Model name: model_name=MEAM_LAMMPS_JeongParkDo_2018_PdCu__MO_353393547686_000
a1: a1=[1, 0, 0]
a2: a2=[0, 1, 0]
a3: a3=[0, 0, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.5402784094053223
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Atom deletion cutoff distance (as fraction of lattice parameter): cutoff_distance=0.5
Min. number unit cell repetitions along x direction: x_repeat=1
Min. number unit cell repetitions along z direction: z_repeat=1
Min. cell height (Angstroms): min_cell_height=10.0
Offset grid fraction (as fraction of lattice parameter): offset_grid_frac=0.25


Isolated atom energy: 0.0 eV

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

Energy: 0.013700240351577549
Energy: 0.014469375968976052
Energy: 0.8633263051634262
Energy: 0.014469375968976052
Energy: 0.014469375968976052
Energy: 0.7316223403358088
Energy: 0.014469375968976052
Energy: 0.7316223403358088
Energy: 0.8633263051640541
Energy: 0.014469375968976052
Energy: 0.013700240351577549
Energy: 0.014469375968976052
Energy: 0.014469375968976052
Energy: 0.7316223403358088
Energy: 0.014469375968976052
Energy: 0.7316223403358088

minimum gb energy = 0.013700240351577549 eV
minimum distance =  2.47126490431956 Angstroms
sigma value = 1


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

Energy: 0.9558526580837459
Energy: 1.0030196614864795
Energy: 0.9164666793815166
Energy: 1.0030196614864795
Energy: 0.8945424872938175
Energy: 1.1435577378990018
Energy: 0.8981535482734033
Energy: 1.1435577378990018
Energy: 1.0171272115898582
Energy: 0.9949307497212219
Energy: 0.9444481492077464
Energy: 0.9949307497204605
Energy: 0.8904029744897298
Energy: 1.075415707230476
Energy: 0.8653326503985816
Energy: 1.075415707230476
Energy: 0.935074994348085
Energy: 1.0622482914577664
Energy: 0.8760537882546652
Energy: 1.062248291457005
Energy: 0.8572548730333969
Energy: 1.180905459992077
Energy: 0.8399384900302261
Energy: 1.180905459992077
Energy: 0.9329382037577737
Energy: 1.0836183287090433
Energy: 0.875836156052557
Energy: 1.0836183287090433
Energy: 0.8188205535160382
Energy: 1.062616318381101
Energy: 0.8285155614986934
Energy: 1.062616318381101
Energy: 0.8782774131455503
Energy: 1.1105668428518327
Energy: 1.0063702235167749
Energy: 1.1105668267381412
Energy: 0.8324892623281497
Energy: 0.9956611040304542
Energy: 0.8125915011015772
Energy: 0.9956611040304542
Energy: 1.0224101759443325
Energy: 0.9577933309964063
Energy: 0.8783736328264281
Energy: 0.957793330997929
Energy: 0.9184522810423937
Energy: 1.0636210863990079
Energy: 0.8429242948592448
Energy: 1.0636210863990079
Energy: 0.8973373902574296
Energy: 1.1182156881287444
Energy: 0.9328555055197841
Energy: 1.1182156881295058
Energy: 0.9468630936006661
Energy: 0.9984392191105617
Energy: 0.8581994611937549
Energy: 0.9984392191105617
Energy: 0.9228984074042645
Energy: 1.0621853582986767
Energy: 0.9959511646260714
Energy: 1.0621853582986767
Energy: 0.922420025848611
Energy: 1.1199664423083326
Energy: 0.8935057183590889
Energy: 1.1199664423090938
Energy: 0.9443329864314848
Energy: 0.996668474761804
Energy: 0.8811081691505288
Energy: 0.996668474761804
Energy: 0.8982138444201057
Energy: 1.119496338715543
Energy: 0.9326373365458283
Energy: 1.1194963387147816
Energy: 0.8213086476029516
Energy: 1.0056855033768182
Energy: 0.8417078525606423
Energy: 1.0056855033775798
Energy: 1.0148312930618264
Energy: 0.8849015587577662
Energy: 0.8798266033043406
Energy: 0.8849015587585277
Energy: 0.8351945682068092
Energy: 0.9954793233125712
Energy: 0.8113991853156807
Energy: 0.9954793233118098
Energy: 0.8793069288940749
Energy: 1.1793103758095884
Energy: 1.0043124414253242
Energy: 1.17931037581035
Energy: 0.9744498713828394
Energy: 1.0630867477624883
Energy: 0.8822318767098859
Energy: 1.0630867477617272
Energy: 0.9638679100016804
Energy: 1.048813947073469
Energy: 0.876076846676386
Energy: 1.048813947073469
Energy: 0.8742329800098717
Energy: 1.1747882750047316
Energy: 1.0333128532822904
Energy: 1.1747882750047316
Energy: 0.9341860460891402
Energy: 1.0579379264057738
Energy: 0.8612172957622961
Energy: 1.0579379264057738
Energy: 0.8891149014502042
Energy: 0.9392178039967183
Energy: 0.878970540310006
Energy: 0.9392178039982411
Energy: 1.0050547486571206
Energy: 0.9938148687987506
Energy: 0.94226321182851
Energy: 0.9938148687979892
Energy: 0.8938563813713213
Energy: 1.0543520539673663
Energy: 0.8959255610460872
Energy: 1.054352053968128
Energy: 0.9560323712070965
Energy: 1.0039543389043875
Energy: 0.9201578383174511
Energy: 1.0039543389051488
Energy: 0.8973136472626138
Energy: 1.086208698544024
Energy: 0.8972574387744343
Energy: 1.086208698544024
Energy: 0.8685409404406874
Energy: 0.9992379417986108
Energy: 0.9475035661339279
Energy: 0.9992379417978494
Energy: 0.9125098584092239
Energy: 0.8862268348045657
Energy: 0.8649568203966215
Energy: 0.8862268348038043

minimum gb energy = 0.8113991853156807 eV
minimum distance =  2.32920952000236 Angstroms
sigma value = 1


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

Energy: 1.016472052364135
Energy: 1.0672389821336783
Energy: 0.9799381682034609
Energy: 1.0672389821310742
Energy: 0.9335785765878415
Energy: 1.1970013653822327
Energy: 0.9366885712946157
Energy: 1.1970013653813647
Energy: 1.071172975488745
Energy: 1.0529239034141529
Energy: 0.9829289574655338
Energy: 1.052923903416718
Energy: 0.9039059502216052
Energy: 0.9045679696462053
Energy: 0.8974993733639351
Energy: 0.9045679696444691
Energy: 0.9040205778522097
Energy: 1.130640568344139
Energy: 1.0494677964110262
Energy: 1.1306405683432708
Energy: 0.9943564875420687
Energy: 1.1358370222932228
Energy: 0.9383393737542409
Energy: 1.1358370222923544
Energy: 1.028166744828078
Energy: 1.087792700817518
Energy: 0.9226407008262079
Energy: 1.087792700817518
Energy: 0.8473311509545935
Energy: 1.0741672859995501
Energy: 0.8703058506069233
Energy: 1.0741672859995501
Energy: 0.9178827205163603
Energy: 0.9324137325819318
Energy: 1.0868103157360332
Energy: 0.9324137325819318
Energy: 0.877195349304433
Energy: 1.1449956154118808
Energy: 0.9586337330709496
Energy: 1.1449956154101446
Energy: 0.9190509824680959
Energy: 1.0897386105937705
Energy: 0.9431694764901423
Energy: 1.0897386105920341
Energy: 0.8841422723501107
Energy: 1.0594002959892976
Energy: 1.010259218477794
Energy: 1.0594002959892976
Energy: 0.9820550095213882
Energy: 1.1287328989278764
Energy: 0.9217219519454599
Energy: 1.1287328989287446
Energy: 0.9820175404673062
Energy: 1.1288632353716415
Energy: 0.978851423036467
Energy: 1.128863235369905
Energy: 0.8841015611270353
Energy: 1.059246397240786
Energy: 0.9498100298866907
Energy: 1.0592463972399178
Energy: 0.9191461364116824
Energy: 1.0895626651086447
Energy: 0.9232087389576994
Energy: 1.0895626651086447
Energy: 0.8771905303072585
Energy: 1.1450129652765029
Energy: 0.9058603373746736
Energy: 1.1450129652765029
Energy: 0.9178667736346039
Energy: 0.9323804781017934
Energy: 0.9523818577674563
Energy: 0.9323804781017934
Energy: 0.8473114911864127
Energy: 1.074007628138103
Energy: 0.8772407205480496
Energy: 1.0740076281372348
Energy: 1.028199175614832
Energy: 1.087694620236637
Energy: 0.9207419162773501
Energy: 1.087694620235769
Energy: 0.9944872736850513
Energy: 1.1355364351715556
Energy: 0.9396838717196628
Energy: 1.1355364351724235
Energy: 0.9040510090025771
Energy: 1.1307458117574958
Energy: 0.9129125640162673
Energy: 1.1307458117548912
Energy: 0.9039745442593105
Energy: 0.9042676090236844
Energy: 0.9059130470116745
Energy: 0.9042676090236844
Energy: 1.071337918724419
Energy: 1.052924793935716
Energy: 0.9504018226886936
Energy: 1.0529247939339796
Energy: 0.933520974159534
Energy: 1.1970542592788538
Energy: 0.9366172000791025
Energy: 1.1970542592771174
Energy: 1.016472052364135
Energy: 1.0672389821345465
Energy: 1.0701240327925992
Energy: 1.0672389821310742
Energy: 0.9335785765878415
Energy: 1.1970013653822327
Energy: 0.9366885712946157
Energy: 1.1970013653813647
Energy: 1.071172975488745
Energy: 1.0529239034141529
Energy: 1.0107210197230068
Energy: 1.052923903416718
Energy: 0.9039059502216052
Energy: 0.9045679696462053
Energy: 0.8904101376847501
Energy: 0.9045679696462053

minimum gb energy = 0.8473114911864127 eV
minimum distance =  2.28505074033606 Angstroms
sigma value = 25


