Model name: model_name=EAM_Dynamo_SunZhangMendelev_2022_Fe__MO_044341472608_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.430137217044831
cohesive_energy=3.990966885422167
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[4.88322609746958e-19, 5.26391928747432e-19, 5.537090403571319e-19, 5.72180534770518e-19, 5.790266355276e-19, 5.867619443165519e-19, 5.994720115540739e-19, 6.14000549271186e-19, 6.239116139291099e-19, 6.255666623920319e-19, 6.20768143373202e-19, 6.135647572267379e-19, 6.064927495642619e-19, 6.011126404272899e-19, 5.98680536296878e-19, 5.99640240100644e-19, 6.03600820739892e-19, 6.096794788892879e-19, 6.16818777970392e-19, 6.24001335820614e-19, 6.30373192294032e-19, 6.352950789136799e-19, 6.3835523628462e-19, 6.3937261844721e-19, 6.38308773162234e-19, 6.3505475241858e-19, 6.29676245458242e-19, 6.2225656546618795e-19, 6.12779690676078e-19, 6.010453490086619e-19, 5.86529628704622e-19, 5.682327715443419e-19, 5.44525363891044e-19, 5.137379376921e-19, 4.74245885840634e-19, 4.2342484301015397e-19, 3.5740234827628197e-19, 2.72342790777222e-19, 1.64737403684514e-19, 3.03942520529604e-20, -1.3588188207084718e-19, -3.42780884314398e-19, -6.09424732804482e-19, -9.8598751144677e-19, -1.6314804446358599e-18, -2.9899820343707996e-18, -6.2219087622419395e-18, -1.45313415262215e-17, -3.76708576715982e-17, -1.078780775558148e-16, -3.4449361113614395e-16]
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.01709693636245497
Energy: 0.439928745174084
Energy: 0.01806466880937089
Energy: 0.017284897350319937
Energy: 0.4402749616538798
Energy: 0.01728831172552117
Energy: 0.4399287451720327
Energy: 0.28061711581773424
Energy: 0.2800732557151254
Energy: 0.28007007101259934
Energy: 0.28014395240617956
Energy: 0.2802295464518506
Energy: 0.01806466880937089
Energy: 0.2800732557151254
Energy: 0.28014130501347384
Energy: 0.32267607789612873
Energy: 0.2800867899822824
Energy: 0.28003196464947533
Energy: 0.017284897350319937
Energy: 0.28007007101364434
Energy: 0.32267607789581915
Energy: 0.017311073851139322
Energy: 0.28007325693998075
Energy: 0.017198808912600033
Energy: 0.4402749616532219
Energy: 0.2801439524218541
Energy: 0.280086789983637
Energy: 0.28007325694032903
Energy: 0.2813590579511748
Energy: 0.28019632399300815
Energy: 0.017288311719057863
Energy: 0.280229546451154
Energy: 0.280031964649127
Energy: 0.01719880891395462
Energy: 0.2801963239960656
Energy: 0.017459552287020057

minimum gb energy = 0.01709693636245497 eV
minimum distance =  2.42312602272901 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 0.9645171305271019
Energy: 0.5259482842203241
Energy: 0.6075675716641111
Energy: 0.6246367105792755
Energy: 0.5819681464800782
Energy: 0.5578884949314223
Energy: 0.9342126323678486
Energy: 0.556715937842535
Energy: 0.5613827589847765
Energy: 0.533735862488389
Energy: 0.5216290494744598
Energy: 0.5955106902002418
Energy: 0.6399756687326289
Energy: 0.5622578703043757
Energy: 0.5448827315763819
Energy: 0.5523708946197801
Energy: 0.590497062977708
Energy: 0.5245747129976371
Energy: 1.0069513157686245
Energy: 0.5417727321451392
Energy: 0.5434704004253983
Energy: 0.6206208683803157
Energy: 0.5676467764304374
Energy: 0.50598874007022
Energy: 0.9731440275171427
Energy: 0.6083272222681706
Energy: 0.5198713175159348
Energy: 0.5936534317929005
Energy: 0.6447270008562949
Energy: 0.5604000805910245
Energy: 0.9898372679524721
Energy: 0.622669356283782
Energy: 0.5790370142719423
Energy: 0.5669797813347331
Energy: 0.6019677620692117
Energy: 0.5717590426591938
Energy: 0.9898570856948833
Energy: 0.5854459834530531
Energy: 0.5874305730446422
Energy: 0.5879473392584494
Energy: 0.6060207911844495
Energy: 0.6166013027558552
Energy: 0.893939826727237
Energy: 0.7061586972326437
Energy: 0.596738412622856
Energy: 0.6021776592519179
Energy: 0.5710998393376762
Energy: 0.5761472385266556
Energy: 0.7808164948120492
Energy: 0.5738296201644159
Energy: 0.5562072567319118
Energy: 0.6013823434178691
Energy: 0.5687803506322507
Energy: 0.5884631386267705
Energy: 0.8056341750884459
Energy: 0.5827063021916694
Energy: 0.5357282570694184
Energy: 0.5774929994665476
Energy: 0.5267302461922541
Energy: 0.5744185863602987
Energy: 0.8368578418106706
Energy: 0.5009342528456153
Energy: 0.49306378710868315
Energy: 0.5745189569501439
Energy: 0.6127071438837928
Energy: 0.539676997314366
Energy: 0.8167099258267104
Energy: 0.5958780822546985
Energy: 0.5415867772200355
Energy: 0.5818019112082593
Energy: 0.575193572868955
Energy: 0.571247464992481
Energy: 0.7860225276084136
Energy: 0.6291028254641198
Energy: 0.5790674614379807
Energy: 0.532361957131666
Energy: 0.5413147444308162
Energy: 0.559971684699814
Energy: 0.85325840515793
Energy: 0.5429283478841069
Energy: 0.48361772307264694
Energy: 0.5850944682713938
Energy: 0.6323551935123615
Energy: 0.5462479779216086
Energy: 0.8059585994100673
Energy: 0.563791956798362
Energy: 0.573960001953516
Energy: 0.5198613964003669
Energy: 0.5494315310681425
Energy: 0.5471464864170784
Energy: 0.7843256211997769
Energy: 0.6209759181497342
Energy: 0.5204315928171529
Energy: 0.5744863569541229
Energy: 0.5470182464095008
Energy: 0.5102147583773884
Energy: 0.865897223353325
Energy: 0.5473950358095397
Energy: 0.5474781271074765
Energy: 0.5766397885064468
Energy: 0.5212420052398518
Energy: 0.5574059849057743
Energy: 0.8924417482205464
Energy: 0.5989610241872998
Energy: 0.5920317259855402
Energy: 0.6161825256741171
Energy: 0.6397096029374464
Energy: 0.5719257981241539
Energy: 0.890141659077025
Energy: 0.5721767008331325
Energy: 0.5781812610722128
Energy: 0.6511019459227805
Energy: 0.6644323514993695
Energy: 0.5962778018137409
Energy: 0.9227901416077245
Energy: 0.606909070260109
Energy: 0.5530503891717639
Energy: 0.6408270422295921
Energy: 0.6076479524125457
Energy: 0.5901393955346359
Energy: 0.9858200601355932
Energy: 0.5457635446523524
Energy: 0.5684897206220253
Energy: 0.6469386518558992
Energy: 0.5498095446766498
Energy: 0.5261511661292011
Energy: 0.9057460195498632
Energy: 0.5772519952818336
Energy: 0.5181786160976043
Energy: 0.5986041791508533
Energy: 0.5798925216420813
Energy: 0.5629942258357511
Energy: 0.9133527626114631
Energy: 0.5553021904675246
Energy: 0.5739435611842326
Energy: 0.5384376230490724
Energy: 0.49480268254100285
Energy: 0.5711329735013502

minimum gb energy = 0.48361772307264694 eV
minimum distance =  2.26316286577963 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 0.9584415480218961
Energy: 0.569596413633426
Energy: 0.49319184720703085
Energy: 0.5036056023667166
Energy: 0.600821839543806
Energy: 0.5158705939143955
Energy: 0.9650883164922565
Energy: 0.648656611023586
Energy: 0.5895164712975226
Energy: 0.5730162571824801
Energy: 0.6352449478983241
Energy: 0.6249667813498401
Energy: 0.8195519194553147
Energy: 0.545553797365282
Energy: 0.5177372935370758
Energy: 0.5478078430528377
Energy: 0.6520802832142156
Energy: 0.5643912175620872
Energy: 0.8484002954437563
Energy: 0.5898798590683701
Energy: 0.6124818878333249
Energy: 0.5900630722880705
Energy: 0.5960670974344052
Energy: 0.5245951506323825
Energy: 0.9099113886567619
Energy: 0.6605556835700042
Energy: 0.643007617733214
Energy: 0.5686797970597649
Energy: 0.6942705724940881
Energy: 0.5903181884375176
Energy: 0.9372431554734968
Energy: 0.5525493665298101
Energy: 0.6008013078916044
Energy: 0.6555537536587325
Energy: 0.5986564578284617
Energy: 0.593912660667064
Energy: 0.9269881653119478
Energy: 0.6707243370426869
Energy: 0.5816182525437095
Energy: 0.652194967726733
Energy: 0.6378224871335629
Energy: 0.5721662266487028
Energy: 0.9376178496581158
Energy: 0.6333453463606239
Energy: 0.6371252113838531
Energy: 0.5495281136669583
Energy: 0.6368673940549459
Energy: 0.5384370766092592
Energy: 0.830986207215334
Energy: 0.6292644514853133
Energy: 0.6342939257638077
Energy: 0.6850137635225666
Energy: 0.607243167817846
Energy: 0.6413859214793634
Energy: 0.9043211407374069
Energy: 0.6136713150118149
Energy: 0.6195547955433802
Energy: 0.6872692216952446
Energy: 0.6136052634260483
Energy: 0.6024440736764185
Energy: 0.8173624703676039
Energy: 0.5404624794464762
Energy: 0.5522597361590286
Energy: 0.5925169185136581
Energy: 0.4982713048118275
Energy: 0.5012418208384347
Energy: 0.8557939256250742
Energy: 0.5348390317917013
Energy: 0.6516807022529868
Energy: 0.6799904330574827
Energy: 0.5819375186940506
Energy: 0.6041616641198589
Energy: 0.8067328234379451
Energy: 0.6657611764702043
Energy: 0.6242399820705317
Energy: 0.6671195389016497
Energy: 0.6462668822531914
Energy: 0.5926740836678661
Energy: 0.866722929915544
Energy: 0.5487785201525688
Energy: 0.599543644967966
Energy: 0.6208215877698724
Energy: 0.547083167497968
Energy: 0.5153522251134738
Energy: 0.8888956742869569
Energy: 0.6221720104826983
Energy: 0.6101625719125364
Energy: 0.6713415475236527
Energy: 0.5798261733901875
Energy: 0.6362667749479076
Energy: 0.8273524019913142
Energy: 0.6442104669279264
Energy: 0.6648233444226033
Energy: 0.708427719861365
Energy: 0.6495338326425003
Energy: 0.5962570269286432
Energy: 0.8996452149403007
Energy: 0.6157346761076884
Energy: 0.6573484651528
Energy: 0.6507314047909818
Energy: 0.6588047923650344
Energy: 0.6669859473657663
Energy: 0.8065316816727216
Energy: 0.6221316931785147
Energy: 0.6275915342448359
Energy: 0.6295450624103727
Energy: 0.581070439128684
Energy: 0.5025225441032798
Energy: 0.8146573781726273
Energy: 0.6533778144248513
Energy: 0.6671836517665873
Energy: 0.5966981454907943
Energy: 0.7045368167551529
Energy: 0.6392549578887553
Energy: 0.9232600335641765
Energy: 0.6558428872024401
Energy: 0.6174463916418296
Energy: 0.6033991076022859
Energy: 0.6382253532292915
Energy: 0.6270224623086192
Energy: 1.0495575797347945
Energy: 0.6592865691187467
Energy: 0.5092480231013076
Energy: 0.4508758329029647
Energy: 0.6172690969706114
Energy: 0.5011372746753513
Energy: 0.8247242737927739
Energy: 0.5650132754681858
Energy: 0.5870902088037562
Energy: 0.6220326279152122
Energy: 0.5681110612403989
Energy: 0.5834315752071716
Energy: 0.8959594067017296
Energy: 0.7032795002900207
Energy: 0.5701245731167432
Energy: 0.6145261381070404
Energy: 0.6664194106343978
Energy: 0.5520376992188804
Energy: 0.8300406383611574
Energy: 0.6475354538151009
Energy: 0.6551297547933025
Energy: 0.5412798336200365
Energy: 0.6494653354525409
Energy: 0.509906900638929
Energy: 0.8922597183288397
Energy: 0.6623144565071044
Energy: 0.6234005767173229
Energy: 0.6178989690221606
Energy: 0.6486871679153491
Energy: 0.6133386719955439
Energy: 0.9971851266521935
Energy: 0.5882582811032838
Energy: 0.5903834948939448
Energy: 0.7160995694705521
Energy: 0.587682844855353
Energy: 0.5918885616035043
Energy: 0.9891538461064381
Energy: 0.6515503959746458
Energy: 0.6269767061197866
Energy: 0.5979598607189971
Energy: 0.6182362208085307
Energy: 0.6861163894914954
Energy: 0.8985155834751432
Energy: 0.626839668975034
Energy: 0.5028499388801795
Energy: 0.6414984501680416
Energy: 0.6219765037356775
Energy: 0.6299237164026722
Energy: 0.8347581005363892
Energy: 0.6115886241084539
Energy: 0.6186104038998007
Energy: 0.6947728979496085
Energy: 0.6114085630206127
Energy: 0.6249582822071555
Energy: 0.8494565359622672
Energy: 0.6018591296469377
Energy: 0.5967173325677684
Energy: 0.6457783194216722
Energy: 0.5935001473236755
Energy: 0.6123437330672704
Energy: 0.8594812786037
Energy: 0.5519560753340486
Energy: 0.4643450032365163
Energy: 0.6634151524506978
Energy: 0.4964151250683281
Energy: 0.5674476744999213
Energy: 0.8470032127363379
Energy: 0.553300966911557
Energy: 0.5314081897781424
Energy: 0.6872640816472033
Energy: 0.5527744964413503
Energy: 0.5744782377424187
Energy: 0.8696663426718597
Energy: 0.6550912433575768
Energy: 0.5992328489327707
Energy: 0.663997427754159
Energy: 0.6021553215467857
Energy: 0.6686960877827898
Energy: 0.8016641368608349
Energy: 0.44466742773105433
Energy: 0.44666523824730764
Energy: 0.6434792513600285
Energy: 0.5712826384608177
Energy: 0.5078016633518994
Energy: 0.8603842641739164
Energy: 0.6664217726429212
Energy: 0.6265911991125513
Energy: 0.6219528080786478
Energy: 0.6184042808579916
Energy: 0.6172998675121687
Energy: 0.8384080922774217
Energy: 0.5673585401303174
Energy: 0.672306338050739
Energy: 0.6939076582668491
Energy: 0.639897313384098
Energy: 0.574836706715528
Energy: 0.9335055481961001
Energy: 0.6636544353342623
Energy: 0.6752078567902737
Energy: 0.5557442278610358
Energy: 0.5980362639427111
Energy: 0.6575821416405441
Energy: 0.799175030846814
Energy: 0.5913258403172746
Energy: 0.5815911238420816
Energy: 0.6274597645899554
Energy: 0.5800796155929231
Energy: 0.6027401051321587
Energy: 0.7942477609403362
Energy: 0.6096365198481607
Energy: 0.5735636986306206
Energy: 0.6286090817229898
Energy: 0.6399399410437198
Energy: 0.5737628404574202
Energy: 0.9071483182109746
Energy: 0.6640611770687997
Energy: 0.6493551077756003
Energy: 0.5573933027125251
Energy: 0.6563405152701602
Energy: 0.6299204439187643
Energy: 0.8846011384191749
Energy: 0.6242599102760934
Energy: 0.5290596744343304
Energy: 0.5410917089407199
Energy: 0.6116078919685445
Energy: 0.5380285386965904

minimum gb energy = 0.44466742773105433 eV
minimum distance =  2.27396499336883 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 0.9438145753038651
Energy: 0.6816502282685842
Energy: 0.634232006737629
Energy: 0.5471940798553946
Energy: 0.6807732763566361
Energy: 0.4725541292934853
Energy: 0.8981416866306701
Energy: 0.5416862996711197
Energy: 0.530773561847553
Energy: 0.548843626483669
Energy: 0.5915996457756056
Energy: 0.6749103824672048
Energy: 0.9176128086525603
Energy: 0.5271750811358457
Energy: 0.5414353168066063
Energy: 0.6495069041904021
Energy: 0.6855202390874278
Energy: 0.6321473749632643
Energy: 0.8664007344087363
Energy: 0.5276199016244177
Energy: 0.5309571605398866
Energy: 0.5211144172793385
Energy: 0.5409546448631215
Energy: 0.5451247252970941
Energy: 0.884700688520165
Energy: 0.694692478689138
Energy: 0.5571074222521406
Energy: 0.5817125986293814
Energy: 0.7024745031623263
Energy: 0.5661248002757451
Energy: 0.8831922385372598
Energy: 0.6767129595613082
Energy: 0.6525009432544947
Energy: 0.7015547085879772
Energy: 0.6633981184178386
Energy: 0.6220193300034043
Energy: 0.8852481719647574
Energy: 0.6749310669674421
Energy: 0.6482737755930849
Energy: 0.7592998791891638
Energy: 0.6798470709376244
Energy: 0.6059939662861296
Energy: 0.9181730558485497
Energy: 0.45882080567784267
Energy: 0.4584374378916744
Energy: 0.5284901704208651
Energy: 0.49006809602716667
Energy: 0.5074349900839115
Energy: 0.8606280062300201
Energy: 0.5025990439929126
Energy: 0.4886537649193697
Energy: 0.5856352908989019
Energy: 0.534906359984407
Energy: 0.5387589987526458
Energy: 0.8767660459820291
Energy: 0.5994792410947267
Energy: 0.6350359564591243
Energy: 0.571496957214853
Energy: 0.6164118182376986
Energy: 0.5909899724011299
Energy: 0.9455296037375466
Energy: 0.41838180430953564
Energy: 0.515463184452957
Energy: 0.6861227550821068
Energy: 0.501698955616635
Energy: 0.4394077875873144
Energy: 0.8760833670115133
Energy: 0.6433622869067434
Energy: 0.6074850997202514
Energy: 0.6117874502229445
Energy: 0.5580921266259294
Energy: 0.5857719534587045
Energy: 0.8834897933502287
Energy: 0.63751636033689
Energy: 0.6231087018286794
Energy: 0.758517364508387
Energy: 0.6305160569807073
Energy: 0.565276965632207
Energy: 0.9065346322884046
Energy: 0.608236255672687
Energy: 0.5693170872880529
Energy: 0.6102993833703109
Energy: 0.5926191648744001
Energy: 0.5659661781951406
Energy: 0.8287739578820233
Energy: 0.5764754523744855
Energy: 0.5812654187256769
Energy: 0.5423174588196398
Energy: 0.6071848820500723
Energy: 0.6175057114945917
Energy: 0.8492108019904424
Energy: 0.5470981790079861
Energy: 0.5342591859086077
Energy: 0.592142861966118
Energy: 0.5688434565329326
Energy: 0.5533432628576712
Energy: 0.9119453570583969
Energy: 0.6287278275681467
Energy: 0.628280193381628
Energy: 0.6896135033544902
Energy: 0.6107076943106386
Energy: 0.5947605454120857
Energy: 1.0122801260202419
Energy: 0.6060255058678119
Energy: 0.5376023190548321
Energy: 0.5296359675233191
Energy: 0.5836660800374736
Energy: 0.5367073162747604

