energy: 1.0090800008806775
Energy: 1.006654310183897
Energy: 1.2257566941084248
Energy: 1.1110440512864723
Energy: 1.0306831621890244
Energy: 1.1110440512864723
Energy: 1.137729907081034
Energy: 1.137294689051484
Energy: 1.2263578372936723
Energy: 1.137294689051484
Energy: 1.1146403560341842
Energy: 1.1150181556593728
Energy: 1.083561651154833
Energy: 1.1150181556593728
Energy: 1.0824433337241302
Energy: 1.0353106444478204
Energy: 1.0930597384997003
Energy: 1.0353106444478204
Energy: 1.1188962755211047
Energy: 1.0250520304909136
Energy: 1.0036262752007008
Energy: 1.0250520304920494
Energy: 1.2254792667681191
Energy: 1.103534864812036
Energy: 1.1224674521789626
Energy: 1.1035348648131718

minimum gb energy = 0.967954416417776 eV
minimum distance =  2.24041128090682 Angstroms
sigma value = 7


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

Energy: 1.52667154312903
Energy: 0.9653076991537352
Energy: 1.186720579437451
Energy: 1.1573273547629015
Energy: 1.093429146114722
Energy: 1.0921827901791197
Energy: 1.1879071554801146
Energy: 1.092182790207993
Energy: 0.9691015629247208
Energy: 0.9694742764901231
Energy: 1.05418932625175
Energy: 0.96947427648932
Energy: 0.970280780452826
Energy: 0.9686550631515591
Energy: 1.179540807285389
Energy: 0.9686550631539683
Energy: 1.001308882896373
Energy: 1.0011505304875123
Energy: 1.1515097389465003
Energy: 1.0011505304899215
Energy: 1.073570421603106
Energy: 0.9998576659649443
Energy: 1.1529690526344543
Energy: 0.999857665963338
Energy: 1.1779885837173008
Energy: 1.0004633211880538
Energy: 0.9682341136990116
Energy: 1.0004633211864478
Energy: 1.1730298044720862
Energy: 1.0012887841760285
Energy: 1.0004069520346628
Energy: 1.0012887841760285
Energy: 1.1667522683315974
Energy: 0.968414397609707
Energy: 0.96706557246425
Energy: 0.9684143976089039
Energy: 1.1452556497264217
Energy: 1.1196891700020184
Energy: 0.9688375369599763
Energy: 1.1196891700028213
Energy: 1.0951228419659238
Energy: 1.0958716631154435
Energy: 1.1975612422863036
Energy: 1.0958716631154435
Energy: 1.1281704752067907
Energy: 1.0923718004813394
Energy: 1.1787412907371975
Energy: 1.0923718004813394
Energy: 1.0930592309880856
Energy: 1.0595568758728313
Energy: 1.1252927899583862
Energy: 1.0595568758720284
Energy: 1.0583799509785299
Energy: 1.0225491789153378
Energy: 0.9660552101784927
Energy: 1.022549178920156
Energy: 1.1262932112267714
Energy: 1.059085044171285
Energy: 0.9653899188883741
Energy: 1.0590850441744972
Energy: 1.1740084763716243
Energy: 1.0913720409380476
Energy: 1.0931875875522363
Energy: 1.0913720409404564
Energy: 1.1746779717675138
Energy: 1.0969444332807665
Energy: 1.2200117163938544
Energy: 1.0969444332807665
Energy: 1.0064066239213074
Energy: 1.1195787332533802
Energy: 1.0528678266872904
Energy: 1.1195787332533802
Energy: 0.966291585357059
Energy: 0.9674133654941712
Energy: 1.1765079161825274
Energy: 0.9674133654941712
Energy: 1.000125132214024
Energy: 1.0014032552894734
Energy: 1.174181584172837
Energy: 1.0014032552878671
Energy: 0.9687552747282888
Energy: 1.0000955394141398
Energy: 1.1470051997969704
Energy: 1.0000955394133366
Energy: 1.1743383253197717
Energy: 1.001176802832445
Energy: 1.0737264448692454
Energy: 1.0011768028340513
Energy: 1.175969321874809
Energy: 1.0014017528544779
Energy: 1.001408420040533
Energy: 1.0014017528544779
Energy: 1.1780620146260963
Energy: 0.9687208024508963
Energy: 0.9697128940265097
Energy: 0.9687208024500932
Energy: 1.1468841818470117
Energy: 0.9694445882571012
Energy: 0.9690547371973214
Energy: 0.9694445882587073
Energy: 1.150097259835712
Energy: 1.0919496611468753
Energy: 1.0028320236780002
Energy: 1.0919496611476784
Energy: 1.1863512926470616
Energy: 1.106889575066061
Energy: 1.3332072370452324
Energy: 1.106889575066061
Energy: 1.097909193247939
Energy: 1.0960086979985613
Energy: 1.1251625832272054
Energy: 1.0960086979977581
Energy: 1.0565205961293587
Energy: 1.024231027843912
Energy: 1.0606079733201441
Energy: 1.024231027843109
Energy: 1.1120369145757412
Energy: 1.0580253277963085
Energy: 0.965335809851652
Energy: 1.0580253277955056
Energy: 1.1744532124656735
Energy: 1.1141013835639708
Energy: 1.0985156797228008
Energy: 1.1141013835639708

minimum gb energy = 0.9653076991537352 eV
minimum distance =  2.25108780137697 Angstroms
sigma value = 29


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

Energy: 0.8873104112309222
Energy: 0.8875958463623294
Energy: 0.9180853885364706
Energy: 1.1531202499628412
Energy: 0.8893606981373234
Energy: 0.9982142371404429
Energy: 0.9095885050141003
Energy: 0.9982142371396349
Energy: 0.9043074895520494
Energy: 0.9733369084359209
Energy: 0.892509294077594
Energy: 0.9733369084359209
Energy: 0.890068602645182
Energy: 0.9083455671205322
Energy: 0.9110775597744182
Energy: 0.9083455671202525
Energy: 0.9039578044114612
Energy: 0.9090751512051732
Energy: 0.8896657926040623
Energy: 0.9090751512051732
Energy: 0.910038881619266
Energy: 0.9752215820822098
Energy: 0.8897228172272297
Energy: 0.9752215820819301
Energy: 0.8922473075718697
Energy: 0.9734574340654345
Energy: 0.9037728367282098
Energy: 0.9734574340654345
Energy: 0.9092199116674256
Energy: 0.9095573323654372
Energy: 0.8902413241471063
Energy: 0.9095573323657169
Energy: 0.8903326647766454
Energy: 0.9099610528077026
Energy: 0.9117514264045171
Energy: 0.909961052807454

minimum gb energy = 0.8873104112309222 eV
minimum distance =  2.31185798834387 Angstroms
sigma value = 5


