Model name: model_name=MEAM_LAMMPS_ShimKoKim_2013_AlVH__MO_344724145339_001
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.044650822877884
cohesive_energy=3.3602642806077534
mass=26.981538
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: 0.010384127763472
Energy: 0.01086925186549944
Energy: 0.38299312677103003
Energy: 0.01086925186549944
Energy: 0.01086925186549944
Energy: 0.5098373809002882
Energy: 0.01086925186549944
Energy: 0.5098373809002882
Energy: 0.38299312677103003
Energy: 0.01086925186549944
Energy: 0.010384127763472
Energy: 0.01086925186549944
Energy: 0.010869251866000478
Energy: 0.5098373809002882
Energy: 0.01086925186549944
Energy: 0.5098373809002882

minimum gb energy = 0.010384127763472 eV
minimum distance =  2.70790589632557 Angstroms
sigma value = 1


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

Energy: 0.5704717277535628
Energy: 0.5618985796234427
Energy: 0.6278163446242333
Energy: 0.561898579622835
Energy: 0.559395628023052
Energy: 0.5699742886820172
Energy: 0.5406669365787448
Energy: 0.5699742886820172
Energy: 0.5398814262663072
Energy: 0.553927749670045
Energy: 0.5535996759137
Energy: 0.5539277496706526
Energy: 0.54314732619723
Energy: 0.5729830798443025
Energy: 0.544440471624427
Energy: 0.5729830798443025
Energy: 0.5448639113903002
Energy: 0.5683436775077859
Energy: 0.5567079994663142
Energy: 0.5683436775083935
Energy: 0.5390241998050813
Energy: 0.6249791715784115
Energy: 0.53559677897722
Energy: 0.6249791715784115
Energy: 0.5609354117073517
Energy: 0.5521742163715785
Energy: 0.5395025505026833
Energy: 0.5521742163721861
Energy: 0.5241953494567952
Energy: 0.5659026422799689
Energy: 0.5367759422402205
Energy: 0.5659026422793612
Energy: 0.5442202452154853
Energy: 0.5505718843722087
Energy: 0.5627698027794631
Energy: 0.5505718843709936
Energy: 0.5396623941821185
Energy: 0.5532119669249217
Energy: 0.5248025265686239
Energy: 0.553211966924314
Energy: 0.5360392138550826
Energy: 0.5680664994501463
Energy: 0.5441865633292825
Energy: 0.5680664994507539
Energy: 0.5735415228513739
Energy: 0.565842223175461
Energy: 0.5445118389691387
Energy: 0.5658422231760686
Energy: 0.5395171376236791
Energy: 0.5541782770253393
Energy: 0.561175925029586
Energy: 0.5541782770253393
Energy: 0.5521320073857561
Energy: 0.5620080331344989
Energy: 0.5431353794228296
Energy: 0.5620080331344989
Energy: 0.55216410862541
Energy: 0.5619273229788875
Energy: 0.548462802731479
Energy: 0.5619273229788875
Energy: 0.555955882438226
Energy: 0.5619146972309154
Energy: 0.5521746151141546
Energy: 0.5619146972309154
Energy: 0.5538566320793148
Energy: 0.5538434156916069
Energy: 0.5342233126281071
Energy: 0.5538434156922145
Energy: 0.5406113866953288
Energy: 0.5624098664151922
Energy: 0.5729262783880692
Energy: 0.5624098664157999
Energy: 0.5351599740716977
Energy: 0.5641773856737161
Energy: 0.5457589466533934
Energy: 0.5641773856737161
Energy: 0.5516111826459154
Energy: 0.6253896225140003
Energy: 0.5451488370909104
Energy: 0.625389622514608
Energy: 0.5400879123229655
Energy: 0.5538177028986678
Energy: 0.5240531120980326
Energy: 0.5538177028986678
Energy: 0.5443542199845163
Energy: 0.6364206884620763
Energy: 0.5519791660173677
Energy: 0.6364206884620763
Energy: 0.5523283104769363
Energy: 0.5683388569277451
Energy: 0.5340310830384568
Energy: 0.5683388569283527
Energy: 0.5481697189103057
Energy: 0.5535447628786091
Energy: 0.5390410434234151
Energy: 0.5535447628786091
Energy: 0.5394615997919767
Energy: 0.6279482309855858
Energy: 0.5616956905051503
Energy: 0.6279482309855858
Energy: 0.5467967261850303
Energy: 0.5657791358773757
Energy: 0.5451950885561844
Energy: 0.565779135876768
Energy: 0.5543656945874944
Energy: 0.6220794341272909
Energy: 0.5442842878813633
Energy: 0.6220794341278987
Energy: 0.5361018926632076
Energy: 0.5521737127940545
Energy: 0.5596854777416577
Energy: 0.5521737127946621
Energy: 0.5588436764825848
Energy: 0.5677861034089212
Energy: 0.5380402131466879
Energy: 0.5677861034089212
Energy: 0.5708040362362787
Energy: 0.562431785903237
Energy: 0.5762446429726774
Energy: 0.562431785903237
Energy: 0.5611094297205854
Energy: 0.5591480982022959
Energy: 0.5394516991876482
Energy: 0.5591480982016883
Energy: 0.5460843859155569
Energy: 0.5563142785092238
Energy: 0.5521218499246764
Energy: 0.5563142785098314
Energy: 0.5447139042794554
Energy: 0.5731616569975228
Energy: 0.5460565155533467
Energy: 0.5731616569969151

minimum gb energy = 0.5240531120980326 eV
minimum distance =  2.56915911341182 Angstroms
sigma value = 1


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

Energy: 0.5947506124250983
Energy: 0.6040401260813896
Energy: 0.612228150060402
Energy: 0.6040401260820822
Energy: 0.574735091259705
Energy: 0.5948676739008495
Energy: 0.5582470289783945
Energy: 0.5948676739008495
Energy: 0.5695443157261575
Energy: 0.6069216972559333
Energy: 0.5691766242109321
Energy: 0.6069216972552403
Energy: 0.5599654985700668
Energy: 0.6036575854601274
Energy: 0.5610079999880372
Energy: 0.6036575854601274
Energy: 0.5602553815765762
Energy: 0.5898777625065286
Energy: 0.5955875921588716
Energy: 0.589877762508607
Energy: 0.6034829687662396
Energy: 0.5900938792483369
Energy: 0.5717820720249477
Energy: 0.5900938792483369
Energy: 0.5747503970144598
Energy: 0.6365556696455297
Energy: 0.5648243197452119
Energy: 0.6365556696434828
Energy: 0.5457459299436358
Energy: 0.6049094336039931
Energy: 0.5626966492596968
Energy: 0.6049094336026074
Energy: 0.5598101108685605
Energy: 0.6711431368574976
Energy: 0.5475160193481431
Energy: 0.6711431368568049
Energy: 0.5652626476088801
Energy: 0.6050555272180582
Energy: 0.578915732154197
Energy: 0.6050555272159799
Energy: 0.5748832807338461
Energy: 0.5856111628718018
Energy: 0.56048979753536
Energy: 0.5856111628711091
Energy: 0.5524847239731673
Energy: 0.5963028957959629
Energy: 0.589903435011006
Energy: 0.5963028957952702
Energy: 0.5804580480177465
Energy: 0.5875477229126052
Energy: 0.5669921811340518
Energy: 0.587547722913298
Energy: 0.5798378515742556
Energy: 0.5875410546246712
Energy: 0.5769747262686256
Energy: 0.587541054625364
Energy: 0.5525193419335801
Energy: 0.5963060998619186
Energy: 0.5712851463396974
Energy: 0.596306099860533
Energy: 0.5748338830217925
Energy: 0.5858850116786305
Energy: 0.5582146564035103
Energy: 0.5858850116786305
Energy: 0.565130233058607
Energy: 0.6050524087403083
Energy: 0.5597035982966871
Energy: 0.6050524087389226
Energy: 0.5598193663021287
Energy: 0.6711760469660245
Energy: 0.5475352667260142
Energy: 0.6711760469653317
Energy: 0.5457321813927706
Energy: 0.6065131498837105
Energy: 0.5609857702458643
Energy: 0.6065131498830177
Energy: 0.5747212599045223
Energy: 0.6364175539469913
Energy: 0.5609195853647624
Energy: 0.636417553944913
Energy: 0.6035315195669457
Energy: 0.5898318042552526
Energy: 0.5621187474132221
Energy: 0.5898318042552526
Energy: 0.5600233740988704
Energy: 0.589867498753862
Energy: 0.5550986949757435
Energy: 0.589867498753862
Energy: 0.5601306589062831
Energy: 0.6035878494815309
Energy: 0.5583065630971549
Energy: 0.6035878494815309
Energy: 0.5696453694624702
Energy: 0.6068766974413337
Energy: 0.5691142333541925
Energy: 0.6068766974413337
Energy: 0.5748016632873988
Energy: 0.5950199868539673
Energy: 0.5581136696023236
Energy: 0.5950199868539673
Energy: 0.5947506124250983
Energy: 0.6040401260813896
Energy: 0.6237064311797735
Energy: 0.6040401260820822
Energy: 0.574735091260398
Energy: 0.5948676739008495
Energy: 0.5582470289777016
Energy: 0.5948676739008495
Energy: 0.5695443157261575
Energy: 0.6069216972559333
Energy: 0.5783597326620262
Energy: 0.6069216972552403
Energy: 0.5599654985700668
Energy: 0.6036575854601274
Energy: 0.5583900571899787
Energy: 0.6036575854608204

minimum gb energy = 0.5457321813927706 eV
minimum distance =  2.52355323263386 Angstroms
sigma value = 25