minimum gb energy = 0.41838180430953564 eV
minimum distance =  2.26114173495098 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.9670754047262773
Energy: 0.8211260514286329
Energy: 0.5538624130168655
Energy: 0.4530143465860031
Energy: 0.8193145523646544
Energy: 0.5562534821383249
Energy: 0.855214951051041
Energy: 0.6524813453921317
Energy: 0.6523027510632757
Energy: 0.5138082349278242
Energy: 0.6540770746548316
Energy: 0.6686806058706577
Energy: 0.8747878775493965
Energy: 0.6291547327363756
Energy: 0.6333088415270346
Energy: 0.5907252222071917
Energy: 0.6305253781132945
Energy: 0.590097247099033
Energy: 0.7476228417469277
Energy: 0.6834685168726392
Energy: 0.6622745622009333
Energy: 0.5302555126049058
Energy: 0.682005205459249
Energy: 0.6757363109825993
Energy: 0.8846377180006849
Energy: 0.5970423930135129
Energy: 0.5848784734614014
Energy: 0.6405575966996553
Energy: 0.714377816726846
Energy: 0.7175851353564942
Energy: 0.9173126214106369
Energy: 0.5555194274999703
Energy: 0.6042648516504422
Energy: 0.6678286942802454
Energy: 0.5550759075644134
Energy: 0.74015150004795
Energy: 0.9173532883902746
Energy: 0.6294970402979063
Energy: 0.6491120166938797
Energy: 0.828323841665133
Energy: 0.5901115863390797
Energy: 0.6125544675416974
Energy: 0.8824280809908676
Energy: 0.48516414003171066
Energy: 0.48320667147138446
Energy: 0.6659456728204127
Energy: 0.5363482728560406
Energy: 0.5557994995020966
Energy: 0.8763786079205372
Energy: 0.4988793697034807
Energy: 0.5006136090651823
Energy: 0.6331965227813134
Energy: 0.5168233983132232
Energy: 0.4982387252955597
Energy: 0.8940584244410997
Energy: 0.5954603252063954
Energy: 0.6020996801898558
Energy: 0.8126331119969087
Energy: 0.5696207337151163
Energy: 0.6011409828357679
Energy: 0.9245987143489344
Energy: 0.5301399862105377
Energy: 0.5271647905725414
Energy: 0.6748998959122247
Energy: 0.5318690851094353
Energy: 0.6740611341967457
Energy: 0.8724939920508934
Energy: 0.7348388662176059
Energy: 0.7447095649695677
Energy: 0.650494370059603
Energy: 0.5914963723761777
Energy: 0.7492469440813108
Energy: 0.7768375906419018
Energy: 0.6973421130513215
Energy: 0.7257384026073519
Energy: 0.5628337763974035
Energy: 0.6660174575515981
Energy: 0.5917973101320947
Energy: 0.8853546702492735
Energy: 0.5798617824722364
Energy: 0.5806838975635784
Energy: 0.635301824973182
Energy: 0.8307187526457716
Energy: 0.7167322301656207
Energy: 0.8398483424585773
Energy: 0.6331861969759986
Energy: 0.6168796994317494
Energy: 0.5093229174944206
Energy: 0.6506665256266947
Energy: 0.5012639873989364
Energy: 0.8378858599963597
Energy: 0.5846935360291822
Energy: 0.5555478753871733
Energy: 0.5377179391672127
Energy: 0.5754334440712779
Energy: 0.4866314638217584
Energy: 0.8532989895992557
Energy: 0.665934187219938
Energy: 0.6653692322779937
Energy: 0.48714144557957184
Energy: 0.7683513754761947
Energy: 0.6650426359084011
Energy: 0.676664151952491
Energy: 0.6322509376285844
Energy: 0.6292725604637827
Energy: 0.4689127779288563
Energy: 0.6327125694563503
Energy: 0.6376393934320267
Energy: 0.7698186835093532
Energy: 0.6324907535586551
Energy: 0.6343710891899235
Energy: 0.44242981863825853
Energy: 0.6343751438826157
Energy: 0.6147479122386242
Energy: 0.8519369261081111
Energy: 0.5635104498661533
Energy: 0.5926574835685973
Energy: 0.5436475453222884
Energy: 0.5644294953715112
Energy: 0.7416476869470416
Energy: 0.9646604343156696
Energy: 0.6441640741105473
Energy: 0.6033851538469356
Energy: 0.6637207173200246
Energy: 0.6419456316079961
Energy: 0.649469048033587
Energy: 0.9145925087829734
Energy: 0.662078094653469
Energy: 0.5957543252513667
Energy: 0.6149033639508483
Energy: 0.6809634634913656
Energy: 0.6311949833595826
Energy: 0.9099763918106307
Energy: 0.5581637952640697
Energy: 0.5562304252301901
Energy: 0.6398606365626672
Energy: 0.4883454071982141
Energy: 0.5553061494168696
Energy: 0.8767239388850533
Energy: 0.5616871511342642
Energy: 0.6118403865093068
Energy: 0.6533505080140982
Energy: 0.49856319065894533
Energy: 0.652106769305442
Energy: 0.8959686094099717
Energy: 0.5892593015067646
Energy: 0.5926634447164814
Energy: 0.6531070110741172
Energy: 0.5897748888521466
Energy: 0.5911542155312607
Energy: 0.9452905092405027
Energy: 0.5290285772389225
Energy: 0.5334423110166624
Energy: 0.6852960833789107
Energy: 0.530424664071288
Energy: 0.8069314717288778
Energy: 0.8766930524051736
Energy: 0.5897008304369316
Energy: 0.5893213750401893
Energy: 0.6617866256505827
Energy: 0.5913344598331419
Energy: 0.6032455383807133
Energy: 0.7524103957127928
Energy: 0.6567655899764896
Energy: 0.7389445817046145
Energy: 0.5627971490942268
Energy: 0.6659684850045215
Energy: 0.7226074003911456
Energy: 0.8839983743649739
Energy: 0.7415202791787395
Energy: 0.58535565076989
Energy: 0.5466590436094418
Energy: 0.8262592930917203
Energy: 0.7181785558107409
Energy: 0.8269282388444016
Energy: 0.5952092138998076
Energy: 0.5409139470412023
Energy: 0.5299112875898582
Energy: 0.6636442390536117
Energy: 0.4801064494611447

minimum gb energy = 0.44242981863825853 eV
minimum distance =  2.26399306963351 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.7470560454473919
Energy: 0.7887228270449858
Energy: 0.7168329468655568
Energy: 0.6845012531067374
Energy: 0.7928874941188896
Energy: 0.6137478704422018
Energy: 0.826873253159853
Energy: 0.5219394411385588
Energy: 0.46702827006343345
Energy: 0.4394488925661293
Energy: 0.5226696926238734
Energy: 0.5054211246158776
Energy: 0.7799272359715144
Energy: 0.4754653882355296
Energy: 0.48065017209099714
Energy: 0.5090828980984816
Energy: 0.5340294718054881
Energy: 0.47852184786070195
Energy: 0.7794853217552885
Energy: 0.5925098994501433
Energy: 0.5078637289734016
Energy: 0.5080739768840052
Energy: 0.6738050930967252
Energy: 0.5096155829969484
Energy: 0.8684822542735996
Energy: 0.3618234616964645
Energy: 0.4383698431014611
Energy: 0.4444054368128156
Energy: 0.40342197816174324
Energy: 0.440426107441204
Energy: 0.7937652223501278
Energy: 0.515228072363691
Energy: 0.4854645868277227
Energy: 0.5738758392601304
Energy: 0.6009183502663151
Energy: 0.3954109064806455
Energy: 0.7322917394975507
Energy: 0.48605168491367906
Energy: 0.49253200069672426
Energy: 0.5245553115926443
Energy: 0.48657450444481976
Energy: 0.49642374809688383
Energy: 0.7428965609047811
Energy: 0.6069200077781094
Energy: 0.6216520694185278
Energy: 0.7083837017323473
Energy: 0.6086125815500482
Energy: 0.5756009522233836
Energy: 0.7698584798513339
Energy: 0.47752675047373994
Energy: 0.49462258960918526
Energy: 0.5237325333985215
Energy: 0.4633419865498755
Energy: 0.5136615308107506
Energy: 0.7444250158906629
Energy: 0.5586594187794954
Energy: 0.4778615768568525
Energy: 0.4511280911258676
Energy: 0.5360643057302901
Energy: 0.47996453818275336
Energy: 0.7806407443204597
Energy: 0.5712734707705884
Energy: 0.5776659033411289
Energy: 0.6015995875555513
Energy: 0.5272288316535323
Energy: 0.582293129924631
Energy: 0.8948991509299004
Energy: 0.5222791809318499
Energy: 0.46339354621150747
Energy: 0.5865980595122006
Energy: 0.5241455843017054
Energy: 0.5056359281196666

minimum gb energy = 0.3618234616964645 eV
minimum distance =  2.28690484539223 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 0.8313168663734015
Energy: 0.5741965815155357
Energy: 0.6207343318936321
Energy: 0.6898435212748211
Energy: 0.48853377337744885
Energy: 0.6170796778553855
Energy: 0.7949917804261417
Energy: 0.4959864892812583
Energy: 0.5303601271305679
Energy: 0.38196923865722054
Energy: 0.4548748957471065
Energy: 0.4824300896963279
Energy: 0.9386549632423961
Energy: 0.40906910243787287
Energy: 0.4871059124576992
Energy: 0.42298211525653834
Energy: 0.40941356594720246
Energy: 0.48260760159505917
Energy: 0.8807345256571022
Energy: 0.572153621952239
Energy: 0.4455457499771808
Energy: 0.43250397752127206
Energy: 0.6031874586319333
Energy: 0.39288801858923467
Energy: 0.782059244638248
Energy: 0.41472954580435656
Energy: 0.4479898588185804
Energy: 0.4621300376350578
Energy: 0.4204907626040654
Energy: 0.480310977176968
Energy: 0.6193277119847408
Energy: 0.5276353525094415
Energy: 0.46514034136620946
Energy: 0.5424595307877927
Energy: 0.5218198494769323
Energy: 0.55405628499178
Energy: 0.6157913447450892
Energy: 0.497416403903001
Energy: 0.5004606075189943
Energy: 0.5682046383304269
Energy: 0.41172602763819616
Energy: 0.4462938856417307
Energy: 0.6903300260598823
Energy: 0.4501994251140721
Energy: 0.45212176581523883
Energy: 0.6108556739982526
Energy: 0.4507478458572552
Energy: 0.5825729510574809
Energy: 0.8216857041578086
Energy: 0.4385068267946195
Energy: 0.44206164395401515
Energy: 0.4690337031862516
Energy: 0.42954469294773
Energy: 0.44122202100983876
Energy: 0.9693460620251978
Energy: 0.5784322716940211
Energy: 0.5819206308962075
Energy: 0.46362059182487236
Energy: 0.6316689901141262
Energy: 0.46510286514190824
Energy: 0.9133750159155298
Energy: 0.42173446382814683
Energy: 0.45009292265432627
Energy: 0.3913113704127172
Energy: 0.3843697680282923
Energy: 0.4901210313337309
Energy: 0.624860300351212
Energy: 0.4596878429482086
Energy: 0.4416388784753302
Energy: 0.4710292608146359
Energy: 0.4220275165181402
Energy: 0.4714494527941278
Energy: 0.8945950737813221
Energy: 0.5742949614781439
Energy: 0.40746187909126835
Energy: 0.5682043414691774
Energy: 0.5215184421030332
Energy: 0.5595590402583858
Energy: 0.8333458940518582
Energy: 0.45471696563792097
Energy: 0.45260151789651537
Energy: 0.4477997773596805
Energy: 0.41324221313109455
Energy: 0.4534803836773006
Energy: 0.717556877276724
Energy: 0.4701338522091748
Energy: 0.42928048790689877
Energy: 0.552629163123743
Energy: 0.4534205133947524
Energy: 0.3615678064788946
Energy: 0.7199890138663383
Energy: 0.4548196642473314
Energy: 0.4616386408587485
Energy: 0.4534833145131572
Energy: 0.42300134927417055
Energy: 0.5045379340494497
Energy: 0.691347541353128
Energy: 0.4183847001365779
Energy: 0.41953163949839023
Energy: 0.4729271449385095
Energy: 0.39601860226641067
Energy: 0.3853420184882405
Energy: 0.7751637918726121
Energy: 0.49388718752207533
Energy: 0.49815242871221205
Energy: 0.6123553678447712
Energy: 0.37418448373639385
Energy: 0.4717070167455969
Energy: 0.7266298677234798
Energy: 0.4814163076815984
Energy: 0.5047773904456575
Energy: 0.4637228606438043
Energy: 0.41877799410891203
Energy: 0.55752542322879
Energy: 0.8115609548768689
Energy: 0.5484605449689398
Energy: 0.5438084376937153
Energy: 0.5089489019872263
Energy: 0.5494578470050795
Energy: 0.41390415653679374
Energy: 0.7942313820992851
Energy: 0.49682590539342136
Energy: 0.5292873469709727
Energy: 0.4597924845307211
Energy: 0.45788070503291023
Energy: 0.44022016978598816
Energy: 0.9414453077472539
Energy: 0.5777635264206175
Energy: 0.4311360660569839
Energy: 0.4080259810074874
Energy: 0.5899463226248405
Energy: 0.487127936424642
Energy: 0.8437382580006229
Energy: 0.4877528091818861
Energy: 0.5176499929334125
Energy: 0.40068940480538384
Energy: 0.4697832056853971
Energy: 0.4436080593206222
Energy: 0.757319380461669
Energy: 0.5003878936562723
Energy: 0.49024406686852917
Energy: 0.43837731189047574
Energy: 0.4964515488445688
Energy: 0.4977790816643262
Energy: 0.8947094479396904
Energy: 0.4774512135018619
Energy: 0.5535175174411162
Energy: 0.47509768403427916
Energy: 0.48033522708518117
Energy: 0.5407247818434247
Energy: 0.7922899529033499
Energy: 0.4721843685608379
Energy: 0.46619574336699704
Energy: 0.47517862873751165
Energy: 0.46935508486443345
Energy: 0.46516752977158543
Energy: 0.6455474991341483
Energy: 0.5494491431509381
Energy: 0.56144261587472
Energy: 0.46948357415551234
Energy: 0.4520155219885411
Energy: 0.30924498980673704
Energy: 0.6377797646221246
Energy: 0.46841095358012663
Energy: 0.4682103463716145
Energy: 0.5257168867049986
Energy: 0.4332027061341018
Energy: 0.46949217487481254
Energy: 0.6232223533944427
Energy: 0.4443134251806988
Energy: 0.4723207503220435
Energy: 0.44269890474733564
Energy: 0.41974931993284803
Energy: 0.4505919591592284
Energy: 0.720041381569505
Energy: 0.5079536610386748
Energy: 0.4547117570739487
Energy: 0.504195455429054
Energy: 0.4647353026763006
Energy: 0.5782863509875685
Energy: 0.8072829526873718
Energy: 0.4587370862683754
Energy: 0.46823585643692245
Energy: 0.48292223574259635
Energy: 0.4254374250432207
Energy: 0.4746400379391254
Energy: 0.9717238047959729
Energy: 0.6098387485426581
Energy: 0.5772748775184628
Energy: 0.5806373522049286
Energy: 0.590811547494827
Energy: 0.5375402536831893
Energy: 0.7870166352010644
Energy: 0.4749498478318759
Energy: 0.4512505057363732
Energy: 0.4810821483479176
Energy: 0.4994439876570989
Energy: 0.46412254428498495
Energy: 0.9391373037044142
Energy: 0.4444681264302641
Energy: 0.434556890393188
Energy: 0.41228132105626
Energy: 0.6219188460171061
Energy: 0.4210865274646128
Energy: 0.9027472429968283
Energy: 0.4706911417368293
Energy: 0.46099306340299173
Energy: 0.4284504416434342
Energy: 0.44730688911745314
Energy: 0.4403966051395012
Energy: 0.8515849135570001
Energy: 0.48257040385172134
Energy: 0.43774001301273535
Energy: 0.6134061209808571
Energy: 0.40129170992932206
Energy: 0.46566474246609
Energy: 0.72215576002715
Energy: 0.439245222381414
Energy: 0.44720870306821836
Energy: 0.43339433288499346
Energy: 0.4263142864110956
Energy: 0.4876912558078372
Energy: 0.7020277070966086
Energy: 0.517631677367548
Energy: 0.4455007018273484
Energy: 0.48568437204006565
Energy: 0.48997112715891905
Energy: 0.4611341686281174
Energy: 0.5564077881735802
Energy: 0.5988239727323379
Energy: 0.5141270184905669
Energy: 0.46837838396767445
Energy: 0.5260772976672009
Energy: 0.5403237587660604
Energy: 0.7437669057609065
Energy: 0.5045258935537027
Energy: 0.4448348836796565
Energy: 0.46463459062854506
Energy: 0.5307833831441308
Energy: 0.46125261424300723
Energy: 0.7676277970333377
Energy: 0.48222544456424665
Energy: 0.4605794260841917
Energy: 0.5336496601823656
Energy: 0.45881378303938136
Energy: 0.46616110734675437
Energy: 0.7822344412326413
Energy: 0.5031409886840141
Energy: 0.5042617346784591
Energy: 0.45694926878465697
Energy: 0.4721199976405363
Energy: 0.48680919660222866
Energy: 0.7705610215222486
Energy: 0.493649377893472
Energy: 0.5337329475935978
Energy: 0.4964612229069347
Energy: 0.4440828311052749
Energy: 0.44563349136632474

minimum gb energy = 0.30924498980673704 eV
minimum distance =  2.28622920420205 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.48926338416202514
Energy: 0.5636906130072273
Energy: 0.29018804034773293
Energy: 0.308223639877349
Energy: 0.5646475269171128
Energy: 0.28871272627634736
Energy: 0.5440668506339451
Energy: 0.3843285919081587
Energy: 0.39014294648903797
Energy: 0.36836294545402093
Energy: 0.3333926158519067
Energy: 0.38795008783537893
Energy: 0.5453371746059231
Energy: 0.36818692996268015
Energy: 0.3304051542030836
Energy: 0.39015949265791927
Energy: 0.34630890661548164
Energy: 0.33862453015457367
Energy: 0.5453027391115893
Energy: 0.38499882056565515
Energy: 0.38126291671761114
Energy: 0.4446836248236421
Energy: 0.38982475911035747
Energy: 0.35767903360859726
Energy: 0.5487235986498524
Energy: 0.15735785644074737
Energy: 0.1578782119695272
Energy: 0.3650030985042965
Energy: 0.15901683642194994
Energy: 0.3788106315447028
Energy: 0.6320936465933329
Energy: 0.15720695541924495
Energy: 0.18110071008987452
Energy: 0.36584526910122606
Energy: 0.15744251316303115
Energy: 0.18094132882439912
Energy: 0.6695956377894288
Energy: 0.3239335161447634
Energy: 0.3598445212678172
Energy: 0.44056493523440776
Energy: 0.36190253534579825
Energy: 0.35670937097750544
Energy: 0.6960638857148969
Energy: 0.563068174809316
Energy: 0.5095003471213071
Energy: 0.5012640497029801
Energy: 0.49806842290819403
Energy: 0.40321744266862447
Energy: 0.7841011589361437
Energy: 0.49544295222004914
Energy: 0.5231353224436817
Energy: 0.44808081928072674
Energy: 0.44045637074033717
Energy: 0.5315698586827251
Energy: 0.3229969686036306
Energy: 0.5038124269038451
Energy: 0.17984104269001913
Energy: 0.15905300921302187
Energy: 0.5093624723857644
Energy: 0.17995707339524053
Energy: 0.32327264901407027
Energy: 0.41478491205763446
Energy: 0.4297739200176835
Energy: 0.15832257852005133
Energy: 0.5241655571640984
Energy: 0.18012030188544867
Energy: 0.7606797501843433
Energy: 0.40145143184108123
Energy: 0.5042147198033986
Energy: 0.5375983850478551
Energy: 0.4117968433590295
Energy: 0.5080388678700292
Energy: 0.8354761612968322
Energy: 0.49608765812737526
Energy: 0.49374927405900676
Energy: 0.5127770511020756
Energy: 0.35883827897762494
Energy: 0.4716629967431731
Energy: 0.7572080703170541
Energy: 0.3250430188073248
Energy: 0.3560573163018856
Energy: 0.40244470802217525
Energy: 0.4619328040966547
Energy: 0.4245538421560923
Energy: 0.7131176538656505
Energy: 0.1646748608458189
Energy: 0.18147930552721192
Energy: 0.389526631572556
Energy: 0.15752946830193518
Energy: 0.18196329488842755
Energy: 0.45963898258288155
Energy: 0.36732787274332546
Energy: 0.35583162714736044
Energy: 0.3547529897371392
Energy: 0.15749910999718106
Energy: 0.3563992785781536
Energy: 0.593314718406443
Energy: 0.34465605969979707
Energy: 0.32556528113236477
Energy: 0.34727691648607306
Energy: 0.3909147093385066
Energy: 0.33105563598016724
Energy: 0.5464789144350444
Energy: 0.38576507059737924
Energy: 0.35499190167143424
Energy: 0.449633487338598
Energy: 0.4173864960158999
Energy: 0.40124029646981507
Energy: 0.5764223789080655
Energy: 0.41789026010577035
Energy: 0.3441161355928331
Energy: 0.27950846080957303
Energy: 0.4291125523636885
Energy: 0.3574640137282908

minimum gb energy = 0.15720695541924495 eV
minimum distance =  2.28619912498778 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.8563735615021497
Energy: 0.5889243825991515
Energy: 0.6360235617444189
Energy: 0.5304962971643854
Energy: 0.6390974947187931
Energy: 0.6548594852588402
Energy: 0.6477825479619167
Energy: 0.4947068609780049
Energy: 0.5182105115297675
Energy: 0.4756821547280782
Energy: 0.4810312941267839
Energy: 0.5012913652995429
Energy: 0.5804225608581043
Energy: 0.508319152105456
Energy: 0.5013857921706271
Energy: 0.45957932720967554
Energy: 0.5199545518093566
Energy: 0.49573641123405116
Energy: 0.5802426564357195
Energy: 0.5640641992544558
Energy: 0.4473602373369818
Energy: 0.4829329956558558
Energy: 0.5390605124435329
Energy: 0.5079189991280646
Energy: 0.5607159298424613
Energy: 0.436129660874775
Energy: 0.46172226541509176
Energy: 0.48089402989365604
Energy: 0.4056644279562914
Energy: 0.4456528868102949
Energy: 0.6861401130956486
Energy: 0.5691851462361057
Energy: 0.5146614613096754
Energy: 0.638785001019309
Energy: 0.44697351547638736
Energy: 0.40071728092517805
Energy: 0.709821935837352
Energy: 0.47663523822434817
Energy: 0.4725718084796199
Energy: 0.49267889870330356
Energy: 0.5039956133268226
Energy: 0.49390359092588376
Energy: 0.6189624842265504
Energy: 0.5136323390556664
Energy: 0.5184396778779685
Energy: 0.49067191102162444
Energy: 0.5295869172557948
Energy: 0.5194229864142987
Energy: 0.7115117453571808
Energy: 0.4884710942839457
Energy: 0.5041714321386531
Energy: 0.5102474097293113
Energy: 0.5176962176269292
Energy: 0.5033919596944039
Energy: 0.774732522609619
Energy: 0.49839632823245966
Energy: 0.47944108486458525
Energy: 0.5707930016006775
Energy: 0.5393133001359061
Energy: 0.4562111965813958
Energy: 0.7814511167217119
Energy: 0.4476531000683075
Energy: 0.5008072644530316
Energy: 0.4640368423323511
Energy: 0.471908352996458
Energy: 0.5164935163265836
Energy: 0.7199211593052136
Energy: 0.5469476381730982
Energy: 0.5569628052788255
Energy: 0.5674258222140215
Energy: 0.5332514153405491
Energy: 0.5575532532843108
Energy: 0.6544612947938864
Energy: 0.5280773770952423
Energy: 0.5634604875333667
Energy: 0.5696990957754454
Energy: 0.5291038252679361
Energy: 0.5312260015388431
Energy: 0.6730579055808034
Energy: 0.46943755669095233
Energy: 0.5476756073596439
Energy: 0.600527425743716
Energy: 0.4451389910771751
Energy: 0.5302423333646618
Energy: 0.6452354086810289
Energy: 0.5928140654121947
Energy: 0.5717539890191125
Energy: 0.5773631264552561
Energy: 0.5507738996051608
Energy: 0.5389486702363446
Energy: 0.8720207063014307
Energy: 0.5433027485075088
Energy: 0.5498352280914705
Energy: 0.4680326632574634
Energy: 0.5328975402601592
Energy: 0.5490534190556285
Energy: 0.6844350704450758
Energy: 0.6640376082219164
Energy: 0.4074068486240812
Energy: 0.5197477138675737
Energy: 0.6721841833990082
Energy: 0.5684102591654496
Energy: 0.8880421909963843
Energy: 0.5089221978847374
Energy: 0.5007550485020883
Energy: 0.5032839729176162
Energy: 0.5438159593734714
Energy: 0.5280830431412135
Energy: 0.8173035652661347
Energy: 0.46428149354662496
Energy: 0.4618953135239753
Energy: 0.5348279255507671
Energy: 0.635972887195432
Energy: 0.46467484087410094
Energy: 0.6567239417126708
Energy: 0.5501223461931293
Energy: 0.5216043230956894
Energy: 0.48829067734984744
Energy: 0.5404379872100615
Energy: 0.5620223046033449
Energy: 0.8306639331553043
Energy: 0.48708230851270123
Energy: 0.5050981278067947
Energy: 0.44051973616983386
Energy: 0.5000469051917621
Energy: 0.5443583417216677
Energy: 0.6643627797469499
Energy: 0.6161035588903198
Energy: 0.6367846105560923
Energy: 0.6582749289378859
Energy: 0.6048142868068646
Energy: 0.721391313967849
Energy: 0.6278833598549338
Energy: 0.4411174291372252
Energy: 0.48059926273774267
Energy: 0.5959433276897877
Energy: 0.4172554630113747
Energy: 0.48035077408368315
Energy: 0.5887543926927924
Energy: 0.5373284228362125
Energy: 0.5273432892905511
Energy: 0.5210794847161107
Energy: 0.5364474217711989
Energy: 0.5178031969993082
Energy: 0.6156955950269783
Energy: 0.5151738927482021
Energy: 0.5138649147525121
Energy: 0.5184383091623636
Energy: 0.5262029415090281
Energy: 0.5461643921628442
Energy: 0.9465993817328543
Energy: 0.5059933169733843
Energy: 0.5107724479449425
Energy: 0.40046128002804865
Energy: 0.49792573365707465
Energy: 0.4387302257267457