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

Energy: 1.1865156971294215
Energy: 0.8993548885469973
Energy: 1.1207297514148815
Energy: 0.9140460951397056
Energy: 1.08415671374777
Energy: 0.9126622933344902
Energy: 1.0612677328065179
Energy: 0.9126622933155257
Energy: 1.0624217114965129
Energy: 0.9848774530669611
Energy: 1.0587238810033353
Energy: 0.9848774530677197
Energy: 0.9271455938867302
Energy: 0.9112194891576916
Energy: 1.1333104244643195
Energy: 0.9112194891584502
Energy: 1.0624720408185557
Energy: 0.9472286159703076
Energy: 1.0577572619549651
Energy: 0.9472286159710661
Energy: 0.9475609020673678
Energy: 0.947264097693449
Energy: 1.058333017115736
Energy: 0.9472640976926905
Energy: 0.9116364645181199
Energy: 0.9110259523401288
Energy: 1.1329605009139136
Energy: 0.9110259523401288
Energy: 0.9121929719998136
Energy: 0.9137833139388045
Energy: 1.1928213800807541
Energy: 0.9137833139380458
Energy: 1.0436455211768225
Energy: 0.9573686587507044
Energy: 1.1828842603648195
Energy: 0.9573686587491873
Energy: 1.0548771890578392
Energy: 0.8980150383376037
Energy: 0.9009870500343443
Energy: 0.8980150383368795
Energy: 1.0419598880444563
Energy: 0.8960010254178054
Energy: 0.8973617026071184
Energy: 0.8960010254178054
Energy: 1.1841348938088765
Energy: 0.901728570113965
Energy: 0.8948855727696939
Energy: 0.901728570113965
Energy: 1.1879519361056041
Energy: 0.8961440655861467
Energy: 1.1011890741609003
Energy: 0.8961440655861467
Energy: 1.081914370044086
Energy: 0.949133231947583
Energy: 1.0582874549848555
Energy: 0.949133231947583
Energy: 0.9137461207389488
Energy: 0.9118224730578085
Energy: 1.0604971621298478
Energy: 0.9118224730570498
Energy: 0.9168881520282738
Energy: 0.9115952760836517
Energy: 1.1373190248536595
Energy: 0.9115952760821345
Energy: 0.9125018871313575
Energy: 0.9110624876829048
Energy: 0.9243230024054909
Energy: 0.9110624876813878
Energy: 1.0914297950656455
Energy: 0.9137029369330487
Energy: 1.0866539957149346
Energy: 0.9137029369345658
Energy: 1.0596972571298147
Energy: 0.986375152762259
Energy: 1.0632947114602893
Energy: 0.986375152762259
Energy: 1.0905528122804233
Energy: 0.9106817092583469
Energy: 0.924566219678513
Energy: 0.9106817092591055
Energy: 1.0592457694540451
Energy: 0.917668988818142
Energy: 1.0614742184833783
Energy: 0.9176689888173835
Energy: 1.057367364156455
Energy: 0.9472124167333279
Energy: 0.9487958938124199
Energy: 0.9472124167333279
Energy: 1.1334544681295515
Energy: 0.9114503162315353
Energy: 0.9116269604223391
Energy: 0.9114503162315353
Energy: 1.1891826334374929
Energy: 0.9123455241929052
Energy: 0.9174414666289614
Energy: 0.9123455241921467
Energy: 1.1976616235219093
Energy: 0.9556895970804998
Energy: 1.0828748885132966
Energy: 0.9556895970804998
Energy: 0.9014211216844331
Energy: 0.8991787749856758
Energy: 1.0547044571621904
Energy: 0.8991787749856758
Energy: 0.8995002094069255
Energy: 0.8963139319176955
Energy: 1.0436202236563987
Energy: 0.896313931918454
Energy: 0.8963681880475975
Energy: 0.898685589899846
Energy: 0.9704597581665111
Energy: 0.898685589899846
Energy: 1.1414952335922752
Energy: 0.89687033527236
Energy: 1.1898883188568459
Energy: 0.8968703352716015
Energy: 1.0589479337596222
Energy: 0.9543195752937818
Energy: 1.0829026617988629
Energy: 0.9543195752930231
Energy: 1.0586302405719716
Energy: 0.9119594506356894
Energy: 0.9134560891471214
Energy: 0.9119594506356894
Energy: 1.1350308358431653
Energy: 0.9124066587559803
Energy: 0.9131043023155047
Energy: 0.9124066587559803
Energy: 0.9262603999756439
Energy: 0.9111201821654074
Energy: 0.9119584164626552
Energy: 0.911120182166166

minimum gb energy = 0.8948855727696939 eV
minimum distance =  2.28525871232204 Angstroms
sigma value = 1