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

Energy: 0.6085130419635401
Energy: 0.6264351653089281
Energy: 0.6887827058552803
Energy: 0.6264351653089281
Energy: 0.5801366438265383
Energy: 0.6274958810490493
Energy: 0.5877300461900095
Energy: 0.6274958810498545
Energy: 0.578565981848264
Energy: 0.6524433340618635
Energy: 0.5883195379796038
Energy: 0.6524433340618635
Energy: 0.5878674915302398
Energy: 0.6440823521907869
Energy: 0.5789766276682737
Energy: 0.6440823521907869
Energy: 0.5809792243936902
Energy: 0.6284431345815853
Energy: 0.5818340242205889
Energy: 0.6284431345815853
Energy: 0.6345697672377025
Energy: 0.6534179231022876
Energy: 0.5930463793113864
Energy: 0.6534179231014822
Energy: 0.5787101964966197
Energy: 0.676442707235409
Energy: 0.5936734884110321
Energy: 0.676442707235409
Energy: 0.6816101090785653
Energy: 0.6281450332270583
Energy: 0.5710020765975702
Energy: 0.6281450332278636
Energy: 0.5936074818284967
Energy: 0.6093491319613551
Energy: 0.5787145931385127
Energy: 0.6093491319613551
Energy: 0.5980218814417724
Energy: 0.6533704311103852
Energy: 0.5761460846867185
Energy: 0.6533704311103852
Energy: 0.5791695829066454
Energy: 0.6256949446988296
Energy: 0.5856489837297968
Energy: 0.625694944699635
Energy: 0.5709956777163335
Energy: 0.6265298295937715
Energy: 0.5856362073693817
Energy: 0.6265298295929661
Energy: 0.5883485087127345
Energy: 0.6452448819186799
Energy: 0.5758478587833978
Energy: 0.6452448819186799
Energy: 0.5938271444573657
Energy: 0.6405348677300517
Energy: 0.5803436397529232
Energy: 0.6405348677300517
Energy: 0.5844488394149806
Energy: 0.6287150138584828
Energy: 0.5699522698629116
Energy: 0.6287150138584828
Energy: 0.5785256242348847
Energy: 0.5893021373975408
Energy: 0.5808690409334847
Energy: 0.5893021373975408
Energy: 0.5696326446115764
Energy: 0.6524910565734275
Energy: 0.567096886469873
Energy: 0.6524910565734275
Energy: 0.5789414578701183
Energy: 0.615281010484881
Energy: 0.5805570895795845
Energy: 0.615281010484881
Energy: 0.5775678770521685
Energy: 0.6450963004277837
Energy: 0.5811406036035683
Energy: 0.6450963004277837
Energy: 0.592916358640639
Energy: 0.6537520637080589
Energy: 0.5862945501084301
Energy: 0.6537520637080589
Energy: 0.5912073505508931
Energy: 0.627281784753041
Energy: 0.5857204436044752
Energy: 0.627281784753041
Energy: 0.6093885669206667
Energy: 0.627619776404159
Energy: 0.6365036655699439
Energy: 0.627619776404159
Energy: 0.5787694962477373
Energy: 0.6151158025312541
Energy: 0.586273452385302
Energy: 0.6151158025304487
Energy: 0.5818087453312494
Energy: 0.6518579977252481
Energy: 0.5973629352402526
Energy: 0.6518579977252481
Energy: 0.5859099930003123
Energy: 0.6246056556706653
Energy: 0.578839022520114
Energy: 0.6246056556706653

minimum gb energy = 0.567096886469873 eV
minimum distance =  2.52540750984537 Angstroms
sigma value = 9


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

Energy: 0.6160792614717313
Energy: 0.682827525910425
Energy: 0.7739793992925444
Energy: 0.682827525910425
Energy: 0.6072807254139349
Energy: 0.647227378287384
Energy: 0.597154916930659
Energy: 0.647227378287384
Energy: 0.5906989048529113
Energy: 0.6856677513096435
Energy: 0.597195698050228
Energy: 0.6856677513086826
Energy: 0.5968594748144531
Energy: 0.7000583819859353
Energy: 0.5961523290789071
Energy: 0.7000583819849746
Energy: 0.6637208547518659
Energy: 0.6444908489126734
Energy: 0.5975249395273362
Energy: 0.6444908489117126
Energy: 0.5843942157710323
Energy: 0.6861625135730193
Energy: 0.5979089306877299
Energy: 0.6861625135730193
Energy: 0.5964798460703654
Energy: 0.5949975675887295
Energy: 0.5955630332805196
Energy: 0.5949975675887295
Energy: 0.6590734587357397
Energy: 0.6858635418973505
Energy: 0.5935612491921318
Energy: 0.6858635418973505
Energy: 0.5963860877055257
Energy: 0.6470336089287817
Energy: 0.5974235963085414
Energy: 0.6470336089297426
Energy: 0.5965203525577052
Energy: 0.6819622126352376
Energy: 0.598125499728566
Energy: 0.6819622126352376
Energy: 0.5891011900087159
Energy: 0.6722617086126521
Energy: 0.5940799545629901
Energy: 0.6722617086116913
Energy: 0.5968211715726318
Energy: 0.6551931445762751
Energy: 0.5961238299332074
Energy: 0.6551931445762751
Energy: 0.5843734257926532
Energy: 0.685914258772184
Energy: 0.5990919023096754
Energy: 0.6859142587731449
Energy: 0.623735817398113
Energy: 0.6010210215528173
Energy: 0.5971784036146275
Energy: 0.6010210215518565
Energy: 0.5843817150807068
Energy: 0.6857425135348449
Energy: 0.6579359962284623
Energy: 0.6857425135358058
Energy: 0.5968038099235826
Energy: 0.6551514604649997
Energy: 0.5961308242935729
Energy: 0.6551514604659606
Energy: 0.5891054968713986
Energy: 0.6722245500776115
Energy: 0.597298863904054
Energy: 0.6722245500776115
Energy: 0.5965284731178074
Energy: 0.6819301045910615
Energy: 0.598140475859285
Energy: 0.6819301045920222
Energy: 0.5962923236111859
Energy: 0.6470634447536612
Energy: 0.5974920186929519
Energy: 0.6470634447536612
Energy: 0.6590562188599196
Energy: 0.6860226342547242
Energy: 0.5936398892848552
Energy: 0.686022634255685
Energy: 0.5964373735052818
Energy: 0.5949753495983499
Energy: 0.5955632549500522
Energy: 0.5949753495983499

minimum gb energy = 0.5843734257926532 eV
minimum distance =  2.6518118552114 Angstroms
sigma value = 25


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

Energy: 0.6039466021794424
Energy: 0.7081764882812647
Energy: 0.795615807998776
Energy: 0.7081764882812647
Energy: 0.5929893625622633
Energy: 0.6015436329604449
Energy: 0.5880382861963737
Energy: 0.601543632942622
Energy: 0.5881045934819036
Energy: 0.657765336817903
Energy: 0.5951311096456373
Energy: 0.6577653368202793
Energy: 0.6034006884914972
Energy: 0.6585507314592076
Energy: 0.6778133421021988
Energy: 0.6585507314592076
Energy: 0.6769682389758434
Energy: 0.5928474230348387
Energy: 0.6126843452388532
Energy: 0.5928474230348387
Energy: 0.5903665604823575
Energy: 0.7330827855266686
Energy: 0.5889939120786488
Energy: 0.7330827855266686
Energy: 0.6129007783630349
Energy: 0.6571323207256912
Energy: 0.5877040071184264
Energy: 0.6571323207245029
Energy: 0.6704278754915021
Energy: 0.7087531611970198
Energy: 0.6031811253569873
Energy: 0.708753161198208
Energy: 0.5952076175296446
Energy: 0.6597815471809635
Energy: 0.5931456779881394
Energy: 0.6597815471809635
Energy: 0.6880808160206382
Energy: 0.6733853178301874
Energy: 0.5902604675399746
Energy: 0.6733853178301874
Energy: 0.6251329979022141
Energy: 0.708147421197823
Energy: 0.7584680959622233
Energy: 0.708147421197823
Energy: 0.5882662147886677
Energy: 0.6073918502463375
Energy: 0.6900290221407208
Energy: 0.6073918502463375
Energy: 0.6799312001924006
Energy: 0.6729749627646127
Energy: 0.5876398502208371
Energy: 0.6729749627646127
Energy: 0.5878608903229067
Energy: 0.66306446182121
Energy: 0.6034059730608696
Energy: 0.66306446182121
Energy: 0.6018523704940942
Energy: 0.7077624835463237
Energy: 0.6707163207385086
Energy: 0.7077624835463237
Energy: 0.5952673670575621
Energy: 0.6730547323546223
Energy: 0.5903770516043954
Energy: 0.6730547323546223
Energy: 0.5951133203023914
Energy: 0.6258530814115683
Energy: 0.6882543505064145
Energy: 0.6258530814115683

minimum gb energy = 0.5876398502208371 eV
minimum distance =  2.6139846891235 Angstroms
sigma value = 17