minimum gb energy = 0.40046128002804865 eV
minimum distance =  2.26853535108663 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.8012814657774168
Energy: 0.693788663964927
Energy: 0.5868840258907491
Energy: 0.5233479480742939
Energy: 0.6948774151745801
Energy: 0.4798257551486902
Energy: 0.676196213473759
Energy: 0.5905230111751586
Energy: 0.5513490767210247
Energy: 0.4653947740921303
Energy: 0.5938870886462536
Energy: 0.508484887391967
Energy: 0.6488335193394482
Energy: 0.5463641859087605
Energy: 0.5460032378606012
Energy: 0.5646232426998978
Energy: 0.5482732060904485
Energy: 0.5435652151556915
Energy: 0.6020549795057731
Energy: 0.5335384978908085
Energy: 0.5368038411782636
Energy: 0.5826752675418222
Energy: 0.5327310110740053
Energy: 0.5427780170449423
Energy: 0.6639279036347527
Energy: 0.4761611171968969
Energy: 0.40360022109106236
Energy: 0.6538939521289903
Energy: 0.4970789867934945
Energy: 0.5308080992258452
Energy: 0.7494093537990807
Energy: 0.48818900292052747
Energy: 0.5827247995797189
Energy: 0.6255660381849901
Energy: 0.5335944030290668
Energy: 0.5341399649567811
Energy: 0.7359576641333
Energy: 0.51947663740043
Energy: 0.5423734532991831
Energy: 0.5515137141684386
Energy: 0.5223893889303747
Energy: 0.5680784336777307
Energy: 0.6315145831861856
Energy: 0.5926009273402929
Energy: 0.5990211512705156
Energy: 0.5282861802436185
Energy: 0.6007138014464706
Energy: 0.5280115409865838
Energy: 0.7736251766998665
Energy: 0.5682875817286017
Energy: 0.5569910628688425
Energy: 0.5866580048640972
Energy: 0.6083398803870184
Energy: 0.5592940630270175
Energy: 0.7168908046146346
Energy: 0.5704053761324949
Energy: 0.5184173577525737
Energy: 0.5334762501489456
Energy: 0.627039986913974
Energy: 0.5762056338536669
Energy: 0.7442693241201381
Energy: 0.4926944490732197
Energy: 0.5140872383027666
Energy: 0.4728363444974089
Energy: 0.5615612924105877
Energy: 0.584195401574968
Energy: 0.8252302451464324
Energy: 0.496864375153523
Energy: 0.4961081375306126
Energy: 0.6662077302242844
Energy: 0.4972353806468065
Energy: 0.5585886679432188
Energy: 0.6636670908804364
Energy: 0.4961820351762049
Energy: 0.502370434689993
Energy: 0.6816087086192034
Energy: 0.6527938815179389
Energy: 0.6825814688304281
Energy: 0.6641729036702378
Energy: 0.5599561592960426
Energy: 0.5897510779704468
Energy: 0.6445662939380041
Energy: 0.5608452784718956
Energy: 0.5831963691306367
Energy: 0.6302622802604608
Energy: 0.546229411899346
Energy: 0.5450759742356738
Energy: 0.6348690827357674
Energy: 0.5517092857591173
Energy: 0.5471772288125564
Energy: 0.6871239652886362
Energy: 0.5537855039486179
Energy: 0.5515246787877051
Energy: 0.5149491845438571
Energy: 0.5559923450227153
Energy: 0.550272682196834
Energy: 0.8004560071927994
Energy: 0.5906045987646508
Energy: 0.4929008477026761
Energy: 0.4851586380185115
Energy: 0.6251599055324278
Energy: 0.46348347413758056
Energy: 0.654714044178709
Energy: 0.5339844899345866
Energy: 0.47458285715048903
Energy: 0.3573384105307065
Energy: 0.5334079699665893
Energy: 0.4668844321124294
Energy: 0.6316246370076198
Energy: 0.5474656778156263
Energy: 0.5247119567555931
Energy: 0.5527570404873178
Energy: 0.5467621671020572
Energy: 0.5547463933791748
Energy: 0.6468629119347783
Energy: 0.5394957408774677
Energy: 0.5663547739971202
Energy: 0.5491297461419359
Energy: 0.5053684295332427
Energy: 0.5779705086178012
Energy: 0.6626676089537604
Energy: 0.5373586767014646
Energy: 0.584617061164595
Energy: 0.5966395776847898
Energy: 0.5380744608727663
Energy: 0.5882789415428682
Energy: 0.7123607772130545
Energy: 0.5094834285226918
Energy: 0.5464431934594365
Energy: 0.5935040804192891
Energy: 0.4407425920452752
Energy: 0.5351497247077189
Energy: 0.7632579837288739
Energy: 0.5247045278459337
Energy: 0.5862360367534115
Energy: 0.576054160100078
Energy: 0.525045960023918
Energy: 0.5853687022379898
Energy: 0.6313797395440764
Energy: 0.550483875247628
Energy: 0.5562716001444267
Energy: 0.5389658820501447
Energy: 0.6459957070783688
Energy: 0.5288548419780044
Energy: 0.7685535682105412
Energy: 0.5814512816317032
Energy: 0.5278904421749555
Energy: 0.5890576352137559
Energy: 0.6095732242962434
Energy: 0.5718778088346221
Energy: 0.7494410698393714
Energy: 0.5405095099563584
Energy: 0.49910253291629053
Energy: 0.45090458610690176
Energy: 0.5658230406030498
Energy: 0.5845029402466718
Energy: 0.7169233532591669
Energy: 0.5688116584996697
Energy: 0.6421368027156684
Energy: 0.5021053422861274
Energy: 0.6530286068194496
Energy: 0.5760395082109581
Energy: 0.7690710444196613
Energy: 0.526546127815014
Energy: 0.5569967546820221
Energy: 0.5694826160221526
Energy: 0.5192463632893529
Energy: 0.5889044490567767
Energy: 0.6453272801709027
Energy: 0.48861475197651943
Energy: 0.5487994868957025
Energy: 0.6470067918835374
Energy: 0.4831657166963027
Energy: 0.5126936941277525
Energy: 0.6748040483962531
Energy: 0.5617201797085799
Energy: 0.5581912133193593
Energy: 0.6589638453668005
Energy: 0.5633869353777716
Energy: 0.5882868686577305
Energy: 0.6284854377303922
Energy: 0.5707004169273604
Energy: 0.6095878066404141
Energy: 0.6304608645060429
Energy: 0.5933547250713843
Energy: 0.6048989084879166
Energy: 0.6371608612340514
Energy: 0.5326834814657763
Energy: 0.5423861840049181
Energy: 0.5551541768294409
Energy: 0.5116462413874894
Energy: 0.5527065386646668
Energy: 0.8333555436011777
Energy: 0.5003916351300466
Energy: 0.45454888716412634
Energy: 0.48268043758243034
Energy: 0.5251471262935113
Energy: 0.5601140160206318

minimum gb energy = 0.3573384105307065 eV
minimum distance =  2.27226981169092 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.6039638790573743
Energy: 0.5134404165472456
Energy: 0.6053596125774151
Energy: 0.578487000979189
Energy: 0.8750476015861652
Energy: 0.6052741808042507
Energy: 0.6225072773296871
Energy: 0.5708278987820957
Energy: 0.5795820347077177
Energy: 0.5471056749096478
Energy: 0.5893045962767909
Energy: 0.501617349845869
Energy: 0.6111400324944991
Energy: 0.49700355518213135
Energy: 0.5003458256908706
Energy: 0.5789992844371349
Energy: 0.5801396529111332
Energy: 0.5141657789315152
Energy: 0.6400285797860809
Energy: 0.5586448251749423
Energy: 0.5345500412773286
Energy: 0.584962317188184
Energy: 0.5621118936570827
Energy: 0.557644077299875
Energy: 0.6227825384412904
Energy: 0.49295220712288784
Energy: 0.5024154233473045
Energy: 0.5769754150867243
Energy: 0.4927717762345452
Energy: 0.5075135889480031
Energy: 0.6346827495360988
Energy: 0.5496166937449333
Energy: 0.5461227860092619
Energy: 0.4615872222837993
Energy: 0.5339061705727008
Energy: 0.5448534018410269
Energy: 0.570785756874909
Energy: 0.5576234355239662
Energy: 0.49554837472251123
Energy: 0.6105250329427305
Energy: 0.5677476737421416
Energy: 0.5094746032877773
Energy: 0.6244912441207888
Energy: 0.6082158531747901
Energy: 0.5008997758566006
Energy: 0.39872798851211694
Energy: 0.606370267405784
Energy: 0.48986489937256034
Energy: 0.5696983813817598
Energy: 0.5601258082093326
Energy: 0.5597888315796549
Energy: 0.6113712143558844
Energy: 0.6392685682310082
Energy: 0.5076739717967237
Energy: 0.7179292284450559
Energy: 0.5980620412648944
Energy: 0.6104356040318495
Energy: 0.511011157087683
Energy: 0.5987068521115646
Energy: 0.48682536986002345
Energy: 0.573664799998134
Energy: 0.5907693451145565
Energy: 0.5130049854517847
Energy: 0.5221146757228141
Energy: 0.590182352430589
Energy: 0.5242365308346425
Energy: 0.5700714678830315
Energy: 0.5204295498418047
Energy: 0.5267776919768924
Energy: 0.5374106048032008
Energy: 0.5071854619623825
Energy: 0.515189189738689
Energy: 0.521501122447096
Energy: 0.508262853940319
Energy: 0.47956816476798014
Energy: 0.521927821641415
Energy: 0.5053987496780188
Energy: 0.521297175460332
Energy: 0.6093441661210729
Energy: 0.5476225854685975
Energy: 0.51428127068141
Energy: 0.5770742143185796
Energy: 0.5369415053088575
Energy: 0.5092621966169987
Energy: 0.5605897468238666
Energy: 0.5913119859257586
Energy: 0.5678847261055192
Energy: 0.5954628660773903
Energy: 0.5905309102501811
Energy: 0.5474328664601494
Energy: 0.6009783871551065
Energy: 0.504319439814776
Energy: 0.5039302620977194
Energy: 0.5688837441072871
Energy: 0.6058534349964564
Energy: 0.5470468643185455
Energy: 0.787275845403548
Energy: 0.4618010873811908
Energy: 0.38250886378809473
Energy: 0.5883143708066475
Energy: 0.46630302255448686
Energy: 0.5257323941009273
Energy: 0.640063773410203
Energy: 0.5262067773801925
Energy: 0.5408686951199094
Energy: 0.4813560434988482
Energy: 0.6092396480265403
Energy: 0.5353996853077007
Energy: 0.6484612236878022
Energy: 0.4308545193449625
Energy: 0.4330332638808734
Energy: 0.5630004628361421
Energy: 0.4313222858578256
Energy: 0.5474905247800629
Energy: 0.6676675101883014
Energy: 0.3552590653986111
Energy: 0.43110445498755623
Energy: 0.6557359221866191
Energy: 0.4894934832693885
Energy: 0.5044980893644395
Energy: 0.5324348072642724
Energy: 0.5441524039418684
Energy: 0.5050673732864541
Energy: 0.5592012792364439
Energy: 0.5225644712309504
Energy: 0.5214031130176104
Energy: 0.5992576481396853
Energy: 0.5249266534939018
Energy: 0.6321035755905728
Energy: 0.6699785539803415
Energy: 0.5860227329867547
Energy: 0.6316659635549062
Energy: 0.6228428898255524
Energy: 0.6096647256226123
Energy: 0.5699678312418973
Energy: 0.5659815546392291
Energy: 0.5770144263362985
Energy: 0.5024985999193111
Energy: 0.606711802367479
Energy: 0.6901711523195888
Energy: 0.6598807931408227
Energy: 0.8171373797757395
Energy: 0.5777229729607635
Energy: 0.6637023057503035
Energy: 0.566779277667775
Energy: 0.6005791394056369
Energy: 0.5885730714475798
Energy: 0.5599710682947379
Energy: 0.5859734363191759
Energy: 0.5090933140082347
Energy: 0.6372088542991201
Energy: 0.5483308547534544
Energy: 0.49628211054034427
Energy: 0.5357250589525421
Energy: 0.582245204912174
Energy: 0.4982514705805231
Energy: 0.6121437239495511
Energy: 0.5590910764875332
Energy: 0.5637806291139417
Energy: 0.5758914626373212
Energy: 0.5636248608035097
Energy: 0.532813835513359
Energy: 0.6216713209260185
Energy: 0.5488520104041008
Energy: 0.5495463681577804
Energy: 0.6328826122729228
Energy: 0.5054080734147636
Energy: 0.5505059645690241
Energy: 0.5992986716084459
Energy: 0.6165391073442013
Energy: 0.6146958482664702
Energy: 0.5147233429432754
Energy: 0.6173744345814266
Energy: 0.5413578707770204
Energy: 0.5697390707249188
Energy: 0.5565840970321403
Energy: 0.5057645761822623
Energy: 0.5780903089084584
Energy: 0.6121775308861488
Energy: 0.5078012367318513
Energy: 0.6242740925032046
Energy: 0.669011951786489
Energy: 0.40521165720486374
Energy: 0.39926714979255684
Energy: 0.5209525019877294
Energy: 0.4979133925437538
Energy: 0.5698094735485727
Energy: 0.6244379357834022
Energy: 0.5192288360871573
Energy: 0.6402872487372484
Energy: 0.6245516626426748
Energy: 0.5417753038697073
Energy: 0.5964024800425762
Energy: 0.5444271979993811
Energy: 0.5400644287432245
Energy: 0.5116224936102388
Energy: 0.5460115831166463
Energy: 0.5847446517511687
Energy: 0.5824337927106051
Energy: 0.48723992305751135
Energy: 0.546969614737727
Energy: 0.47736188950652314
Energy: 0.48967881767410104
Energy: 0.509746685922669
Energy: 0.567757203125705
Energy: 0.5368773649680435
Energy: 0.5435098152422805
Energy: 0.5733432255820405
Energy: 0.4622286050328594
Energy: 0.5081155225612242
Energy: 0.5950671054610399
Energy: 0.38269460073357003
Energy: 0.69158113855929
Energy: 0.5196796923939169
Energy: 0.4786319591099615
Energy: 0.600736047184725
Energy: 0.6058604512610443
Energy: 0.5159432283131209
Energy: 0.5083966300299024
Energy: 0.5740857909527703
Energy: 0.5406303946321561
Energy: 0.5124647651024317
Energy: 0.5557817892046832
Energy: 0.5742709876870434
Energy: 0.5735439280549047
Energy: 0.5585587815320566
Energy: 0.5926896932203215
Energy: 0.5408177771805982
Energy: 0.6030987830063329
Energy: 0.5050686588039462
Energy: 0.5073047213534668
Energy: 0.5354298665319306
Energy: 0.5144803960595967
Energy: 0.5377769734828025
Energy: 0.6866817038267901
Energy: 0.575514162328849
Energy: 0.5759778423595241
Energy: 0.42306426728580293
Energy: 0.4622900996506053
Energy: 0.5237331611682273
Energy: 0.6337570491120156
Energy: 0.5108307937213528
Energy: 0.5252724705314958
Energy: 0.48176695859684177
Energy: 0.6157514212733406
Energy: 0.5122096926535166
Energy: 0.6101158461347886
Energy: 0.3565020495103288
Energy: 0.35551243126880044
Energy: 0.5642725556055527
Energy: 0.4747333285135721
Energy: 0.53595840970502
Energy: 0.5484738696580855
Energy: 0.4867238850048865
Energy: 0.4316889455106819
Energy: 0.548590340365007
Energy: 0.49186850044739744
Energy: 0.4313379570226351
Energy: 0.5582892638298982
Energy: 0.523480394798411
Energy: 0.54526263646542
Energy: 0.5522363540257725
Energy: 0.5480975566021973
Energy: 0.5040254487060825
Energy: 0.5990938390307176
Energy: 0.597528196726087
Energy: 0.5852467919322871
Energy: 0.5975402207213941
Energy: 0.5194724485602946
Energy: 0.601042971725918
Energy: 0.6216999277406158
Energy: 0.5563959183272316
Energy: 0.6067926210226476
Energy: 0.5646747171900314
Energy: 0.5629662424281854
Energy: 0.502701592512384
Energy: 0.6790440922704164
Energy: 0.6306981009053685
Energy: 0.5993015190815676
Energy: 0.4714965787586547
Energy: 0.6834191474198317
Energy: 0.5825994979761533

minimum gb energy = 0.3552590653986111 eV
minimum distance =  2.23616141771921 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.8783689536082199
Energy: 0.8138810711121619
Energy: 0.280362040621342
Energy: 0.2847719387405612
Energy: 0.7589600226656514
Energy: 0.27953035536310006
Energy: 0.5123485500096504
Energy: 0.49962662656565276
Energy: 0.5032678757817052
Energy: 0.5251267022808285
Energy: 0.5145674608091573
Energy: 0.6000521778307198
Energy: 0.6370150927932297
Energy: 0.28311639281155915
Energy: 0.41506691234890203
Energy: 0.482601392808987
Energy: 0.28193210592970425
Energy: 0.46120432149936363
Energy: 0.5174650107826164
Energy: 0.40152051354396495
Energy: 0.4412459899695112
Energy: 0.5276227170838418
Energy: 0.3979705580781233
Energy: 0.5247489393516139
Energy: 0.5079295607937062
Energy: 0.4415660423743926
Energy: 0.44968523039414554
Energy: 0.5173623615880916
Energy: 0.3987426784788779
Energy: 0.4490666583963481
Energy: 0.5406741143065037
Energy: 0.38118622499305976
Energy: 0.4491477937922494
Energy: 0.45360195044125545
Energy: 0.3818756228823842
Energy: 0.4390956500047508
Energy: 0.43065689334816676
Energy: 0.3754521250587318
Energy: 0.3986992663241487
Energy: 0.38554344734072155
Energy: 0.3830572026986541
Energy: 0.5229002917837838