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

Energy: 1.3843430984456393
Energy: 0.8760449371578386
Energy: 0.8864205784654196
Energy: 0.8864695264112264
Energy: 1.1340496801384785
Energy: 0.8867117248227578
Energy: 1.081949412918702
Energy: 0.8867117248237829
Energy: 1.0674956197839018
Energy: 0.9807182234754551
Energy: 1.0792756892728095
Energy: 0.9807182234744062
Energy: 0.9837025678712288
Energy: 0.8895965390980027
Energy: 1.0827024909631489
Energy: 0.8895965390980027
Energy: 1.0583599565030155
Energy: 0.9431840819369458
Energy: 0.9951565173247664
Energy: 0.9431840819369458
Energy: 0.9326435868837494
Energy: 0.9311227023843727
Energy: 1.0295270825045133
Energy: 0.9311227023843727
Energy: 0.889249646162255
Energy: 0.8889378359805329
Energy: 1.1141470576455477
Energy: 0.8889378359805329
Energy: 0.8909242600739591
Energy: 0.8933095015687352
Energy: 1.179605702863124
Energy: 0.8933095015687352
Energy: 0.8891891080259281
Energy: 0.9505779880530123
Energy: 1.1329226174356164
Energy: 0.9505779880530123
Energy: 1.1645464811191755
Energy: 0.8540041795847468
Energy: 0.958119036954138
Energy: 0.8540041795826491
Energy: 1.0493553816429901
Energy: 0.8601288803331654
Energy: 0.9571795174525369
Energy: 0.8601288803331654
Energy: 1.2334498036789017
Energy: 0.8603939473352825
Energy: 0.9342815383709746
Energy: 0.8603939473352825
Energy: 1.233602130970626
Energy: 0.8537940917866277
Energy: 1.0964545839208097
Energy: 0.8537940917866277
Energy: 1.113726465605022
Energy: 0.8525312382960955
Energy: 1.1455027642221025
Energy: 0.8525312382960955
Energy: 0.9863729531576263
Energy: 0.9467043699089508
Energy: 1.1430954350690044
Energy: 0.9467043699089508
Energy: 0.9866026266028842
Energy: 0.8905508066401712
Energy: 1.0833754725914417
Energy: 0.8905508066391222
Energy: 0.955108255036957
Energy: 0.8912974504949382
Energy: 0.9930899761649415
Energy: 0.8912974504959871
Energy: 0.9016335068055075
Energy: 0.8932279180259884
Energy: 1.031298268736077
Energy: 0.8932279180259884
Energy: 0.8911232469232462
Energy: 0.8904034524516324
Energy: 1.192694365614324
Energy: 0.8904034524516324
Energy: 0.9314671421735427
Energy: 1.0767237953953457
Energy: 1.1804280415704993
Energy: 1.076723795394297
Energy: 1.157839047797969
Energy: 0.9518971096164245
Energy: 1.0851305388492452
Energy: 0.9518971096153757
Energy: 1.1592510029011092
Energy: 0.8863493145786004
Energy: 0.8856231540199376
Energy: 0.8863493145786004
Energy: 1.171973889544088
Energy: 0.8845285303809176
Energy: 0.8851323425241218
Energy: 0.8845285303788197
Energy: 1.1636690104252818
Energy: 0.9084722878448446
Energy: 0.9128291220545354
Energy: 0.9084722878437956

minimum gb energy = 0.8525312382960955 eV
minimum distance =  2.28247436912917 Angstroms
sigma value = 17


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

Energy: 1.336980289652327
Energy: 0.8606358472501615
Energy: 1.093404056256247
Energy: 0.8717974271975232
Energy: 0.9422030827068358
Energy: 0.8676309101196834
Energy: 0.9959916622212673
Energy: 0.8676309101196834
Energy: 1.105114890322561
Energy: 0.8671205580602894
Energy: 0.992981508349175
Energy: 0.8671205580609377
Energy: 1.1043968432234768
Energy: 0.8538498152958046
Energy: 0.9539401916370153
Energy: 0.8538498152983978
Energy: 1.086252593783155
Energy: 0.85437470466405
Energy: 1.1916019015989827
Energy: 0.8543747046646983
Energy: 0.8548946744493628
Energy: 0.8668843160284868
Energy: 1.1851773979721678
Energy: 0.8668843160284868
Energy: 0.8547046373150663
Energy: 0.8539664821343685
Energy: 0.9515478339763901
Energy: 0.8539664821343685
Energy: 0.8580933454606986
Energy: 0.8558859407240207
Energy: 1.2866358372732294
Energy: 0.8558859407233723
Energy: 1.1437866717185339
Energy: 0.8559348094891074
Energy: 1.1917508408003663
Energy: 0.8559348094891074
Energy: 0.9868231055599274
Energy: 0.9205293250226536
Energy: 1.0190294401034445
Energy: 0.9205293250239502
Energy: 1.1863520161702976
Energy: 0.8656231862400385
Energy: 0.8749349896559658
Energy: 0.8656231862393904
Energy: 1.2337707874860866
Energy: 0.8701755215589039
Energy: 0.9962143271124786
Energy: 0.8701755215608488
Energy: 1.1881064809663546
Energy: 0.8654777283829589
Energy: 0.8668610889949564
Energy: 0.8654777283849038
Energy: 1.0911180107036682
Energy: 0.8665571106867062
Energy: 0.8678576617377434
Energy: 0.8665571106867062
Energy: 1.10165425609301
Energy: 0.8689028140386975
Energy: 0.870966521876044
Energy: 0.8689028140386975
Energy: 1.2780657582887156
Energy: 0.8988847828579902
Energy: 1.0970894243308098
Energy: 0.8988847828579902
Energy: 0.9073338466882177
Energy: 0.8705751124460022
Energy: 1.217989623554328
Energy: 0.8705751124447055
Energy: 0.8752911407268352
Energy: 0.8673966976535976
Energy: 1.207935144244526
Energy: 0.8673966976542459
Energy: 0.9085293739350774
Energy: 0.8683025363094742
Energy: 1.1884296156029155
Energy: 0.8683025363094742
Energy: 0.8735848675008493
Energy: 0.9682599938113156
Energy: 1.3367918796403822
Energy: 0.9682599938177985
Energy: 0.996833891097347
Energy: 0.8679089789891631
Energy: 1.0312249889881078
Energy: 0.8679089789878666
Energy: 0.9941998590366247
Energy: 0.8658251812048683
Energy: 1.1034180559140185
Energy: 0.8658251812048683
Energy: 0.9509128054725076
Energy: 0.8534711292714392
Energy: 1.1032398748152878
Energy: 0.8534711292720875
Energy: 1.1927699306094492
Energy: 0.8549682970398862
Energy: 0.9683942679075833
Energy: 0.8549682970405346
Energy: 1.1837524341850942
Energy: 0.8651304300680631
Energy: 0.8662849926964842
Energy: 0.8651304300687114
Energy: 0.9330323397682628
Energy: 0.8545857830211694
Energy: 0.8571188267925756
Energy: 0.854585783020521
Energy: 1.336919740052936
Energy: 0.8570385296234178
Energy: 0.8615311635848788
Energy: 0.8570385295839317
Energy: 1.1864608619787274
Energy: 0.8553737340046741
Energy: 1.1608500204171621
Energy: 0.8553737340059706
Energy: 0.9924957883893805
Energy: 0.9175641363973102
Energy: 0.9885514419396085
Energy: 0.9175641363953653
Energy: 0.8762085055602501
Energy: 0.8651910560546537
Energy: 1.159854514412591
Energy: 0.8651910560546537
Energy: 0.9962725201522223
Energy: 0.8928661155795684
Energy: 1.1840691874998577
Energy: 0.8928661155789201
Energy: 0.8943878489080109
Energy: 0.8929665069225134
Energy: 1.1854785347310242
Energy: 0.8929665069225134
Energy: 0.8656618635593794
Energy: 0.8653666191506081
Energy: 1.0936240619932793
Energy: 0.8653666191499598
Energy: 0.8737476834539749
Energy: 0.8676871923905635
Energy: 1.101074969719153
Energy: 0.8676871923905635
Energy: 1.206263525941596
Energy: 0.9026686347893428
Energy: 1.2760346181096276
Energy: 0.9026686347899912
Energy: 1.2177344051297994
Energy: 0.8700867555919297
Energy: 0.9040653183519263
Energy: 0.8700867555899849
Energy: 1.0980144043896671
Energy: 0.8657365122823899
Energy: 0.8664017547567009
Energy: 0.8657365122823899
Energy: 1.192430215896823
Energy: 0.8697496466978504
Energy: 0.9057355923799827
Energy: 0.8697496466959057