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

Energy: 0.6592508504211713
Energy: 0.6600388206935318
Energy: 0.8239284220796652
Energy: 0.6600388206942046
Energy: 0.6848583013473282
Energy: 0.6292091977791585
Energy: 0.6007664153925681
Energy: 0.6292091977791585
Energy: 0.6906571793853593
Energy: 0.6579478010130908
Energy: 0.6043894790398646
Energy: 0.6579478010130908
Energy: 0.5999587343805572
Energy: 0.60438654494439
Energy: 0.6499750135983802
Energy: 0.6043865449450629
Energy: 0.7023281776996343
Energy: 0.6746725676889765
Energy: 0.6078531785269184
Energy: 0.6746725676883036
Energy: 0.6045289436533742
Energy: 0.6132539383761367
Energy: 0.6856825850470118
Energy: 0.6132539383754638
Energy: 0.6014510243657214
Energy: 0.6545559255535265
Energy: 0.6046190863582118
Energy: 0.6545559255535265
Energy: 0.6844112135611329
Energy: 0.6046927726898763
Energy: 0.6056862021368834
Energy: 0.6046927726898763
Energy: 0.6046451944622526
Energy: 0.6765690353361993
Energy: 0.6945220112099143
Energy: 0.6765690353368722
Energy: 0.7465749901285812
Energy: 0.6346697304977377
Energy: 0.6025809998203575
Energy: 0.6346697304970645
Energy: 0.600622341837529
Energy: 0.6055793396170619
Energy: 0.6921206060038548
Energy: 0.605579339616389
Energy: 0.6052356739845586
Energy: 0.6523352598558465
Energy: 0.6062481238712063
Energy: 0.6523352598551735
Energy: 0.685677459569332
Energy: 0.6058520739005872
Energy: 0.6047139369750201
Energy: 0.6058520738999142
Energy: 0.6024363340467085
Energy: 0.6099546592603234
Energy: 0.6848572566041655
Energy: 0.6099546592381165
Energy: 0.6523781433896878
Energy: 0.6545844356878086
Energy: 0.6048360804843925
Energy: 0.6545844356878086
Energy: 0.6849655204846217
Energy: 0.6047977130891958
Energy: 0.6998058700940646
Energy: 0.6047977130905416
Energy: 0.6044311115362849
Energy: 0.6426973962089034
Energy: 0.6977226082761016
Energy: 0.6426973962095457
Energy: 0.6837957378343625
Energy: 0.6578397497706361
Energy: 0.6043412198437514
Energy: 0.657839749771309
Energy: 0.6009856634818272
Energy: 0.6584223239964122
Energy: 0.645547836591746
Energy: 0.6584223239964122
Energy: 0.6005841435508776
Energy: 0.6055199056461097
Energy: 0.6001205681189207
Energy: 0.6055199056454368
Energy: 0.6492239977112536
Energy: 0.6583344673089183
Energy: 0.6908190514882985
Energy: 0.6583344673089183
Energy: 0.6017317279031719
Energy: 0.6885651664191089
Energy: 0.7460249333971336
Energy: 0.6885651664197819
Energy: 0.6990877965695922
Energy: 0.6598499882024988
Energy: 0.5988635896814022
Energy: 0.6598499882024988
Energy: 0.6038096242562694
Energy: 0.6562473994420409
Energy: 0.683469619778076
Energy: 0.6562473994420409
Energy: 0.6039736803309133
Energy: 0.6580575101033743
Energy: 0.6844484186690023
Energy: 0.6580575101040472
Energy: 0.6964211028574814
Energy: 0.6047943460275208
Energy: 0.5995053894125504
Energy: 0.6047943460275208
Energy: 0.6072917271393241
Energy: 0.6891410976240013
Energy: 0.7588698638176353
Energy: 0.6891410976240013
Energy: 0.6862673217769579
Energy: 0.6130844268189962
Energy: 0.6914408093684574
Energy: 0.6130844268189962
Energy: 0.7266753415580214
Energy: 0.6062267348497006
Energy: 0.6013446802970136
Energy: 0.6062267348503736
Energy: 0.604650380666284
Energy: 0.6776497499474915
Energy: 0.6854078145518105
Energy: 0.6776497499474915

minimum gb energy = 0.5988635896814022 eV
minimum distance =  2.49535161137543 Angstroms
sigma value = 53


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

Energy: 0.5521537170336185
Energy: 0.5523348766223528
Energy: 0.8565292221309285
Energy: 0.5523348766223528
Energy: 0.6732069376026041
Energy: 0.600800026681004
Energy: 0.6464838776303359
Energy: 0.600800026681004
Energy: 0.5527820318064052
Energy: 0.5526712998668675
Energy: 0.5739022651435907
Energy: 0.5526712998668675
Energy: 0.5528150713279861
Energy: 0.5526958538525828
Energy: 0.5739383978325662
Energy: 0.5526958538525828
Energy: 0.6732708921558496
Energy: 0.600792940555139
Energy: 0.6579048111253194
Energy: 0.600792940555139
Energy: 0.5521537170320693
Energy: 0.5523348766239021
Energy: 0.8094845919528684
Energy: 0.5523348766223528
Energy: 0.6732069376026041
Energy: 0.600800026681004
Energy: 0.6669509716580131
Energy: 0.600800026681004
Energy: 0.5527820318064052
Energy: 0.5526712998668675
Energy: 0.6403576920356124
Energy: 0.5526712998668675
Energy: 0.5528150713279861
Energy: 0.5526958538525828
Energy: 0.6477179514951632
Energy: 0.5526958538525828
Energy: 0.6732708921558496
Energy: 0.600792940555139
Energy: 0.6470845456331972
Energy: 0.600792940555139
Energy: 0.5521537170320693
Energy: 0.5523348766239021
Energy: 0.7696263423243449
Energy: 0.5523348766223528
Energy: 0.6732069376026041
Energy: 0.600800026681004
Energy: 0.666950971656464
Energy: 0.600800026681004
Energy: 0.5527820318048561
Energy: 0.5526712998668675
Energy: 0.667215424702033
Energy: 0.5526712998668675

minimum gb energy = 0.5521537170320693 eV
minimum distance =  2.60635031024793 Angstroms
sigma value = 9


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

Energy: 0.6202807463483418
Energy: 0.6288604987494452
Energy: 0.8345798160710365
Energy: 0.6288604987500186
Energy: 0.7517860839211085
Energy: 0.6502775122429608
Energy: 0.6340707172192156
Energy: 0.6502775122423874
Energy: 0.627828134744045
Energy: 0.614601880675251
Energy: 0.6377798247044134
Energy: 0.6146018806758246
Energy: 0.7029386556450816
Energy: 0.7303653853555212
Energy: 0.635281547797596
Energy: 0.7303653853555212
Energy: 0.6925572435115273
Energy: 0.6414920477768615
Energy: 0.6375958263055025
Energy: 0.6414920477768615
Energy: 0.6142909934554643
Energy: 0.6140727615562317
Energy: 0.7257609090500768
Energy: 0.6140727615556583
Energy: 0.8228112574143677
Energy: 0.6383955038566527
Energy: 0.6347571668909178
Energy: 0.6383955038566527
Energy: 0.6294917341574325
Energy: 0.6832182231077898
Energy: 0.6881108609885627
Energy: 0.6832182231077898
Energy: 0.6295442214508217
Energy: 0.7322132239486366
Energy: 0.6218044562784542
Energy: 0.7322132239486366
Energy: 0.6275338521013177
Energy: 0.6428089494725912
Energy: 0.6285124263494241
Energy: 0.6428089494731645
Energy: 0.6334167947722037
Energy: 0.7234899661229617
Energy: 0.7905766752243581
Energy: 0.7234899661229617
Energy: 0.6929955689455825
Energy: 0.7598550785551349
Energy: 0.6351106424026649
Energy: 0.7598550785551349
Energy: 0.6306449281196133
Energy: 0.6794627249752385
Energy: 0.7296444301822326
Energy: 0.6794627249752385
Energy: 0.7246490984228706
Energy: 0.7238755361174255
Energy: 0.6247026229955407
Energy: 0.723875536116852
Energy: 0.6350902668887668
Energy: 0.6885648168854479
Energy: 0.6522095456519135
Energy: 0.6885648168860212
Energy: 0.6355676348534887
Energy: 0.7322234489373446
Energy: 0.7134905175840315
Energy: 0.732223448937918
Energy: 0.650586472525694
Energy: 0.6885411465092561
Energy: 0.6314651264840365
Energy: 0.6885411465092561
Energy: 0.6344513109480627
Energy: 0.6385635416938258
Energy: 0.7196705893867076
Energy: 0.6385635416938258
Energy: 0.6995867109201893
Energy: 0.6797328368308844
Energy: 0.6160461837386394
Energy: 0.6797328368308844
Energy: 0.6360117930404511
Energy: 0.6496747356858174
Energy: 0.6959792648921858
Energy: 0.649674735685244
Energy: 0.6861846444156334
Energy: 0.7257753969973377
Energy: 0.6890756185822825
Energy: 0.725775396997911
Energy: 0.6529810149035364
Energy: 0.6824400146096248
Energy: 0.6299062598121625
Energy: 0.6824400146107715
Energy: 0.6219805727082598
Energy: 0.6790466285836041
Energy: 0.6317598671520631
Energy: 0.6790466285841774
Energy: 0.7816487873269525
Energy: 0.6839101121694934
Energy: 0.6300353949043708
Energy: 0.6839101121694934
Energy: 0.6347973747723614
Energy: 0.7601831379631702
Energy: 0.7810475597822417
Energy: 0.7601831379637435
Energy: 0.6802598288537173
Energy: 0.6145964539796253
Energy: 0.6294601505562418
Energy: 0.6145964539807721
Energy: 0.6461411198957578
Energy: 0.6532788829889589
Energy: 0.7083097490762517
Energy: 0.6532788829889589
Energy: 0.629603625052065
Energy: 0.7221330923899456
Energy: 0.7225899879458672
Energy: 0.7221330923899456
Energy: 0.6771834996201415
Energy: 0.6143161728550373
Energy: 0.6285479401660685
Energy: 0.6143161728544639
Energy: 0.6341685080977103
Energy: 0.7903773871498411
Energy: 0.781528651358112
Energy: 0.7903773871504144
Energy: 0.7780299549760921
Energy: 0.7275361868695517
Energy: 0.6290954606548559
Energy: 0.7275361868695517
Energy: 0.6250124506413534
Energy: 0.6430608621103954
Energy: 0.6297082705004432
Energy: 0.6430608621103954
Energy: 0.6272319206463685
Energy: 0.6818027002122831
Energy: 0.6281291077450559
Energy: 0.6818027002122831
Energy: 0.6855419790855655
Energy: 0.7232301539230693
Energy: 0.7139563830508874
Energy: 0.723230153922496
Energy: 0.6448745008351877
Energy: 0.6922111018643708
Energy: 0.8222022623241649
Energy: 0.6922111018643708

minimum gb energy = 0.6140727615556583 eV
minimum distance =  2.55555600695853 Angstroms
sigma value = 73