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

Energy: 0.9551754463176325
Energy: 1.11821676199197
Energy: 1.093358818180121
Energy: 1.11821676199197
Energy: 0.992389111233374
Energy: 1.1484819989634305
Energy: 1.0150619468610547
Energy: 1.1484819989634305
Energy: 0.9456307362495078
Energy: 1.177303581079086
Energy: 0.9314468957749356
Energy: 1.177303581079086
Energy: 0.9247105704756616
Energy: 0.9586562788819056
Energy: 0.9347221977544276
Energy: 0.9586562788203926
Energy: 0.9355248393301003
Energy: 1.1634360886259758
Energy: 1.091079079616454
Energy: 1.1634360886259758
Energy: 1.0419713646808983
Energy: 1.1815568463623187
Energy: 1.0853876332059944
Energy: 1.1815568463623187
Energy: 0.9792988388461296
Energy: 1.1991658715991897
Energy: 0.9795483635751907
Energy: 1.1991658715991897
Energy: 1.137665839063127
Energy: 1.1234285399330106
Energy: 0.8994614778471238
Energy: 1.1234285399330106
Energy: 0.9796555852943912
Energy: 1.1114524704946793
Energy: 0.9786735946583817
Energy: 1.1114524704946793
Energy: 0.9332396533807593
Energy: 1.182098282094147
Energy: 0.9151877961182868
Energy: 1.182098282093138
Energy: 0.9698321294007433
Energy: 1.1167856982092426
Energy: 0.9904424049430742
Energy: 1.1167856982092426
Energy: 0.9570520909846967
Energy: 1.1537304657566483
Energy: 1.1046045950117747
Energy: 1.1537304657566483
Energy: 0.9315121600377719
Energy: 1.051547939118617
Energy: 0.9281664246910766
Energy: 1.0515479391196263
Energy: 0.9806423967971976
Energy: 1.0211316934575863
Energy: 0.9794552682128554
Energy: 1.0211316934585952
Energy: 1.0095348958507067
Energy: 1.1651845464838242
Energy: 0.8983979810187065
Energy: 1.1651845464838242
Energy: 1.0351016220553566
Energy: 0.9759222149965504
Energy: 0.9676707002103353
Energy: 0.9759222149965504
Energy: 0.885394675169633
Energy: 1.1833113560575022
Energy: 0.8831906593166043
Energy: 1.1833113560575022
Energy: 0.9352768218254293
Energy: 1.1733750528852844
Energy: 0.9707163572213083
Energy: 1.1733750528842752
Energy: 0.9240465035577692
Energy: 0.9584967492910418
Energy: 0.935449870980307
Energy: 0.9584967493142067
Energy: 0.9793114694050182
Energy: 1.1786928970952038
Energy: 0.9566749369734959
Energy: 1.1786928970952038
Energy: 0.9601775834251556
Energy: 1.0892694927697395
Energy: 0.9569112656660358
Energy: 1.0892694927697395
Energy: 0.9572397440189898
Energy: 1.1283643118485303
Energy: 1.0417709821589685
Energy: 1.1283643118485303
Energy: 0.9906127148496409
Energy: 1.114577481672032
Energy: 1.0110642700118653
Energy: 1.114577481672032
Energy: 1.154159609401045
Energy: 1.1814995618682698
Energy: 0.933288105619538
Energy: 1.1814995618682698
Energy: 1.1653493241585233
Energy: 0.9591071423076408
Energy: 0.9625907455638765
Energy: 0.95910714230865

minimum gb energy = 0.8831906593166043 eV
minimum distance =  2.28577240053987 Angstroms
sigma value = 9


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

Energy: 1.0008562344379035
Energy: 1.189036710253936
Energy: 1.0863695661949904
Energy: 1.189036710256344
Energy: 1.0270045425452792
Energy: 1.106824337947334
Energy: 1.0733128366019686
Energy: 1.1068243380303453
Energy: 0.9916590447769599
Energy: 1.0507840104369328
Energy: 0.9568529301305039
Energy: 1.0507840104369328
Energy: 1.217357139326792
Energy: 1.0244783999224096
Energy: 0.9793021478007182
Energy: 1.0244783999212057
Energy: 1.1327337889499263
Energy: 1.1073980657779183
Energy: 1.1318846117183023
Energy: 1.1073980657779183
Energy: 0.913884441420136
Energy: 1.0513139213697955
Energy: 1.2681721962380965
Energy: 1.0513139213685918
Energy: 1.1311466934046663
Energy: 0.9490299945188571
Energy: 1.0148041502008465
Energy: 0.9490299945188571
Energy: 1.0685979692666376
Energy: 1.0603669271661778
Energy: 0.9382224124724635
Energy: 1.0603669271661778
Energy: 1.0795614106916187
Energy: 1.1074084116182172
Energy: 1.0619504511861264
Energy: 1.1074084127349062
Energy: 1.001323239078168
Energy: 1.0487758183553588
Energy: 1.0134539859029672
Energy: 1.0487758183553588
Energy: 0.9722396704407941
Energy: 1.1142254896811057
Energy: 0.9887361095215129
Energy: 1.1142254896811057
Energy: 1.078987306522455
Energy: 1.2268465117571064
Energy: 0.9803279287854564
Energy: 1.2268465117571064
Energy: 0.9124772329510574
Energy: 1.2622228036091994
Energy: 0.9522169068477381
Energy: 1.2622228036079952
Energy: 1.0441406656211363
Energy: 1.0363709509115704
Energy: 1.1156976643554037
Energy: 1.0363709509103667
Energy: 0.9124878696445805
Energy: 1.26216688472826
Energy: 1.0687947024480198
Energy: 1.262166884729464
Energy: 1.078966436762986
Energy: 1.228329174230257
Energy: 0.9806856076787712
Energy: 1.228329174230257
Energy: 0.9723903326061203
Energy: 1.1143912566373322
Energy: 0.9562437326718359
Energy: 1.1143912566373322
Energy: 1.00128101672404
Energy: 1.048751944723257
Energy: 1.0131101036073118
Energy: 1.048751944722053
Energy: 1.0794768506097956
Energy: 1.1066774046662133
Energy: 1.0320291396474364
Energy: 1.1066773342247744
Energy: 1.0685726207459252
Energy: 1.0604055576490632
Energy: 0.9383087295094271
Energy: 1.0604055576466553
Energy: 1.1311531232100986
Energy: 0.9488335503146759
Energy: 1.014805344891673
Energy: 0.9488335503146759

minimum gb energy = 0.9124772329510574 eV
minimum distance =  2.38014360505623 Angstroms
sigma value = 25


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

Energy: 0.9650897102163798
Energy: 1.159782611839613
Energy: 1.1665053615264946
Energy: 1.159782611839613
Energy: 0.9466875191796915
Energy: 1.1731563484622831
Energy: 0.9324964908444013
Energy: 1.173156348463772
Energy: 1.0638777206445946
Energy: 1.2957648572505716
Energy: 0.9329556999430335
Energy: 1.2957648572505716
Energy: 1.394198714405457
Energy: 1.1861283442897634
Energy: 1.1332997754616754
Energy: 1.1861283442912525
Energy: 1.133289438807004
Energy: 1.0625023341679596
Energy: 1.0156607795442478
Energy: 1.0625023341694484
Energy: 0.9323284863103897
Energy: 1.2350769277670985
Energy: 1.3590675873786273
Energy: 1.2350769277670985
Energy: 1.0412918786525118
Energy: 1.1470550161727275
Energy: 1.0634166269704641
Energy: 1.1470550161727275
Energy: 1.2535753783872337
Energy: 1.2073517808447507
Energy: 1.0179228244040925
Energy: 1.2073517808447507
Energy: 0.9329514219776411
Energy: 1.0607576997228574
Energy: 1.0014408992928578
Energy: 1.0607576997243462
Energy: 1.2083699023114782
Energy: 1.2601832374970288
Energy: 1.0627571760149186
Energy: 1.2601832374970288
Energy: 0.9773567199591023
Energy: 1.2635182167815908
Energy: 1.3209995528324665
Energy: 1.2635182167815908
Energy: 1.0626235175086884
Energy: 1.0230198386148461
Energy: 1.1577258266483248
Energy: 1.0230198386148461
Energy: 1.127127461575306
Energy: 1.235330397799405
Energy: 0.9317200534916193
Energy: 1.2353303977979162
Energy: 1.0635603555466708
Energy: 1.1310301059061922
Energy: 1.0939325755044311
Energy: 1.1310301059061922
Energy: 1.017012337082851
Energy: 1.13171889673644
Energy: 1.2543374056400765
Energy: 1.1317188967379288
Energy: 1.0007488432939895
Energy: 1.2816872985417613
Energy: 0.935700087642528
Energy: 1.2816872985417613
Energy: 1.0633614148145143
Energy: 1.026784471644422
Energy: 1.2068255247445905
Energy: 1.026784471644422

minimum gb energy = 0.9317200534916193 eV
minimum distance =  2.36426571934188 Angstroms
sigma value = 17