minimum gb energy = 0.27953035536310006 eV
minimum distance =  2.29257442712622 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 0.8300111245305904
Energy: 0.5725796237747139
Energy: 0.5088744742649546
Energy: 0.43944401594049165
Energy: 0.6327385948664033
Energy: 0.543120022695729
Energy: 0.5391307853933451
Energy: 0.5289378256475895
Energy: 0.5222109263067759
Energy: 0.5042931433088115
Energy: 0.5042767009709155
Energy: 0.5260179292795791
Energy: 0.5094685639347009
Energy: 0.5026058169782504
Energy: 0.48341510039921093
Energy: 0.4533752264676355
Energy: 0.4979867948314629
Energy: 0.4673178227952162
Energy: 0.5516652466627662
Energy: 0.4935630884443107
Energy: 0.47235562338274956
Energy: 0.5543229872260146
Energy: 0.4680426417622566
Energy: 0.4671399641263885
Energy: 0.5619672408206563
Energy: 0.4807174824416146
Energy: 0.4790992051064695
Energy: 0.5455577450517048
Energy: 0.4665499166143846
Energy: 0.48024079830009103
Energy: 0.544875924446495
Energy: 0.48219058036801865
Energy: 0.48748178834599887
Energy: 0.48478629575040216
Energy: 0.4635157671762905
Energy: 0.4900556100861289
Energy: 0.5443596098079292
Energy: 0.48744986738699975
Energy: 0.4983767008880424
Energy: 0.48227867630237886
Energy: 0.5287726264276589
Energy: 0.4830848540652957
Energy: 0.6225094656353984
Energy: 0.5189339327156839
Energy: 0.4466002458299123
Energy: 0.505639510600297
Energy: 0.542617649760708
Energy: 0.49352407165130574
Energy: 0.5374581205655263
Energy: 0.5498573853622107
Energy: 0.5399755060197136
Energy: 0.49577348827896317
Energy: 0.5353725182428429
Energy: 0.5289491638936835
Energy: 0.5363092121544951
Energy: 0.4841686926025029
Energy: 0.4532202112523544
Energy: 0.5163186020290238
Energy: 0.48115256144535445
Energy: 0.4924822610265604
Energy: 0.6097213463169651
Energy: 0.4841132479591177
Energy: 0.47676398094355327
Energy: 0.5915123590351403
Energy: 0.4814651695896643
Energy: 0.5001918883754876
Energy: 0.5864536456836749
Energy: 0.5001735471622208
Energy: 0.5011618373512051
Energy: 0.4586315843251297
Energy: 0.48456409005760065
Energy: 0.4755068605829898
Energy: 0.6362559061841383
Energy: 0.5034861914488385
Energy: 0.48562864236274733
Energy: 0.45079605194962163
Energy: 0.5018521788421281
Energy: 0.4963106627861106
Energy: 0.5961154809264412
Energy: 0.5491377342668292
Energy: 0.5199887177398593
Energy: 0.49405717690438233
Energy: 0.5627102502524586
Energy: 0.47397222145422063
Energy: 0.5825617603360912
Energy: 0.45801957009568345
Energy: 0.44725688787531953
Energy: 0.4696510854103798
Energy: 0.43030344491055406
Energy: 0.49375024974440707
Energy: 0.6008612501883751
Energy: 0.5066948515628421
Energy: 0.5195193197090225
Energy: 0.5113858390835762
Energy: 0.507096292432085
Energy: 0.5350563776594848
Energy: 0.5909396689190346
Energy: 0.4937128089029148
Energy: 0.4646148076823659
Energy: 0.5587619808913967
Energy: 0.4793292532787676
Energy: 0.5354186826948149
Energy: 0.607273262573184
Energy: 0.48375958361000887
Energy: 0.5362533522323233
Energy: 0.5693321731870709
Energy: 0.49390474444710314
Energy: 0.5611591832540439
Energy: 0.5917877071740607
Energy: 0.4380414746227325
Energy: 0.46458496181345765
Energy: 0.5174396434342745
Energy: 0.4376198255291855
Energy: 0.5005742057548072
Energy: 0.6167235233702029
Energy: 0.5375880023789605
Energy: 0.5230002704221803
Energy: 0.4992442436296598
Energy: 0.5397761876665655
Energy: 0.4958887487792476
Energy: 0.589204278743378
Energy: 0.5171284323225394
Energy: 0.47580376472704267
Energy: 0.49395973806969196
Energy: 0.5484600770421247
Energy: 0.48050701660446826
Energy: 0.6184529046060036
Energy: 0.5099599891964873
Energy: 0.4832012152770915
Energy: 0.5788383995312127
Energy: 0.5444006552131265
Energy: 0.5419306922650685
Energy: 0.5677344047179325
Energy: 0.46082077404884475
Energy: 0.47681948883218545
Energy: 0.5456370673571518
Energy: 0.45930801651103803
Energy: 0.47876121834066354
Energy: 0.556452638427467
Energy: 0.4531081490480894
Energy: 0.42806148518362963
Energy: 0.5135591209034425
Energy: 0.4684613375015324
Energy: 0.5304143548589296
Energy: 0.5226059597994462
Energy: 0.5386785510572636
Energy: 0.5429138880720603
Energy: 0.47276596024664647
Energy: 0.5353354434173822
Energy: 0.4846909805432222
Energy: 0.6255265703725829
Energy: 0.5724291728921426
Energy: 0.5709876200479397
Energy: 0.47320773047571757
Energy: 0.518838302088381
Energy: 0.5161239435673894
Energy: 0.6086697068817761
Energy: 0.5065495921945541
Energy: 0.5272956090995807
Energy: 0.4984024630307764
Energy: 0.5110298599775834
Energy: 0.4791223977600545
Energy: 0.5203477518795567
Energy: 0.5079512416906456
Energy: 0.4878352164103246
Energy: 0.479027331690313
Energy: 0.4837615604451968
Energy: 0.4841222251972773
Energy: 0.5218358351698832
Energy: 0.5011205110173753
Energy: 0.4778494790003341
Energy: 0.5174359218395749
Energy: 0.4962481845662799
Energy: 0.5215775634566016
Energy: 0.5472419103330762
Energy: 0.49986027308227915
Energy: 0.526305436341929
Energy: 0.5372198639390516
Energy: 0.4968244208037323
Energy: 0.48947009939169417
Energy: 0.5527678965333023
Energy: 0.5060464819053838
Energy: 0.49314093068718456
Energy: 0.5398272702458345
Energy: 0.5414164706342134
Energy: 0.56307069707621
Energy: 0.5316734913408034
Energy: 0.4809333438130528
Energy: 0.49129552366650653
Energy: 0.486119209320018
Energy: 0.4693112371951306
Energy: 0.48204486883636904
Energy: 0.6855792637229406
Energy: 0.5871870979331739
Energy: 0.5351793309011532
Energy: 0.49433929393954157
Energy: 0.5475504317021462
Energy: 0.4783906287211918
Energy: 0.5751399085372854
Energy: 0.530715132722618
Energy: 0.5471703663930861
Energy: 0.5053833713988206
Energy: 0.552983574219793
Energy: 0.5680523264595495
Energy: 0.5472823228857064
Energy: 0.538901812695324
Energy: 0.5086864982384123
Energy: 0.5095229885039823
Energy: 0.5469378616578342
Energy: 0.5066833294730002
Energy: 0.5705614139152897
Energy: 0.48493459317925286
Energy: 0.42631456205509183
Energy: 0.5636575109078988
Energy: 0.5357850885714736
Energy: 0.5346416699891892
Energy: 0.578586713451475
Energy: 0.4743618028897447
Energy: 0.4834454758021261
Energy: 0.5238155224290851
Energy: 0.47680415277578936
Energy: 0.4908518358051692
Energy: 0.6947278168457186
Energy: 0.5286350500021877
Energy: 0.5270361077819208
Energy: 0.4798434274068832
Energy: 0.4939941136150332
Energy: 0.4911275283706188
Energy: 0.609316056594672
Energy: 0.5559005999766289
Energy: 0.5177567352537266
Energy: 0.4858784308154318
Energy: 0.5574005551452504
Energy: 0.49458438794440857
Energy: 0.6324540887458999
Energy: 0.5029567297024619
Energy: 0.5007281473745147
Energy: 0.45639145954833543
Energy: 0.521512548377679
Energy: 0.48243070153566064
Energy: 0.5987595751444285
Energy: 0.4590508230618441
Energy: 0.5192240472138219
Energy: 0.5274998852540672
Energy: 0.47245552551503384
Energy: 0.5174294935491589
Energy: 0.631789239932367
Energy: 0.4875407891798365
Energy: 0.5373750128241493
Energy: 0.5882741049589736
Energy: 0.447066519289363
Energy: 0.5159535862701012
Energy: 0.6377348537731109
Energy: 0.501525005839888
Energy: 0.459147710905749
Energy: 0.4637862427102573
Energy: 0.5169981236355448
Energy: 0.5149772667397741
Energy: 0.5603509747066435
Energy: 0.5263586286212599
Energy: 0.5322213674740948
Energy: 0.5320596515303613
Energy: 0.5281331627659133
Energy: 0.5538871324222417
Energy: 0.7619914708043393
Energy: 0.4953095958056884
Energy: 0.4521106766263919
Energy: 0.47219356469668
Energy: 0.4956020941185496
Energy: 0.5262077453411695
Energy: 0.5766052754382498
Energy: 0.5290285070448575
Energy: 0.5073648508398416
Energy: 0.4588856547831674
Energy: 0.5614092877888183
Energy: 0.46849169245929956
Energy: 0.6299935394144724
Energy: 0.536843521675087
Energy: 0.518309109928788
Energy: 0.5221985407871125
Energy: 0.5212861947334068
Energy: 0.5507049937310082
Energy: 0.5642990006183926
Energy: 0.46577718208287866
Energy: 0.46016609220289983
Energy: 0.5559792770832538
Energy: 0.49869645715609257
Energy: 0.4559621064973298
Energy: 0.5323236233081154
Energy: 0.47191071751318375
Energy: 0.48816822990798375
Energy: 0.532476942309217
Energy: 0.4806506058085972
Energy: 0.4919577244813263
Energy: 0.5111142549379808
Energy: 0.500228602884464
Energy: 0.4355286199781174
Energy: 0.4602554195231211
Energy: 0.4604980472897644
Energy: 0.4668273815096675
Energy: 0.5367520609060829
Energy: 0.5136256895856701
Energy: 0.5032642266710788
Energy: 0.4912318707121266
Energy: 0.5534805561150983
Energy: 0.5228430127700076

minimum gb energy = 0.42631456205509183 eV
minimum distance =  2.277499239407 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.0322061249649732
Energy: 0.516790013189269
Energy: 0.4736760017790212
Energy: 0.5036908650126268
Energy: 0.4546734903777991
Energy: 0.5021235676961041
Energy: 0.5710977152832287
Energy: 0.41120351271238953
Energy: 0.4099486023454672
Energy: 0.4583705856849887
Energy: 0.5197464088981615
Energy: 0.4798092395732678
Energy: 0.5467647423754719
Energy: 0.45126557722762445
Energy: 0.4440394211792615
Energy: 0.5151579429692206
Energy: 0.4627479114299959
Energy: 0.5200769043694989
Energy: 0.5517184096369863
Energy: 0.4344852777675923
Energy: 0.5159102831960206
Energy: 0.5577189404148524
Energy: 0.4382494169510346
Energy: 0.49459604602556034
Energy: 0.6114121305770631
Energy: 0.4977956939172576
Energy: 0.5584217138983327
Energy: 0.5730714157803131
Energy: 0.49548062955096633
Energy: 0.5213067641795828
Energy: 0.6061609490131223
Energy: 0.6146357160863196
Energy: 0.5867245537416684
Energy: 0.5548828786077837
Energy: 0.522355857091229
Energy: 0.5837631543090143
Energy: 0.632991927549822
Energy: 0.5546193481323014
Energy: 0.5648134864727666
Energy: 0.6119569410493796
Energy: 0.5117754506823203
Energy: 0.5638760661104144
Energy: 0.6396141349323402
Energy: 0.5137230226838784
Energy: 0.4698441090166288
Energy: 0.40836223421455775
Energy: 0.5297739142762321
Energy: 0.3887695682817293
Energy: 0.6356811208642325
Energy: 0.48109265708026683
Energy: 0.4638631173116456
Energy: 0.6109143328194736
Energy: 0.48702455386088483
Energy: 0.5778214997295177
Energy: 0.5462954483492545
Energy: 0.444980535515418
Energy: 0.46672155715522745
Energy: 0.507461267396577
Energy: 0.5424274870278769
Energy: 0.48574361574123054
Energy: 0.5765850082991687
Energy: 0.43407350578932447
Energy: 0.44298514444056425
Energy: 0.5701674684646837
Energy: 0.4239286226960839
Energy: 0.49881346902344603
Energy: 0.6027937397398186
Energy: 0.49096016920204283
Energy: 0.48816566145200196
Energy: 0.5104360645499159
Energy: 0.5235601540166923
Energy: 0.5418049646833127
Energy: 0.5951848858194744
Energy: 0.5227304554695702
Energy: 0.5095074028506695
Energy: 0.4539541454332681
Energy: 0.520841814391688
Energy: 0.4322055931907637
Energy: 0.5925820306299536
Energy: 0.5709776615301003
Energy: 0.5026746242895214
Energy: 0.5113234045218886
Energy: 0.5688295616459416
Energy: 0.5084012340677103
Energy: 0.6292402399110294
Energy: 0.5428370438737903
Energy: 0.5393812787525175
Energy: 0.6037393904669212
Energy: 0.5377697420597451
Energy: 0.5473076498336543
Energy: 0.5606506826855452
Energy: 0.5773532589838045
Energy: 0.5692593347467988
Energy: 0.4725217889595495
Energy: 0.5765486361225951
Energy: 0.5442512277235858
Energy: 0.5528537809889199
Energy: 0.4228640102309283
Energy: 0.39780747705840946
Energy: 0.5535189040810021
Energy: 0.4208042211935255
Energy: 0.39401406069977946
Energy: 0.5442259086122649
Energy: 0.5564779605492378
Energy: 0.5204180896662242
Energy: 0.5389737841898186
Energy: 0.5251571049361815
Energy: 0.5176347168324158
Energy: 0.5283935990879128
Energy: 0.5287932848532784
Energy: 0.5229150091539253
Energy: 0.5248319902954998
Energy: 0.5230318316937086
Energy: 0.4846073057038376
Energy: 0.5483143807017242
Energy: 0.5738166505406035
Energy: 0.5060212360238326
Energy: 0.5435360550706054
Energy: 0.5695060858813873
Energy: 0.45334565288991546
Energy: 0.534779816853616
Energy: 0.46092783064422893
Energy: 0.41237258681283057
Energy: 0.4675526769304926
Energy: 0.5392308245153171
Energy: 0.40981571079589285
Energy: 0.554292856395608
Energy: 0.45303750219957617
Energy: 0.45566038898185135
Energy: 0.525887472999953
Energy: 0.599829133128461
Energy: 0.4346042724059976
Energy: 0.5652743535558142
Energy: 0.46167555241629843
Energy: 0.43078764089386523
Energy: 0.5635792412966656
Energy: 0.48523328011721817
Energy: 0.4497388218531877
Energy: 0.5981224058841661
Energy: 0.52410436756706
Energy: 0.5253656845119903
Energy: 0.57043085695173
Energy: 0.5779901791060682
Energy: 0.5763350258894286
Energy: 0.5861806023180992
Energy: 0.4945840520465101
Energy: 0.510789539042558
Energy: 0.5670578310624586
Energy: 0.49517089296017747
Energy: 0.5826830087687564
Energy: 0.6639742952073229
Energy: 0.5581709170255857
Energy: 0.5221500548403438
Energy: 0.44304594121795565
Energy: 0.5456894593435215
Energy: 0.5029052807956561
Energy: 0.5773379427558658
Energy: 0.5811055242845363
Energy: 0.5816004890075253
Energy: 0.4882844608633253
Energy: 0.546310477502821
Energy: 0.5689216656495918
Energy: 0.5665021428869289
Energy: 0.4296946361954487
Energy: 0.49826424574426853
Energy: 0.5386149485519984
Energy: 0.4245776873269304
Energy: 0.5765505801335867
Energy: 0.5835141114425167
Energy: 0.5659843866696891
Energy: 0.49244389414889134
Energy: 0.5788918442883378
Energy: 0.5368252420466277
Energy: 0.4888105126555291
Energy: 0.6003766896326478
Energy: 0.4820504269598134
Energy: 0.4798701171846416
Energy: 0.6036623115487536
Energy: 0.4825880785626607
Energy: 0.47648460606869847
Energy: 0.5998043026866436
Energy: 0.4540112782651662
Energy: 0.4381560245227358
Energy: 0.46859429598958474
Energy: 0.48145918962007644
Energy: 0.4372868975243436
Energy: 0.6425125739257287
Energy: 0.4605838030766844
Energy: 0.46907748288783124
Energy: 0.47622999251109643
Energy: 0.5622102169091766
Energy: 0.4735370652209241
Energy: 0.6087092977691392
Energy: 0.5732652209345808
Energy: 0.5682876271144734
Energy: 0.5851498991801949
Energy: 0.5781208705690787
Energy: 0.5381566825866113
Energy: 0.6110350374946109
Energy: 0.5598189911787397
Energy: 0.5961247958863186
Energy: 0.5461241021148707
Energy: 0.5607742065422298
Energy: 0.5638781038469236
Energy: 0.5652000551683383
Energy: 0.5185337838639714
Energy: 0.5983194054040288
Energy: 0.563103630741913
Energy: 0.4205047297753077
Energy: 0.5796612811827102
Energy: 0.5541729888506806
Energy: 0.3930717431664097
Energy: 0.4413613492480168
Energy: 0.5225873510266433
Energy: 0.3946618513136835
Energy: 0.6011291590570143
Energy: 0.5687887479597065
Energy: 0.4890376849747792
Energy: 0.5025335764667026
Energy: 0.47380568320442906
Energy: 0.46785425854025964
Energy: 0.45054784639165574
Energy: 0.5412979858902529
Energy: 0.47206754607970774
Energy: 0.5068956050541116
Energy: 0.49556014449695185
Energy: 0.472180784811394
Energy: 0.5071332762503843

minimum gb energy = 0.3887695682817293 eV
minimum distance =  2.2607631999515 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 0.7948823195055253
Energy: 0.5468818414184202
Energy: 0.4847401217979042
Energy: 0.41528130717819806
Energy: 0.556686633052213
Energy: 0.4162810730646871
Energy: 0.5987709012053805
Energy: 0.4996063333173149
Energy: 0.5045167958651512
Energy: 0.5950270928308516
Energy: 0.49694958780216353
Energy: 0.47828504440854064
Energy: 0.5843364256418205
Energy: 0.4642882501024923
Energy: 0.536982769638231
Energy: 0.5026294090068392
Energy: 0.4383961962648028
Energy: 0.5225956815900149
Energy: 0.5847513739821731
Energy: 0.4526819702832869
Energy: 0.4895342686522927
Energy: 0.5833139237304862
Energy: 0.4645782408901852
Energy: 0.488996054093218
Energy: 0.6027235617038171
Energy: 0.47501317931892045
Energy: 0.4661191326389148
Energy: 0.5310193283437534
Energy: 0.48320337312762657
Energy: 0.4512565407332584
Energy: 0.6036366214391323
Energy: 0.4590571301382089
Energy: 0.504203864913851
Energy: 0.48346772909892977
Energy: 0.46594306278938363
Energy: 0.4982501795034307
Energy: 0.5842823427902923
Energy: 0.4621344797212986
Energy: 0.45948996318999447
Energy: 0.4752899927487527
Energy: 0.5791373991126824
Energy: 0.4647149936349801
Energy: 0.6732143217304152
Energy: 0.50250034212057
Energy: 0.4911949973629658
Energy: 0.5004633092554485
Energy: 0.4997718161021258
Energy: 0.5318475933796868
Energy: 0.5860516881401325
Energy: 0.5689520390831455
Energy: 0.45246697715854495
Energy: 0.47236259461965074
Energy: 0.5711592727769028
Energy: 0.4654198955209885
Energy: 0.6277943345562582
Energy: 0.48737752433341497
Energy: 0.45615576767545163
Energy: 0.5216864312751246
Energy: 0.5075698876435798
Energy: 0.46971436067772515
Energy: 0.5718918813119338
Energy: 0.5131817141065259
Energy: 0.513331335936879
Energy: 0.5813513596528102
Energy: 0.4470324822545031
Energy: 0.5328796168728218
Energy: 0.6012732781995412
Energy: 0.5536764909904628
Energy: 0.5787254844686021
Energy: 0.5003999108888495
Energy: 0.5405850683476877
Energy: 0.5123624371526652
Energy: 0.5896954710428582
Energy: 0.5787193743371738
Energy: 0.5439149017649977
Energy: 0.4596247191820342
Energy: 0.5731379118580485
Energy: 0.4759213974990338
Energy: 0.5625850744799942
Energy: 0.43847334994624015
Energy: 0.43965651796354877
Energy: 0.5194164744293277
Energy: 0.4748655028345736
Energy: 0.44497724860677984
Energy: 0.5925116980043594
Energy: 0.5051960470876501
Energy: 0.5349882304522255
Energy: 0.5690155908418223
Energy: 0.5124926761615637
Energy: 0.5146978487902212
Energy: 0.5731766955922163
Energy: 0.4359080136812278
Energy: 0.4242856635557354
Energy: 0.5745665842536816
Energy: 0.4497627706868209
Energy: 0.4184820378742979
Energy: 0.5768662395421877
Energy: 0.5297287282532949
Energy: 0.5628161164398107
Energy: 0.5760770117225713
Energy: 0.4668589951801816
Energy: 0.5757064538519601
Energy: 0.5742513132238642
Energy: 0.43763147355519233
Energy: 0.42099268309037685
Energy: 0.5450940829417614
Energy: 0.42368961012507694
Energy: 0.4197797581725581
Energy: 0.5882222261195411
Energy: 0.49766148796113097
Energy: 0.5468301467414532
Energy: 0.43616515693983393
Energy: 0.5401782139122957
Energy: 0.5136273749814756
Energy: 0.5720476198388676
Energy: 0.5282952570773598
Energy: 0.5520351142262128
Energy: 0.47183951291337944
Energy: 0.5445006254739211
Energy: 0.46350551907339077
Energy: 0.5932883904397686
Energy: 0.5340334563350593
Energy: 0.5001597846058644
Energy: 0.5661163441429146
Energy: 0.4892076160299658
Energy: 0.48707844561728164
Energy: 0.5697219824909426
Energy: 0.5047756593170382
Energy: 0.4617001562213687
Energy: 0.5387445284526636
Energy: 0.49138523260569766
Energy: 0.48515660812561534
Energy: 0.6584204651106897
Energy: 0.5353167533641694
Energy: 0.4573107983335257
Energy: 0.5124301834900342
Energy: 0.5536201650012479
Energy: 0.47505500121058236
Energy: 0.6740254472329672
Energy: 0.5588371852265825
Energy: 0.511333922704331
Energy: 0.4261659964231271
Energy: 0.5545263565302164
Energy: 0.51227663956614
Energy: 0.6130871580906642
Energy: 0.5034673503491919
Energy: 0.43724802224428344
Energy: 0.4479773499311273
Energy: 0.5574636345771323
Energy: 0.41517505453846953
Energy: 0.5879925961723381
Energy: 0.44315041899276636
Energy: 0.4294466514181279
Energy: 0.4397782014459952
Energy: 0.43458539168190546
Energy: 0.4290981261489256
Energy: 0.6266463355971178
Energy: 0.5452005732855357
Energy: 0.49917007351390547
Energy: 0.44475451205846006
Energy: 0.5458295298043591
Energy: 0.45538685932835465
Energy: 0.614272593837926
Energy: 0.5010269721858686
Energy: 0.49423912060601705
Energy: 0.6236577855076155
Energy: 0.49071163644454296
Energy: 0.4957445804937198
Energy: 0.5758813900545835
Energy: 0.5079361829907688
Energy: 0.551320162323966
Energy: 0.5005897707347142
Energy: 0.48184789833763614
Energy: 0.48236165163724726
Energy: 0.5861514812669355
Energy: 0.5131590243997955
Energy: 0.4991021174522793
Energy: 0.5950491938953395
Energy: 0.524743012764856
Energy: 0.4798276823285997
Energy: 0.55929919187979
Energy: 0.5356111632816182
Energy: 0.5017139376147021
Energy: 0.5430833281194775
Energy: 0.5368864107676121
Energy: 0.4698191655322456