minimum gb energy = 0.8534711292714392 eV
minimum distance =  2.28438311715025 Angstroms
sigma value = 89


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

Energy: 1.4044739000301276
Energy: 0.8236181270295057
Energy: 0.7973937913144956
Energy: 0.7973588229146354
Energy: 0.7868896474917666
Energy: 0.795671859369767
Energy: 0.8137361166508899
Energy: 0.7956718593714632
Energy: 0.7873947487643738
Energy: 0.8777108960822705
Energy: 0.8509213377078638
Energy: 0.8777108960822705
Energy: 0.7887271431362701
Energy: 0.8789329846764896
Energy: 0.8136122627031296
Energy: 0.8789329846781859
Energy: 0.7940632970864289
Energy: 0.7955516936049852
Energy: 1.026928480594931
Energy: 0.7955516936066814
Energy: 0.7943155741987216
Energy: 0.7958396912927818
Energy: 1.0249475526805958
Energy: 0.7958396912944781
Energy: 0.7931966309710887
Energy: 0.7935455686399587
Energy: 0.8510209650837219
Energy: 0.7935455686399587
Energy: 0.7968964519563839
Energy: 0.798143369706063
Energy: 0.787217345285816
Energy: 0.798143369706063
Energy: 0.8133310856980956
Energy: 0.8779680462954201
Energy: 0.7865281699424737
Energy: 0.877968046293724
Energy: 0.8498561283028638
Energy: 0.8792989666159059
Energy: 0.8524726581641393
Energy: 0.8792989666159059
Energy: 0.8134738407171439
Energy: 0.8785997007070265
Energy: 0.7861438658260536
Energy: 0.8785997007070265
Energy: 1.024290073597656
Energy: 0.7975032942962509
Energy: 0.8133372120244189
Energy: 0.7975032942962509
Energy: 1.0278106396172537
Energy: 0.7965841433822536
Energy: 0.7966282357294483
Energy: 0.7965841433822536
Energy: 0.8489343803180666
Energy: 0.7932825377991725
Energy: 0.7929858895893315
Energy: 0.7932825378008687
Energy: 0.7875845046288014
Energy: 0.7958912867446797
Energy: 0.7962304239157059
Energy: 0.795891286746376

minimum gb energy = 0.7861438658260536 eV
minimum distance =  2.31168017613203 Angstroms
sigma value = 13


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

Energy: 1.2445165925937032
Energy: 0.7654353350890346
Energy: 1.0081591731836408
Energy: 0.7605142791213666
Energy: 1.1807162659908137
Energy: 0.7550130441497191
Energy: 0.8938144005781773
Energy: 0.7550130441475863
Energy: 1.1837976914536552
Energy: 0.7548014465773155
Energy: 0.8822559109408709
Energy: 0.7548014465766044
Energy: 0.9871512690493995
Energy: 0.8189600740967944
Energy: 1.0355475189898211
Energy: 0.8189600740989272
Energy: 1.0378497479308817
Energy: 0.8139339535334815
Energy: 1.0953295686743196
Energy: 0.8139339535349034
Energy: 0.8833477845557621
Energy: 0.756237396478323
Energy: 1.0956679217513186
Energy: 0.7562373964776121
Energy: 0.8850031325789027
Energy: 0.7550929635062682
Energy: 1.0337389022685763
Energy: 0.7550929635062682
Energy: 0.8709473803532523
Energy: 0.7564267805891063
Energy: 1.1043856319204
Energy: 0.7564267805891063
Energy: 0.7696257610711161
Energy: 0.7572125362432517
Energy: 1.103318128153486
Energy: 0.7572125362439626
Energy: 0.7565235760070086
Energy: 0.7551108872474529
Energy: 1.1069781086076012
Energy: 0.7551108872488747
Energy: 0.7799700039871325
Energy: 0.7613769192488182
Energy: 1.245792308852393
Energy: 0.7613769192573497
Energy: 1.096343494481395
Energy: 0.7549577695769344
Energy: 1.10706688333149
Energy: 0.7549577695790671
Energy: 1.0965308516470502
Energy: 0.8027355064430901
Energy: 1.0959701201131615
Energy: 0.8027355064473558
Energy: 1.10220738892665
Energy: 0.7541437330603484
Energy: 0.9887970116242194
Energy: 0.7541437330603484
Energy: 1.1042566757452552
Energy: 0.7557517960880296
Energy: 1.01381805790291
Energy: 0.7557517960894515
Energy: 1.1042443475975585
Energy: 0.7557240356804938
Energy: 0.7580828133408991
Energy: 0.7557240356819158
Energy: 1.1003339105940517
Energy: 0.7552001732610222
Energy: 0.7561887491610114
Energy: 0.7552001732631549
Energy: 1.2442017926250917
Energy: 0.7561552373014733
Energy: 0.7609194394117529
Energy: 0.7561552373000513
Energy: 1.0019857891017165
Energy: 0.7563500543890356
Energy: 0.9000419528130457
Energy: 0.7563500543904574
Energy: 1.1093172833558262
Energy: 0.7537581086719346
Energy: 0.8741430992071261
Energy: 0.7537581086705127
Energy: 0.9849567996607921
Energy: 0.7603312422342843
Energy: 0.9035061596120728
Energy: 0.7603312422335734
Energy: 1.1066985251509358
Energy: 0.8110386574125547
Energy: 1.0958211551350072
Energy: 0.8110386574125547
Energy: 0.888026503531948
Energy: 0.7564145469064426
Energy: 1.0957454196692051
Energy: 0.7564145469050207
Energy: 0.7580459062080519
Energy: 0.7535826437238764
Energy: 1.1032060215449795
Energy: 0.7535826437245873
Energy: 0.8694552488050242
Energy: 0.7697273842823673
Energy: 1.1035171812833988
Energy: 0.7697273842816564
Energy: 0.7708339826141427
Energy: 0.769443247641295
Energy: 1.103638208114941
Energy: 0.7694432476420061
Energy: 0.7543812833582492
Energy: 0.7538394005110888
Energy: 1.10537268484755
Energy: 0.7538394005117998
Energy: 0.7542480156233416
Energy: 0.7581116167352625
Energy: 1.193697154485244
Energy: 0.7581116167381063
Energy: 1.0785879470778792
Energy: 0.7549968579961849
Energy: 1.0044490915722954
Energy: 0.7549968579961849
Energy: 0.8718475901162468
Energy: 0.8058665149101301
Energy: 1.098350370567941
Energy: 0.8058665149101301
Energy: 1.0981767698183267
Energy: 0.8103311005869597
Energy: 0.9860661210707523
Energy: 0.8103311005883815
Energy: 1.1040767285472024
Energy: 0.7561506617284309
Energy: 1.01499271360842
Energy: 0.7561506617255871
Energy: 1.1036124106439065
Energy: 0.7564249926513439
Energy: 0.7622274093840748
Energy: 0.7564249926520549
Energy: 1.158595879682531
Energy: 0.7534395346692979
Energy: 0.7545708660915915
Energy: 0.7534395346692979
Energy: 1.0039321058684885
Energy: 0.7554692579734675
Energy: 0.7593924568780901
Energy: 0.7554692579741785