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

Energy: 0.6637687222843361
Energy: 0.6260218276153164
Energy: 0.8384218647945915
Energy: 0.6260218276153164
Energy: 0.6355122221958053
Energy: 0.6564717570161844
Energy: 0.6291947952773563
Energy: 0.6564717570161844
Energy: 0.63423491396033
Energy: 0.6294172569726796
Energy: 0.6198130765379432
Energy: 0.6294172569726796
Energy: 0.6397477951637798
Energy: 0.6281907519825871
Energy: 0.6444452886865221
Energy: 0.6281907519825871
Energy: 0.6551933149226016
Energy: 0.6589338114162753
Energy: 0.6200268423087731
Energy: 0.6589338114162753
Energy: 0.6374210815210365
Energy: 0.6211799734618538
Energy: 0.7850919840666648
Energy: 0.6211799734609442
Energy: 0.73181585015366
Energy: 0.7054572588672524
Energy: 0.6393521813658444
Energy: 0.7054572588672524
Energy: 0.6327425735464031
Energy: 0.6147109932149367
Energy: 0.6948015560754386
Energy: 0.614710993214027
Energy: 0.840746445847881
Energy: 0.6164588610430836
Energy: 0.6169453003920456
Energy: 0.6164588610430836
Energy: 0.6278295592318561
Energy: 0.6599621249236011
Energy: 0.616839724559648
Energy: 0.6599621249245108
Energy: 0.6290250434582415
Energy: 0.616650178747615
Energy: 0.7687046741100626
Energy: 0.6166501787485248
Energy: 0.6606956428273645
Energy: 0.6274113332088558
Energy: 0.6399087004586413
Energy: 0.6274113332088558
Energy: 0.631783194122634
Energy: 0.6496139402144514
Energy: 0.729322331682406
Energy: 0.6496139402144514
Energy: 0.7819921005867712
Energy: 0.686293347607455
Energy: 0.6401001870217347
Energy: 0.686293347607455
Energy: 0.633968570538073
Energy: 0.6652542588245607
Energy: 0.7352715511081879
Energy: 0.6652542588245607
Energy: 0.7718184039055667
Energy: 0.6159612811986027
Energy: 0.6339709773340186
Energy: 0.6159612811986027
Energy: 0.6674971723424895
Energy: 0.6802124935630164
Energy: 0.6342922182071061
Energy: 0.6802124935630164
Energy: 0.6664486137757539
Energy: 0.6793372487444856
Energy: 0.6408208796960589
Energy: 0.6793372487435759
Energy: 0.7131935439105387
Energy: 0.6145810380977573
Energy: 0.6325680240469268
Energy: 0.6145810380977573
Energy: 0.6361998875440407
Energy: 0.6886052168890345
Energy: 0.8009498441802995
Energy: 0.6886052168890345
Energy: 0.77063013898419
Energy: 0.6209678510546481
Energy: 0.6382606091561513
Energy: 0.6209678510546481
Energy: 0.6443316410445965
Energy: 0.6557073220634078
Energy: 0.712109224445796
Energy: 0.6557073220634078

minimum gb energy = 0.6145810380977573 eV
minimum distance =  2.55365745568502 Angstroms
sigma value = 7


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

Energy: 0.6312800157402813
Energy: 0.6311034548229459
Energy: 0.8221298462756387
Energy: 0.6311034548210162
Energy: 0.7491065609326463
Energy: 0.654616910587484
Energy: 0.6187605213017959
Energy: 0.654616910587484
Energy: 0.6246433364340027
Energy: 0.6315823053371066
Energy: 0.6420505556764746
Energy: 0.63158230533775
Energy: 0.6568002942047612
Energy: 0.660298969705931
Energy: 0.6282565438952054
Energy: 0.6602989697052879
Energy: 0.624778297848671
Energy: 0.6494752756255061
Energy: 0.6315700802868084
Energy: 0.6494752756274358
Energy: 0.6251817235666667
Energy: 0.6322370441589843
Energy: 0.7875722222510698
Energy: 0.6322370441596276
Energy: 0.7320155547338008
Energy: 0.6923813093747667
Energy: 0.6505434381562913
Energy: 0.6923813093741233
Energy: 0.6250558940763832
Energy: 0.6314942137102584
Energy: 0.8277412384748968
Energy: 0.6314942137089719
Energy: 0.7060716044809021
Energy: 0.655804275307835
Energy: 0.6269505093655832
Energy: 0.655804275307835
Energy: 0.6246076135632426
Energy: 0.6658636169077791
Energy: 0.7028485115679609
Energy: 0.6658636169064924
Energy: 0.6561477251159861
Energy: 0.7082758826834281
Energy: 0.6509290289015586
Energy: 0.7082758826821416
Energy: 0.6311768631719863
Energy: 0.6494632939936082
Energy: 0.6561977632103351
Energy: 0.6494632939936082
Energy: 0.6336882414086742
Energy: 0.6324127873074771
Energy: 0.6545558981862145
Energy: 0.6324127873055473
Energy: 0.6317469062868893
Energy: 0.6283222778196678
Energy: 0.6443479005189106
Energy: 0.6283222778190246
Energy: 0.6163333783240298
Energy: 0.6599548538104654
Energy: 0.7546430666981891
Energy: 0.6599548538123952
Energy: 0.82625183219564
Energy: 0.6279989772037626
Energy: 0.6317349410441427
Energy: 0.6279989772037626
Energy: 0.6256335026577322
Energy: 0.6482280422311266
Energy: 0.6985325405553939
Energy: 0.6482280422298401
Energy: 0.62585881800411
Energy: 0.625581931052607
Energy: 0.6440305664257839
Energy: 0.6255819310519638
Energy: 0.6257874106610875
Energy: 0.7079864114240764
Energy: 0.65114303646955
Energy: 0.7079864114234331
Energy: 0.6173256196640085
Energy: 0.6528537801519764
Energy: 0.6305580916927523
Energy: 0.6528537801532629
Energy: 0.6403652219877005
Energy: 0.7088392126151182
Energy: 0.626983722275903
Energy: 0.7088392126164048
Energy: 0.6245706453825156
Energy: 0.6319557666273535
Energy: 0.6439502083855054
Energy: 0.6319557666273535
Energy: 0.786996440125563
Energy: 0.6563674760888951
Energy: 0.6438320192945338
Energy: 0.6563674760882519
Energy: 0.631487367339764
Energy: 0.6311938340187794
Energy: 0.8159982435853959
Energy: 0.6311938340162061
Energy: 0.6317196290610817
Energy: 0.6524763520663677
Energy: 0.6504282481720718
Energy: 0.6524763520644379
Energy: 0.6377485556612852
Energy: 0.6607683680252524
Energy: 0.649382994677513
Energy: 0.660768368023966
Energy: 0.6248043981153664
Energy: 0.6626782794040367
Energy: 0.6906930470539331
Energy: 0.6626782794033933
Energy: 0.6724519599618374
Energy: 0.6485793808580603
Energy: 0.6282950379777635
Energy: 0.648579380856774
Energy: 0.6287128270872369
Energy: 0.6312009272523941
Energy: 0.7426486850503073
Energy: 0.6312009272511074
Energy: 0.6823453668881242
Energy: 0.6448451242243308
Energy: 0.6177162193073689
Energy: 0.6448451242236877
Energy: 0.6287167392167631
Energy: 0.6313246282259771
Energy: 0.7577786390681923
Energy: 0.6313246282266205

minimum gb energy = 0.6163333783240298 eV
minimum distance =  2.53991492874172 Angstroms
sigma value = 29


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

Energy: 0.5941618331606645
Energy: 0.581146012248168
Energy: 0.8610218101102619
Energy: 0.581146012248392
Energy: 0.6589475802427284
Energy: 0.5719420772346239
Energy: 0.5732689768941578
Energy: 0.5719420772339766
Energy: 0.6045244194251124
Energy: 0.6092057785408035
Energy: 0.6583998247186089
Energy: 0.6092057785405796
Energy: 0.5938142552089842
Energy: 0.5943385226036849
Energy: 0.6694644665370253
Energy: 0.594338522603909
Energy: 0.5943031067617796
Energy: 0.5924024750137727
Energy: 0.6141462228244676
Energy: 0.5924024750133496
Energy: 0.5811715269320118
Energy: 0.6092193228711991
Energy: 0.5811856363565236
Energy: 0.6092193228711991
Energy: 0.5811474498521644
Energy: 0.5925416706370623
Energy: 0.59430408241197
Energy: 0.5925416706370623
Energy: 0.66952483245691
Energy: 0.5945352635142086
Energy: 0.5937857977589942
Energy: 0.5945352635140095
Energy: 0.6582637120914621
Energy: 0.6091942326023612
Energy: 0.6585977491130591
Energy: 0.6091942326021371

minimum gb energy = 0.5719420772339766 eV
minimum distance =  2.59977551204706 Angstroms
sigma value = 5


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

Energy: 0.5941082859166268
Energy: 0.5917517825344295
Energy: 0.7119123795759253
Energy: 0.5917517825344295
Energy: 0.6018829853176813
Energy: 0.5867098698652945
Energy: 0.5913666519796467
Energy: 0.5867098698659022
Energy: 0.5821407464293723
Energy: 0.5877762136123872
Energy: 0.6960319477636436
Energy: 0.5877762136117796
Energy: 0.5950894642161864
Energy: 0.6144080202317532
Energy: 0.5848484538913815
Energy: 0.6144080202317532
Energy: 0.5861197196882408
Energy: 0.6173739082652858
Energy: 0.6402947297103487
Energy: 0.6173739082652858
Energy: 0.6178222668523665
Energy: 0.5922915509359755
Energy: 0.5811142783869698
Energy: 0.5922915509353678
Energy: 0.582990791273259
Energy: 0.6158036973451263
Energy: 0.5937717404238153
Energy: 0.6158036973445187
Energy: 0.5805431699769816
Energy: 0.5927808625267952
Energy: 0.5832978383469505
Energy: 0.5927808625267952
Energy: 0.5865558545742855
Energy: 0.6160812364369573
Energy: 0.5862776331218821
Energy: 0.6160812364369573
Energy: 0.5830679739544867
Energy: 0.6161630046623656
Energy: 0.6030354322703801
Energy: 0.616163004661758
Energy: 0.5988759604821274
Energy: 0.6149860095720927
Energy: 0.5881705522609167
Energy: 0.614986009571485
Energy: 0.5880162975926451
Energy: 0.6182226838857572
Energy: 0.5930377698248156
Energy: 0.6182226838863648
Energy: 0.6187084722914203
Energy: 0.591914923551643
Energy: 0.5939012247484102
Energy: 0.591914923551643
Energy: 0.5920677344804712
Energy: 0.5929365588869971
Energy: 0.6038301141935117
Energy: 0.5929365588863894
Energy: 0.7059646136082445
Energy: 0.5814072891952479
Energy: 0.5880159352504813
Energy: 0.5814072891958555
Energy: 0.583355349685313
Energy: 0.5881261780856653
Energy: 0.7026264852024127
Energy: 0.5881261780856653
Energy: 0.6749317961652438
Energy: 0.5885186966887841
Energy: 0.5913403342637088
Energy: 0.5885186966881765
Energy: 0.5861849859658255
Energy: 0.5918746282253202
Energy: 0.7550987708920059
Energy: 0.5918746282259278
Energy: 0.5924741260902938
Energy: 0.6173830390907182
Energy: 0.5835111501358122
Energy: 0.6173830390907182
Energy: 0.5831761925938388
Energy: 0.6452961299836572
Energy: 0.5845869804159832
Energy: 0.6452961299830495
Energy: 0.5931915116694646
Energy: 0.6129556568673784
Energy: 0.5870011638855329
Energy: 0.6129556568673784
Energy: 0.594195284404969
Energy: 0.6159428758841523
Energy: 0.5815252848844382
Energy: 0.61594287588476
Energy: 0.5911424099940817
Energy: 0.5930169363464658
Energy: 0.5968377208951109
Energy: 0.5930169363470735
Energy: 0.5918330801620005
Energy: 0.6175861593932089
Energy: 0.5910544774881831
Energy: 0.6175861593932089
Energy: 0.5970906703165552
Energy: 0.5924939004616386
Energy: 0.5891858007688401
Energy: 0.5924939004616386
Energy: 0.5917560439845094
Energy: 0.5929179375044723
Energy: 0.5861859322392394
Energy: 0.5929179375044723
Energy: 0.5911793565008269
Energy: 0.5786327816561718
Energy: 0.6138613972909579
Energy: 0.5786327816567794
Energy: 0.7096265088886913
Energy: 0.6155680858844895
Energy: 0.5833467497781296
Energy: 0.6155680858857048
Energy: 0.5922572869662287
Energy: 0.5862517160808003
Energy: 0.6240854297243323
Energy: 0.5862517160808003
Energy: 0.7623218529691933
Energy: 0.591885066786836
Energy: 0.5861136127009745
Energy: 0.591885066786836
Energy: 0.5828235375657235
Energy: 0.5845973674167599
Energy: 0.7408848238708623
Energy: 0.5845973674167599
Energy: 0.6736511657163204
Energy: 0.6196638060901223
Energy: 0.5820694936328262
Energy: 0.6196638060901223
Energy: 0.5849820232474952
Energy: 0.6144153844700474
Energy: 0.5919415449591628
Energy: 0.6144153844700474