minimum gb energy = 0.41517505453846953 eV
minimum distance =  2.28359897916293 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 0.6347442626729325
Energy: 0.44709952604927844
Energy: 0.4455229542551023
Energy: 0.549118239360549
Energy: 0.4490767069344555
Energy: 0.4485430906928298
Energy: 0.5736001101945675
Energy: 0.48094718366474304
Energy: 0.48569377661259616
Energy: 0.5679630713508511
Energy: 0.533344385230111
Energy: 0.43836959853874524
Energy: 0.6140553596256985
Energy: 0.441622305414337
Energy: 0.4479657795269101
Energy: 0.6270095596122311
Energy: 0.4120043696844229
Energy: 0.4434427592303016
Energy: 0.5601729437639984
Energy: 0.4088603611714525
Energy: 0.40999315025497324
Energy: 0.5624026810815211
Energy: 0.4089943219018074
Energy: 0.45542983850107904
Energy: 0.5897425639990952
Energy: 0.434580204862621
Energy: 0.43179678382306436
Energy: 0.5288348972663127
Energy: 0.4799133681418125
Energy: 0.43489357298163195
Energy: 0.6161552538149649
Energy: 0.5008767523075928
Energy: 0.4858936458447486
Energy: 0.5561500827805865
Energy: 0.5775881052563044
Energy: 0.5121358458697878
Energy: 0.559421271230475
Energy: 0.5268801753422881
Energy: 0.45317629927174585
Energy: 0.46413297055479863
Energy: 0.5158427679213943
Energy: 0.4307965426580208
Energy: 0.6097912989438579
Energy: 0.5014794430221812
Energy: 0.5021150224418448
Energy: 0.5369253062864837
Energy: 0.48113726679842955
Energy: 0.5378363444600067
Energy: 0.5742799352676534
Energy: 0.43618738444757665
Energy: 0.438123588272322
Energy: 0.5671411440200164
Energy: 0.5587093106396018
Energy: 0.43584015861318753
Energy: 0.5457982032669844
Energy: 0.41314011900081465
Energy: 0.38207065240198423
Energy: 0.5470252870567499
Energy: 0.4123862422158731
Energy: 0.41395880589135914
Energy: 0.5432078824185846
Energy: 0.39264981402691884
Energy: 0.4809976713454409
Energy: 0.5419580004572896
Energy: 0.40316150489533514
Energy: 0.49265040967289114
Energy: 0.43887185627469166
Energy: 0.586543153463931
Energy: 0.5000370573193754
Energy: 0.4000261511297627
Energy: 0.5917931199620055
Energy: 0.4516601682812861
Energy: 0.44301469548653266
Energy: 0.5211869581498391
Energy: 0.5016851503507082
Energy: 0.448266665540805
Energy: 0.5644094451880182
Energy: 0.5528478488601403
Energy: 0.5479252273716938
Energy: 0.45774676969942424
Energy: 0.4387183360154648
Energy: 0.5826584173143534
Energy: 0.5048655421535854
Energy: 0.4390025908916007
Energy: 0.5958185267323038
Energy: 0.46685962956912996
Energy: 0.4750090975070165
Energy: 0.6360548349238544
Energy: 0.44400608880578407
Energy: 0.481193068986697
Energy: 0.5479969373432438
Energy: 0.43080404534611083
Energy: 0.4325689751181378
Energy: 0.5569399733960392
Energy: 0.4554833210181304
Energy: 0.4325939827055858
Energy: 0.659392184251033
Energy: 0.5718168657175402
Energy: 0.49792907699013217
Energy: 0.5595953476627917
Energy: 0.5524879957841958
Energy: 0.44992292512930654
Energy: 0.6580954519093248
Energy: 0.5207156918788347
Energy: 0.42467994514875934
Energy: 0.42558757918424467
Energy: 0.532472374134686
Energy: 0.4621711792401015
Energy: 0.6288503205833224
Energy: 0.5276554568446343
Energy: 0.5216530859889564
Energy: 0.44062278876363115
Energy: 0.5552709436756361
Energy: 0.45731408453623434
Energy: 0.6255073974786293
Energy: 0.5840185637297952
Energy: 0.5348494107698589
Energy: 0.4368751701332922
Energy: 0.5820531843962415
Energy: 0.5331441449498785
Energy: 0.5328474810143865
Energy: 0.4409987199756804
Energy: 0.49770391611369197
Energy: 0.5347077084757685
Energy: 0.5389128961399846
Energy: 0.4806202806722735
Energy: 0.4826280772712259
Energy: 0.43340779712438005
Energy: 0.4383087767073591
Energy: 0.5183202113634079
Energy: 0.4333881970175258
Energy: 0.3897394050051975
Energy: 0.603599186257772
Energy: 0.4750112431162649
Energy: 0.43992099426203607
Energy: 0.5816429363866663
Energy: 0.5573336490345682
Energy: 0.4994508045088329
Energy: 0.4341540630342049
Energy: 0.5442824125849606
Energy: 0.5014094039456822
Energy: 0.4486840904095445
Energy: 0.5583840537976898
Energy: 0.5531888082374784

minimum gb energy = 0.38207065240198423 eV
minimum distance =  2.29007243109253 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 0.46337859625207967
Energy: 0.5570680360274753
Energy: 0.6130675088154576
Energy: 0.47547161845370567
Energy: 0.6043988136026183
Energy: 0.4871397902635608
Energy: 0.6059288205683613
Energy: 0.5498207884575139
Energy: 0.5224820217883989
Energy: 0.5959986501016472
Energy: 0.5499113438073352
Energy: 0.4659035564488338
Energy: 0.54079403679261
Energy: 0.4513373679734485
Energy: 0.44967368251879997
Energy: 0.5667844997876538
Energy: 0.4515380504435759
Energy: 0.4536209669515909
Energy: 0.5061914596404493
Energy: 0.41494009361344214
Energy: 0.4184993667936226
Energy: 0.502064107180587
Energy: 0.4151895982472762
Energy: 0.47529561457937886
Energy: 0.5034060061997281
Energy: 0.5544685276760944
Energy: 0.45066889503617663
Energy: 0.5150299604282579
Energy: 0.5541632512747564
Energy: 0.44919925513855624
Energy: 0.4632361211173372
Energy: 0.5354166651102494
Energy: 0.46745711389923167
Energy: 0.45730507503020024
Energy: 0.45944457403813316
Energy: 0.47539246242576044
Energy: 0.5142744893844993
Energy: 0.46773915931511545
Energy: 0.45872994847592374
Energy: 0.44499578990764777
Energy: 0.5202219186388152
Energy: 0.43968272923920043
Energy: 0.5359668977137767
Energy: 0.4952929868068383
Energy: 0.49898670062016787
Energy: 0.4931296625604218
Energy: 0.5153045757035128
Energy: 0.4677624636101954
Energy: 0.5143819662565452
Energy: 0.4699356313469282
Energy: 0.49198967557015155
Energy: 0.5157487439718522
Energy: 0.4710998610391642
Energy: 0.45792833813430994
Energy: 0.5259080162969209
Energy: 0.4677976581037498
Energy: 0.4740061827996244
Energy: 0.5154414451415997
Energy: 0.4856830459141041
Energy: 0.4724359833523365
Energy: 0.5878808773972234
Energy: 0.4462335875909486
Energy: 0.4446582126972839
Energy: 0.544555822334139
Energy: 0.44380928829179217
Energy: 0.4377413798005834
Energy: 0.4640998681428024
Energy: 0.4561218489847425
Energy: 0.47122136820214783
Energy: 0.4099688386025284
Energy: 0.5350378932346457
Energy: 0.4725703778404155
Energy: 0.41459719500480297
Energy: 0.5558596318676496
Energy: 0.5697972639971006
Energy: 0.45585571860698
Energy: 0.4702208098715831
Energy: 0.5389678478670646
Energy: 0.47131424338444394
Energy: 0.5437339471745746
Energy: 0.4656020950093319
Energy: 0.4387032546111809
Energy: 0.5856795459035897
Energy: 0.5069882287381976
Energy: 0.5975698740467739
Energy: 0.5872023238758163
Energy: 0.6035223943615861
Energy: 0.5581319803078673
Energy: 0.569664671191914
Energy: 0.5582914088830008
Energy: 0.5472264369201142
Energy: 0.564085278280317
Energy: 0.49389403161961193
Energy: 0.5335154644848193
Energy: 0.5381222012780723
Energy: 0.5139044739575838
Energy: 0.5137703119715061
Energy: 0.4998569176378021
Energy: 0.49058021494080123
Energy: 0.3881483754986656
Energy: 0.6286889208904677
Energy: 0.5462878459150519

minimum gb energy = 0.3881483754986656 eV
minimum distance =  2.27658450868672 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 0.48525205823240236
Energy: 0.5457697931017313
Energy: 0.48551255255381204
Energy: 0.5137083554833344
Energy: 0.6162509685727463
Energy: 0.5353194655761774
Energy: 0.5179636412287575
Energy: 0.5286435283456887
Energy: 0.47794019285731415
Energy: 0.5685446642813958
Energy: 0.5588829260021873
Energy: 0.5373251407907121
Energy: 0.4982829131318374
Energy: 0.4512042125004613
Energy: 0.3942631528193987
Energy: 0.5347350375798205
Energy: 0.45193517937059197
Energy: 0.497582879301507
Energy: 0.4849546068433953
Energy: 0.4688258401179245
Energy: 0.4956907309657392
Energy: 0.5040922109588698
Energy: 0.483081646343473
Energy: 0.4233330594835444
Energy: 0.572611405531534
Energy: 0.4971909370624878
Energy: 0.43462881000219294
Energy: 0.49425096902690163
Energy: 0.5218655317941854
Energy: 0.45692670851599015
Energy: 0.4578021168884361
Energy: 0.5084848555949606
Energy: 0.4007603689196941
Energy: 0.4627628679372509
Energy: 0.507589983742663
Energy: 0.4768622749958766
Energy: 0.4657389733437908
Energy: 0.4287637763286672
Energy: 0.434374801159981
Energy: 0.4721598858044045
Energy: 0.46638418364928447
Energy: 0.4267473414775134
Energy: 0.5217650736351808
Energy: 0.45164387321512894
Energy: 0.450233527641907
Energy: 0.5265062867162699
Energy: 0.45626161004953564
Energy: 0.4500090606610858
Energy: 0.5126948052312873
Energy: 0.44423785409205135
Energy: 0.4423270382466687
Energy: 0.5124689111101561
Energy: 0.4441391534725617
Energy: 0.4414891500786823
Energy: 0.448647649971705
Energy: 0.42846043353958563
Energy: 0.4663721135940559
Energy: 0.49466422385990805
Energy: 0.4646305729720967
Energy: 0.4737560392225303
Energy: 0.44381203863375174
Energy: 0.4817060951860658
Energy: 0.49511747349503693
Energy: 0.4811521531197585
Energy: 0.4759297236047435
Energy: 0.4701457187135689
Energy: 0.4620664323685465
Energy: 0.4647776789245027
Energy: 0.4696888930172751
Energy: 0.44712207544663873
Energy: 0.4901674350534983
Energy: 0.44492436562741783
Energy: 0.4771152952641775
Energy: 0.4623164933201983
Energy: 0.4640144773691348
Energy: 0.4644135501737177
Energy: 0.4946771845528957
Energy: 0.4844641389394031
Energy: 0.5000854060146251
Energy: 0.4877210157839461
Energy: 0.424182552691538
Energy: 0.4750332997246643
Energy: 0.5010879222439506
Energy: 0.4261811780437561
Energy: 0.4129057027763752
Energy: 0.461164919793886
Energy: 0.4429821732181635
Energy: 0.534205891269418
Energy: 0.40340765831505204
Energy: 0.4968438379053791
Energy: 0.4043165742696249
Energy: 0.43020926662096726
Energy: 0.4100922473671452
Energy: 0.5160108428169349
Energy: 0.4602793254629664
Energy: 0.4763473518693605
Energy: 0.4502613137851243
Energy: 0.5323787446041219
Energy: 0.5123695169353382
Energy: 0.43336581579579625
Energy: 0.49690721265800725
Energy: 0.44582536334348116
Energy: 0.44975392741992715
Energy: 0.5736588669667527
Energy: 0.6169437777815339
Energy: 0.43908575408930056
Energy: 0.56091035960383
Energy: 0.4654282112298148
Energy: 0.5161558852956609
Energy: 0.5299135150777798
Energy: 0.4599211009535098
Energy: 0.5863898795198282
Energy: 0.4409315920060378
Energy: 0.518881867723763
Energy: 0.3792196272029327
Energy: 0.413105966045985
Energy: 0.47637266741414014
Energy: 0.6115945462255722
Energy: 0.49377946700602204
Energy: 0.6037994200906686
Energy: 0.4574186281331478
Energy: 0.6130020051625
Energy: 0.5539352212080765
Energy: 0.5289476130309453
Energy: 0.6428088275282887
Energy: 0.5650621228849366
Energy: 0.4318276184684719
Energy: 0.5556210647406515
Energy: 0.544179455707402
Energy: 0.41834065202958864
Energy: 0.4803508456333396
Energy: 0.46558041215680523
Energy: 0.4347322157423076
Energy: 0.5404981926748939
Energy: 0.5064632728318792
Energy: 0.43218299481934125
Energy: 0.5338259465345365
Energy: 0.5705445714548805
Energy: 0.5921960073739222
Energy: 0.47602034292754664
Energy: 0.5582071741361658
Energy: 0.5320949672870272
Energy: 0.4831221307592218
Energy: 0.5539556140540891
Energy: 0.4714066582491084
Energy: 0.4331395545975232
Energy: 0.55710318267517
Energy: 0.493526927408147
Energy: 0.4446271367593799
Energy: 0.49287326863811043
Energy: 0.5255208920448375
Energy: 0.5106549361858658
Energy: 0.4501585601923756
Energy: 0.5560458546445716
Energy: 0.5160546281912171
Energy: 0.4371359620588616
Energy: 0.45609188339196716
Energy: 0.4828141477700164
Energy: 0.5115771322692724
Energy: 0.46115568755063674
Energy: 0.541498368477326
Energy: 0.4835421059496885
Energy: 0.46646257017536213
Energy: 0.46116010838236265
Energy: 0.43570087792384715
Energy: 0.4185232506713523
Energy: 0.45647000670077964
Energy: 0.4327226523780125
Energy: 0.5308756455136898
Energy: 0.44551922137949274
Energy: 0.4456042663537387
Energy: 0.4474507898207922
Energy: 0.45805475431788734
Energy: 0.44507810728771485
Energy: 0.4412379108341793
Energy: 0.43600407000634467
Energy: 0.4487559713299429
Energy: 0.4705732242645766
Energy: 0.4560058909525627
Energy: 0.47112585596661255
Energy: 0.48365608033797264
Energy: 0.47865511088614693
Energy: 0.48044460466602973
Energy: 0.5085251853464023
Energy: 0.4753639112967896
Energy: 0.4292349846844622
Energy: 0.4083453663316583
Energy: 0.5161598968242126
Energy: 0.5390350852477513
Energy: 0.47149971205827
Energy: 0.5115379116111842
Energy: 0.4438388388430846
Energy: 0.4720758280485621
Energy: 0.4532045330986375
Energy: 0.45023080449837405
Energy: 0.4710386494076674
Energy: 0.4963021388042573
Energy: 0.4512620918688681
Energy: 0.4430308730666735
Energy: 0.5181895691993161
Energy: 0.48028243070266424
Energy: 0.44666159884648443
Energy: 0.541010489013458
Energy: 0.4773433902646364
Energy: 0.4550451876086114
Energy: 0.4846125866922263
Energy: 0.454169242224638
Energy: 0.4575672298315346
Energy: 0.5014309481824969
Energy: 0.4258198353192123
Energy: -0.2813307920270299
Energy: 0.42030655745581147
Energy: 0.47348475822808583
Energy: 0.45109433731372833
Energy: 0.4539511550801171
Energy: 0.47341027322275003
Energy: 0.5790341715211871
Energy: 0.47198447205214106
Energy: 0.47612725367304654
Energy: 0.4891865617417426
Energy: 0.4372878400978149
Energy: 0.3439818674075911
Energy: 0.4489878270276302
Energy: 0.4863256177757722
Energy: 0.453383081623005
Energy: 0.5744905251363465
Energy: 0.5420493365321549
Energy: 0.5036559557075609
Energy: 0.4695502004984007
Energy: 0.6316429171012178
Energy: 0.5230059893847712
Energy: 0.47156829214335483
Energy: 0.6682420687472838
Energy: 0.5170138200172686
Energy: 0.6957149451651705
Energy: 0.5660771908132508
Energy: 0.53550258654604
Energy: 0.6338333980764523
Energy: 0.5742090538267179
Energy: 0.5628260474369118
Energy: 0.5591147426544645
Energy: 0.42574117276732426
Energy: 0.538655750683217
Energy: 0.5387189892556209
Energy: 0.42693610565853257
Energy: 0.5113748189076267
Energy: 0.5690612643280863
Energy: 0.4612582414834685
Energy: 0.44356921831481516
Energy: 0.510730481949573
Energy: 0.5169140658711328
Energy: 0.49304441639232666
Energy: 0.43294965849785927
Energy: 0.5431404696489223
Energy: 0.4581391175723264
Energy: 0.41809905767867345
Energy: 0.5494475964080491
Energy: 0.5460284312401315

minimum gb energy = -0.2813307920270299 eV
minimum distance =  2.27206797999287 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 0.5178862246853599
Energy: 0.632992471828239
Energy: 0.5499664384357712
Energy: 0.37634721146152145
Energy: 0.7382843274208332
Energy: 0.5483728764689061
Energy: 0.45746493138645355
Energy: 0.5301979593630934
Energy: 0.5765414593500318
Energy: 0.5616324484292592
Energy: 0.6434950767087905
Energy: 0.45735029664962096
Energy: 0.37549250958855956
Energy: 0.46744109450574606
Energy: 0.4698566698846699
Energy: 0.425254394322595
Energy: 0.466301431486051
Energy: 0.5324243911241938
Energy: 0.5041984907639065
Energy: 0.4361096244110032
Energy: 0.49008002352028013
Energy: 0.4920571415955258
Energy: 0.4149254211079905
Energy: 0.5255184931363394
Energy: 0.5256943006392814
Energy: 0.48043518396942203
Energy: 0.39568823419229976
Energy: 0.5492945177507813
Energy: 0.5114449253121831
Energy: 0.5255272681985695
Energy: 0.45033960673034445
Energy: 0.40208241662896804
Energy: 0.4593874715346224
Energy: 0.4072766522580247
Energy: 0.40015878977271935
Energy: 0.5009876547028318
Energy: 0.4131067395615686
Energy: 0.39007517984452594
Energy: 0.4682927652314506
Energy: 0.5077198461389099
Energy: 0.5032355424085194
Energy: 0.43594350501387097
Energy: 0.33151291821494105
Energy: 0.44406892200583115
Energy: 0.4231401924175091
Energy: 0.4691527369752876
Energy: 0.4434191925067056
Energy: 0.49511862693036995
Energy: 0.45442702878781044
Energy: 0.4350764864982746
Energy: 0.4500650540615999
Energy: 0.45931435215559985
Energy: 0.4464699458741169
Energy: 0.4311731282543599
Energy: 0.43383782129219606
Energy: 0.39334414500153597
Energy: 0.42810595763604115
Energy: 0.46420729409527606
Energy: 0.40636562687244027
Energy: 0.433415362968285
Energy: 0.39876161698156026
Energy: 0.4518090332262931
Energy: 0.4557556159958681
Energy: 0.45991904303950926
Energy: 0.47552097647241115
Energy: 0.4227006574857855
Energy: 0.4185697749917679
Energy: 0.4340550985388304
Energy: 0.4493853219362113
Energy: 0.4754166073236004
Energy: 0.49652149112707084
Energy: 0.4856213872987143
Energy: 0.3891844459287768
Energy: 0.40176601947862145
Energy: 0.4011782750804029
Energy: 0.49103890729506133
Energy: 0.4973454329015957
Energy: 0.372772072025539
Energy: 0.4955562343186141
Energy: 0.436020125433225
Energy: 0.4364419640991479
Energy: 0.4976493815765624
Energy: 0.4910125125439184
Energy: 0.4314351975363903
Energy: 0.3792178588722444
Energy: 0.45802941947571707
Energy: 0.4630781690243082
Energy: 0.48228232454517905
Energy: 0.3867346310684571
Energy: 0.4432746191139796
Energy: 0.4673274167944467
Energy: 0.48034790543700184
Energy: 0.4584045261480889
Energy: 0.47631500084843714
Energy: 0.4552565038945724
Energy: 0.4528370561680701
Energy: 0.4315659829578308
Energy: 0.4078933703286439
Energy: 0.441189621703651
Energy: 0.4530129046177405
Energy: 0.44259952148381215
Energy: 0.4418173101686495
Energy: 0.5031670433266344
Energy: 0.4296475407745412
Energy: 0.3962028193622696
Energy: 0.4778958713131621
Energy: 0.46044991663074797
Energy: 0.4759802119468218
Energy: 0.4600336570268994
Energy: 0.49823420502573335
Energy: 0.44252423014337444
Energy: 0.4607611283135882
Energy: 0.5433323245404645
Energy: 0.43747303432445617
Energy: 0.5834399863312143
Energy: 0.45364461842550424
Energy: 0.4614573628363841
Energy: 0.5499041682061138
Energy: 0.41533133585565846
Energy: 0.5896077660922548
Energy: 0.47413938999558086
Energy: 0.4641639786261061
Energy: 0.45352050849174685
Energy: 0.506712149121967
Energy: 0.5792240530527045
Energy: 0.4584716875823137
Energy: 0.5066630765237934
Energy: 0.5239074513454527
Energy: 0.4658695259030435
Energy: 0.45361332397396775
Energy: 0.48562637568578026
Energy: 0.45440869215083773
Energy: 0.5511509418317079
Energy: 0.6077543310246886
Energy: 0.5681059989307438
Energy: 0.45368972879363334
Energy: 0.5627699876250571
Energy: 0.5702506108248514
Energy: 0.4617906571656859
Energy: 0.5162010417531123
Energy: 0.4833633089728328
Energy: 0.526508139675521
Energy: 0.5745825295645967
Energy: 0.4881323479612849
Energy: 0.4974995890299032
Energy: 0.4621985432493483
Energy: 0.4921713014276736
Energy: 0.48055884894656287
Energy: 0.43984608250375445
Energy: 0.559310667000716
Energy: 0.7132417667858879
Energy: 0.6035960553509307
Energy: 0.558664966654697
Energy: 0.586814048583822
Energy: 0.6143842264932308
Energy: 0.5863398766279042
Energy: 0.5006168926716481
Energy: 0.5885119455712925
Energy: 0.39940708290475296
Energy: 0.44006506413279295
Energy: 0.5792758809651672
Energy: 0.5177167096549841