minimum gb energy = 0.7534395346692979 eV
minimum distance =  2.3067171381235 Angstroms
sigma value = 37


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

Energy: 1.2163802959171786
Energy: 0.726829436681786
Energy: 0.7076156153318578
Energy: 0.7049291808524102
Energy: 1.1691030124445136
Energy: 0.7062713270838697
Energy: 0.9049691332820533
Energy: 0.7062713270838697
Energy: 1.156963507283396
Energy: 0.7045598515915327
Energy: 0.9035550252945737
Energy: 0.7045598515915327
Energy: 1.1568092209882357
Energy: 0.7942170813353265
Energy: 0.910412254288095
Energy: 0.7942170813353265
Energy: 1.1126434531055158
Energy: 0.7936550150958818
Energy: 0.990402979126342
Energy: 0.793655015097105
Energy: 0.7852494264216486
Energy: 0.6953778578208906
Energy: 1.0109604794193157
Energy: 0.6953778578208906
Energy: 0.7896418911246135
Energy: 0.6944137836763928
Energy: 1.0799235633101625
Energy: 0.6944137836763928
Energy: 0.8806964347866767
Energy: 0.6868822941820476
Energy: 1.1605900397302917
Energy: 0.6868822941832707
Energy: 0.7912832437135443
Energy: 0.6979995795702076
Energy: 1.1607417932987147
Energy: 0.6979995795689845
Energy: 0.7840765172149391
Energy: 0.6838545995869402
Energy: 1.0744222736156985
Energy: 0.683854599585717
Energy: 0.8521250392658148
Energy: 0.8526809477392666
Energy: 1.0847175599174539
Energy: 0.8526809477392666
Energy: 0.979145661030454
Energy: 0.6839117521214759
Energy: 1.075149708071913
Energy: 0.6839117521214759
Energy: 0.9818710919424741
Energy: 0.6947016423838934
Energy: 1.157047456430428
Energy: 0.6947016423838934
Energy: 1.0831907861354717
Energy: 0.7704452997937912
Energy: 1.156821524177819
Energy: 0.7704452997950143
Energy: 0.990402979126342
Energy: 0.7837671927258398
Energy: 1.079206888098486
Energy: 0.7837671927258398
Energy: 1.0109604794180922
Energy: 0.7831731745622261
Energy: 0.7853023681193787
Energy: 0.7831731745622261
Energy: 1.113563236890378
Energy: 0.704616333392637
Energy: 0.7900884429500624
Energy: 0.7046163333914138
Energy: 1.1605900397302917
Energy: 0.7051585697896884
Energy: 0.6981557954955874
Energy: 0.7051585697896884
Energy: 1.1607417932987147
Energy: 0.7083772281487791
Energy: 0.7054893952439708
Energy: 0.708377228147556
Energy: 1.0954507664484259
Energy: 0.7061596088794273
Energy: 0.7126600665226761
Energy: 0.7061596088794273

minimum gb energy = 0.683854599585717 eV
minimum distance =  2.29750303561993 Angstroms
sigma value = 25