minimum gb energy = 0.5786327816561718 eV
minimum distance =  2.5275089423087 Angstroms
sigma value = 1


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

Energy: 0.565910560187334
Energy: 0.5659658459076953
Energy: 0.7201416113576222
Energy: 0.5659658459076953
Energy: 0.590761144271276
Energy: 0.5536553814597484
Energy: 0.566025146644709
Energy: 0.5536553814605885
Energy: 0.5537169105548517
Energy: 0.5664194590932236
Energy: 0.6459187255014439
Energy: 0.5664194590932236
Energy: 0.6767054895022506
Energy: 0.5974736345806296
Energy: 0.5580232705672326
Energy: 0.5974736345797894
Energy: 0.5537340675697875
Energy: 0.5690015912114772
Energy: 0.6270215398529081
Energy: 0.5690015912114772
Energy: 0.5541631133817111
Energy: 0.5966082061954693
Energy: 0.5581995640429391
Energy: 0.5966082061946293
Energy: 0.5538751506470261
Energy: 0.6083136821496448
Energy: 0.5572359690923369
Energy: 0.6083136821496448
Energy: 0.5540301939361144
Energy: 0.5664614276969587
Energy: 0.5879672485576809
Energy: 0.5664614276977991
Energy: 0.5659253541945674
Energy: 0.5691040478763711
Energy: 0.5637045508349271
Energy: 0.5691040478763711
Energy: 0.5660176308767738
Energy: 0.5691989460397214
Energy: 0.588029735313834
Energy: 0.5691989460405616
Energy: 0.5541118700515633
Energy: 0.5665927115325174
Energy: 0.5634927185699464
Energy: 0.5665927115333577
Energy: 0.554004826691995
Energy: 0.6083741048838606
Energy: 0.5628150225496605
Energy: 0.6083741048838606
Energy: 0.5542080763411585
Energy: 0.5974842945217461
Energy: 0.5580275456168734
Energy: 0.5974842945217461
Energy: 0.5537049133201059
Energy: 0.5689848345865467
Energy: 0.6437432975654724
Energy: 0.5689848345857064
Energy: 0.6765451794616197
Energy: 0.5974355159671861
Energy: 0.5580274723025055
Energy: 0.5974355159671861
Energy: 0.5537079060936242
Energy: 0.5663877200384765
Energy: 0.5811344916074725
Energy: 0.5663877200376363
Energy: 0.5906522856558799
Energy: 0.5536462597958307
Energy: 0.5660263386659025
Energy: 0.5536462597958307
Energy: 0.565910560187334
Energy: 0.5659658459076953
Energy: 0.8109514533826364
Energy: 0.5659658459076953
Energy: 0.5907611442721162
Energy: 0.553655381458068
Energy: 0.566025146644709
Energy: 0.5536553814597484
Energy: 0.5537169105548517
Energy: 0.5664194590932236
Energy: 0.7569527164548487
Energy: 0.5664194590940638
Energy: 0.6767054895022506
Energy: 0.5974736345806296
Energy: 0.5580232705672326
Energy: 0.5974736345797894
Energy: 0.5537340675697875
Energy: 0.5690015912114772
Energy: 0.6270215398537483
Energy: 0.5690015912114772
Energy: 0.5541631133833915
Energy: 0.5966082061946293
Energy: 0.5581995640429391
Energy: 0.5966082061946293
Energy: 0.553875150646186
Energy: 0.6083136821496448
Energy: 0.5572359691376875
Energy: 0.6083136821496448

minimum gb energy = 0.5536462597958307 eV
minimum distance =  2.54447285189087 Angstroms
sigma value = 17


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

Energy: 0.5629233436519111
Energy: 0.5630442641024666
Energy: 0.8236004430353739
Energy: 0.5630442641014279
Energy: 0.5920733915306765
Energy: 0.5608827094347395
Energy: 0.5561711514117699
Energy: 0.5608827094342201
Energy: 0.5543651916022606
Energy: 0.5568516890807872
Energy: 0.5997324349553356
Energy: 0.5568516890818257
Energy: 0.588052873300556
Energy: 0.550213208425636
Energy: 0.5532116044606046
Energy: 0.5502132084251168
Energy: 0.5505817290550011
Energy: 0.5915516055960068
Energy: 0.6402775847755569
Energy: 0.5915516055960068
Energy: 0.567141615069312
Energy: 0.6520221943849622
Energy: 0.5597118093132022
Energy: 0.6520221943849622
Energy: 0.5674357758237085
Energy: 0.5825990184653148
Energy: 0.5593247870436332
Energy: 0.5825990184658342
Energy: 0.5494277601824219
Energy: 0.6538046437648745
Energy: 0.5536697700773884
Energy: 0.6538046437648745
Energy: 0.5643257461126758
Energy: 0.6577101723934163
Energy: 0.5618612610148461
Energy: 0.6577101723939358
Energy: 0.5664842299773538
Energy: 0.5822393153962682
Energy: 0.5547265095773429
Energy: 0.5822393153962682
Energy: 0.5573697192637315
Energy: 0.6480001546793461
Energy: 0.5566452958417013
Energy: 0.6480001546798654
Energy: 0.5528380247554786
Energy: 0.5814439310393671
Energy: 0.5476213577470607
Energy: 0.5814439310388478
Energy: 0.550629988919142
Energy: 0.6531520508754011
Energy: 0.5558554320377054
Energy: 0.6531520508754011
Energy: 0.5616963503970075
Energy: 0.5903938787714345
Energy: 0.5630520739338607
Energy: 0.590393878770915
Energy: 0.5528050796308078
Energy: 0.6480513294478288
Energy: 0.5684871157351199
Energy: 0.6480513294478288
Energy: 0.5575491343250754
Energy: 0.5573131443816475
Energy: 0.6407511285166817
Energy: 0.5573131443816475
Energy: 0.5757844801983809
Energy: 0.6474159203881722
Energy: 0.5560256615657254
Energy: 0.6474159203881722
Energy: 0.550257049799349
Energy: 0.5632387762388753
Energy: 0.7612207638453488
Energy: 0.563238776238356
Energy: 0.6054348514424073
Energy: 0.5836822638298061
Energy: 0.5563489026246075
Energy: 0.5836822638303256
Energy: 0.5568216186344135
Energy: 0.5566693472478551
Energy: 0.7107161465777703
Energy: 0.5566693472483745
Energy: 0.5693067910219325
Energy: 0.5562528125027025
Energy: 0.5656549620657365
Energy: 0.5562528125027025
Energy: 0.5662558048158954
Energy: 0.5643533638163344
Energy: 0.5699625039363082
Energy: 0.5643533638163344
Energy: 0.5760928868254571
Energy: 0.5561532778217874
Energy: 0.5580893753655132
Energy: 0.5561532778228259
Energy: 0.556761434345257
Energy: 0.5834037633035807
Energy: 0.6440022735038067
Energy: 0.5834037633030613
Energy: 0.6844299634318817
Energy: 0.5633619761291955
Energy: 0.551522122257113
Energy: 0.5633619761291955
Energy: 0.5574740405862469
Energy: 0.5911503614673967
Energy: 0.5543802555148267
Energy: 0.5911503614673967
Energy: 0.6202623082481645
Energy: 0.5793819647742247
Energy: 0.5587336553390221
Energy: 0.5793819647726668
Energy: 0.5713165101409661
Energy: 0.6485802569324806
Energy: 0.5557173548888406
Energy: 0.6485802569319613
Energy: 0.5630372317679058
Energy: 0.5897336784505696
Energy: 0.5638382075862273
Energy: 0.5897336784510889
Energy: 0.5574445758668672
Energy: 0.6538187692123185
Energy: 0.5655350136229753
Energy: 0.6538187692123185
Energy: 0.5548759095604423
Energy: 0.5891566842106317
Energy: 0.5573028879742083
Energy: 0.5891566842106317
Energy: 0.5597773223668907
Energy: 0.6466136526536709
Energy: 0.5552988476524113
Energy: 0.6466136526541901
Energy: 0.5589315938857127
Energy: 0.582426872441696
Energy: 0.6274747871687625
Energy: 0.5824268724411765
Energy: 0.5769511685896177
Energy: 0.6568686744512013
Energy: 0.5620901144341104
Energy: 0.6568686744517207
Energy: 0.5531378727110143
Energy: 0.5636141815828927
Energy: 0.5783571564866347
Energy: 0.5636141815844505
Energy: 0.5603131208566191
Energy: 0.5835023759279331
Energy: 0.5681860068431497
Energy: 0.5835023759274138
Energy: 0.5580343799237352
Energy: 0.6517491247861912
Energy: 0.5689385558458259
Energy: 0.6517491247856719
Energy: 0.5770829747066192
Energy: 0.592392227935887
Energy: 0.5577200378940476
Energy: 0.5923922279343292

minimum gb energy = 0.5476213577470607 eV
minimum distance =  2.54126170622462 Angstroms
sigma value = 89