minimum gb energy = 0.33151291821494105 eV
minimum distance =  2.2677432113655 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.5052684981348988
Energy: 0.6817804899865164
Energy: 0.6288117172383384
Energy: 0.5026878000550582
Energy: 0.7903570716457187
Energy: 0.541552148168341
Energy: 0.757338345320899
Energy: 0.5268311747535072
Energy: 0.46956010080436594
Energy: 0.6011080332545149
Energy: 0.6205469453817383
Energy: 0.5565676654847732
Energy: 0.7249977798775149
Energy: 0.43676151769669647
Energy: 0.5035232447439312
Energy: 0.5558953158242607
Energy: 0.44223760640120713
Energy: 0.5700607275159725
Energy: 0.5790821089584376
Energy: 0.4675163832853343
Energy: 0.5005272355486909
Energy: 0.6397399412550631
Energy: 0.4242386698187444
Energy: 0.5915692005014546
Energy: 0.5805110672440834
Energy: 0.605429133143559
Energy: 0.547179640670695
Energy: 0.5394426085842863
Energy: 0.5969254890136361
Energy: 0.49747554236726677
Energy: 0.36482042834481787
Energy: 0.5986509226448811
Energy: 0.5713943102802518
Energy: 0.44592382167227385
Energy: 0.47883833198980125
Energy: 0.4793403600110373
Energy: 0.6624324628078752
Energy: 0.5163653705056287
Energy: 0.4850463578018374
Energy: 0.5612871082742164
Energy: 0.5290835928713993
Energy: 0.5853359891273753
Energy: 0.5728814109966999
Energy: 0.4028780027088851
Energy: 0.466661916656074
Energy: 0.47717631214835315
Energy: 0.4030984751056881
Energy: 0.4850317128163155
Energy: 0.44035312935448684
Energy: 0.44745872519910473
Energy: 0.501957101262177
Energy: 0.4412273091934264
Energy: 0.45389195976573726
Energy: 0.49970293042041236
Energy: 0.5171926569838097
Energy: 0.4961788493231712
Energy: 0.480760860983852
Energy: 0.5273926900708658
Energy: 0.4985768665092836
Energy: 0.48933419301808057
Energy: 0.37980899213357683
Energy: 0.3665173679799074
Energy: 0.48397541058412114
Energy: 0.432897916517734
Energy: 0.3502957462836995
Energy: 0.46985019171882125
Energy: 0.5183916296643194
Energy: 0.47618659288880394
Energy: 0.47467934930543504
Energy: 0.524409440439537
Energy: 0.47942062610951847
Energy: 0.5016996028699713
Energy: 0.41252149264494536
Energy: 0.3606427374474909
Energy: 0.4335104317236963
Energy: 0.4661904181445625
Energy: 0.4492830862571901
Energy: 0.48181394886231566
Energy: 0.42975069152719725
Energy: 0.356880065020814
Energy: 0.3764549369337717
Energy: 0.4278536402885456
Energy: 0.43467883441063865
Energy: 0.39929411098578893
Energy: 0.4120645646668475
Energy: 0.417187148882975
Energy: 0.4318723898330692
Energy: 0.4605970554431671
Energy: 0.40956905164953933
Energy: 0.38397167883205097
Energy: 0.45462848018085944
Energy: 0.3772627124038672
Energy: 0.3594839252085568
Energy: 0.45341021065043563
Energy: 0.36819269664983306
Energy: 0.4127936458336473
Energy: 0.43937302415742613
Energy: 0.367335409804986
Energy: 0.4679420364159522
Energy: 0.4526055944648837
Energy: 0.40365713897008176
Energy: 0.44934858399735206
Energy: 0.40069839558521125
Energy: 0.4458344163404497
Energy: 0.4338190077966735
Energy: 0.4611435609186695
Energy: 0.42627270379896864
Energy: 0.4591003307617416
Energy: 0.4600815605200805
Energy: 0.43491635914788773
Energy: 0.4220108671639722
Energy: 0.46356559134044095
Energy: 0.45044126218042213
Energy: 0.3373120338802274
Energy: 0.49737290377125876
Energy: 0.41164713888588705
Energy: 0.44367781323899574
Energy: 0.46362243099289896
Energy: 0.45312087141757157
Energy: 0.4617166674681789
Energy: 0.4746255109707441
Energy: 0.43593003181009643
Energy: 0.45059619652724847
Energy: 0.4483256008545273
Energy: 0.41758669745196947
Energy: 0.47784006079087177
Energy: 0.46301354940340206
Energy: 0.33603100823852444
Energy: 0.39372117183661565
Energy: 0.48006069491236203
Energy: 0.3400736981043921
Energy: 0.49457519460066307
Energy: 0.4658548576055495
Energy: 0.44850064191650585
Energy: 0.42596227338694836
Energy: 0.4746466254559268
Energy: 0.446374803571366
Energy: 0.4389010603760178
Energy: 0.4491765419657651
Energy: 0.40741589930359956
Energy: 0.4372062021946169
Energy: 0.43907607017215683
Energy: 0.5011852065402862
Energy: 0.43065880846792465
Energy: 0.5231528047270128
Energy: 0.40223351855703526
Energy: 0.47758057023425254
Energy: 0.46634951200066527
Energy: 0.45560250406878944
Energy: 0.48000717969435625
Energy: 0.5854334605794266
Energy: 0.5306359545457184
Energy: 0.5282690452476622
Energy: 0.5331252858649999
Energy: 0.5142441991088599
Energy: 0.5465173161244995
Energy: 0.4322591970886487
Energy: 0.42629722429127725
Energy: 0.5219111930647329
Energy: 0.44410628975629135
Energy: 0.38300482919732504
Energy: 0.42474848745645094
Energy: 0.574026329631715
Energy: 0.5517028879062644
Energy: 0.5424547015742813
Energy: 0.4379193495192811
Energy: 0.5373608064348996
Energy: 0.5118980027787886
Energy: 0.5221148273694133
Energy: 0.47171029268292597
Energy: 0.5612936232462077
Energy: 0.5579963334192724
Energy: 0.4572097396285298
Energy: 0.5341547841210043
Energy: 0.5494178508829527
Energy: 0.41501909811903726
Energy: 0.48349364259406885
Energy: 0.6118476555439968
Energy: 0.4222162522086413
Energy: 0.47306855269957426
Energy: 0.7478138591245168
Energy: 0.5318516793350295
Energy: 0.5502121386579027
Energy: 0.5823454086383713
Energy: 0.5684510529872171
Energy: 0.6068136712384293
Energy: 0.4635288054149415
Energy: 0.6294944204820633
Energy: 0.5718213839735957
Energy: 0.40514123581180655
Energy: 0.6423637914539436
Energy: 0.5033669773555419
Energy: 0.6051151117520605
Energy: 0.6207196177296478
Energy: 0.6136898805834685
Energy: 0.5586617480984934
Energy: 0.6263302806040679
Energy: 0.5451286857269084
Energy: 0.748334931508451
Energy: 0.46088793118375143
Energy: 0.48887907746753767
Energy: 0.7146593471865366
Energy: 0.4167873082430818
Energy: 0.560832154073372
Energy: 0.553318716098383
Energy: 0.4564762647848689
Energy: 0.5102532887465572
Energy: 0.4687624303924885
Energy: 0.4328346562171212
Energy: 0.4837598821262094
Energy: 0.7293446542202975
Energy: 0.43072443428573015
Energy: 0.31364040091925055
Energy: 0.5564437611411533
Energy: 0.5251662585329803
Energy: 0.5533957015349378

minimum gb energy = 0.31364040091925055 eV
minimum distance =  2.28438069479847 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.12231624184733106
Energy: 0.08638104035796934
Energy: 0.07150461621058063
Energy: 0.12248733958159905
Energy: 0.08748966978188645
Energy: 0.07160590524469608
Energy: 0.26303168879094313
Energy: 0.15950578635029097
Energy: 0.12584180144662577
Energy: 0.19556044333360162
Energy: 0.15961168071041795
Energy: 0.12570027143595067
Energy: 0.1284008630864018
Energy: 0.07149542157723933
Energy: 0.0711518157501616
Energy: 0.1935089104016957
Energy: 0.07127866532134552
Energy: 0.07136382388035248
Energy: 0.16012378050176523
Energy: 0.07259639496384994
Energy: 0.071372840592957
Energy: 0.1606245184908007
Energy: 0.07345775321211682
Energy: 0.07138108519197839
Energy: 0.11030435572601523
Energy: 0.11963642273024475
Energy: 0.19606952280782028
Energy: 0.07133803516924113
Energy: 0.1936573551743872
Energy: 0.19462441306696757
Energy: 0.12437391973321424
Energy: 0.12568390997027273
Energy: 0.07162421665107165
Energy: 0.12239003025665203
Energy: 0.12627399151157284
Energy: 0.07306307657001795
Energy: 0.2738045103527312
Energy: 0.16040485008573227
Energy: 0.16185251155465966
Energy: 0.19643710187537075
Energy: 0.15951846508432657
Energy: 0.12543372840649203
Energy: 0.2731338767419779
Energy: 0.11073611818008117
Energy: 0.03658430431346818
Energy: 0.18780571878229768
Energy: 0.07122943844500121
Energy: 0.07122928178281888
Energy: 0.16494432186378372
Energy: 0.0724115902746396
Energy: 0.07135765271481154
Energy: 0.16112186631122213
Energy: 0.07242223731403168
Energy: 0.07158520634541841
Energy: 0.03669590628554389
Energy: 0.1944977922417659
Energy: 0.19569147040375162
Energy: 0.07125141819573648
Energy: 0.12165899797700248
Energy: 0.19435109659908162

minimum gb energy = 0.03658430431346818 eV
minimum distance =  2.36377738819631 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.5586798351445045
Energy: 0.39743923686404625
Energy: 0.5824875416314795
Energy: 0.42978840279622754
Energy: 0.39979077664164747
Energy: 0.4421031099948194
Energy: 0.6771884326326623
Energy: 0.5864508148061586
Energy: 0.6201976099649186
Energy: 0.630943123146473
Energy: 0.6337681858547396
Energy: 0.5430461934805488
Energy: 0.6531827311043786
Energy: 0.44861072330075996
Energy: 0.4689626591368074
Energy: 0.6130449881239788
Energy: 0.47048641324974694
Energy: 0.5748947230690709
Energy: 0.6242729959851092
Energy: 0.42372881305514615
Energy: 0.48901146777485077
Energy: 0.6276520386988054
Energy: 0.4437646693657904
Energy: 0.5794784995397055
Energy: 0.5176174232933085
Energy: 0.5762650523594435
Energy: 0.5700620972902012
Energy: 0.4597879354486714
Energy: 0.620105790001575
Energy: 0.5780035753829863
Energy: 0.40314125426566866
Energy: 0.47654710956293955
Energy: 0.5117674613700379
Energy: 0.49393650867045796
Energy: 0.4773947341930116
Energy: 0.46743836163032054
Energy: 0.5591690277777167
Energy: 0.5153360154211257
Energy: 0.5261525983983054
Energy: 0.621398750422547
Energy: 0.535702931619593
Energy: 0.5248461332892201
Energy: 0.5916502136316812
Energy: 0.5084624267628842
Energy: 0.5314794703859872
Energy: 0.5792030042591378
Energy: 0.4321698033868331
Energy: 0.520675833229823
Energy: 0.5990678091024316
Energy: 0.391527959832112
Energy: 0.5484917363708238
Energy: 0.6021362555795043
Energy: 0.38927065268291716
Energy: 0.5710803790933863
Energy: 0.44798745041179283
Energy: 0.5735620866640898
Energy: 0.5656782501772892
Energy: 0.43283085882162675
Energy: 0.5413225868313567
Energy: 0.5108858443926496
Energy: 0.3640145900925465
Energy: 0.3333537048414261
Energy: 0.49701362738149163
Energy: 0.40790737937304056
Energy: 0.3452927864243388
Energy: 0.4527172570556279
Energy: 0.4710222681108818
Energy: 0.48238884235003376
Energy: 0.48134049049996863
Energy: 0.4572334294490781
Energy: 0.47331042633580234
Energy: 0.481446328099326
Energy: 0.45314542874175506
Energy: 0.4612520006426602
Energy: 0.5280950461493995
Energy: 0.4534193948848099
Energy: 0.4420076132786006
Energy: 0.544893919184781
Energy: 0.49600252615701906
Energy: 0.3838724238859169
Energy: 0.42995600805380335
Energy: 0.45309607828955967
Energy: 0.380597015017768
Energy: 0.4542625592527456
Energy: 0.35739012288877126
Energy: 0.5007720484760068
Energy: 0.5003324478023
Energy: 0.46732608771474404
Energy: 0.44695277081243456
Energy: 0.5016269553388768
Energy: 0.5132763166168259
Energy: 0.4295747267726539
Energy: 0.46959801047072175
Energy: 0.40350272606929577
Energy: 0.39111488192649047
Energy: 0.4737597217761488
Energy: 0.4175755445394471
Energy: 0.43132128840801465
Energy: 0.44255530854630626
Energy: 0.3759561681746976
Energy: 0.43479488884515555
Energy: 0.4836197395024274
Energy: 0.3528725810906269
Energy: 0.46324151929171187
Energy: 0.4625968474867233
Energy: 0.362182117091791
Energy: 0.44888922145179166
Energy: 0.4770236618838887
Energy: 0.5090023796974342
Energy: 0.43157409078340436
Energy: 0.5207094879339302
Energy: 0.4449220652369787
Energy: 0.4197246393897522
Energy: 0.5158143504355405
Energy: 0.4774955349854659
Energy: 0.4721334171320249
Energy: 0.49831342049844235
Energy: 0.41642500533222737
Energy: 0.5313013623975639
Energy: 0.4189350784911841
Energy: 0.523699413740689
Energy: 0.49086156586986257
Energy: 0.49802518398862156
Energy: 0.44536046694474984
Energy: 0.4172406502992225
Energy: 0.4789737164781623
Energy: 0.508343674578641
Energy: 0.473424221801285
Energy: 0.47222010632480244
Energy: 0.4325928495916794
Energy: 0.4764129864781291
Energy: 0.4809368303639615
Energy: 0.39559738401272015
Energy: 0.4479177924611223
Energy: 0.4543295999249257
Energy: 0.3624078715789278
Energy: 0.4123037654886323
Energy: 0.45322369919099387
Energy: 0.49785645318852667
Energy: 0.5019372468201592
Energy: 0.46181398614511765
Energy: 0.4489745704130571
Energy: 0.5013742427494192
Energy: 0.47725714330857166
Energy: 0.3828758185118362
Energy: 0.47864212752540763
Energy: 0.4814561682056012
Energy: 0.47185815922859276
Energy: 0.5331065474644299
Energy: 0.4799530144024166
Energy: 0.4053028489266634
Energy: 0.5074208906003406
Energy: 0.5186048022317135
Energy: 0.46846516747525674
Energy: 0.4494134833071672
Energy: 0.5217853686610461
Energy: 0.5202997575350012
Energy: 0.5150579116927709
Energy: 0.506750738135372
Energy: 0.5215140640977491
Energy: 0.47646840255883616
Energy: 0.5794324729524737
Energy: 0.44115372482010706
Energy: 0.5472636713775294
Energy: 0.5181519419734529
Energy: 0.40035276188567487
Energy: 0.4838153802631253
Energy: 0.4936367148756876
Energy: 0.37305760071677363
Energy: 0.5397277826054208
Energy: 0.5039850724370085
Energy: 0.4886629106231378
Energy: 0.5474505847520897
Energy: 0.4803310906266493
Energy: 0.5742076900951228
Energy: 0.6092221021865458
Energy: 0.6232657971330664
Energy: 0.5499652945742364
Energy: 0.5932097148436016
Energy: 0.5934510109759437
Energy: 0.4931328250930982
Energy: 0.4941000512741494
Energy: 0.516637008167339
Energy: 0.4935221328178633
Energy: 0.4433286822220699
Energy: 0.5122899298236007
Energy: 0.6536479429891964
Energy: 0.45485070671894146
Energy: 0.5603545543932368
Energy: 0.6380975939240456
Energy: 0.4556162369131974
Energy: 0.5749241010384756
Energy: 0.5336339618913882
Energy: 0.6042961512144144
Energy: 0.5432278651890262
Energy: 0.5021817988502354
Energy: 0.6031133891293821
Energy: 0.4974225428996362

minimum gb energy = 0.3333537048414261 eV
minimum distance =  2.27050940148389 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.5075029107374703
Energy: 0.5514153632928173
Energy: 0.49269079342678773
Energy: 0.42725400153723553
Energy: 0.5523147387042405
Energy: 0.4874306863465588
Energy: 0.6146020338490686
Energy: 0.5910119961542711
Energy: 0.5908871085748444
Energy: 0.5638857167086534
Energy: 0.5978039334909874
Energy: 0.5690202748699861
Energy: 0.5661640683722649
Energy: 0.4628505778340263
Energy: 0.5450817132696852
Energy: 0.5566687336846878
Energy: 0.472173195181444
Energy: 0.5455554348105404
Energy: 0.6067797828993068
Energy: 0.5478697983014903
Energy: 0.558963628423904
Energy: 0.5806633822062108
Energy: 0.41563095263412847
Energy: 0.5487787032901532
Energy: 0.576590689924407
Energy: 0.5859339945650691
Energy: 0.5525168321596846
Energy: 0.5460546323327418
Energy: 0.5957161486147599
Energy: 0.6345784163854993
Energy: 0.42923560205391503
Energy: 0.3790811428479953
Energy: 0.4513400950611932
Energy: 0.5201297897964556
Energy: 0.5333996790315574
Energy: 0.48685203702550156
Energy: 0.570082394190438
Energy: 0.6069260635163497
Energy: 0.5755315433216952
Energy: 0.5363421104364933
Energy: 0.5192695009085968
Energy: 0.5690368972616574
Energy: 0.5404343449807185
Energy: 0.5165056371779662
Energy: 0.45438398089673315
Energy: 0.5424956122657086
Energy: 0.4710488168216335
Energy: 0.5865319875260485
Energy: 0.4993803369132423
Energy: 0.4511076605659522
Energy: 0.5250559644980399
Energy: 0.5906725872512334
Energy: 0.4550641732891359
Energy: 0.5844123925332904
Energy: 0.4818778221249639
Energy: 0.5297044446472196
Energy: 0.5459241812468709
Energy: 0.48012047164194765
Energy: 0.5082058452681706
Energy: 0.44632873675624996
Energy: 0.4812528297889524
Energy: 0.5345202382529188
Energy: 0.48470965053168935
Energy: 0.4408170853132518
Energy: 0.5177750589716573
Energy: 0.48077244175655154
Energy: 0.3690679321622577
Energy: 0.47840391143814476
Energy: 0.48287053228870996
Energy: 0.39789076829249204
Energy: 0.4763051985616379
Energy: 0.4887904258440956
Energy: 0.4207719170774736
Energy: 0.4765873771536373
Energy: 0.4725707361426797
Energy: 0.420877384000943
Energy: 0.473998422206697
Energy: 0.4692184631540179
Energy: 0.48841267956855
Energy: 0.45425297023950284
Energy: 0.4568250705120816
Energy: 0.4469197349516026
Energy: 0.4559151107087922
Energy: 0.4855404201631767
Energy: 0.5105737544121006
Energy: 0.5325913398026376
Energy: 0.5208088566158076
Energy: 0.4660721617239041
Energy: 0.5015472437715656
Energy: 0.4497542312329636
Energy: 0.5114505003992006
Energy: 0.4307762471872863
Energy: 0.47538223596101364
Energy: 0.47777768589255687
Energy: 0.4390969240023361
Energy: 0.4721888774840664
Energy: 0.5078825877900566
Energy: 0.5046301082064021
Energy: 0.4491255953950161
Energy: 0.5097754768987103
Energy: 0.4808448718327239
Energy: 0.5157921588966349
Energy: 0.4696559069517126
Energy: 0.5586325750385591
Energy: 0.5413392633823799
Energy: 0.4784734771258942
Energy: 0.4816047883292813
Energy: 0.5410405981905184
Energy: 0.4353969187421646
Energy: 0.5225325297924568
Energy: 0.4731884363772475
Energy: 0.553941887866908
Energy: 0.5168375745918047
Energy: 0.5002072522266587
Energy: 0.5527070840880978
Energy: 0.5531967752253815
Energy: 0.5995214371359019
Energy: 0.5189061943482184
Energy: 0.561846213118903
Energy: 0.6303511700296672
Energy: 0.5761807232117194
Energy: 0.5353874985275645
Energy: 0.5812277975258624
Energy: 0.5618268765275582
Energy: 0.44738563667793213
Energy: 0.5835721870804076
Energy: 0.5377564788216431
Energy: 0.447227428032089
Energy: 0.5841144944464521
Energy: 0.5231290191183751
Energy: 0.4566084510884169
Energy: 0.530260673901712
Energy: 0.5541067694264729
Energy: 0.5776274092715736
Energy: 0.586523436405053
Energy: 0.5108791104555677
Energy: 0.5814888183428012
Energy: 0.5369353977866658