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

Energy: 1.4006232671201284
Energy: 0.6442985822157032
Energy: 0.6247124134733268
Energy: 0.6233215696811477
Energy: 1.2139358351029224
Energy: 0.6202850274857704
Energy: 0.783828471739396
Energy: 0.6202850274848153
Energy: 1.2663678396458324
Energy: 0.6200114854414468
Energy: 0.7805683136499549
Energy: 0.6200114854424019
Energy: 1.0070292907588012
Energy: 0.6244298560892847
Energy: 0.9312628537825015
Energy: 0.6244298560892847
Energy: 1.2128399940559647
Energy: 0.6891891006294034
Energy: 1.076604607484534
Energy: 0.6891891006294034
Energy: 1.0012308999465322
Energy: 0.688897252788208
Energy: 1.075077699789845
Energy: 0.688897252788208
Energy: 1.0021614320603744
Energy: 0.6146417363196722
Energy: 1.074606535279138
Energy: 0.6146417363187172
Energy: 0.9520979729315053
Energy: 0.6181007758146756
Energy: 1.1322338109813959
Energy: 0.6181007758156306
Energy: 0.7808884190290781
Energy: 0.6149874846680622
Energy: 1.2136456652334213
Energy: 0.6149874846680622
Energy: 0.7830744220395789
Energy: 0.6160038299875752
Energy: 1.1984778095697246
Energy: 0.6160038299866201
Energy: 0.6911171144449815
Energy: 0.6169755607459843
Energy: 1.1973350730102448
Energy: 0.6169755605894289
Energy: 0.6931734977672079
Energy: 0.6162204993267312
Energy: 1.198611978851654
Energy: 0.6162204993286413
Energy: 0.6941339490841604
Energy: 0.6106804517040152
Energy: 1.1983189195643633
Energy: 0.6106804517030601
Energy: 0.8512087622069932
Energy: 0.6089536459913412
Energy: 1.198870939199313
Energy: 0.6089536459894309
Energy: 0.8479217356049075
Energy: 0.6095985639375606
Energy: 1.1990923851922066
Energy: 0.6095985639366055
Energy: 0.8506885994933266
Energy: 0.6100765913838181
Energy: 1.2697646141972363
Energy: 0.6100765913847732
Energy: 1.062685868437107
Energy: 0.6110692965158682
Energy: 1.2635064152921487
Energy: 0.6110692965158682
Energy: 0.8376708100165026
Energy: 0.6892172930455238
Energy: 0.9375856878509846
Energy: 0.6892172930464789
Energy: 1.0747757799540043
Energy: 0.6861653248637876
Energy: 1.0006784026711553
Energy: 0.6861653248647426
Energy: 1.2148652466897387
Energy: 0.6848206719752701
Energy: 1.0015163713818795
Energy: 0.6848206719771806
Energy: 1.1992747925909542
Energy: 0.6866201116006903
Energy: 0.7843433170315001
Energy: 0.6866201116006903
Energy: 1.2182220830260697
Energy: 0.6187379445979834
Energy: 0.6870104364114248
Energy: 0.6187379445989384
Energy: 1.2107935230699736
Energy: 0.6222777862508703
Energy: 0.7856293205669945
Energy: 0.6222777862499151
Energy: 1.1339768959797016
Energy: 0.6204395332096391
Energy: 0.6195393831136307
Energy: 0.6204395332096391
Energy: 1.2132166193275193
Energy: 0.6198441963655894
Energy: 0.6209119674105332
Energy: 0.6198441963655894
Energy: 1.2676340442305754
Energy: 0.6278903027300595
Energy: 0.6237136034945919
Energy: 0.6278903027291043

minimum gb energy = 0.6089536459894309 eV
minimum distance =  2.3091045666509 Angstroms
sigma value = 41


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

Energy: 1.4292504594692361
Energy: 0.5831568811928735
Energy: 0.5611493386842298
Energy: 0.562413505729755
Energy: 1.2980272065114784
Energy: 0.5542002475712204
Energy: 0.6917617763336522
Energy: 0.5542002475696544
Energy: 1.2844175934324138
Energy: 0.5547409148504212
Energy: 0.6798227356437918
Energy: 0.5547409148504212
Energy: 1.0632978602151708
Energy: 0.5596962355252164
Energy: 0.9471484077281459
Energy: 0.5596962355252164
Energy: 1.1800864302099825
Energy: 0.5526430969006254
Energy: 0.9401772910095492
Energy: 0.5526430968982763
Energy: 1.0546222706426869
Energy: 0.554100045702205
Energy: 0.9394236353407732
Energy: 0.5541000457014218
Energy: 1.059948987892743
Energy: 0.6135212971294228
Energy: 1.0647113940901851
Energy: 0.6135212971294228
Energy: 1.0654153241500948
Energy: 0.6181113970374845
Energy: 0.9305266355343442
Energy: 0.6181113970359184
Energy: 0.8015424150797291
Energy: 0.554406398627811
Energy: 1.1704482014032147
Energy: 0.5544063986270281
Energy: 0.8183978553912782
Energy: 0.5528356679864117
Energy: 1.291021129116268
Energy: 0.5528356679856287
Energy: 0.6887627959600227
Energy: 0.5619617291675854
Energy: 1.2652718829761618
Energy: 0.5619617291675854
Energy: 0.6764873396562633
Energy: 0.5535786624945097
Energy: 1.2923942513773763
Energy: 0.5535786624945097
Energy: 0.6940278862043925
Energy: 0.5557771388803926
Energy: 1.2901839955145504
Energy: 0.5557771388803926
Energy: 0.5537571089353445
Energy: 0.5608236662344218
Energy: 1.1776850115689983
Energy: 0.5608236662359879
Energy: 0.5552999468615964
Energy: 0.5535775517157516
Energy: 1.2879001234992513
Energy: 0.5535775517149685
Energy: 0.559362733233903
Energy: 0.5556340771141105
Energy: 1.2880142911948416
Energy: 0.5556340771141105
Energy: 0.6931162039251677
Energy: 0.5578221641515999
Energy: 1.2910065270825706
Energy: 0.557822164150817
Energy: 0.6758144623120584
Energy: 0.5530184332084221
Energy: 1.2885138155464961
Energy: 0.5530184332084221
Energy: 0.6943419218476224
Energy: 0.5572609523834021
Energy: 1.05735841804563
Energy: 0.5572609523849682
Energy: 0.9432148673498332
Energy: 0.5556173382862576
Energy: 1.0553854734051933
Energy: 0.5556173382839086
Energy: 0.9490268304083617
Energy: 0.5536291089076739
Energy: 1.1721513742448755
Energy: 0.553629108908457
Energy: 0.9399192318507206
Energy: 0.6124125589068672
Energy: 1.0613981557829526
Energy: 0.6124125589068672
Energy: 1.170408803496011
Energy: 0.6103873808007175
Energy: 1.054127618932192
Energy: 0.6103873807999343
Energy: 0.9299753535614314
Energy: 0.6133673405440216
Energy: 0.9413463281271047
Energy: 0.6133673405448048
Energy: 1.1737003117110494
Energy: 0.5533690177646077
Energy: 0.7956710687314862
Energy: 0.5533690177653906
Energy: 1.1721007396430514
Energy: 0.5555541332562601
Energy: 0.9392228605112198
Energy: 0.5555541332562601
Energy: 1.1748429858330094
Energy: 0.5577992983342683
Energy: 0.6981790732612131
Energy: 0.5577992983350515
Energy: 1.286058401504406
Energy: 0.5535975281214294
Energy: 0.6741668267935393
Energy: 0.5535975281190803
Energy: 1.1738347053345934
Energy: 0.5571558225163473
Energy: 0.6920943795692923
Energy: 0.5571558225171304
Energy: 1.1715190827630473
Energy: 0.5597058329666252
Energy: 0.5542089723771872
Energy: 0.5597058329658422
Energy: 1.2876426243493444
Energy: 0.5546212839110863
Energy: 0.5546082639640459
Energy: 0.5546212839110863
Energy: 1.293746162785539
Energy: 0.5602969877010598
Energy: 0.5534472478250703
Energy: 0.5602969877010598

minimum gb energy = 0.5526430968982763 eV
minimum distance =  2.31213921131538 Angstroms
sigma value = 15