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

Energy: 0.49262444230979663
Energy: 0.49267285111074716
Energy: 0.7148447283236605
Energy: 0.49267285111074716
Energy: 0.49295672577249855
Energy: 0.5088652859667433
Energy: 0.5033439161442029
Energy: 0.5088652859667433
Energy: 0.5014170427535753
Energy: 0.5728465022864029
Energy: 0.6302445204694459
Energy: 0.5728465022864029
Energy: 0.6318783260937995
Energy: 0.5088637513284657
Energy: 0.5033811248013087
Energy: 0.5088637513284657
Energy: 0.5013951680167658
Energy: 0.4942520546720972
Energy: 0.6333191826177985
Energy: 0.4942520546720972
Energy: 0.5015121173485796
Energy: 0.49285958703343963
Energy: 0.49498016744137796
Energy: 0.49285958703343963
Energy: 0.5015809400308974
Energy: 0.5732788263564567
Energy: 0.492846396320548
Energy: 0.5732788263564567
Energy: 0.5058157554993139
Energy: 0.666676237387554
Energy: 0.5032116671161403
Energy: 0.666676237387554
Energy: 0.5014347036347927
Energy: 0.5322761597916869
Energy: 0.6300629618871919
Energy: 0.5322761597916869
Energy: 0.5088723480030201
Energy: 0.6206230898796468
Energy: 0.5013874233894791
Energy: 0.6206230898782881
Energy: 0.49259160235365673
Energy: 0.5089565324069497
Energy: 0.5013559606716027
Energy: 0.5089565324069497
Energy: 0.4926465322399623
Energy: 0.5712804309709543
Energy: 0.5032752244635266
Energy: 0.5712804309709543
Energy: 0.5015056385410313
Energy: 0.5304263570367656
Energy: 0.5043991040402201
Energy: 0.5304263570367656
Energy: 0.5014275867740792
Energy: 0.5300912825239588
Energy: 0.5014502877710064
Energy: 0.5300912825239588
Energy: 0.49549495508236696
Energy: 0.5304393642134172
Energy: 0.501396145612753
Energy: 0.5304393642134172

minimum gb energy = 0.49259160235365673 eV
minimum distance =  2.55287685660293 Angstroms
sigma value = 13


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

Energy: 0.5018066512273187
Energy: 0.4923348454782743
Energy: 0.6491551845188105
Energy: 0.49233484547941325
Energy: 0.5267877091548034
Energy: 0.5031894321141193
Energy: 0.49133713942300805
Energy: 0.5031894321152584
Energy: 0.4927455923476847
Energy: 0.49260388862241633
Energy: 0.5696454965353913
Energy: 0.49260388862070786
Energy: 0.49090376463223223
Energy: 0.5033106385777841
Energy: 0.4883632353006607
Energy: 0.5033106385783536
Energy: 0.49641451946391413
Energy: 0.5184751965519773
Energy: 0.5216227087265296
Energy: 0.5184751965491298
Energy: 0.48597032490334763
Energy: 0.5055274530063627
Energy: 0.4917374689215056
Energy: 0.5055274530080711
Energy: 0.49620922132937434
Energy: 0.6212917409069336
Energy: 0.5994207343029234
Energy: 0.6212917409080726
Energy: 0.4854165496990174
Energy: 0.5036601194122987
Energy: 0.4917426705197783
Energy: 0.5036601194105902
Energy: 0.496278680415764
Energy: 0.5210369625234862
Energy: 0.5449937013568459
Energy: 0.5210369625229166
Energy: 0.5756662009613561
Energy: 0.5274997298130174
Energy: 0.48831842905766343
Energy: 0.5274997298130174
Energy: 0.4964528925580775
Energy: 0.5282421848428371
Energy: 0.49257711015695904
Energy: 0.5282421848434067
Energy: 0.5956938788812455
Energy: 0.52782921459959
Energy: 0.49272335224276315
Energy: 0.5278292146001595
Energy: 0.5081845944031558
Energy: 0.49660128532590375
Energy: 0.5012819924599097
Energy: 0.4966012853247647
Energy: 0.6084898320634521
Energy: 0.5277277546170918
Energy: 0.4928838965264082
Energy: 0.5277277546165222
Energy: 0.4963497719006623
Energy: 0.4918790175766963
Energy: 0.489471759220736
Energy: 0.4918790175784048
Energy: 0.4843816453281518
Energy: 0.5276593164170509
Energy: 0.4867930644726365
Energy: 0.5276593164181899
Energy: 0.4924007129290847
Energy: 0.5144000874505832
Energy: 0.48709819747640704
Energy: 0.5144000874505832
Energy: 0.4911226312072764
Energy: 0.5199214349185413
Energy: 0.4899946012560202
Energy: 0.5199214349179717
Energy: 0.49228584492172456
Energy: 0.5221612451656195
Energy: 0.4899395662712564
Energy: 0.5221612451644805
Energy: 0.49228943663931213
Energy: 0.5223694307803806
Energy: 0.4901318388625819
Energy: 0.5223694307803806
Energy: 0.4910223854593329
Energy: 0.5198927118763746
Energy: 0.4900641951238289
Energy: 0.5198927118797916
Energy: 0.4921566043333201
Energy: 0.5144262824099555
Energy: 0.48711582753679195
Energy: 0.5144262824088165
Energy: 0.48436031843923466
Energy: 0.5277236484308605
Energy: 0.48705338401417897
Energy: 0.527723648430291
Energy: 0.496350297296055
Energy: 0.4918353864089484
Energy: 0.4878406356588956
Energy: 0.49183538640780944
Energy: 0.6088695449200303
Energy: 0.5278786772941612
Energy: 0.4928991423734998
Energy: 0.5278786772867576
Energy: 0.5086064613563626
Energy: 0.49651517684451496
Energy: 0.48621884858882236
Energy: 0.4965151768428066
Energy: 0.5958680535799601
Energy: 0.5278580567773156
Energy: 0.4926800123644304
Energy: 0.5278580567778851
Energy: 0.49627203109463686
Energy: 0.5280636039145377
Energy: 0.4924353530616215
Energy: 0.5280636039156766
Energy: 0.5754690069881393
Energy: 0.5276318785858577
Energy: 0.48831169625084836
Energy: 0.5276318785852884
Energy: 0.49652682143996446
Energy: 0.5210589070497269
Energy: 0.5847024699269308
Energy: 0.5210589070508659
Energy: 0.4854455219043888
Energy: 0.5034571745585327
Energy: 0.4916187402752649
Energy: 0.5034571745608106
Energy: 0.4991177110548375
Energy: 0.6219279530169316
Energy: 0.6358144581986083
Energy: 0.6219279530186401
Energy: 0.4860399219356273
Energy: 0.5056501763209518
Energy: 0.49177294377776337
Energy: 0.5056501763220907
Energy: 0.4963442872864596
Energy: 0.5186736809846584
Energy: 0.5238491928278912
Energy: 0.5186736809857972
Energy: 0.49095102796508944
Energy: 0.5032087969122889
Energy: 0.4883725945396837
Energy: 0.5032087969134279

minimum gb energy = 0.48436031843923466 eV
minimum distance =  2.56768965683108 Angstroms
sigma value = 37


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

Energy: 0.5324898226881734
Energy: 0.5427283839357645
Energy: 0.4550368474598729
Energy: 0.5427283839347846
Energy: 0.5248067546533008
Energy: 0.5863025768065278
Energy: 0.4514480459470505
Energy: 0.5863025768065278
Energy: 0.4606402946136183
Energy: 0.600499603832856
Energy: 0.602331705648606
Energy: 0.6004996038318763
Energy: 0.4897007170439126
Energy: 0.4624413911279169
Energy: 0.4532852674328907
Energy: 0.4624413911279169
Energy: 0.45272016877940596
Energy: 0.5865223473256777
Energy: 0.47586475843797066
Energy: 0.5865223473246979
Energy: 0.45534382213735763
Energy: 0.5882274044318172
Energy: 0.5102026736890747
Energy: 0.5882274044318172
Energy: 0.45979195348851104
Energy: 0.7157611014970668
Energy: 0.5836911807875407
Energy: 0.7157611014970668
Energy: 0.4411589876724941
Energy: 0.4619126262214372
Energy: 0.46352028794978267
Energy: 0.4619126262214372
Energy: 0.45185482305714664
Energy: 0.5867769268520407
Energy: 0.5424960296610368
Energy: 0.5867769268520407
Energy: 0.6026575580029748
Energy: 0.5870994163315828
Energy: 0.5101774759449526
Energy: 0.5870994163315828
Energy: 0.4523816433618687
Energy: 0.6866964807413463
Energy: 0.4955317736367797
Energy: 0.6866964807423261
Energy: 0.6074446925100585
Energy: 0.4616776803004237
Energy: 0.4533815207423027
Energy: 0.4616776803004237
Energy: 0.5082988611409665
Energy: 0.5867241418462292
Energy: 0.4494721468918158
Energy: 0.5867241418462292
Energy: 0.5983479047858854
Energy: 0.713393267009671
Energy: 0.4456888209129664
Energy: 0.7133932670086911
Energy: 0.5326517969417317
Energy: 0.48433768542427014
Energy: 0.4459034800586161
Energy: 0.48433768542427014
Energy: 0.5271775783126982
Energy: 0.587337035649996
Energy: 0.45135043998000784
Energy: 0.587337035649996
Energy: 0.5083137227695358
Energy: 0.5878282946762261
Energy: 0.45180623199807723
Energy: 0.5878282946762261
Energy: 0.4955889986012706
Energy: 0.6876944067425397
Energy: 0.4524379206170213
Energy: 0.6876944067425397
Energy: 0.4524878560015019
Energy: 0.4616913138410863
Energy: 0.4505418964507263
Energy: 0.4616913138410863
Energy: 0.4502786207995265
Energy: 0.5873818348974904
Energy: 0.5037776432630907
Energy: 0.5873818348974904

minimum gb energy = 0.4411589876724941 eV
minimum distance =  2.54528899074664 Angstroms
sigma value = 25