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

Energy: 1.0438401016412477
Energy: 1.3077125020697533
Energy: 1.3145714534327981
Energy: 1.3077125020697533
Energy: 1.1256265043577678
Energy: 1.0841508098544623
Energy: 0.9542553159565003
Energy: 1.0841508098553054
Energy: 1.2529445060214182
Energy: 1.2503933601394739
Energy: 0.9544381094768404
Energy: 1.2503933601394739
Energy: 1.0433737907475695
Energy: 1.2581088589801044
Energy: 1.136652626514897
Energy: 1.2581088589809475
Energy: 1.183518784744676
Energy: 1.1105280483577662
Energy: 1.1883072504004588
Energy: 1.11052804835608
Energy: 0.9650030588076438
Energy: 1.0579061665863114
Energy: 1.4060210050331852
Energy: 1.057906166893117
Energy: 1.0610174348041201
Energy: 1.0655155532259681
Energy: 1.0924054879737217
Energy: 1.0655155532268115
Energy: 1.2579449114266168
Energy: 1.0596521821658775
Energy: 0.9646097605603755
Energy: 1.059652182167564
Energy: 1.0414632109586193
Energy: 1.2375510678907764
Energy: 1.21554001276938
Energy: 1.237551067889933
Energy: 1.296927985040213
Energy: 1.1740826386615346
Energy: 1.0466379334358107
Energy: 1.1740826386615346
Energy: 0.9542727408836822
Energy: 1.1017089693196382
Energy: 1.4023390704863583
Energy: 1.1017089693204813
Energy: 1.071944034151891
Energy: 1.0650505389242702
Energy: 1.1106400775659018
Energy: 1.0650505389259566
Energy: 1.3727917280704915
Energy: 1.0442386589774943
Energy: 1.0493845411734302
Energy: 1.0442386589344916
Energy: 0.9545522540730751
Energy: 1.1623831701382674
Energy: 1.1662640263483512
Energy: 1.162383170187134
Energy: 1.1126123572624413
Energy: 1.0655655247570484
Energy: 1.0812969472009872
Energy: 1.0655655247578917
Energy: 1.162129575412644
Energy: 1.254056458043536
Energy: 1.1642299295948217
Energy: 1.254056458043536
Energy: 1.0596552065691052
Energy: 1.1511683099656684
Energy: 1.256093974332416
Energy: 1.1511683099656684
Energy: 1.3703623389843087
Energy: 1.288718187187672
Energy: 0.9649681216116495
Energy: 1.288718187187672
Energy: 0.9980357511518323
Energy: 1.1810729551023444
Energy: 1.025583852601818
Energy: 1.181072955099815
Energy: 1.0721850616024027
Energy: 1.058490341971013
Energy: 1.0698386758783827
Energy: 1.0584903419684835
Energy: 1.0585772941808758
Energy: 1.094111258195501
Energy: 1.1620148066075031
Energy: 1.0941112581971875
Energy: 1.0345227621159638
Energy: 1.1092849132134879
Energy: 1.2955518295960209
Energy: 1.1092849132143312
Energy: 1.1724156686800629
Energy: 1.2344090553275326
Energy: 0.9517446919966317
Energy: 1.2344090553275326
Energy: 1.0556444081410252
Energy: 1.1828934339532358
Energy: 1.2163863407651825
Energy: 1.1828934339515496
Energy: 1.0436175722322285
Energy: 1.3234893455759846
Energy: 1.2181432531559
Energy: 1.3234893455759846
Energy: 1.2832219327326309
Energy: 1.101866648071674
Energy: 0.9531293273893985
Energy: 1.1018666483093378
Energy: 1.016241825805166
Energy: 1.2566644086543044
Energy: 1.3137502024131538
Energy: 1.256664408653461
Energy: 1.1629900153286898
Energy: 1.0589449608581387
Energy: 1.1631770785016384
Energy: 1.058944960839627
Energy: 1.2558656593877202
Energy: 1.1957591946996795
Energy: 1.0609890842702265
Energy: 1.1957591946996795
Energy: 0.9647042605600129
Energy: 1.183461627396234
Energy: 1.2223038766830077
Energy: 1.1834616273953908

minimum gb energy = 0.9517446919966317 eV
minimum distance =  2.27219568757326 Angstroms
sigma value = 53


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

Energy: 0.8986038812881576
Energy: 0.8984614357171529
Energy: 1.3240881649456702
Energy: 0.8984614357190941
Energy: 1.1825731747924064
Energy: 1.202015341386747
Energy: 1.1507233696267565
Energy: 1.202015341386747
Energy: 0.9173076864616876
Energy: 0.918621061938605
Energy: 1.1652702530124133
Energy: 0.9186210619405462
Energy: 0.9173906402468786
Energy: 0.9182838611887676
Energy: 1.0473075114509451
Energy: 0.9182838611887676
Energy: 1.1825386663351716
Energy: 1.201961204848118
Energy: 1.067808248588414
Energy: 1.201961204848118
Energy: 0.8986038812881576
Energy: 0.8984614357171529
Energy: 1.3732541130731366
Energy: 0.8984614357171529
Energy: 1.1825731747943478
Energy: 1.202015341386747
Energy: 1.1507233696267565
Energy: 1.202015341386747
Energy: 0.9173076864616876
Energy: 0.9186210619405462
Energy: 1.1652702530143546
Energy: 0.9186210619405462
Energy: 0.9173906402468786
Energy: 0.9182838611868264
Energy: 1.0726587453733147
Energy: 0.9182838611868264
Energy: 1.1825386663332302
Energy: 1.201961204848118
Energy: 1.050292754486843
Energy: 1.201961204848118
Energy: 0.8986038812881576
Energy: 0.8984614357190941
Energy: 1.453799132665479
Energy: 0.8984614357190941
Energy: 1.1825731747924064
Energy: 1.202015341386747
Energy: 1.1507233696267565
Energy: 1.202015341388688
Energy: 0.9173076864616876
Energy: 0.9186210619405462
Energy: 1.1652702530143546
Energy: 0.9186210619405462

minimum gb energy = 0.8984614357171529 eV
minimum distance =  2.3427681646544 Angstroms
sigma value = 9


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

Energy: 0.9906218042892488
Energy: 1.3351527192181665
Energy: 1.5018733148187333
Energy: 1.3351527192188848
Energy: 1.3219041810047858
Energy: 1.1032076651227911
Energy: 1.0711781464800398
Energy: 1.1032076651220728
Energy: 1.207449092047509
Energy: 1.1980278812455736
Energy: 1.0117921022554979
Energy: 1.1980278812470107
Energy: 1.4272937720790768
Energy: 1.279741917862304
Energy: 1.0955898149945704
Energy: 1.2797419178615856
Energy: 1.3575336723766733
Energy: 1.0377414169084784
Energy: 1.0589016047773028
Energy: 1.037741416909197
Energy: 0.9794388979180145
Energy: 0.9793718990128166
Energy: 1.4737824615220587
Energy: 0.9793718990128166
Energy: 1.48495817128523
Energy: 1.3928413941392686
Energy: 1.0568696822418182
Energy: 1.39284139413855
Energy: 1.2084777495169414
Energy: 1.316936991151677
Energy: 1.2563744829527457
Energy: 1.3169369911509585
Energy: 1.2142515243414584
Energy: 1.364802745716745
Energy: 0.9880610152313138
Energy: 1.364802745716745
Energy: 1.0602655506455132
Energy: 1.082057794487743
Energy: 1.0437467027454712
Energy: 1.082057794487743
Energy: 1.1157425806198862
Energy: 1.3543897898674213
Energy: 1.4416546065794587
Energy: 1.3543897898674213
Energy: 1.3173656313282123
Energy: 1.3291770929484101
Energy: 1.0226583718442595
Energy: 1.3291770929469735
Energy: 1.0735046731784832
Energy: 1.085507816900356
Energy: 1.3491746323613132
Energy: 1.0855078168982004
Energy: 1.42675931590386
Energy: 1.3034844424886667
Energy: 0.9940035549950159
Energy: 1.3034844424879486
Energy: 1.0591998333983903
Energy: 1.2291744719276954
Energy: 1.2325811345764952
Energy: 1.2291744719284137
Energy: 1.0411752287143248
Energy: 1.2882853641786731
Energy: 1.2486099698759825
Energy: 1.2882853641793917
Energy: 1.1466303681253667
Energy: 1.2305061427866588
Energy: 1.0593373963947796
Energy: 1.2305061427866588
Energy: 1.1038797364973048
Energy: 1.0345566585578807
Energy: 1.271955516450204
Energy: 1.0345566585593176
Energy: 1.4697822933091913
Energy: 1.171881360961757
Energy: 0.9823316456559119
Energy: 1.1718813609610386
Energy: 1.0179179161870027
Energy: 1.1106173006754225
Energy: 1.224651343809376
Energy: 1.1106173006732671
Energy: 1.2593418461589179
Energy: 1.3689633031520514
Energy: 1.2576950316610842
Energy: 1.3689633031520514
Energy: 1.1398597204911112
Energy: 1.1569646782542296
Energy: 1.0573103839062066
Energy: 1.1569646782542296
Energy: 0.9882829807032766
Energy: 1.171395647681931
Energy: 1.142679501880099
Energy: 1.1713956476826493
Energy: 1.4375181840112734
Energy: 1.2234087559002034
Energy: 1.113371832674584
Energy: 1.2234087559009221
Energy: 1.05621746646045
Energy: 1.2945743846486057
Energy: 1.403139180455138
Energy: 1.2945743846486057
Energy: 1.189794526823792
Energy: 0.9795940909662126
Energy: 1.1106951335576847
Energy: 0.9795940909654942
Energy: 1.1215565120845719
Energy: 1.2322302923193493
Energy: 1.2729641012513617
Energy: 1.2322302923193493
Energy: 0.9957677170140004
Energy: 1.2637212755346066
Energy: 1.2760914099960794
Energy: 1.2637212755338882
Energy: 1.1292023289064226
Energy: 0.9796052045250361
Energy: 1.109317566149401
Energy: 0.9796052045271915
Energy: 1.0230478888079293
Energy: 1.3980709326163459
Energy: 1.4211628674936043
Energy: 1.3980709326177827
Energy: 1.3588426579738386
Energy: 1.3525416646436978
Energy: 1.1125317725884305
Energy: 1.3525416646436978
Energy: 0.9788777027741881
Energy: 1.0363540626695384
Energy: 1.14215906007553
Energy: 1.0363540626681018
Energy: 0.9803088715705018
Energy: 1.1563283027079287
Energy: 1.206366116849897
Energy: 1.15632830270721
Energy: 1.2615738573603728
Energy: 1.288986155228383
Energy: 1.2556123373873793
Energy: 1.288986155228383
Energy: 1.0188386523350195
Energy: 1.215173848651302
Energy: 1.4890622139854968
Energy: 1.2151738486520207

minimum gb energy = 0.9788777027741881 eV
minimum distance =  2.29894688816458 Angstroms
sigma value = 73