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

Energy: 1.2332128421916504
Energy: 0.5342653977707794
Energy: 0.5167346082663842
Energy: 0.5172108591752678
Energy: 1.352080716417873
Energy: 0.5118438282955733
Energy: 0.6171134720482216
Energy: 0.5118438282962366
Energy: 1.3440294594550786
Energy: 0.511697257249073
Energy: 0.6175256333550478
Energy: 0.5116972572464197
Energy: 1.1544966381479704
Energy: 0.5155285208043207
Energy: 0.8495403611666199
Energy: 0.5155285208036573
Energy: 1.2522420740907882
Energy: 0.5089626135444826
Energy: 0.8315869443481066
Energy: 0.5089626135458094
Energy: 1.1460100099312176
Energy: 0.5091901524624596
Energy: 0.8417333311989391
Energy: 0.5091901524617962
Energy: 0.9436351234750633
Energy: 0.5134936970146637
Energy: 1.0504626740943495
Energy: 0.5134936970126737
Energy: 1.0536857934933161
Energy: 0.5662046387006489
Energy: 0.8374820862614429
Energy: 0.5662046387013122
Energy: 0.942951948845227
Energy: 0.5579806800431485
Energy: 1.044592120084086
Energy: 0.5579806800418219
Energy: 0.94190760768976
Energy: 0.55773381880398
Energy: 1.2432817093366673
Energy: 0.5577338188026533
Energy: 0.8485890613286216
Energy: 0.5130311072505247
Energy: 1.098641285708806
Energy: 0.5130311072412377
Energy: 0.7151938369031109
Energy: 0.5082211357462288
Energy: 1.2441524482447244
Energy: 0.5082211357449022
Energy: 0.83800495324289
Energy: 0.5105831357352114
Energy: 1.2438719098424948
Energy: 0.510583135734548
Energy: 0.6347691607868443
Energy: 0.5149929842323102
Energy: 1.0502293887856382
Energy: 0.5149929842323102
Energy: 0.6118785635696592
Energy: 0.5091543167214279
Energy: 1.3465631176541353
Energy: 0.5091543167214279
Energy: 0.6297433330358319
Energy: 0.51307453294824
Energy: 1.2462808228924607
Energy: 0.51307453294824
Energy: 0.5203868776940993
Energy: 0.5137809937932769
Energy: 1.2511278826535701
Energy: 0.5137809937919502
Energy: 0.5097480409157933
Energy: 0.510104328199731
Energy: 1.3448704439921582
Energy: 0.510104328199731
Energy: 0.5197422738706271
Energy: 0.5124240983859102
Energy: 1.151090113100952
Energy: 0.5124240983786132
Energy: 0.6274971812553196
Energy: 0.5117521019391551
Energy: 1.3493667605394983
Energy: 0.5117521019398183
Energy: 0.6103099175663452
Energy: 0.5108286843466592
Energy: 1.3463833153576923
Energy: 0.5108286843453325
Energy: 0.6331615735490528
Energy: 0.5144463182155938
Energy: 1.1516705596210763
Energy: 0.514446318212277
Energy: 0.843315993697661
Energy: 0.5106261712595584
Energy: 1.1434707590978401
Energy: 0.5106261712602218
Energy: 0.8324882196879332
Energy: 0.508338575672312
Energy: 1.2460928639487356
Energy: 0.508338575672312
Energy: 0.8467742008853436
Energy: 0.5126905956042587
Energy: 0.9637042662690614
Energy: 0.5126905956029318
Energy: 1.0450691902542406
Energy: 0.5577334587276791
Energy: 1.1592487847677226
Energy: 0.5577334587170655
Energy: 0.8302961292046294
Energy: 0.5583227886312684
Energy: 1.0465241551540314
Energy: 0.5583227886325951
Energy: 1.0532702425427605
Energy: 0.5650779748108034
Energy: 0.9476396438836899
Energy: 0.5650779748094766
Energy: 1.046253356725708
Energy: 0.5118238681131939
Energy: 1.049548363913049
Energy: 0.5118238681138573
Energy: 1.0441048466042464
Energy: 0.5095602396622511
Energy: 0.8423954510767923
Energy: 0.5095602396649044
Energy: 1.2511583126671348
Energy: 0.509440080633325
Energy: 0.7141912830475281
Energy: 0.5094400806346517
Energy: 1.0501047781063875
Energy: 0.5146259124415486
Energy: 0.8487029249136815
Energy: 0.5146259124435387
Energy: 1.2443714004421293
Energy: 0.5116295765873586
Energy: 0.6171552507846445
Energy: 0.5116295765860319
Energy: 1.3522939193814536
Energy: 0.511357412646051
Energy: 0.6160384405660512
Energy: 0.5113574126447243
Energy: 1.2551952377758842
Energy: 0.5174797765731464
Energy: 0.6364819690625335
Energy: 0.5174797765738096
Energy: 1.3486227865144835
Energy: 0.5115184908379002
Energy: 0.5148814697695651
Energy: 0.5115184908405536
Energy: 1.3417068445434746
Energy: 0.511651984155424
Energy: 0.5143630966669902
Energy: 0.5116519841560875

minimum gb energy = 0.5082211357449022 eV
minimum distance =  2.31406823041572 Angstroms
sigma value = 85