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

Energy: 0.43118894406767205
Energy: 0.41367728427868616
Energy: 0.4190134009109328
Energy: 0.41367728427868616
Energy: 0.4911418790987027
Energy: 0.6167822673402475
Energy: 0.4125816324441043
Energy: 0.6167822673402475
Energy: 0.4078178807672159
Energy: 0.40791316435791436
Energy: 0.7367857983400705
Energy: 0.40791316435791436
Energy: 0.41644135037147
Energy: 0.6183795764088724
Energy: 0.41156802364523243
Energy: 0.6183795764088724
Energy: 0.4116920575491772
Energy: 0.6166284091507591
Energy: 0.41966482044325254
Energy: 0.6166284091507591
Energy: 0.3986499331785819
Energy: 0.6185731670044046
Energy: 0.4126988417596893
Energy: 0.6185731670051696
Energy: 0.4122550615971656
Energy: 0.40947570306336584
Energy: 0.41782622733022
Energy: 0.40947570306336584
Energy: 0.40002264702247237
Energy: 0.5331075690503353
Energy: 0.4088169179802428
Energy: 0.5331075690511005
Energy: 0.41156641248909426
Energy: 0.61687364043679
Energy: 0.5281048635835319
Energy: 0.61687364043679
Energy: 0.39936457685081406
Energy: 0.4105496035147544
Energy: 0.43209345607867844
Energy: 0.4105496035147544
Energy: 0.41223188208717276
Energy: 0.40926287618239293
Energy: 0.5523507624393003
Energy: 0.40926287618162777
Energy: 0.5113770082950825
Energy: 0.6515561205321391
Energy: 0.4088216913474845
Energy: 0.6515561205321391
Energy: 0.4115186663015323
Energy: 0.6173665327238046
Energy: 0.4755679801387996
Energy: 0.6173665327238046
Energy: 0.5208376389836801
Energy: 0.6295136285111639
Energy: 0.4126110092043874
Energy: 0.6295136285111639
Energy: 0.41209558132318974
Energy: 0.4092325574319694
Energy: 0.40248105345136215
Energy: 0.4092325574319694
Energy: 0.505310391261087
Energy: 0.6376698273846955
Energy: 0.4114065489728778
Energy: 0.6376698273839303
Energy: 0.4116598863871291
Energy: 0.5331823870031964
Energy: 0.40005245119549765
Energy: 0.5331823870031964
Energy: 0.48965024096251286
Energy: 0.6163813359036171
Energy: 0.4124058902192784
Energy: 0.616381335902852
Energy: 0.4349614513796177
Energy: 0.40812321164451754
Energy: 0.39896889827302173
Energy: 0.40812321164451754
Energy: 0.5521943847332391
Energy: 0.6351326476710129
Energy: 0.4112967098831217
Energy: 0.6351326476710129
Energy: 0.41175493961571036
Energy: 0.6502301433741922
Energy: 0.4002186249734556
Energy: 0.6502301433741922
Energy: 0.40810416735685395
Energy: 0.6166754628454315
Energy: 0.41092192067433514
Energy: 0.6166754628446663
Energy: 0.41233461189760223
Energy: 0.6283061697540219
Energy: 0.5209741437621556
Energy: 0.6283061697540219
Energy: 0.3995193248230859
Energy: 0.6344078410566749
Energy: 0.41126884601677294
Energy: 0.6344078410566749
Energy: 0.41143736921179636
Energy: 0.6504365876054888
Energy: 0.49624615410267947
Energy: 0.6504365876054888
Energy: 0.3990618666522747
Energy: 0.5328872959320687
Energy: 0.407929408274128
Energy: 0.5328872959328339

minimum gb energy = 0.3986499331785819 eV
minimum distance =  2.48337151548258 Angstroms
sigma value = 41


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

Energy: 0.53228231916473
Energy: 0.5508722263418838
Energy: 0.7015614973816588
Energy: 0.5508722263418838
Energy: 0.5044645630560597
Energy: 0.3796957320547505
Energy: 0.3722621169878631
Energy: 0.37969573205537777
Energy: 0.3821882933435286
Energy: 0.37371210487896367
Energy: 0.4707044621941588
Energy: 0.3737121048770819
Energy: 0.44388702538284364
Energy: 0.37737117631227
Energy: 0.372206069483261
Energy: 0.3773711763116428
Energy: 0.36934689843184926
Energy: 0.5579614959771338
Energy: 0.3863905201424282
Energy: 0.5579614959771338
Energy: 0.38312587762233113
Energy: 0.376466009275986
Energy: 0.3723017071970087
Energy: 0.37646600927034063
Energy: 0.3715855772217838
Energy: 0.38054068280220327
Energy: 0.38367904092408783
Energy: 0.3805406828053396
Energy: 0.36553216598110166
Energy: 0.46806864102501844
Energy: 0.3699393970762494
Energy: 0.46806864102501844
Energy: 0.373871213015295
Energy: 0.5763015439248718
Energy: 0.47438275952122777
Energy: 0.5763015439248718
Energy: 0.3694413622333257
Energy: 0.3720531897082785
Energy: 0.38268987447747815
Energy: 0.3720531897089058
Energy: 0.37162395403099646
Energy: 0.3785682496943213
Energy: 0.5046980492898342
Energy: 0.3785682496949485
Energy: 0.3648258229572972
Energy: 0.5494727955123511
Energy: 0.5328323741991721
Energy: 0.5494727955117238
Energy: 0.37391449848757935
Energy: 0.5777208419633441
Energy: 0.5529216081415895
Energy: 0.5777208419633441
Energy: 0.45869745327348427
Energy: 0.4980582355767693
Energy: 0.38264112035725706
Energy: 0.4980582355773966
Energy: 0.37159810795835424
Energy: 0.3792499697228317
Energy: 0.48964162797337246
Energy: 0.37924996972345904
Energy: 0.46676281849967016
Energy: 0.5782542121684282
Energy: 0.36985489300878827
Energy: 0.5782542121690554
Energy: 0.3739498570532625
Energy: 0.5773133306400292
Energy: 0.45972353220468365
Energy: 0.5773133306400292
Energy: 0.4637018281673358
Energy: 0.49598019216404576
Energy: 0.37219221559629134
Energy: 0.49598019216404576
Energy: 0.3716706897748622
Energy: 0.4680220574744994
Energy: 0.36527402984830687
Energy: 0.4680220574738721
Energy: 0.4496092196304034
Energy: 0.5782348546824281
Energy: 0.37407841575879164
Energy: 0.5782348546818008
Energy: 0.3844207158702189
Energy: 0.5774750535909037
Energy: 0.36663732336395904
Energy: 0.5774750535909037
Energy: 0.5880890718987187
Energy: 0.6068836317286161
Energy: 0.3721936419747425
Energy: 0.6068836317292435
Energy: 0.5340036761537905
Energy: 0.5497644970227957
Energy: 0.365314048136821
Energy: 0.5497644970227957
Energy: 0.5021965925110168
Energy: 0.5780132406182747
Energy: 0.3740205819498151
Energy: 0.5780132406182747
Energy: 0.38445698642605786
Energy: 0.5761651185950789
Energy: 0.36692184899441316
Energy: 0.5761651185950789
Energy: 0.48841541956176543
Energy: 0.6056367551681471
Energy: 0.37217472320988026
Energy: 0.6056367551687744
Energy: 0.3717010517452849
Energy: 0.5756389551989778
Energy: 0.46776144862280056
Energy: 0.5756389551989778
Energy: 0.3739475707823983
Energy: 0.576665881488208
Energy: 0.3739335841039852
Energy: 0.576665881488208
Energy: 0.3739630038180164
Energy: 0.5996445594027799
Energy: 0.4641910993058818
Energy: 0.5996445594034072
Energy: 0.36967306890428175
Energy: 0.5948349467997528
Energy: 0.3742650124101094
Energy: 0.5948349467991256
Energy: 0.37185468496325236
Energy: 0.5758006611435954
Energy: 0.4516786176671873
Energy: 0.5758006611442226
Energy: 0.3696468961576783
Energy: 0.5765456895815969
Energy: 0.3870673453572414
Energy: 0.5765456895803422

minimum gb energy = 0.3648258229572972 eV
minimum distance =  2.47864034838727 Angstroms
sigma value = 15