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

Energy: 1.0532084662078702
Energy: 1.0520989189356855
Energy: 1.4846991928600692
Energy: 1.0520989189721361
Energy: 1.2544856691703874
Energy: 1.202696471962369
Energy: 1.053075946626806
Energy: 1.202696471962369
Energy: 1.0996995081174832
Energy: 1.0572376373731636
Energy: 1.004959122508307
Energy: 1.0572376373743033
Energy: 1.2513336587573674
Energy: 1.1449448694483537
Energy: 1.1667409130278952
Energy: 1.1449448694494937
Energy: 1.1321920066282887
Energy: 1.124593184688764
Energy: 0.9906118192326172
Energy: 1.124593184689904
Energy: 1.155723326991551
Energy: 1.0082436328721451
Energy: 1.4093599739466054
Energy: 1.0082436328721451
Energy: 1.4941382508654202
Energy: 1.2684158075193481
Energy: 1.101387260398216
Energy: 1.268415807520488
Energy: 1.0849840577439351
Energy: 1.2019647565584808
Energy: 1.3375443321455687
Energy: 1.2019647565584808
Energy: 1.4200874648161481
Energy: 0.9802229255703329
Energy: 0.9805437775017058
Energy: 0.9802229255703329
Energy: 1.0584430203502198
Energy: 1.1657008876543238
Energy: 0.9807524291514468
Energy: 1.1657008876531838
Energy: 1.07949388729186
Energy: 1.0568867412342824
Energy: 1.3780827847572277
Energy: 1.0568867412331424
Energy: 1.2789885481990848
Energy: 1.1710349981033579
Energy: 1.0697009470977765
Energy: 1.1710349981056376
Energy: 1.117325722695477
Energy: 1.1885427729612286
Energy: 1.2854958984136562
Energy: 1.1885427729612286
Energy: 1.3794189349698873
Energy: 1.1708741437403931
Energy: 1.1408275090691018
Energy: 1.170874143741533
Energy: 0.9907094811016234
Energy: 1.2619713966735082
Energy: 1.384670600731626
Energy: 1.2619713966723682
Energy: 1.333574960207537
Energy: 1.1904571766567718
Energy: 1.0525210118509938
Energy: 1.1904571766567718
Energy: 1.0526726944562221
Energy: 1.116315799026142
Energy: 1.0997789630173536
Energy: 1.116315799026142
Energy: 1.051830718100789
Energy: 1.0738651114984048
Energy: 1.1051103726727802
Energy: 1.0738651114904254
Energy: 1.041083236728116
Energy: 0.9796312836029439
Energy: 1.143362938616045
Energy: 0.9796312836029439
Energy: 1.0604830152688316
Energy: 1.3766955550843891
Energy: 1.4553384758164747
Energy: 1.3766955550832494
Energy: 1.3829709479671397
Energy: 1.142338181907832
Energy: 1.1548786127725266
Energy: 1.142338181907832
Energy: 1.1252253944788935
Energy: 1.1131783034972302
Energy: 1.4164767774529012
Energy: 1.1131783034972302

minimum gb energy = 0.9796312836029439 eV
minimum distance =  2.30985286644783 Angstroms
sigma value = 7


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

Energy: 1.0512847248586266
Energy: 1.066354699691139
Energy: 1.4863904961165928
Energy: 1.066354699690333
Energy: 1.528642374717187
Energy: 1.1385264432800397
Energy: 1.1159602379546174
Energy: 1.1385264432800397
Energy: 1.086011070973474
Energy: 1.164305882271186
Energy: 1.0696580025540865
Energy: 1.16430588227038
Energy: 1.3149093113387413
Energy: 1.1196340029197702
Energy: 1.1068371956252283
Energy: 1.1196340029181582
Energy: 1.1085077107510615
Energy: 1.1409618110456765
Energy: 1.0043276907532954
Energy: 1.1409618110448705
Energy: 1.0835210447178718
Energy: 1.056245876196696
Energy: 1.3827484088417186
Energy: 1.056245876196696
Energy: 1.3504144576738306
Energy: 1.1549569104622766
Energy: 1.1705175208681589
Energy: 1.1549569104582464
Energy: 1.080194778733901
Energy: 1.0010196746570441
Energy: 1.469691189938592
Energy: 1.0010196746578501
Energy: 1.317840725119396
Energy: 1.1357823692612665
Energy: 1.1013976833567578
Energy: 1.1357823692628783
Energy: 1.0711441734961342
Energy: 1.1800714445482867
Energy: 1.4041184005531264
Energy: 1.1800714445482867
Energy: 1.078487746502071
Energy: 1.1923900601842508
Energy: 1.1625798736031496
Energy: 1.1923900601834447
Energy: 1.0025719580417936
Energy: 1.1730500450733397
Energy: 1.1166257609894885
Energy: 1.1730500450749515
Energy: 1.0101642559523758
Energy: 1.0721012011530442
Energy: 1.252284659710858
Energy: 1.0721012011530442
Energy: 1.1975678404005003
Energy: 0.9970749243711788
Energy: 1.20118887433576
Energy: 0.9970749243695667
Energy: 1.0652427235806583
Energy: 1.2960810222525607
Energy: 1.3752877223130935
Energy: 1.2960810222525607
Energy: 1.4198374125320383
Energy: 1.0606643484880305
Energy: 1.1135763248254176
Energy: 1.060664348328511
Energy: 1.0520678466671403
Energy: 1.0899531937681506
Energy: 1.3115567697470272
Energy: 1.0899531937689566
Energy: 1.0147811809292677
Energy: 1.0702131814815372
Energy: 1.117196405284283
Energy: 1.0702131814815372
Energy: 1.0522946516665057
Energy: 1.1080563467980349
Energy: 1.1499241212953095
Energy: 1.108056346798841
Energy: 1.0603410199644638
Energy: 1.134408587956657
Energy: 1.190147910010637
Energy: 1.1344085879574632
Energy: 1.1289942096744237
Energy: 1.2079298112174872
Energy: 1.0864974329428356
Energy: 1.2079298112448553
Energy: 1.111485112365263
Energy: 1.1865475133154864
Energy: 1.3049945765669584
Energy: 1.186547513313874
Energy: 1.3992985130592146
Energy: 1.1160712789222895
Energy: 1.1193818542056193
Energy: 1.1160712789166476
Energy: 1.0549390408696844
Energy: 1.0509095121992633
Energy: 1.5218865269556041
Energy: 1.0509095121944274
Energy: 1.2826885362946452
Energy: 1.157708404917394
Energy: 1.0495877958222357
Energy: 1.157708404915782
Energy: 1.1696729874089624
Energy: 1.161984259893425
Energy: 1.0795866141519919
Energy: 1.161984259893425
Energy: 1.0734754066022612
Energy: 1.1484355369289398
Energy: 1.0476656594350477
Energy: 1.148435536928134
Energy: 1.292764207429157
Energy: 1.1190603218804493
Energy: 1.0857982839801144
Energy: 1.1190603218796433
Energy: 1.0819856442829652
Energy: 1.0003348888308088
Energy: 1.2941069183283664
Energy: 1.0003348888300028
Energy: 1.360602591403658
Energy: 1.2370735608748606
Energy: 1.1303624423196792
Energy: 1.2370735608748606
Energy: 1.060336811125311
Energy: 1.000695058216982
Energy: 1.305639610895993
Energy: 1.00069505821537

minimum gb energy = 0.9970749243695667 eV
minimum distance =  2.2971278628694 Angstroms
sigma value = 29


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

Energy: 0.9428588606125432
Energy: 0.9423440747438476
Energy: 1.479054286086893
Energy: 0.942344074743567
Energy: 1.4061194919940678
Energy: 1.17417098924361
Energy: 0.9407665560210924
Energy: 1.17417098924361
Energy: 1.0231692451484034
Energy: 1.1268611216517859
Energy: 1.1602095456662698
Energy: 1.1268611216520663
Energy: 0.9410283332873671
Energy: 0.9130236943279938
Energy: 1.1734652617377679
Energy: 0.9130236943268707
Energy: 0.9434760116970413
Energy: 0.913669607918308
Energy: 1.1615637825558263
Energy: 0.9136696079191191
Energy: 1.171526163903494
Energy: 0.9923141350226166
Energy: 1.171496390395195
Energy: 0.9923141350226166
Energy: 0.9416629039003801
Energy: 0.9131215908033963
Energy: 0.9434562707774321
Energy: 0.9131215908044881
Energy: 1.1748734761376691
Energy: 0.9133155794493696
Energy: 0.9407959617553716
Energy: 0.9133155794488392
Energy: 1.1600489024081029
Energy: 1.1268621137576944
Energy: 1.3407798768842876
Energy: 1.1268621137576944

minimum gb energy = 0.9130236943268707 eV
minimum distance =  2.33641844156943 Angstroms
sigma value = 5