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

Energy: 1.3818450125068242
Energy: 0.4987532099695612
Energy: 0.4584979602741402
Energy: 0.45860380524799266
Energy: 1.3821137486749853
Energy: 0.46081336357826447
Energy: 0.5479295271206247
Energy: 0.46081336357883984
Energy: 1.2414078772500643
Energy: 0.4603416629507655
Energy: 0.5475580045539523
Energy: 0.4603416629501902
Energy: 1.0610227877104406
Energy: 0.45876222526848226
Energy: 0.7480187196467883
Energy: 0.4587622252656056
Energy: 1.2885215993169963
Energy: 0.45862530813211005
Energy: 0.7417322526021782
Energy: 0.45862530813211005
Energy: 1.0632154437005825
Energy: 0.45941155913129195
Energy: 0.7430976238689908
Energy: 0.4594115591301413
Energy: 1.067568301936515
Energy: 0.46000140925697947
Energy: 0.939155034972069
Energy: 0.46000140925755484
Energy: 1.112192671911404
Energy: 0.458667003466958
Energy: 0.7952778325703235
Energy: 0.45866700346580735
Energy: 1.0669442934986832
Energy: 0.4597453174586948
Energy: 0.933413774770279
Energy: 0.4597453174598455
Energy: 1.0660373424932374
Energy: 0.5453945682898804
Energy: 1.1109355264314753
Energy: 0.5453945682887297
Energy: 0.9329136029236338
Energy: 0.4582548567421253
Energy: 1.023644798931872
Energy: 0.45825485669782484
Energy: 0.8882116415279445
Energy: 0.4586422940146494
Energy: 1.1116491221627516
Energy: 0.4586422941521013
Energy: 0.9330787757178021
Energy: 0.45824512650638916
Energy: 1.1530940233755997
Energy: 0.4582451265058137
Energy: 0.7458998602133046
Energy: 0.46087447666447623
Energy: 0.9721252631151895
Energy: 0.46087447666447623
Energy: 0.6877940618110191
Energy: 0.4580645885923212
Energy: 1.285653637296385
Energy: 0.4580645885923212
Energy: 0.751222863042573
Energy: 0.46082798097219985
Energy: 1.154330914181045
Energy: 0.46082798097104916
Energy: 0.5616632348267182
Energy: 0.45916335569584266
Energy: 1.15147025748804
Energy: 0.459163355694692
Energy: 0.5563242492957842
Energy: 0.4579469707446363
Energy: 1.3337480680899476
Energy: 0.457946970744061
Energy: 0.5563307353275256
Energy: 0.45982710685388717
Energy: 1.3263749274668895
Energy: 0.4598271068556132
Energy: 0.5049827210852026
Energy: 0.45744724879403104
Energy: 1.3259419424590013
Energy: 0.45744724879288035
Energy: 0.5016179454042269
Energy: 0.4566067265045969
Energy: 1.3744895210050623
Energy: 0.45660672650344625
Energy: 0.5049393734086043
Energy: 0.4562946206114522
Energy: 1.1952526971272717
Energy: 0.45629462061087683
Energy: 0.603244068575146
Energy: 0.4594131878742441
Energy: 1.368083936035491
Energy: 0.45941318787366875
Energy: 0.5929862826100178
Energy: 0.45811757839845896
Energy: 1.3696040884674316
Energy: 0.4581175783990343
Energy: 0.6021176166563014
Energy: 0.4565480447368793
Energy: 1.0610446558204873
Energy: 0.45654804473572863
Energy: 0.7501359088824165
Energy: 0.45844835327267275
Energy: 1.3745770138593025
Energy: 0.4584483532732481
Energy: 0.7485605286294662
Energy: 0.45766562506828734
Energy: 1.2410324768363497
Energy: 0.4576656250694119
Energy: 0.8581741396927235
Energy: 0.4605215773873886
Energy: 1.0630713391368942
Energy: 0.4605215773862379
Energy: 0.9314233364440045
Energy: 0.4576127034045683
Energy: 1.245740241029746
Energy: 0.457612703405719
Energy: 0.9312314132559257
Energy: 0.457687797751609
Energy: 1.0642656133663115
Energy: 0.45768779775103374
Energy: 1.1162996865611363
Energy: 0.5459213423708443
Energy: 0.8853231899386503
Energy: 0.5459213423731457
Energy: 0.979470038278416
Energy: 0.5457397164137101
Energy: 1.0824126668917038
Energy: 0.5457397164131347
Energy: 1.1114831524512128
Energy: 0.6138667972435752
Energy: 0.8845804323005582
Energy: 0.6138667972435752
Energy: 1.2074537682901951
Energy: 0.46010780087239667
Energy: 0.8848351768076568
Energy: 0.4601078008706706
Energy: 0.9723484135377991
Energy: 0.4616608837736711
Energy: 0.8308944413581008
Energy: 0.46166088377597236
Energy: 1.2863054186718195
Energy: 0.4585829712274081
Energy: 0.7418276244633772
Energy: 0.4585829712262574
Energy: 1.3282043228303677
Energy: 0.45977248202437904
Energy: 0.7521003298946993
Energy: 0.45977248202437904
Energy: 1.1524369589995598
Energy: 0.4588116000612911
Energy: 0.5584424666262913
Energy: 0.4588116000618664
Energy: 1.3757603847355317
Energy: 0.45868586301715336
Energy: 0.5491258111110546
Energy: 0.4586858630177287
Energy: 1.3302845757331792
Energy: 0.45971799229337557
Energy: 0.5573268295150944
Energy: 0.4597179922928002
Energy: 1.1506024509194233
Energy: 0.4594777701311557
Energy: 0.45904286508897635
Energy: 0.4594777701317311
Energy: 1.3747246787719203
Energy: 0.4589371040583559
Energy: 0.45932470272355663
Energy: 0.45893710405662996
Energy: 1.244804162075667
Energy: 0.4603761724098342
Energy: 0.46006791617523013
Energy: 0.46037617240925893

minimum gb energy = 0.45629462061087683 eV
minimum distance =  2.30806713802091 Angstroms
sigma value = 113


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

Energy: 0.01540594804213933
Energy: 0.016220704782579805
Energy: 1.047799436060642
Energy: 0.3997383203554812
Energy: 0.0161725306857622
Energy: 0.11004228736680959
Energy: 0.7554363021785858
Energy: 0.11004228736680959
Energy: 0.01593131612585869
Energy: 0.10975868893063208
Energy: 0.7543465200061421
Energy: 0.1097586889301898
Energy: 0.01702441868492866
Energy: 0.1111630419681394
Energy: 0.756606885447171
Energy: 0.11116304196855713
Energy: 0.7492448352285784
Energy: 0.11148420738485867
Energy: 0.7572692192067211
Energy: 0.11148420738485867
Energy: 0.015921997928183523
Energy: 0.10961102065740108
Energy: 0.7539812834116807
Energy: 0.10961102065740108

minimum gb energy = 0.01540594804213933 eV
minimum distance =  2.52574800048564 Angstroms
sigma value = 1