minimum gb energy = 0.3690679321622577 eV
minimum distance =  2.27534408872002 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 0.49779223845146703
Energy: 0.5964386314517629
Energy: 0.641662270204863
Energy: 0.47348776672749143
Energy: 0.5913875923348028
Energy: 0.47168088449953605
Energy: 0.6238446126875546
Energy: 0.5538357329547167
Energy: 0.5672966891517368
Energy: 0.650199834995568
Energy: 0.5510329882222886
Energy: 0.5681473022885211
Energy: 0.6887219346143385
Energy: 0.5057277717805859
Energy: 0.5371382595310089
Energy: 0.6189871952100621
Energy: 0.508182191911222
Energy: 0.5620209440413872
Energy: 0.5703385343331003
Energy: 0.5540556861750363
Energy: 0.5668235821608607
Energy: 0.5777684697332116
Energy: 0.5747814912048578
Energy: 0.5562390210373809
Energy: 0.6125997423420908
Energy: 0.6181109198354655
Energy: 0.6163621803797007
Energy: 0.5691588251921462
Energy: 0.6443538946626794
Energy: 0.5683207942435298
Energy: 0.44929432156654775
Energy: 0.5939143943533963
Energy: 0.5540417611746059
Energy: 0.5068852963527762
Energy: 0.639388531527064
Energy: 0.5032826906032115
Energy: 0.5595980156274829
Energy: 0.5757790421409263
Energy: 0.5709290811396032
Energy: 0.5633316042557007
Energy: 0.5194091155199932
Energy: 0.5755107765949687
Energy: 0.5463473619503926
Energy: 0.5283461758805346
Energy: 0.5309371384961943
Energy: 0.5502715121107624
Energy: 0.5723054594530036
Energy: 0.532306289801323
Energy: 0.5277458833262704
Energy: 0.48918928985794036
Energy: 0.4648890689892952
Energy: 0.5074878183344713
Energy: 0.4868098647993363
Energy: 0.4933329447520893
Energy: 0.581579915941324
Energy: 0.5489730632038959
Energy: 0.48566933136217916
Energy: 0.4908262326655564
Energy: 0.500955404082622
Energy: 0.5499736339527315
Energy: 0.5583155219241699
Energy: 0.49721028989260474
Energy: 0.47525945219735455
Energy: 0.4819815658924909
Energy: 0.4791327277540922
Energy: 0.522794509221196
Energy: 0.5111240660452012
Energy: 0.499494337456573
Energy: 0.5148230734844793
Energy: 0.5072154768151769
Energy: 0.44110775131650415
Energy: 0.47278875242535967
Energy: 0.5577342169488607
Energy: 0.5156896284333866
Energy: 0.5464239017180559
Energy: 0.5615721239418716
Energy: 0.5195143155031973
Energy: 0.495437514085527
Energy: 0.5004675437652775
Energy: 0.4734234869845427
Energy: 0.5098296927298647
Energy: 0.4502075160508604
Energy: 0.4867755579659849
Energy: 0.45553946571952014
Energy: 0.646553553120107
Energy: 0.5593448255929643
Energy: 0.5268702038671547
Energy: 0.4387453192830125
Energy: 0.5277931331826768
Energy: 0.571999618621984
Energy: 0.5587540953642958
Energy: 0.4964017058218617
Energy: 0.5423249446482433
Energy: 0.5576436546048436
Energy: 0.5049058974905671
Energy: 0.5190997369356352
Energy: 0.6961196904267947
Energy: 0.5670419691996784
Energy: 0.5683017299116793
Energy: 0.6254530167513622
Energy: 0.5198299670830951
Energy: 0.5391851708799913
Energy: 0.5542868711407332
Energy: 0.5625154662820385
Energy: 0.5441944276310331
Energy: 0.5529180098035433
Energy: 0.5577965955452034
Energy: 0.6054917719104154
Energy: 0.4963125797830281
Energy: 0.5841207180729634
Energy: 0.5261262439063614
Energy: 0.46375038570059657
Energy: 0.5825571257969852
Energy: 0.483292711920525
Energy: 0.5180596187060322
Energy: 0.6149607039335979
Energy: 0.6132145101900716
Energy: 0.49642207490090595
Energy: 0.5514885108838468
Energy: 0.5449573473627096
Energy: 0.6593854707049962
Energy: 0.4903568733397268
Energy: 0.5138622635622536
Energy: 0.6499555899998934
Energy: 0.48789300335467245
Energy: 0.5371880221461349
Energy: 0.6096148016218564
Energy: 0.5641368749568695
Energy: 0.5846442561827171
Energy: 0.6149643613945526
Energy: 0.5717213198162974
Energy: 0.5574677293961052
Energy: 0.5751796435598806
Energy: 0.6241103225073547
Energy: 0.6251210008728992
Energy: 0.6264967111406101
Energy: 0.5519203875941555
Energy: 0.622187609128733
Energy: 0.5821780318000542
Energy: 0.5965294339543176
Energy: 0.5931545748302626
Energy: 0.48899421277430233
Energy: 0.5903273966277984
Energy: 0.5367279896732976
Energy: 0.5613663637837535
Energy: 0.555725262582651
Energy: 0.5742069003737907
Energy: 0.5488046938549334
Energy: 0.6061971990293714
Energy: 0.5765831162446405
Energy: 0.5557978418531916
Energy: 0.526051655869634
Energy: 0.5364608582328394
Energy: 0.5529829945058828
Energy: 0.5636496721351895
Energy: 0.5357286419213264
Energy: 0.5276505422632416
Energy: 0.48754731537939283
Energy: 0.5215680456188962
Energy: 0.4938575944881259
Energy: 0.4809091199293891
Energy: 0.5097872805773239
Energy: 0.5902428366851784
Energy: 0.5368101158977916
Energy: 0.57117989398836
Energy: 0.4692910519321106
Energy: 0.5024941207730625
Energy: 0.5182597872840191
Energy: 0.5622712218903595
Energy: 0.4749124576052076
Energy: 0.4708658467250782
Energy: 0.4937939409235893
Energy: 0.47817714097366093
Energy: 0.5087324317472222
Energy: 0.5534307027608434
Energy: 0.4937592648109689
Energy: 0.5068161950813519
Energy: 0.553201853177169
Energy: 0.4732824926638884
Energy: 0.4864603689892781
Energy: 0.5554375949419978
Energy: 0.514460675893517
Energy: 0.516562463621671
Energy: 0.5573160812429943
Energy: 0.4676639323594141
Energy: 0.51390221699683
Energy: 0.5400391136767267
Energy: 0.5034447712506691
Energy: 0.5077969322219001
Energy: 0.4526823014963392
Energy: 0.5402227737462616
Energy: 0.4746527350088704
Energy: 0.5761123570294225
Energy: 0.541595555546898
Energy: 0.5343479673874045
Energy: 0.46166972023483255
Energy: 0.5257130217688396
Energy: 0.5480309575787063
Energy: 0.5305395367630745
Energy: 0.4840713143502569
Energy: 0.5068863943993366
Energy: 0.5257756716344985
Energy: 0.46915368058881185
Energy: 0.47395999372147524
Energy: 0.5594656637119104
Energy: 0.5260858231319356
Energy: 0.5024774303263948
Energy: 0.5811513130291336
Energy: 0.4855639947971497
Energy: 0.5668490525963402
Energy: 0.5536118291656545
Energy: 0.5504682272247848
Energy: 0.4810621800834729
Energy: 0.557688589753324
Energy: 0.5543999423604238
Energy: 0.6106472365913556
Energy: 0.532944991495101
Energy: 0.6269301288254805
Energy: 0.5109972631825891
Energy: 0.486025074651852
Energy: 0.5970467501804085
Energy: 0.4862132326687048

minimum gb energy = 0.4387453192830125 eV
minimum distance =  2.25756404770085 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 0.5384114886166828
Energy: 0.6927277262684239
Energy: 0.6064693251362782
Energy: 0.46647726808336526
Energy: 0.6928563289366438
Energy: 0.605033286571324
Energy: 0.5841986151130505
Energy: 0.6112485267412023
Energy: 0.563079173687747
Energy: 0.5700889640967227
Energy: 0.6254190734360664
Energy: 0.5690625182302909
Energy: 0.6225766179607639
Energy: 0.4863471879586922
Energy: 0.4843237099459057
Energy: 0.5761348891828888
Energy: 0.47932224403078644
Energy: 0.545386290246039
Energy: 0.5701847574533154
Energy: 0.5500733964071876
Energy: 0.5395382669110194
Energy: 0.5152616694786099
Energy: 0.4320746893581971
Energy: 0.5423733005828664
Energy: 0.573578794347432
Energy: 0.6142254938217581
Energy: 0.6148883438254247
Energy: 0.5185160245817119
Energy: 0.638429930138339
Energy: 0.5891695180922272
Energy: 0.5916882801704372
Energy: 0.6263060747827439
Energy: 0.6118920059619172
Energy: 0.5165407416702676
Energy: 0.5967253324169268
Energy: 0.5773812954865538
Energy: 0.5671114712277551
Energy: 0.5494792837039492
Energy: 0.5070025108543347
Energy: 0.5592846327823503
Energy: 0.5540626400301532
Energy: 0.5328788733396261
Energy: 0.5699353233390869
Energy: 0.5777837675742291
Energy: 0.5601463471715165
Energy: 0.5707985712667863
Energy: 0.5703477429445367
Energy: 0.5373297218972471
Energy: 0.5161651559383365
Energy: 0.49247830555450206
Energy: 0.49874370969240306
Energy: 0.5352772921789816
Energy: 0.4953355667757686
Energy: 0.5635751759030952
Energy: 0.6826424410040269
Energy: 0.627357076149843
Energy: 0.5691212921195772
Energy: 0.543137546075614
Energy: 0.6318977006126485
Energy: 0.573675579213626
Energy: 0.6967910557665163
Energy: 0.5124306005981517
Energy: 0.5197525867607017
Energy: 0.5589186868399548
Energy: 0.47364527442039894
Energy: 0.4947563376752544
Energy: 0.6098544059808985
Energy: 0.539034206621835
Energy: 0.5782058577808334
Energy: 0.612305363745257
Energy: 0.5357883676324391
Energy: 0.5415204888287731
Energy: 0.5922363860491806
Energy: 0.5609853903226082
Energy: 0.5159008432723572
Energy: 0.6063843468121525
Energy: 0.5430809048815406
Energy: 0.5172914173483703
Energy: 0.5207456176667644
Energy: 0.5518234433559359
Energy: 0.656611252462099
Energy: 0.4898926165268516
Energy: 0.5762133102426018
Energy: 0.645266245877531

minimum gb energy = 0.4320746893581971 eV
minimum distance =  2.27801694122222 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 0.8148468961143596
Energy: 0.6136484423200546
Energy: 0.6405274583202448
Energy: 0.5966642045234909
Energy: 0.6161019295184255
Energy: 0.5874848816234756
Energy: 0.7759760488802271
Energy: 0.569219554251485
Energy: 0.5973316750334619
Energy: 0.5768775242038133
Energy: 0.6023794172006123
Energy: 0.6131357837347284
Energy: 0.6942941429595789
Energy: 0.5421175294976889
Energy: 0.5853493500069632
Energy: 0.6349271777752041
Energy: 0.5999243374355201
Energy: 0.5642391996030095
Energy: 0.5678601326428735
Energy: 0.5411799065576283
Energy: 0.5926037925511237
Energy: 0.6085629459100935
Energy: 0.5252057523410147
Energy: 0.5855577681653996
Energy: 0.6047699220275498
Energy: 0.5308085898213966
Energy: 0.5796079886257822
Energy: 0.5066635058408615
Energy: 0.5994324027614404
Energy: 0.5645893693433262
Energy: 0.6243683413427003
Energy: 0.5484173857807962
Energy: 0.5601643318426787
Energy: 0.537712891442275
Energy: 0.5578497493089071
Energy: 0.5649132663907741
Energy: 0.6093447698338978
Energy: 0.544685622825582
Energy: 0.5239916170474377
Energy: 0.5798338701609855
Energy: 0.49639904445057176
Energy: 0.5526122838372102
Energy: 0.5973184449033981
Energy: 0.5224123734513677
Energy: 0.5312554671153414
Energy: 0.577193730629494
Energy: 0.5516549902506663
Energy: 0.5428884104196634
Energy: 0.5556970755387345
Energy: 0.5831532036623829
Energy: 0.5841947720306827
Energy: 0.5399367422311482
Energy: 0.5848933278470831
Energy: 0.5859148608002863
Energy: 0.5074669880010625
Energy: 0.5461663287388564
Energy: 0.5908268060262252
Energy: 0.5405740148809804
Energy: 0.5856158229295481
Energy: 0.6386919803944391
Energy: 0.6051940968764903
Energy: 0.538482177343817
Energy: 0.5866195717089533
Energy: 0.5860600800994714
Energy: 0.550536316162159
Energy: 0.5639141197259766
Energy: 0.5984305019287731
Energy: 0.5709394680134728
Energy: 0.5654974618509463
Energy: 0.6102009343374866
Energy: 0.5315284901663186
Energy: 0.5540161205820078
Energy: 0.5905458472501104
Energy: 0.6047226078653081
Energy: 0.5948297137635332
Energy: 0.5605584511493653
Energy: 0.6142940951594738
Energy: 0.5819251762081064
Energy: 0.5676734371112134
Energy: 0.5981873097971856
Energy: 0.601822378879034
Energy: 0.5526282314887946
Energy: 0.601417443624791
Energy: 0.6469183661535027
Energy: 0.5416024644342153
Energy: 0.5758850015861559
Energy: 0.5781960948968732
Energy: 0.558367886656744
Energy: 0.5792886068607114
Energy: 0.5744064174885225
Energy: 0.5785963128910928
Energy: 0.5426336252402997
Energy: 0.577733607605398
Energy: 0.5866134612676176
Energy: 0.5147808254490264
Energy: 0.5887808677858718
Energy: 0.5379516763516015
Energy: 0.5313817739931744
Energy: 0.5680425683404354
Energy: 0.5251892268739073
Energy: 0.5818540322931486
Energy: 0.5410276307108668
Energy: 0.6825602021454751
Energy: 0.6267442674789472
Energy: 0.5452092351786474
Energy: 0.5476181813210104
Energy: 0.5964053719252924
Energy: 0.532381488448237
Energy: 0.5829952922886481
Energy: 0.5368490694586788
Energy: 0.5533518816207108
Energy: 0.5699589789916147
Energy: 0.5918147549738519
Energy: 0.5093482776846083
Energy: 0.5586825020014431
Energy: 0.5007648016977392
Energy: 0.5322055150556086
Energy: 0.5622803175223047
Energy: 0.5879373373869321
Energy: 0.5374101568983484
Energy: 0.635312497455273
Energy: 0.5310528059326187
Energy: 0.5555737791530091
Energy: 0.5734873143376094
Energy: 0.4571555285417432
Energy: 0.5627933539344592
Energy: 0.5884029688506056
Energy: 0.5757771528492792
Energy: 0.5478147425230684
Energy: 0.5493435158597461
Energy: 0.5881018064269387
Energy: 0.5625120315174841
Energy: 0.6113427104750313
Energy: 0.5650559273579325
Energy: 0.5359298535288917
Energy: 0.557969902846014
Energy: 0.6071703641958114
Energy: 0.5789382277278229
Energy: 0.6619828584464079
Energy: 0.5718991485742704
Energy: 0.5726573995007757
Energy: 0.5688035587502129
Energy: 0.56527030577098
Energy: 0.5993475918176876
Energy: 0.6371206852043635
Energy: 0.5434120527885625
Energy: 0.5513322218181551
Energy: 0.6346113224822424
Energy: 0.4969227583999215
Energy: 0.5518631801538241
Energy: 0.6201967087538484
Energy: 0.5295085839360586
Energy: 0.5079179532300458
Energy: 0.6145017847876283
Energy: 0.5130586447658255
Energy: 0.5521888393532598
Energy: 0.6261880059056336
Energy: 0.5841346509345464
Energy: 0.6041048269487624
Energy: 0.536469586581204
Energy: 0.5869194902917972
Energy: 0.5919298900449093
Energy: 0.6461340024456287
Energy: 0.5876947000264269
Energy: 0.5633677951330135
Energy: 0.6157217867662689
Energy: 0.5773322810418567
Energy: 0.5674525782141371
Energy: 0.7341939918146112
Energy: 0.5573731173479771
Energy: 0.5565360795319516
Energy: 0.6229701132396951
Energy: 0.49297097527353917
Energy: 0.542026455584476
Energy: 0.7792099906392695
Energy: 0.6008703586739996
Energy: 0.5988430974554084
Energy: 0.5435590179555786
Energy: 0.6156935011697945
Energy: 0.5982317594070636
Energy: 0.5636658340149395
Energy: 0.6059367530033953
Energy: 0.5301549940786583
Energy: 0.5727570808432674
Energy: 0.6006428836626808
Energy: 0.5637549679261704

minimum gb energy = 0.4571555285417432 eV
minimum distance =  2.2484316162427 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 0.891731797030169
Energy: 0.6783039856035228
Energy: 0.5781092636935838
Energy: 0.5342406278298164
Energy: 0.6455228978705744
Energy: 0.5823247346128494
Energy: 0.6641825527015202
Energy: 0.6401121743965227
Energy: 0.5852943766076798
Energy: 0.5960315545224064
Energy: 0.6442337518067909
Energy: 0.5987170154327826
Energy: 0.6487578316295699
Energy: 0.5429673722569347
Energy: 0.5268277684198396
Energy: 0.6345109370888501
Energy: 0.5191254634028138
Energy: 0.5660199244603048
Energy: 0.5811100151642159
Energy: 0.5774968575465139
Energy: 0.5914811649575954
Energy: 0.5884175008514957
Energy: 0.4984421985044434
Energy: 0.5558139002287735
Energy: 0.6586501296215133
Energy: 0.6019824260242466
Energy: 0.587177335628014
Energy: 0.6181241526139015
Energy: 0.603506787281806
Energy: 0.6089412829580644
Energy: 0.7151247719251719
Energy: 0.5847602408211697
Energy: 0.5861305280166232
Energy: 0.5754901670727651
Energy: 0.6048101606568593
Energy: 0.5740431512966456
Energy: 0.6061598382790612
Energy: 0.5540305831798112
Energy: 0.5231710902008357
Energy: 0.600095694020678
Energy: 0.518653396497022
Energy: 0.6103977326640987
Energy: 0.6658727828460574
Energy: 0.5765378459271948
Energy: 0.5835190423982403
Energy: 0.6035984084065542
Energy: 0.6190428013769853
Energy: 0.5611725550726088
Energy: 0.6191918361071436
Energy: 0.5730152920773078
Energy: 0.592866845788085
Energy: 0.5008953209859257
Energy: 0.5662407295725311
Energy: 0.5250003235778025
Energy: 0.4558152837670419
Energy: 0.6011901522405597
Energy: 0.5220879795256826
Energy: 0.5030051124681194
Energy: 0.5961323061605045
Energy: 0.5211482391898503
Energy: 0.6634628784035009
Energy: 0.5744211210456115
Energy: 0.5846643814662799
Energy: 0.6030904613390866
Energy: 0.6101343079111087
Energy: 0.553907913431028
Energy: 0.6746195889518728
Energy: 0.514378410487921
Energy: 0.5220995435741116
Energy: 0.6604156903841131
Energy: 0.5017007005183632
Energy: 0.5461408734638958
Energy: 0.5830051239887523
Energy: 0.6308081337606743
Energy: 0.5811540051190649
Energy: 0.5866002456836049
Energy: 0.6336529352004714
Energy: 0.6078513453712624
Energy: 0.5832311612221874
Energy: 0.6019250508774144
Energy: 0.6046853701755266
Energy: 0.5804865495754015
Energy: 0.594614329352751
Energy: 0.603623979782273
Energy: 0.6591194830177893
Energy: 0.5240659928647641
Energy: 0.5419315829041611
Energy: 0.6184515950801095
Energy: 0.5209424351066483
Energy: 0.5404077784636205
Energy: 0.6463479349567633
Energy: 0.5226299831295157
Energy: 0.5226540015933794
Energy: 0.59508715858761
Energy: 0.5180264707225489
Energy: 0.5920970347216322
Energy: 0.5140212127290718
Energy: 0.5578217312271803
Energy: 0.5524551317206463
Energy: 0.5268555808713792
Energy: 0.5595718057215018
Energy: 0.5571925822516409