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

Energy: 0.9508731861538647
Energy: 1.0173062770779573
Energy: 1.2937824146240242
Energy: 1.0173062770802417
Energy: 1.4618016954332957
Energy: 1.1555764700302713
Energy: 0.9426598112122881
Energy: 1.1555764700317939
Energy: 0.9253110894398258
Energy: 1.036424859471851
Energy: 1.1613852016463833
Energy: 1.0364248594726124
Energy: 1.011174301580611
Energy: 1.068688417083848
Energy: 0.9377351362476501
Energy: 1.068688417085371
Energy: 0.9534650839862292
Energy: 0.9964630207717017
Energy: 1.2307810230873073
Energy: 0.9964630207724631
Energy: 0.9588852574076328
Energy: 1.0398421765185206
Energy: 0.9316500751491852
Energy: 1.0398421765200432
Energy: 0.9279253143593093
Energy: 1.001934279293025
Energy: 0.9265743872687053
Energy: 1.0019342792922636
Energy: 0.9348454617637462
Energy: 0.946744885320309
Energy: 0.9497758422922743
Energy: 0.946744885320309
Energy: 0.9334049892587757
Energy: 1.103730123819729
Energy: 0.9556029651100418
Energy: 1.1037301238174448
Energy: 0.9403822668826437
Energy: 0.9974018402414055
Energy: 0.9300661679089786
Energy: 0.9974018402398828
Energy: 0.9668531025026772
Energy: 1.1721990436873397
Energy: 0.9257784735605886
Energy: 1.1721990436865783
Energy: 0.9579727974743674
Energy: 0.9706455045437796
Energy: 1.0569765588861273
Energy: 0.9706455045293132
Energy: 1.083308584316853
Energy: 0.9458599272484574
Energy: 0.9493637619686351
Energy: 0.9458599272492186
Energy: 0.9345956422511952
Energy: 1.057279820677862
Energy: 1.2152984027545135
Energy: 1.0572798206771006
Energy: 1.4878553991484984
Energy: 1.1825458018693384
Energy: 0.925982390794791
Energy: 1.182545801868577
Energy: 0.935424381743681
Energy: 1.0130595423977342
Energy: 1.4546099119793736
Energy: 1.0130595423969728
Energy: 1.144332483495271
Energy: 0.9279883989709835
Energy: 0.9525632074843593
Energy: 0.927988398971745
Energy: 0.9321213925890515
Energy: 1.040522036879595
Energy: 1.1222999742224442
Energy: 1.0405220368788335
Energy: 0.9817896028873611
Energy: 1.0022350077025262
Energy: 0.9345277163020641
Energy: 1.0022350077017648
Energy: 0.9510146091792263
Energy: 1.0604285860100373
Energy: 0.9396088003542414
Energy: 1.0604285860100373
Energy: 0.9653493206954562
Energy: 1.0961332313363528
Energy: 0.9330368873302347
Energy: 1.096133231338637
Energy: 0.9458025429656471
Energy: 0.9964760046994896
Energy: 0.9330413988170915
Energy: 0.9964760046972054
Energy: 0.9293392913242913
Energy: 1.1745345011570203
Energy: 0.9690323267274096
Energy: 1.1745345011577815
Energy: 1.056996044333394
Energy: 0.9504742524579511
Energy: 0.9568144581813829
Energy: 0.9504742524579511
Energy: 1.0225356876275418
Energy: 1.1007243030584062
Energy: 0.9413937647059806
Energy: 1.1007243030591676
Energy: 0.9636260762290895
Energy: 0.9920907032115572
Energy: 0.9364900651722395
Energy: 0.9920907032092731
Energy: 0.9284454755565136
Energy: 0.918411384574122
Energy: 1.061913090888873
Energy: 0.918411384574122
Energy: 1.2461964017561566
Energy: 1.1450675029202668
Energy: 0.934121371647085
Energy: 1.1450675029210282
Energy: 0.931323501687381
Energy: 1.1354041687726537
Energy: 1.5031178927447344
Energy: 1.1354041687726537
Energy: 1.1234536078741983
Energy: 1.0404904404109947
Energy: 0.9321454676030717
Energy: 1.0404904404125175
Energy: 0.9311950213065524
Energy: 0.9399403773095668
Energy: 1.3313433737459033
Energy: 0.9399403773103282
Energy: 1.1432354232517994
Energy: 1.0024993931571544
Energy: 0.9477882025095129
Energy: 1.0024993931571544
Energy: 0.937206456357861
Energy: 1.1737277952286804
Energy: 0.9899890627720589
Energy: 1.173727795227919

minimum gb energy = 0.918411384574122 eV
minimum distance =  2.27582283981264 Angstroms
sigma value = 1


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

Energy: 1.0068139678329415
Energy: 1.080369792570241
Energy: 1.285557652126716
Energy: 1.080369792570241
Energy: 1.2676204987959683
Energy: 0.8778071868527582
Energy: 0.8972848646544196
Energy: 0.8778071868517054
Energy: 0.8899584312981074
Energy: 0.90737096170153
Energy: 1.0776469709069763
Energy: 0.9073709617036354
Energy: 0.9041167896977019
Energy: 0.9729823625409387
Energy: 0.8976812204251835
Energy: 0.9729823625419914
Energy: 0.896307073590984
Energy: 0.9036477845207951
Energy: 1.1568701928204235
Energy: 0.9036477845207951
Energy: 0.8953748056598643
Energy: 1.0993300520309919
Energy: 0.897693656795666
Energy: 1.0993300520320446
Energy: 0.8900157543039944
Energy: 1.001024364669713
Energy: 1.0242207249581647
Energy: 1.0010243646686603
Energy: 0.8902695178331987
Energy: 0.9094160524591498
Energy: 0.8985160179888062
Energy: 0.9094160524570444
Energy: 0.9063898027067885
Energy: 0.9123371371468173
Energy: 0.9657827244541772
Energy: 0.9123371371478701
Energy: 0.9064051606946616
Energy: 1.131188773057919
Energy: 0.9440373756960511
Energy: 1.1311887730589716
Energy: 0.8906338090632866
Energy: 0.9088294020540995
Energy: 0.9155534458855766
Energy: 0.908829402051994
Energy: 0.8901291127896949
Energy: 1.1028658565088116
Energy: 1.0563715650416454
Energy: 1.1028658565077591
Energy: 0.8955183109552933
Energy: 1.1772181248193914
Energy: 0.8995233721876288
Energy: 1.1772181248183389
Energy: 0.896165272949452
Energy: 0.9096014074645518
Energy: 1.1744532491574606
Energy: 0.909601407463499
Energy: 0.9585430852457475
Energy: 0.9706419726187532
Energy: 0.8995389124919618
Energy: 0.9706419726187532
Energy: 0.8896886954869981
Energy: 0.9069330471931465
Energy: 1.1819374465619772
Energy: 0.9069330471931465
Energy: 1.0628297673102747
Energy: 1.295854645219458
Energy: 0.8940270279446606
Energy: 1.295854645219458
Energy: 1.0068139678329415
Energy: 1.080369792570241
Energy: 1.285605180795841
Energy: 1.080369792570241
Energy: 1.2676204987959683
Energy: 0.8778071868527582
Energy: 0.8972848646544196
Energy: 0.8778071868527582
Energy: 0.8899584312981074
Energy: 0.9073709617036354
Energy: 1.0776469709069763
Energy: 0.9073709617025827
Energy: 0.9041167896998075
Energy: 0.9729823625409387
Energy: 0.8976812204251835
Energy: 0.9729823625419914
Energy: 0.896307073590984
Energy: 0.9036477845207951
Energy: 1.1568701928204235
Energy: 0.9036477845207951
Energy: 0.8953748056598643
Energy: 1.0993300520309919
Energy: 0.8976936567946134
Energy: 1.0993300520320446
Energy: 0.8900157543039944
Energy: 1.001024364669713
Energy: 0.9029134605006015
Energy: 1.001024364669713

minimum gb energy = 0.8778071868517054 eV
minimum distance =  2.30023509295404 Angstroms
sigma value = 17