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

Energy: 0.48506882892523523
Energy: 0.542963648699843
Energy: 0.5864926177873305
Energy: 0.5429636486993117
Energy: 0.541823689044305
Energy: 0.5208702929493446
Energy: 0.349988498553685
Energy: 0.5208702929493446
Energy: 0.36054603737509205
Energy: 0.500350803647409
Energy: 0.6029932832336685
Energy: 0.5003508036484717
Energy: 0.4579144871005013
Energy: 0.5333969394688534
Energy: 0.34993846938516915
Energy: 0.5333969394683219
Energy: 0.34809564277958305
Energy: 0.5493050605112867
Energy: 0.5148097085037737
Energy: 0.5493050605107553
Energy: 0.40727564611394995
Energy: 0.5192790393593675
Energy: 0.34985859084898807
Energy: 0.5192790393593675
Energy: 0.3494979606648034
Energy: 0.5008293820005669
Energy: 0.3564154829221597
Energy: 0.5008293820010983
Energy: 0.35648906268400954
Energy: 0.49964526074842636
Energy: 0.3498728338028076
Energy: 0.4996452607489577
Energy: 0.3510216564956638
Energy: 0.547358337203389
Energy: 0.40763052260656196
Energy: 0.547358337203389
Energy: 0.33971919677556034
Energy: 0.5230263025539903
Energy: 0.34843428802891924
Energy: 0.5230263025534588
Energy: 0.34960957237057555
Energy: 0.5196358727967225
Energy: 0.4597695976400406
Energy: 0.5196358727967225
Energy: 0.34081930641535957
Energy: 0.3506794848656859
Energy: 0.3607519997422551
Energy: 0.3506794848651545
Energy: 0.3512441041290707
Energy: 0.5470663253001101
Energy: 0.539231816617647
Energy: 0.5470663253006416
Energy: 0.34070198027869714
Energy: 0.5540097917889198
Energy: 0.4855589936302265
Energy: 0.5540097917878571
Energy: 0.3494982015234412
Energy: 0.5221052980692922
Energy: 0.541349168370728
Energy: 0.5221052980692922
Energy: 0.4162136397836096
Energy: 0.5005332299942001
Energy: 0.3607556118724364
Energy: 0.5005332299931373
Energy: 0.35101037578865946
Energy: 0.5469739653989815
Energy: 0.46034571610583097
Energy: 0.5469739653984501
Energy: 0.4263529750178227
Energy: 0.5600458449198051
Energy: 0.3484120349576849
Energy: 0.5600458449203365
Energy: 0.34948737503384913
Energy: 0.5223019647396842
Energy: 0.40972398104282415
Energy: 0.5223019647396842
Energy: 0.4209253914282953
Energy: 0.5219935564613459
Energy: 0.3498228914853755
Energy: 0.5219935564613459
Energy: 0.35095484741151806
Energy: 0.5336394498766812
Energy: 0.3573096122170124
Energy: 0.5336394498766812
Energy: 0.4234486476036173
Energy: 0.5589288600372517
Energy: 0.35273791405817484
Energy: 0.5589288600372517
Energy: 0.3494656407577252
Energy: 0.5218724995060222
Energy: 0.3386802528327501
Energy: 0.5218724995060222
Energy: 0.5204125126200525
Energy: 0.522128978364568
Energy: 0.34986169863161604
Energy: 0.522128978364568
Energy: 0.3618880186559986
Energy: 0.5332875961438397
Energy: 0.3443041820054008
Energy: 0.533287596144371
Energy: 0.539335102284057
Energy: 0.558556917218719
Energy: 0.35276656048514965
Energy: 0.5585569172192504
Energy: 0.48624100645620016
Energy: 0.5403074260486923
Energy: 0.3388219229244823
Energy: 0.5403074260476295
Energy: 0.6157926000977204
Energy: 0.5225810666149993
Energy: 0.349834354835253
Energy: 0.5225810666144678
Energy: 0.36200182138396186
Energy: 0.5589373847566338
Energy: 0.34438327304561844
Energy: 0.5589373847561024
Energy: 0.4461637538857861
Energy: 0.5481089901151731
Energy: 0.35277851680976313
Energy: 0.5481089901146419
Energy: 0.34949987094509344
Energy: 0.5471295581265535
Energy: 0.4288383360382339
Energy: 0.547129558126022
Energy: 0.45044990071104085
Energy: 0.5219255864077942
Energy: 0.3500109718763279
Energy: 0.5219255864077942
Energy: 0.3510027165052796
Energy: 0.5596913570379682
Energy: 0.4286041587435533
Energy: 0.5596913570379682
Energy: 0.34152501925812967
Energy: 0.5331930736577806
Energy: 0.35285240689173714
Energy: 0.533193073659906
Energy: 0.34328856662764007
Energy: 0.5472310819775804
Energy: 0.42916538559538764
Energy: 0.5472310819775804
Energy: 0.34969353026100636
Energy: 0.5218010474799107
Energy: 0.35129620572240455
Energy: 0.5218010474793794
Energy: 0.3509216666774073
Energy: 0.5598199461815684
Energy: 0.5164910063491157
Energy: 0.559819946181037

minimum gb energy = 0.3386802528327501 eV
minimum distance =  2.56073792595189 Angstroms
sigma value = 85


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

Energy: 0.45636356899606306
Energy: 0.5043091461580396
Energy: 0.6539170048136106
Energy: 0.5043091461575787
Energy: 0.5648627102509373
Energy: 0.4792331017864651
Energy: 0.319388943418539
Energy: 0.47923310178600426
Energy: 0.4378120958103946
Energy: 0.4555994094206144
Energy: 0.3975107732530359
Energy: 0.45559940942107524
Energy: 0.4952449949964804
Energy: 0.47918403256641406
Energy: 0.3194156684971182
Energy: 0.4791840325668749
Energy: 0.333060639891054
Energy: 0.4423338877235424
Energy: 0.47428798275670075
Energy: 0.4423338877235424
Energy: 0.4247755555854067
Energy: 0.4806521387818375
Energy: 0.3193254573024516
Energy: 0.4806521387822983
Energy: 0.3174475687102383
Energy: 0.46472907265591756
Energy: 0.3373566014973899
Energy: 0.46472907265591756
Energy: 0.3808631709469846
Energy: 0.4787873034078134
Energy: 0.31946320116901006
Energy: 0.4787873034078134
Energy: 0.31901984776364245
Energy: 0.44879276354615577
Energy: 0.3810041867746892
Energy: 0.448792763545695
Energy: 0.3372387445426945
Energy: 0.46453982620144074
Energy: 0.31784876624925307
Energy: 0.46453982620144074
Energy: 0.3203447947106056
Energy: 0.4799097396576768
Energy: 0.42480207350220084
Energy: 0.4799097396576768
Energy: 0.30583274730267196
Energy: 0.4791402234728643
Energy: 0.33335986525507083
Energy: 0.4791402234728643
Energy: 0.31900763834142704
Energy: 0.4484167673015274
Energy: 0.5268228832275996
Energy: 0.4484167673010666
Energy: 0.3062568152039453
Energy: 0.45554322785626333
Energy: 0.4380249397912207
Energy: 0.45554322785626333
Energy: 0.32038134003277485
Energy: 0.4791958790009417
Energy: 0.5653960988587869
Energy: 0.4791958790009417
Energy: 0.3045391880605613
Energy: 0.504430415221208
Energy: 0.4566817743826895
Energy: 0.504430415221208
Energy: 0.31907699889736196
Energy: 0.44831634276456617
Energy: 0.565261302601642
Energy: 0.44831634276456617
Energy: 0.37096272954425724
Energy: 0.45553649028470033
Energy: 0.43818319945926115
Energy: 0.4555364902851612
Energy: 0.320363623148603
Energy: 0.4791691322768746
Energy: 0.4961354927542526
Energy: 0.4791691322768746
Energy: 0.37850050429178966
Energy: 0.5137748785161609
Energy: 0.3334614944092133
Energy: 0.5137748785156999
Energy: 0.31899159100193214
Energy: 0.4486277621587755
Energy: 0.45928171045157073
Energy: 0.44862776215831457
Energy: 0.37713596892865453
Energy: 0.47966234818464987
Energy: 0.31785016599535115
Energy: 0.47966234818464987
Energy: 0.3203071593031689
Energy: 0.47862735763164027
Energy: 0.381512181626005
Energy: 0.4786273576311794
Energy: 0.37957155876808524
Energy: 0.5117844507640971
Energy: 0.31948606426549475
Energy: 0.5117844507640971
Energy: 0.3189057446904233
Energy: 0.3958576010901533
Energy: 0.33775326732588956
Energy: 0.3958576010901533
Energy: 0.45099573447237806
Energy: 0.47906506044448827
Energy: 0.3197693232325
Energy: 0.47906506044448827
Energy: 0.3345321661908532
Energy: 0.4789902282198375
Energy: 0.306396382862184
Energy: 0.4789902282198375
Energy: 0.45726528529182237
Energy: 0.5119577323426652
Energy: 0.3194016592045831
Energy: 0.5119577323426652
Energy: 0.43900805330098475
Energy: 0.45558539601761144
Energy: 0.30650172211971455
Energy: 0.4555853960180723
Energy: 0.6109602408889862
Energy: 0.4790857726771423
Energy: 0.31954575048900546
Energy: 0.4790857726771423
Energy: 0.45764457262527947
Energy: 0.501235140725734
Energy: 0.3051924504354806
Energy: 0.501235140725734
Energy: 0.5512836788924992
Energy: 0.5126988961010851
Energy: 0.3194110607105304
Energy: 0.5126988961010851
Energy: 0.4391204229650749
Energy: 0.45557649914431975
Energy: 0.30573926617216823
Energy: 0.45557649914431975
Energy: 0.5437470772544617
Energy: 0.47902891501713507
Energy: 0.31993455555814715
Energy: 0.47902891501713507
Energy: 0.33450095242134864
Energy: 0.5099638062742935
Energy: 0.37870189087609823
Energy: 0.5099638062742935
Energy: 0.3991371016518459
Energy: 0.5103192222599187
Energy: 0.3193250538444438
Energy: 0.5103192222599187
Energy: 0.3190654580592835
Energy: 0.4793486352488457
Energy: 0.37735491811120975
Energy: 0.4793486352488457
Energy: 0.39356708948017927
Energy: 0.4785477127572811
Energy: 0.3198881680378277
Energy: 0.4785477127572811
Energy: 0.3204490705239349
Energy: 0.5100512667417371
Energy: 0.37938076036699514
Energy: 0.5100512667417371
Energy: 0.30798636215422864
Energy: 0.4980792002959967
Energy: 0.3206351981404935
Energy: 0.4980792002964577
Energy: 0.31889524595483043
Energy: 0.4791706851632317
Energy: 0.46464272602267603
Energy: 0.47917068516277084
Energy: 0.30465630576226066
Energy: 0.47872239656950316
Energy: 0.33340653824517097
Energy: 0.47872239656950316
Energy: 0.32038467142083826
Energy: 0.5099456702991847
Energy: 0.45709307440751806
Energy: 0.5099456702991847

minimum gb energy = 0.3045391880605613 eV
minimum distance =  2.56116711534732 Angstroms
sigma value = 113


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

Energy: 0.011735057889953613
Energy: 0.013136781830751235
Energy: 0.39294801752329167
Energy: 0.013136781830396948
Energy: 0.3926159767451175
Energy: 0.17518896732930145
Energy: 0.17553377386147462
Energy: 0.17518896732930145
Energy: 0.0117350578903079
Energy: 0.013136781831105525
Energy: 0.39294804098320696
Energy: 0.013136781830751235
Energy: 0.3926159767451175
Energy: 0.17518896732930145
Energy: 0.17552762337096922
Energy: 0.17518896732930145
Energy: 0.0117350578903079
Energy: 0.013136781830751235
Energy: 0.3929481871370744
Energy: 0.013136781830751235
Energy: 0.3926159767447829
Energy: 0.17518896732930145
Energy: 0.17551708756615703
Energy: 0.17518896732930145

minimum gb energy = 0.011735057889953613 eV
minimum distance =  2.83530856680944 Angstroms
sigma value = 1