minimum gb energy = 0.4558152837670419 eV
minimum distance =  2.26956126186268 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 0.7644091444227465
Energy: 0.6614567684210316
Energy: 0.592926642978518
Energy: 0.6061368144903175
Energy: 0.7493234154390362
Energy: 0.5780882910821743
Energy: 0.7163350438034898
Energy: 0.6358238159351562
Energy: 0.6292387702657433
Energy: 0.6025740957335225
Energy: 0.6299883495172095
Energy: 0.6107271542110217
Energy: 0.6507278870433084
Energy: 0.5476393739823854
Energy: 0.575046708954468
Energy: 0.6099630498834038
Energy: 0.563938268871275
Energy: 0.6064497653464008
Energy: 0.7076032920788644
Energy: 0.6048632579655695
Energy: 0.5851584465542047
Energy: 0.570614927782722
Energy: 0.6076803885282492
Energy: 0.5346756332572721
Energy: 0.6062465568665651
Energy: 0.6330522861334282
Energy: 0.6323317888625475
Energy: 0.561454724737905
Energy: 0.616816366122362
Energy: 0.6118967269663883
Energy: 0.6275909518327266
Energy: 0.5654868828738926
Energy: 0.5968632705528519
Energy: 0.5673696838633742
Energy: 0.6438615703476147
Energy: 0.566764944502713
Energy: 0.634035983620264
Energy: 0.5635319217078771
Energy: 0.5848218259833959
Energy: 0.5877121378912626
Energy: 0.5648686364440054
Energy: 0.6218889342132244
Energy: 0.657501786265213
Energy: 0.5746002860534899
Energy: 0.6039712726617739
Energy: 0.5835599560872995
Energy: 0.5773961143437251
Energy: 0.5987799778381503
Energy: 0.6595107758653342
Energy: 0.6277562990111367
Energy: 0.6076264141906111
Energy: 0.5929676614678405
Energy: 0.617249497148902
Energy: 0.6092464785325136
Energy: 0.6644713988374255
Energy: 0.5958571570170162
Energy: 0.5909846700256755
Energy: 0.5082004169792605
Energy: 0.6173080736790754
Energy: 0.6106300026154629
Energy: 0.6477546481376902
Energy: 0.5882196864454656
Energy: 0.5997931114686091
Energy: 0.6289689037003185
Energy: 0.5793133998701486
Energy: 0.5916822755686347
Energy: 0.6458119289928298
Energy: 0.5454213033981605
Energy: 0.5190455096952564
Energy: 0.6327950814265527
Energy: 0.5184882342445977
Energy: 0.6241728396169585
Energy: 0.7029810286924639
Energy: 0.6376459792043042
Energy: 0.612405529793972
Energy: 0.5220622671537618
Energy: 0.6015525566860025
Energy: 0.6118321908234454
Energy: 0.705736778491458
Energy: 0.6431985466735944
Energy: 0.6649134941820615
Energy: 0.5920930829499385
Energy: 0.6321057333136867
Energy: 0.6175895195794378
Energy: 0.6402156476920937
Energy: 0.567098470878117
Energy: 0.5633224904442173
Energy: 0.6146868085497601
Energy: 0.5671027991852853
Energy: 0.6493527480259899
Energy: 0.6124255497607227
Energy: 0.5798527738691523
Energy: 0.5700379804846637
Energy: 0.6044207683128461
Energy: 0.5898058211920963
Energy: 0.5697189183409894
Energy: 0.6630299054069064
Energy: 0.6038126090978715
Energy: 0.6130982046805914
Energy: 0.6118687630447632
Energy: 0.6485771276290384
Energy: 0.6000463226464331
Energy: 0.6882769695355792
Energy: 0.6195928652391224
Energy: 0.6361789836156339
Energy: 0.5490843530249577
Energy: 0.6075383531906263
Energy: 0.6580850220388533
Energy: 0.7411810551374524
Energy: 0.5080711803138775
Energy: 0.529659362907601
Energy: 0.635728410939002
Energy: 0.49969787783562397
Energy: 0.5306788749512664
Energy: 0.7172096935203452
Energy: 0.5692229253838241
Energy: 0.5601448912571252
Energy: 0.6425500711065769
Energy: 0.50958907663174
Energy: 0.5835614513670719
Energy: 0.6355929337498656
Energy: 0.5668099861391936
Energy: 0.5439683685604148
Energy: 0.5615502678541113
Energy: 0.5976758230273328
Energy: 0.6173578456274104

minimum gb energy = 0.49969787783562397 eV
minimum distance =  2.25241069991872 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 0.7485591486798238
Energy: 0.7556248701128937
Energy: 0.6537112415731633
Energy: 0.5906127850498737
Energy: 0.7582916582289789
Energy: 0.6396094060855733
Energy: 0.6839334202396486
Energy: 0.5722138750710826
Energy: 0.6310940515638647
Energy: 0.633982322799892
Energy: 0.6434151241167961
Energy: 0.6799695834760597
Energy: 0.5766133507593895
Energy: 0.5612888840087542
Energy: 0.5800118999026029
Energy: 0.508782120727362
Energy: 0.3359788236076345
Energy: 0.599643647297875
Energy: 0.6143529659421478
Energy: 0.5871622688872964
Energy: 0.5655356310693795
Energy: 0.5212034163343856
Energy: 0.5881201013560379
Energy: 0.5624668769349251
Energy: 0.5554750688665948
Energy: 0.5954378407567261
Energy: 0.5909956024410766
Energy: 0.48719281121836666
Energy: 0.5996813123847398
Energy: 0.6105510124057375
Energy: 0.6827000554830234
Energy: 0.6375192318406525
Energy: 0.6454464740054293
Energy: 0.6568112409463657
Energy: 0.6466330340661699
Energy: 0.6447910243843485
Energy: 0.7405276253782636
Energy: 0.6066730676588562
Energy: 0.6382872327094081
Energy: 0.6998837657598652
Energy: 0.3027124604077144
Energy: 0.649274364668089
Energy: 0.6856256614675565
Energy: 0.6100280189521237
Energy: 0.6466831509977453
Energy: 0.6202418804408328
Energy: 0.6073523760924276
Energy: 0.6197282201241878
Energy: 0.7195689301254935
Energy: 0.5700999377086728
Energy: 0.5629627661558926
Energy: 0.5839019822507483
Energy: 0.5285533439759295
Energy: 0.5617913095604559
Energy: 0.7787851265532427
Energy: 0.5752607483465174
Energy: 0.5715636850349075
Energy: 0.5295443748827977
Energy: 0.5695888431314894
Energy: 0.5619274080792884
Energy: 0.6853527513940642
Energy: 0.6719989631693731
Energy: 0.676295520343808
Energy: 0.6241610456094079
Energy: 0.49315281626889285
Energy: 0.5905126668547852
Energy: 0.7094312664008752
Energy: 0.6191078925464616
Energy: 0.6290266097201873
Energy: 0.7046678671927854
Energy: 0.6399561390927434
Energy: 0.6882670246964638
Energy: 0.5319085313752016
Energy: 0.6700186434334943
Energy: 0.6342772331194333
Energy: 0.5410182737995597
Energy: 0.6628169448696885
Energy: 0.5926639761086303
Energy: 0.6243096199450564
Energy: 0.580703263707332
Energy: 0.574086795585561
Energy: 0.6093152552443762
Energy: 0.5883834978054493
Energy: 0.5850146453236922
Energy: 0.650470242346562
Energy: 0.556533066124644
Energy: 0.5481517768028805
Energy: 0.5321179588568006
Energy: 0.5723951612461051
Energy: 0.5373310033017654
Energy: 0.6188285203974442
Energy: 0.5641583584707761
Energy: 0.5936002717741239
Energy: 0.5516630983130258
Energy: 0.6038795019226568
Energy: 0.5815374799625113
Energy: 0.5819586187784368
Energy: 0.6574035226814868
Energy: 0.6665378557762632
Energy: 0.49233807541888563
Energy: 0.5899496112865491
Energy: 0.6317896395376247
Energy: 0.5842063892629547
Energy: 0.719066497825149
Energy: 0.689426666324551
Energy: 0.4795755661696941
Energy: 0.7062923712125283
Energy: 0.7158329265196641
Energy: 0.6720529164186699
Energy: 0.6075361713757119
Energy: 0.5878823108330099
Energy: 0.6303687646958761
Energy: 0.606840731679671
Energy: 0.5870850499020405
Energy: 0.7126373935179581
Energy: 0.606236181100085
Energy: 0.45727441557619436
Energy: 0.6669082445573391
Energy: 0.6071358789805394
Energy: 0.5721058671416129
Energy: 0.7020845332115315
Energy: 0.5694744227449559
Energy: 0.5924552469079937
Energy: 0.6241571599956378
Energy: 0.5691419865371851
Energy: 0.5756492024770357
Energy: 0.41658856663674965
Energy: 0.648914319125254
Energy: 0.5560683368639251
Energy: 0.37543037301114396
Energy: 0.6637408169378272
Energy: 0.5850899638807333
Energy: 0.6803583769335262
Energy: 0.6586648208352883
Energy: 0.4936894850397952
Energy: 0.6127299474844947
Energy: 0.623681979874651
Energy: 0.6327474938517137
Energy: 0.7804273465604523
Energy: 0.6862430624428327
Energy: 0.684017151885205
Energy: 0.7285604717261344
Energy: 0.6380101324996599
Energy: 0.6798868897541496
Energy: 0.6213473560801437
Energy: 0.6566189795166121
Energy: 0.671139522040542
Energy: 0.5578291951683164
Energy: 0.6470612434051809
Energy: 0.6023116374928095

minimum gb energy = 0.3027124604077144 eV
minimum distance =  2.23684472675217 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 0.6954285643453453
Energy: 0.6523241373495694
Energy: 0.6497102095976489
Energy: 0.5533874756255523
Energy: 0.6965076184156239
Energy: 0.647681123616878
Energy: 0.7866490786687068
Energy: 0.5052754915390424
Energy: 0.5940663661573063
Energy: 0.6635511783184929
Energy: 0.5594093010640535
Energy: 0.5247478854959502
Energy: 0.7511956249992395
Energy: 0.5723319352765024
Energy: 0.5796901321575673
Energy: 0.6950457380027462
Energy: 0.5325456658950557
Energy: 0.6596963656882848
Energy: 0.6744814215202302
Energy: 0.60598895277378
Energy: 0.6180014273035036
Energy: 0.6206159703785933
Energy: 0.6278907933968099
Energy: 0.6053824263938277
Energy: 0.6107681300555293
Energy: 0.6877204889161116
Energy: 0.6822368568032515
Energy: 0.48493511700910935
Energy: 0.6923376130718697
Energy: 0.6436634348152831
Energy: 0.6885689374370548
Energy: 0.6480336794081735
Energy: 0.5072432781182897
Energy: 0.6123912127739014
Energy: 0.6484289446362013
Energy: 0.5236181378218275
Energy: 0.7135970910974009
Energy: 0.6014289196252293
Energy: 0.5833164646821873
Energy: 0.6015433861409736
Energy: 0.6115641965186744
Energy: 0.6220224190731624
Energy: 0.649314043440983
Energy: 0.5406557637495594
Energy: 0.6021597481018146
Energy: 0.6033748098662209
Energy: 0.5850728880777868
Energy: 0.5738790053034936
Energy: 0.6447453704349684
Energy: 0.6490740343914305
Energy: 0.5591607972146638
Energy: 0.5338399294977306
Energy: 0.6534714071190075
Energy: 0.5169018281541485
Energy: 0.6462230341060128
Energy: 0.590609916758185
Energy: 0.5872316950076556
Energy: 0.5855280841510933
Energy: 0.5921266591119817
Energy: 0.5436857002103666
Energy: 0.7022758619620713
Energy: 0.6215655733302995
Energy: 0.6273851679668557
Energy: 0.7050829709522272
Energy: 0.5810896613651699
Energy: 0.6380763368121292
Energy: 0.7034283033006575
Energy: 0.5905612834631857
Energy: 0.59493024846987
Energy: 0.6327754805025838
Energy: 0.6020252122371988
Energy: 0.6371531272199784
Energy: 0.6026610698592324
Energy: 0.6293036713527312
Energy: 0.6037020718590508
Energy: 0.515285763339587
Energy: 0.6322630661421721
Energy: 0.615908056463355
Energy: 0.6868806835052697
Energy: 0.6374770878575741
Energy: 0.6346773855053557
Energy: 0.5826087127176978
Energy: 0.6432183724094993
Energy: 0.5991660238590257
Energy: 0.7735668908755968
Energy: 0.5503210741744744
Energy: 0.5554747752852114
Energy: 0.6441503063487067
Energy: 0.5257441351492463
Energy: 0.5331444449216932
Energy: 0.7117623483548894
Energy: 0.5819138074503764
Energy: 0.5794621142865756
Energy: 0.6313347127051454
Energy: 0.5420479983076384
Energy: 0.5749424035661399
Energy: 0.5853446538703669
Energy: 0.6608809931858715
Energy: 0.5729444382620245
Energy: 0.537064379164729
Energy: 0.6980611719694311
Energy: 0.6060274154715108
Energy: 0.6834367542332842
Energy: 0.6035056922766086
Energy: 0.5998648924143247
Energy: 0.6113325820577657
Energy: 0.6148354012901057
Energy: 0.5896802984867827
Energy: 0.6657648504926852
Energy: 0.5838144058854255
Energy: 0.5454272820091123
Energy: 0.625579185453838
Energy: 0.5108464961089155
Energy: 0.6005452701277665
Energy: 0.6396207264017582
Energy: 0.5740371306716425
Energy: 0.5759206369959428
Energy: 0.5912626268523813
Energy: 0.5715239009603842
Energy: 0.6470668902985574
Energy: 0.602428917892638
Energy: 0.6403758706789613
Energy: 0.640452957219694
Energy: 0.48491470790662916
Energy: 0.6355742036743949
Energy: 0.5896416590596459
Energy: 0.6215040201274624
Energy: 0.6203513756585953
Energy: 0.6341595882484696
Energy: 0.521278404023227
Energy: 0.6172230532897909
Energy: 0.5517241696241948
Energy: 0.6582100946959271
Energy: 0.5940787997301678
Energy: 0.5657294018286925
Energy: 0.5277192531822846
Energy: 0.5279825866764708
Energy: 0.6271705626673069
Energy: 0.644775909244006
Energy: 0.5275952501407372
Energy: 0.5948153962257863
Energy: 0.6306713461669771
Energy: 0.5615315605128894
Energy: 0.6039203821224807
Energy: 0.6737570310649339
Energy: 0.6190603140719669
Energy: 0.622955986831904
Energy: 0.5470832101925438
Energy: 0.618201671495515
Energy: 0.5388356508128592
Energy: 0.6623923645906218
Energy: 0.6414819436475223
Energy: 0.5794135063187844
Energy: 0.5755626484682801
Energy: 0.7101194439650261
Energy: 0.5779838207978656
Energy: 0.759630175378619
Energy: 0.5738202647305646
Energy: 0.5976627439821707
Energy: 0.6686435430423485
Energy: 0.5299757726690868
Energy: 0.5945137940062863
Energy: 0.7474769458486862
Energy: 0.5227067386157482
Energy: 0.5629991412134717
Energy: 0.6932205551558328
Energy: 0.5614147148969996
Energy: 0.5382244696685174
Energy: 0.6263035405517198
Energy: 0.6371161592100442
Energy: 0.6242464207271383
Energy: 0.4757188329138725
Energy: 0.5231455654736686
Energy: 0.589680807700369

minimum gb energy = 0.4757188329138725 eV
minimum distance =  2.25888881687242 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 0.6206934590005712
Energy: 0.5462399837143425
Energy: 0.6634046288567977
Energy: 0.6089123406984795
Energy: 0.5656981243493941
Energy: 0.6049178344883112
Energy: 0.8028333239300888
Energy: 0.5936628098700109
Energy: 0.5930024886566512
Energy: 0.6495793533576284
Energy: 0.5922247200158897
Energy: 0.5878179356429837
Energy: 0.7579288927233648
Energy: 0.6323306905019227
Energy: 0.6139764817971745
Energy: 0.6960805899255493
Energy: 0.5856895142120955
Energy: 0.6110861135458723
Energy: 0.6658231634956068
Energy: 0.6261397391451222
Energy: 0.6193669693102937
Energy: 0.5384145681713649
Energy: 0.5421585354981785
Energy: 0.6583486918819923
Energy: 0.6731834359533786
Energy: 0.6658538406775849
Energy: 0.6651325549954022
Energy: 0.5201566454162342
Energy: 0.5872339827841617
Energy: 0.6548438065876719
Energy: 0.6670525053654869
Energy: 0.5929472541878581
Energy: 0.5373903661954418
Energy: 0.5531560332980857
Energy: 0.6236411827858326
Energy: 0.5423043959829166
Energy: 0.713574169831227
Energy: 0.590232606791535
Energy: 0.5545857960460644
Energy: 0.6488707511060192
Energy: 0.6107027734283833
Energy: 0.5845196209930359
Energy: 0.6383309482893845
Energy: 0.5506963293699089
Energy: 0.6192375457854261
Energy: 0.5498655865163691
Energy: 0.4863085707291218
Energy: 0.5464891960649405
Energy: 0.6719211774195738
Energy: 0.5741599950448102
Energy: 0.5352156738088213
Energy: 0.5534818048139925
Energy: 0.6868696497865721
Energy: 0.5167647651863276
Energy: 0.6501818291353306
Energy: 0.6080110098717809
Energy: 0.585188858956756
Energy: 0.564623864864414
Energy: 0.6131380838921862
Energy: 0.6342900790011519
Energy: 0.7100111615335707
Energy: 0.6448898626198145
Energy: 0.6178115517029885
Energy: 0.675509316925125
Energy: 0.6399006947760897
Energy: 0.616140342776973
Energy: 0.728726472893409
Energy: 0.5610967693979065
Energy: 0.5831582380989496
Energy: 0.611091975885309
Energy: 0.5987779126967933
Energy: 0.5931105793803819
Energy: 0.6614114705334048
Energy: 0.5639539898899041
Energy: 0.5436732994898846
Energy: 0.432604878713541
Energy: 0.6081546017453654
Energy: 0.6358113358455897
Energy: 0.5876843726003649
Energy: 0.644994067184925
Energy: 0.6319361126106453
Energy: 0.6430357960314752
Energy: 0.5736318909683193
Energy: 0.5975832017300975
Energy: 0.8248975877987872
Energy: 0.576625716172405
Energy: 0.586748816580757
Energy: 0.6272829740176314
Energy: 0.5621361731576565
Energy: 0.6152269589241222
Energy: 0.7345251049603368
Energy: 0.5698776769898264
Energy: 0.5638858131939744
Energy: 0.6448258069392012
Energy: 0.6074726988031123
Energy: 0.5789867031080423
Energy: 0.5783296377287044
Energy: 0.6302895833206138
Energy: 0.5672029092033699
Energy: 0.5748939248734097
Energy: 0.6095626821266877
Energy: 0.5635587221964449
Energy: 0.7459294661417899
Energy: 0.5991527347610609
Energy: 0.5893392556919881
Energy: 0.537555168381776
Energy: 0.5906555539784809
Energy: 0.5850100171197185
Energy: 0.8120608192434388
Energy: 0.6344160803794754
Energy: 0.6183920066987967
Energy: 0.7038220371743971
Energy: 0.573701776760898
Energy: 0.6243189512864888
Energy: 0.7426985784132782
Energy: 0.6048689049656031
Energy: 0.5842810920055256
Energy: 0.5939827672098791
Energy: 0.580298043727841
Energy: 0.5953285503481954
Energy: 0.6535627554314374
Energy: 0.6068644485260662
Energy: 0.6104438171356066
Energy: 0.5293027670728836
Energy: 0.5892333551281635
Energy: 0.5452868673696636
Energy: 0.6467327405195249
Energy: 0.6245419467030241
Energy: 0.5670976125835124
Energy: 0.5321486627623779
Energy: 0.6258645600002192
Energy: 0.5567610312828873
Energy: 0.6591313508573295
Energy: 0.6196723314660112
Energy: 0.541058623062258
Energy: 0.6093682599224498
Energy: 0.6200671946223366
Energy: 0.6492740434618158
Energy: 0.678705684863588
Energy: 0.5009743173900727
Energy: 0.5651265218074631
Energy: 0.4529916783914623
Energy: 0.4965816551201174
Energy: 0.5922356459114294
Energy: 0.6635843574601453
Energy: 0.6242961816264225
Energy: 0.5365323647935134
Energy: 0.5361102907994555
Energy: 0.6448990351581593
Energy: 0.5339256636250134
Energy: 0.6822772867644992
Energy: 0.5813988925480111
Energy: 0.5686584577684933
Energy: 0.6659666901129487
Energy: 0.5858396080971672
Energy: 0.6225860077285121
Energy: 0.7132463736598996
Energy: 0.6106926774947423
Energy: 0.6421328846022998
Energy: 0.6902614434871814
Energy: 0.5807013609229519
Energy: 0.6229077770841808
Energy: 0.6078306044139733
Energy: 0.505423970579915
Energy: 0.549788121406598
Energy: 0.6321511978154422
Energy: 0.5178719428060515
Energy: 0.6276137480729506
Energy: 0.6703859070628471
Energy: 0.5904986927890499
Energy: 0.5691039750295162
Energy: 0.5317449780892246
Energy: 0.5885692739976403
Energy: 0.581150622761268
Energy: 0.5998353710238148
Energy: 0.5913957056635223
Energy: 0.6350446658596133
Energy: 0.6068705395462586
Energy: 0.5946164043890758
Energy: 0.6377321645888476
Energy: 0.7501349387464002
Energy: 0.5578623024436788
Energy: 0.5668056607822171
Energy: 0.6378630125331262
Energy: 0.5461153259586017
Energy: 0.5499797323169405
Energy: 0.7752826728895292
Energy: 0.5910545290150281
Energy: 0.5847557596420974
Energy: 0.6417127481500589
Energy: 0.5662622490023618
Energy: 0.6334282561996377
Energy: 0.4771051844114929
Energy: 0.6100624848035617
Energy: 0.5348374753282966
Energy: 0.5760951933356679
Energy: 0.5775515676248091
Energy: 0.5368685208966135

minimum gb energy = 0.432604878713541 eV
minimum distance =  2.25846344937876 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.019342975467029237
Energy: 0.44936045910146993
Energy: 0.4254428345948711
Energy: 0.019483828044417655
Energy: 0.44988644324384014
Energy: 0.020143752135480544
Energy: 0.5132688437127818
Energy: 0.3478005869145501
Energy: 0.3476129835632444
Energy: 0.3499153983967917
Energy: 0.3478648152119743
Energy: 0.34800037147262947
Energy: 0.60201431233997
Energy: 0.44867847791724214
Energy: 0.45035500319541044
Energy: 0.4476931998462681
Energy: 0.5054715948183933
Energy: 0.45345361756103986
Energy: 0.01951186192821734
Energy: 0.34780058691307236
Energy: 0.34761298356417486
Energy: 0.3499153983992
Energy: 0.34786481521339735
Energy: 0.34800037147454516

minimum gb energy = 0.019342975467029237 eV
minimum distance =  2.39629625026247 Angstroms
sigma value = 1