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

Energy: 0.9013677283816798
Energy: 0.9012626054991953
Energy: 1.3174393995345555
Energy: 0.901262605499846
Energy: 1.078605353645473
Energy: 0.8937534878468876
Energy: 0.88403854718192
Energy: 0.8937534878455862
Energy: 0.8815654193288661
Energy: 0.9796925479514924
Energy: 1.1106525492460226
Energy: 0.9796925479508417
Energy: 1.010887518463849
Energy: 1.0777753230922023
Energy: 0.8799267431832144
Energy: 1.0777753230922023
Energy: 0.8824977573769697
Energy: 0.8988251951581242
Energy: 1.1912922302328628
Energy: 0.8988251951574735
Energy: 0.9444772347965946
Energy: 1.2440227356269344
Energy: 0.8883508214919791
Energy: 1.2440227356262836
Energy: 0.8995504386934627
Energy: 1.0932251028560933
Energy: 0.8926318921366662
Energy: 1.0932251028560933
Energy: 0.8801145613150132
Energy: 1.1110778245086008
Energy: 0.8808851071180125
Energy: 1.1110778245086008
Energy: 0.9038268755678714
Energy: 1.110435404920603
Energy: 0.9460828866516501
Energy: 1.110435404920603
Energy: 0.9052574090560829
Energy: 1.112390704060838
Energy: 0.8903788859249891
Energy: 1.1123907040614887
Energy: 0.8862906002176569
Energy: 1.0972832992629489
Energy: 0.88872350199268
Energy: 1.0972832992635995
Energy: 0.8872130941282143
Energy: 0.9424656723554083
Energy: 0.8755305469891655
Energy: 0.9424656723547578
Energy: 0.8902975916180168
Energy: 1.1058343960122596
Energy: 0.8826883057444921
Energy: 1.1058343960122596
Energy: 0.8992690955589825
Energy: 1.1050498124360733
Energy: 0.9012933164934476
Energy: 1.1050498124373747
Energy: 0.8963452816455587
Energy: 1.1152904292634536
Energy: 0.9088934292618297
Energy: 1.115290429264755
Energy: 0.8869644145487243
Energy: 0.8953109867525134
Energy: 1.1895724080769787
Energy: 0.8953109867538149
Energy: 0.8835489902748921
Energy: 1.081690247573744
Energy: 0.8847524598549923
Energy: 1.081690247571792
Energy: 0.8766507416518713
Energy: 0.9873065904188065
Energy: 1.082255378059797
Energy: 0.9873065904188065
Energy: 1.430241130004781
Energy: 1.008185006324163
Energy: 0.883925648076807
Energy: 1.0081850063319713
Energy: 0.8853587881160264
Energy: 0.8926240009652313
Energy: 1.0948876732849784
Energy: 0.892624000965882
Energy: 1.36646198138848
Energy: 0.8881749264385914
Energy: 0.8975293562158779
Energy: 0.8881749264385914
Energy: 0.8971522352334288
Energy: 0.9895741815697012
Energy: 1.2407776685472633
Energy: 0.9895741815716533
Energy: 0.9897623851993785
Energy: 1.0867630371544421
Energy: 0.8864570018530123
Energy: 1.0867630371544421
Energy: 0.884034013933515
Energy: 0.8874379692860196
Energy: 1.1353523461205277
Energy: 0.8874379692879717
Energy: 0.9483240911739738
Energy: 0.987264529133816
Energy: 0.8783142574582394
Energy: 0.9872645291331653
Energy: 0.8850961407038612
Energy: 0.960002727984156
Energy: 0.8830974186272411
Energy: 0.9600027279835054
Energy: 1.0745805613756418
Energy: 1.1098593227458504
Energy: 0.8883311371981599
Energy: 1.109859322746501
Energy: 0.912774025343484
Energy: 1.115514943661104
Energy: 0.8964813355514604
Energy: 1.1155149436604537
Energy: 0.9011706600410692
Energy: 1.1051113981585787
Energy: 0.9012719068113968
Energy: 1.1051113981579281
Energy: 0.8845378787842253
Energy: 1.1056833914047366
Energy: 0.9059821747686977
Energy: 1.105683391406038
Energy: 0.8751443938362261
Energy: 0.956884356592447
Energy: 0.8762939047121294
Energy: 0.9568843565917963
Energy: 0.88591164709366
Energy: 1.0965785386268339
Energy: 0.8835609391288024
Energy: 1.0965785386261833
Energy: 0.8882230411489859
Energy: 1.1136017805707492
Energy: 1.0863236267414798
Energy: 1.1136017805713998
Energy: 0.9328208385772236
Energy: 1.1276085987369382
Energy: 0.8910340616783388
Energy: 1.1276085987362874
Energy: 0.8796961104675036
Energy: 0.986839868117924
Energy: 0.9075255540747735
Energy: 0.9868398681192254
Energy: 0.8927878414760823
Energy: 1.093740392890733
Energy: 0.9000763988152229
Energy: 1.093740392890733
Energy: 0.8866263871289326
Energy: 1.2384598810491652
Energy: 0.9447203886187342
Energy: 1.2384598810485146
Energy: 1.1923171876936403
Energy: 0.8988743692077856
Energy: 0.8853850320112293
Energy: 0.8988743710757101

minimum gb energy = 0.8751443938362261 eV
minimum distance =  2.30410981347015 Angstroms
sigma value = 89


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

Energy: 0.8002610972384963
Energy: 0.8012494020804365
Energy: 1.0756228853254244
Energy: 0.8012494020804365
Energy: 0.8016508221512889
Energy: 0.8225051945010777
Energy: 0.8119849925661686
Energy: 0.8225051945010777
Energy: 0.8102446702681072
Energy: 1.2083296261841758
Energy: 1.4725299493793027
Energy: 1.2083296261841758
Energy: 0.86298549684443
Energy: 0.8222008781629446
Energy: 0.8121240402215628
Energy: 0.8222008781646473
Energy: 0.8097647605566264
Energy: 1.1494492898998767
Energy: 1.4541987111836139
Energy: 1.1494492898998767
Energy: 0.8097599161482407
Energy: 0.8008195384214899
Energy: 0.8029090209956776
Energy: 0.8008195384214899
Energy: 0.8104665404852385
Energy: 0.942887398022625
Energy: 0.8004861074137456
Energy: 0.942887398022625
Energy: 0.8305132650246081
Energy: 1.2076296077674828
Energy: 0.8119855755272264
Energy: 1.2076296077674828
Energy: 0.8110390045395219
Energy: 0.8861942828962852
Energy: 0.8031822745188686
Energy: 0.8861942828962852
Energy: 0.8216612469529289
Energy: 1.1492610349459789
Energy: 0.810466396502897
Energy: 1.1492610349408714
Energy: 0.7999285009873571
Energy: 0.8228379640405502
Energy: 0.809600525203519
Energy: 0.8228379640388477
Energy: 0.8001293178531937
Energy: 0.9439871080667992
Energy: 0.8120699593942169
Energy: 0.9439871080667992
Energy: 0.8111546153884532
Energy: 1.1509250559656472
Energy: 0.8305889643298923
Energy: 1.1509250559656472
Energy: 0.8111273462686692
Energy: 0.8835722391699258
Energy: 0.8105718891780594
Energy: 0.8835722391699258
Energy: 0.8033765004960124
Energy: 1.1508444650384018
Energy: 0.8110839585404388
Energy: 1.1508444650384018

minimum gb energy = 0.7999285009873571 eV
minimum distance =  2.29304045548128 Angstroms
sigma value = 13


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

Energy: 0.7993567779085947
Energy: 1.0126806748867205
Energy: 1.1376637977101522
Energy: 1.0126806748867205
Energy: 1.265655071322129
Energy: 1.0248902965473083
Energy: 0.7741529896992427
Energy: 1.0248902965480218
Energy: 0.7783862955889537
Energy: 1.0348137945653495
Energy: 0.9705103139870445
Energy: 1.034813794562495
Energy: 0.7743984404725363
Energy: 1.024767406454241
Energy: 0.7720887687664914
Energy: 1.024767406454241
Energy: 0.7852064652040207
Energy: 1.1980554845701425
Energy: 0.8218335315936699
Energy: 1.1980554845694291
Energy: 0.7743632898087729
Energy: 0.9095082151243356
Energy: 0.7834077125881048
Energy: 0.9095082151243356
Energy: 0.782946401977236
Energy: 1.019545462500575
Energy: 1.0508276104258434
Energy: 1.0195454625012887
Energy: 0.7758977635944477
Energy: 1.045729632249681
Energy: 0.7836519209017254
Energy: 1.0457296322518217
Energy: 0.7829487154611074
Energy: 0.9564554918332278
Energy: 0.9844617548229264
Energy: 0.9564554918289463
Energy: 0.9509621077341206
Energy: 1.2460665637803767
Energy: 0.7719816488348351
Energy: 1.2460665637803767
Energy: 0.7844660968279379
Energy: 1.0149153189380646
Energy: 0.7706437649914915
Energy: 1.0149153189380646
Energy: 1.055768657167291
Energy: 1.2295787125850899
Energy: 0.7779022689315538
Energy: 1.2295787125836626
Energy: 0.8076344561730053
Energy: 0.7869421751473328
Energy: 0.7967119913156491
Energy: 0.786942179625995
Energy: 1.0277977070547002
Energy: 0.965882256809243
Energy: 0.7779353360925235
Energy: 0.9658822568113837
Energy: 0.7850736486536645
Energy: 0.9169847376327853
Energy: 0.7878815218203248
Energy: 0.9169847376220814
Energy: 0.7728625571443959
Energy: 0.9660452394024713
Energy: 0.7793300425425251
Energy: 0.9660452394031849
Energy: 0.7824079282422103
Energy: 1.1249449049321008
Energy: 0.7792139611843301
Energy: 1.1249449049356688
Energy: 0.8043252632783277
Energy: 0.8369561370652199
Energy: 0.7919624065030058
Energy: 0.8369561370637927
Energy: 0.783329749886743
Energy: 1.0971562345504366
Energy: 0.7922506820108683
Energy: 1.0971562345511505
Energy: 0.783042984739088
Energy: 1.0969863986314963
Energy: 0.7926957008385409
Energy: 1.0969863986336372
Energy: 0.8044888976229378
Energy: 0.8371591720985235
Energy: 0.7922207591051403
Energy: 0.8371591720978101
Energy: 0.7826982692814551
Energy: 1.1248175362398931
Energy: 0.7792071549922254
Energy: 1.1248175362391797
Energy: 0.7729301161778941
Energy: 0.9660925615792052
Energy: 0.7792430552802716
Energy: 0.9660925615820596
Energy: 0.7845620788120827
Energy: 0.9166406669280043
Energy: 0.7793536037204424
Energy: 0.916640666926577
Energy: 1.0494092382351519
Energy: 0.9661029548427861
Energy: 0.7778494934394227
Energy: 0.9661029548406453
Energy: 0.8078925100807619
Energy: 0.7869170971095395
Energy: 0.7855112345744795
Energy: 0.7869170971109667
Energy: 1.055355898492485
Energy: 1.2295076103634022
Energy: 0.7780288651436336
Energy: 1.2295076103634022
Energy: 0.7834606624831914
Energy: 1.0147679150753715
Energy: 0.7698956980754046
Energy: 1.014767915074658
Energy: 0.9512771802270962
Energy: 1.2460981129355804
Energy: 0.7719300891982581
Energy: 1.246098112936294
Energy: 0.7860514875865888
Energy: 0.9568288755148692
Energy: 0.9022025898058572
Energy: 0.9568288756304053
Energy: 0.7753033469764138
Energy: 1.0461151877195427
Energy: 0.7836175798992442
Energy: 1.0461151877216834
Energy: 0.7825849612946854
Energy: 1.0189669401227912
Energy: 1.136019264271846
Energy: 1.0189669401220776
Energy: 0.7745703651185003
Energy: 0.9091428053224998
Energy: 0.783680976768449
Energy: 0.9091428053246405
Energy: 0.7847500183748212
Energy: 1.2348299234143736
Energy: 1.0508006607062121
Energy: 1.234829923418655
Energy: 0.7738888784488394
Energy: 1.0259098039706247
Energy: 0.7720943220793957
Energy: 1.0259098039691974

minimum gb energy = 0.7698956980754046 eV
minimum distance =  2.28380058573609 Angstroms
sigma value = 37


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

Energy: 0.7331754589408378
Energy: 0.7325274959615524
Energy: 0.715193916409916
Energy: 0.7325274959603247
Energy: 1.183862620507015
Energy: 0.9250256280860892
Energy: 0.7066292221427306
Energy: 0.9250256280860892
Energy: 0.7135566935541399
Energy: 1.153432477993549
Energy: 1.3550461097644482
Energy: 1.153432477993549
Energy: 0.7017624579200222
Energy: 0.9251165720889597
Energy: 0.7066093662473865
Energy: 0.9251165720889597
Energy: 0.7055802546534305
Energy: 0.9252905088050711
Energy: 0.700451344899589
Energy: 0.9252905088050711
Energy: 0.7034024562221711
Energy: 0.9250348043674421
Energy: 0.702938958112498
Energy: 0.9250348043686698
Energy: 0.7229446857335512
Energy: 1.1388659547224702
Energy: 0.9418758843967568
Energy: 1.1388659547224702
Energy: 0.7055161216149876
Energy: 0.7332212968007935
Energy: 0.734081298691228
Energy: 0.7332212968007935
Energy: 0.705910404842475
Energy: 0.9254965758033901
Energy: 0.9408398040865458
Energy: 0.9254965758033901
Energy: 1.0167273274189552
Energy: 1.153446528780854
Energy: 0.7028635365468682
Energy: 1.153446528780854
Energy: 0.7228629032518117
Energy: 1.1393956512291796
Energy: 0.700643257023299
Energy: 1.139395651236546
Energy: 0.9542436395934398
Energy: 1.0278307361426766
Energy: 0.706765913845229
Energy: 1.0278307361439045
Energy: 0.7062475175911647
Energy: 1.0274827646705784
Energy: 0.7030878342146655
Energy: 1.0274827646718063
Energy: 0.9414207410089583
Energy: 1.1926599572308287
Energy: 0.7069909369003514
Energy: 1.1926599572320564
Energy: 0.7322308607754073
Energy: 0.7660270247741495
Energy: 0.7053167943911522
Energy: 0.7660270247741495
Energy: 0.732831930671334
Energy: 1.0275805042822626
Energy: 0.7067518997682829
Energy: 1.0275805042822626
Energy: 0.7003283299572738
Energy: 1.1549615544451874
Energy: 0.7198558528230155
Energy: 1.1549615544451874
Energy: 0.7007694571770455
Energy: 1.246515866277516
Energy: 0.7063658133240237
Energy: 1.246515866277516
Energy: 0.706800295592808
Energy: 1.0286729452409074
Energy: 0.7061370400678472
Energy: 1.0286729452396794
Energy: 0.7059014162275269
Energy: 1.0318359454781523
Energy: 0.7005529996996752
Energy: 1.0318359454781523

minimum gb energy = 0.7003283299572738 eV
minimum distance =  2.29811000932498 Angstroms
sigma value = 25


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

Energy: 0.6789193626311202
Energy: 0.9394037809024535
Energy: 0.6502284820723999
Energy: 0.939403780903412
Energy: 1.162178340227493
Energy: 0.9484667937791991
Energy: 0.6459739096501308
Energy: 0.9484667937782404
Energy: 0.6422939992148851
Energy: 0.6428738850005893
Energy: 1.2393084619362051
Energy: 0.6428738850005893
Energy: 0.7878064421957249
Energy: 0.948288251897987
Energy: 0.6460405776447944
Energy: 0.948288251897987
Energy: 0.6472648712334849
Energy: 0.9483451550572614
Energy: 0.6292670509476357
Energy: 0.9483451550572614
Energy: 0.6275140530142735
Energy: 0.948108701985731
Energy: 0.6459685611759579
Energy: 0.9481087019866897
Energy: 0.647626356559879
Energy: 0.791459147735183
Energy: 0.8382363953836567
Energy: 0.7914591477342243
Energy: 0.6302529353871295
Energy: 0.8197191367525165
Energy: 0.6435092946100677
Energy: 0.8197191367534751
Energy: 0.6476159906351703
Energy: 0.948571449930102
Energy: 1.04914786918653
Energy: 0.948571449930102
Energy: 0.6318422394004835
Energy: 0.9395168882170203
Energy: 0.6802570166305045
Energy: 0.9395168882170203
Energy: 0.6476527348916331
Energy: 0.7913788961950834
Energy: 0.9417828401378786
Energy: 0.7913788961950834
Energy: 0.8836925012692467
Energy: 0.9954795632082653
Energy: 0.6437992073794796
Energy: 0.9954795632082653
Energy: 0.6471116829248824
Energy: 0.948605338420045
Energy: 0.7870165346593181
Energy: 0.948605338420045
Energy: 0.8553952501153181
Energy: 0.9790618540867886
Energy: 0.6457451723929465
Energy: 0.9790618540858298
Energy: 0.647812281207998
Energy: 0.7906968029567265
Energy: 0.6274932956467711
Energy: 0.7906968029557679
Energy: 0.8388005319918762
Energy: 1.1174116372952494
Energy: 0.6498100573201375
Energy: 1.1174116372952494
Energy: 0.6476340431333085
Energy: 0.8199764223421323
Energy: 0.6303456927291531
Energy: 0.819976422343091
Energy: 0.8036221749248414
Energy: 0.9981199452909146
Energy: 0.6460374117713107
Energy: 0.9981199452918732
Energy: 0.6830812368305854
Energy: 1.0332527581443998
Energy: 0.63118904317294
Energy: 1.0332527581443998
Energy: 0.9407032831737854
Energy: 1.088083347423277
Energy: 0.6488151474671885
Energy: 1.088083347423277
Energy: 0.6475122919524647
Energy: 0.9987169174880905
Energy: 0.635528493075964
Energy: 0.9987169174871319
Energy: 0.6422471753858098
Energy: 0.9488411199864274
Energy: 0.6480479685087319
Energy: 0.9488411199864274
Energy: 0.6477641972780542
Energy: 1.0212254783770491
Energy: 0.8565381040188028
Energy: 1.0212254783770491
Energy: 0.6275512143938284
Energy: 1.0850745922510836
Energy: 0.6487105055012448
Energy: 1.0850745922501248
Energy: 0.646005412664076
Energy: 1.1168532486726468
Energy: 0.8379606048469795
Energy: 1.1168532486726468
Energy: 0.6324140624882694
Energy: 0.8198642953307403
Energy: 0.6484941247060622
Energy: 0.8198642953307403

minimum gb energy = 0.6274932956467711 eV
minimum distance =  2.30149900648055 Angstroms
sigma value = 41


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

Energy: 0.8307203299425043
Energy: 0.832119570088701
Energy: 0.8027407795879941
Energy: 0.832119570088701
Energy: 1.1378581727149562
Energy: 0.8258373625743994
Energy: 0.581712857281503
Energy: 0.8258373625759713
Energy: 0.5984594646941409
Energy: 0.8200810357918545
Energy: 1.15593700194664
Energy: 0.8200810357942123
Energy: 0.8216044629494074
Energy: 0.8258179412587758
Energy: 0.5816095640385711
Energy: 0.8258179412587758
Energy: 0.5780175631914863
Energy: 0.8432653277500574
Energy: 0.6150435862783947
Energy: 0.8432653273886612
Energy: 0.6987010613612913
Energy: 0.8255163484327718
Energy: 0.5817107967000067
Energy: 0.8255163484343436
Energy: 0.5810836212746356
Energy: 0.8251481126880296
Energy: 0.750739043207478
Energy: 0.8251481126896015
Energy: 0.5703552808963983
Energy: 0.7150898231655146
Energy: 0.5787594702800267
Energy: 0.7150898231663005
Energy: 0.5841164359773753
Energy: 0.9709243032975559
Energy: 0.8959908199893163
Energy: 0.9709243032975559
Energy: 0.5722087205420515
Energy: 0.8205158120878245
Energy: 0.599305169966555
Energy: 0.8205158120886107
Energy: 0.5810806162027113
Energy: 0.8273512335772323
Energy: 0.9808135481553609
Energy: 0.8273512335795544
Energy: 0.5732536686828116
Energy: 0.8333239799467431
Energy: 0.8314340146455098
Energy: 0.8333239799467431
Energy: 0.5838283709934575
Energy: 0.9694544189200551
Energy: 0.9815596378797588
Energy: 0.9694544189184832
Energy: 0.7858281305021654
Energy: 1.1001186707628283
Energy: 0.5992029840143224
Energy: 1.1001186707628283
Energy: 0.5810578085858643
Energy: 0.8264449243600284
Energy: 0.8231068397901045
Energy: 0.8264449243600284
Energy: 0.7656337585202924
Energy: 0.860334684495198
Energy: 0.5786960774101428
Energy: 0.860334684493626
Energy: 0.5837567648587588
Energy: 0.9694222974394898
Energy: 0.6985692248773756
Energy: 0.9694222974402756
Energy: 0.7501290047797261
Energy: 1.1349262298983565
Energy: 0.5816749003286326
Energy: 1.1349262298991423
Energy: 0.5810736439567291
Energy: 0.715959391266089
Energy: 0.570662468318567
Energy: 0.715959391266089
Energy: 0.7459888301776448
Energy: 0.9189397093091656
Energy: 0.5861657125775477
Energy: 0.9189397092164586
Energy: 0.6013462744699628
Energy: 1.0442131965033319
Energy: 0.5760565894056251
Energy: 1.0442131965041177
Energy: 0.9814830887561049
Energy: 1.0977976628898483
Energy: 0.5819477244463659
Energy: 1.0977976628898483
Energy: 0.8338473793462647
Energy: 0.8320951881024666
Energy: 0.5731253665788543
Energy: 0.8320951881040384
Energy: 0.8337762914606479
Energy: 0.9681573314101201
Energy: 0.5834781242277665
Energy: 0.9681573314101201
Energy: 0.6014165114810218
Energy: 1.0444007670641153
Energy: 0.5770751848743517
Energy: 1.0444007670649014
Energy: 0.8198184670524289
Energy: 1.0965826550587603
Energy: 0.5819106148171105
Energy: 1.0965826550579745
Energy: 0.5810947489784163
Energy: 0.8685587069299736
Energy: 0.7655192056806146
Energy: 0.8685587069299736
Energy: 0.5787612464054878
Energy: 0.9689283225482299
Energy: 0.583626495014653
Energy: 0.9689283225474441
Energy: 0.5840565322939549
Energy: 1.0595852537519894
Energy: 0.750123449547096
Energy: 1.0595852537512038
Energy: 0.571154857580354
Energy: 0.9957028791085345
Energy: 0.5844777564765613
Energy: 0.9957028791085345
Energy: 0.585928703523331
Energy: 0.9182698799551798
Energy: 0.7457611963948486
Energy: 0.9182698799559658
Energy: 0.5740832158371549
Energy: 1.043498439681201
Energy: 0.6047323762400166
Energy: 1.043498439681201

minimum gb energy = 0.5703552808963983 eV
minimum distance =  2.26371940637038 Angstroms
sigma value = 15


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

Energy: 0.7541161646638873
Energy: 0.9840894231223404
Energy: 0.830606232005398
Energy: 0.9840894231223404
Energy: 1.1156921527493626
Energy: 0.8680010722058743
Energy: 0.5442871041877742
Energy: 0.8680010722058743
Energy: 0.5617055368070047
Energy: 0.7427422991530758
Energy: 0.6761341985068248
Energy: 0.7427422991717185
Energy: 1.0851434287559867
Energy: 0.8713884124145542
Energy: 0.5441383018310986
Energy: 0.87138841241522
Energy: 0.5418726523420305
Energy: 1.0461174438876828
Energy: 0.5374252440178704
Energy: 1.0461174438876828
Energy: 0.7346530394568306
Energy: 0.8675212370246683
Energy: 0.5444223720614253
Energy: 0.867521237026
Energy: 0.5437555778032536
Energy: 0.7479757328223049
Energy: 0.6817490278891896
Energy: 0.7479757328209732
Energy: 0.6332449626858297
Energy: 0.747300702647368
Energy: 0.544311024538732
Energy: 0.747300702647368
Energy: 0.5456757119424982
Energy: 0.9875644909077852
Energy: 0.8326498526500592
Energy: 0.9875644909077852
Energy: 0.5259500327168665
Energy: 1.0326051759014485
Energy: 0.5424154573140897
Energy: 1.0326051759014485
Energy: 0.543857540182751
Energy: 0.8636751395786715
Energy: 0.9267154921258536
Energy: 0.8636751395786715
Energy: 0.5276522972920145
Energy: 0.7402499017708518
Energy: 0.5623856075041925
Energy: 0.7402499017715176
Energy: 0.5456989471881417
Energy: 0.9896589899604035
Energy: 0.9941373043755667
Energy: 0.9896589899604035
Energy: 0.5276922699822326
Energy: 0.9836620121922428
Energy: 0.7543000317605636
Energy: 0.9836620121922428
Energy: 0.5438008733285895
Energy: 0.8671805724777057
Energy: 1.0135880304521616
Energy: 0.8671805724777057
Energy: 0.710753372990189
Energy: 0.7419638944704842
Energy: 0.5621013979210013
Energy: 0.7419638944738133
Energy: 0.5454543915665152
Energy: 0.9892999195549937
Energy: 0.8717722191304093
Energy: 0.9892999195549937
Energy: 0.6943622642977859
Energy: 1.0447378492401356
Energy: 0.5424145325064281
Energy: 1.0447378492401356
Energy: 0.5438108893172569
Energy: 0.8669009440227468
Energy: 0.7349714061513297
Energy: 0.8669009440234126
Energy: 0.6801236470119313
Energy: 0.7651202196815499
Energy: 0.5442383989949492
Energy: 0.7651202196782207
Energy: 0.5454917672217804
Energy: 0.8832876033813409
Energy: 0.6303292524393064
Energy: 0.8832876033766802
Energy: 0.6787958789293714
Energy: 0.984208511842657
Energy: 0.5477459308516712
Energy: 0.984208511842657
Energy: 0.543824324657435
Energy: 0.9421548340344773
Energy: 0.52555373789323
Energy: 0.9421548340351431
Energy: 0.9223614348646542
Energy: 0.8634817634133893
Energy: 0.5443957874461605
Energy: 0.8634817634140551
Energy: 0.563608527587407
Energy: 1.0490390540468681
Energy: 0.5284584821709356
Energy: 1.0490390540462025
Energy: 0.8961859796327167
Energy: 0.9862692098682342
Energy: 0.5476678719235627
Energy: 0.9862692098669025
Energy: 0.7559100536234706
Energy: 0.9774096073324922
Energy: 0.5463934374734079
Energy: 0.977409607333158
Energy: 1.012930307772222
Energy: 0.8677054779516115
Energy: 0.5441924130415399
Energy: 0.8677054779516115
Energy: 0.5634983482284673
Energy: 1.0589358393229746
Energy: 0.5316164585382136
Energy: 1.058935839322309
Energy: 0.7401363880165072
Energy: 0.9862583974504004
Energy: 0.5479852302060175
Energy: 0.9862583974504004
Energy: 0.543920091538221
Energy: 1.0420881174960341
Energy: 0.7082878261402464
Energy: 1.0420881174960341
Energy: 0.7342479079023753
Energy: 0.8672188776751144
Energy: 0.5441733741147108
Energy: 0.8672188776744486
Energy: 0.5456699192720672
Energy: 1.0374407570054314
Energy: 0.6797844433051042
Energy: 1.0374407570040998
Energy: 0.5312987237279166
Energy: 0.8832069519584044
Energy: 0.5480649830081187
Energy: 0.8832069519590702
Energy: 0.5402897208118083
Energy: 0.983408160793273
Energy: 0.6787976476901841
Energy: 0.9834081607919413
Energy: 0.5255844736592167
Energy: 0.9401971634460776
Energy: 0.5460471794654326
Energy: 0.9401971634460776
Energy: 0.5455616509982717
Energy: 1.002402921114597
Energy: 0.9196437229202167
Energy: 1.0024029211139311

minimum gb energy = 0.52555373789323 eV
minimum distance =  2.31179635339617 Angstroms
sigma value = 85


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

Energy: 0.7069501764151851
Energy: 0.9423154034776647
Energy: 0.5851093513633068
Energy: 0.9423154034771136
Energy: 1.0884376627040273
Energy: 0.8129190457095381
Energy: 0.4964322203523692
Energy: 0.8129190457101155
Energy: 0.6783215772989403
Energy: 0.678626867771719
Energy: 0.5931302617385094
Energy: 0.6786268677722964
Energy: 1.0520165502948025
Energy: 0.8125246572546058
Energy: 0.4965219385987193
Energy: 0.8125246572546058
Energy: 0.5205874274583913
Energy: 0.659043203466889
Energy: 0.47078257086791403
Energy: 0.659043203466889
Energy: 0.7711184933563308
Energy: 0.8247963450699202
Energy: 0.4964246584191787
Energy: 0.8247963450687653
Energy: 0.4941669949525092
Energy: 0.6922002447529987
Energy: 0.6056458011184291
Energy: 0.6922002447529987
Energy: 0.6526798462492871
Energy: 0.8125802200590976
Energy: 0.49652027762709666
Energy: 0.812580220059675
Energy: 0.4959017483659323
Energy: 0.6696673420479078
Energy: 0.728791235332883
Energy: 0.6696673420484853
Energy: 0.5609225513160363
Energy: 0.6922505872785126
Energy: 0.4945444629296575
Energy: 0.6922505872629211
Energy: 0.49746807854082514
Energy: 0.8003586383160015
Energy: 0.8118538957805754
Energy: 0.8003586383165789
Energy: 0.47091186052152
Energy: 0.9576657312825348
Energy: 0.5211513396722054
Energy: 0.9576657312825348
Energy: 0.4960494548563657
Energy: 0.668546245754512
Energy: 0.893875168717645
Energy: 0.6685462457527797
Energy: 0.4730920766922314
Energy: 0.6787171481386244
Energy: 0.6788876636833274
Energy: 0.678717148138047
Energy: 0.4968957771409412
Energy: 0.812060211506444
Energy: 0.9836564274105094
Energy: 0.812060211506444
Energy: 0.472458063073392
Energy: 0.9425070598455085
Energy: 0.7075009525766877
Energy: 0.9425070598455085
Energy: 0.49599044451857077
Energy: 0.6682717207462836
Energy: 0.9832755120339766
Energy: 0.668271720746861
Energy: 0.622889455168129
Energy: 0.6801004498586888
Energy: 0.6789270425274172
Energy: 0.6801004498586888
Energy: 0.4977583886410324
Energy: 0.8120720490922194
Energy: 0.8893231656172499
Energy: 0.8120720490927968
Energy: 0.606693609010722
Energy: 0.9858253873386223
Energy: 0.5212473553987501
Energy: 0.9858253873386223
Energy: 0.4959192859702487
Energy: 0.6678216427810406
Energy: 0.7709835092478954
Energy: 0.6678216427804632
Energy: 0.6067123031155971
Energy: 0.699352360940517
Energy: 0.4946089492893591
Energy: 0.699352360941672
Energy: 0.497373992538439
Energy: 0.8039531818425211
Energy: 0.6505051613944554
Energy: 0.8039531818430985
Energy: 0.6084828373421223
Energy: 0.9581777855865043
Energy: 0.4964742602269859
Energy: 0.9581777855865043
Energy: 0.49604283665203525
Energy: 0.6001672183861736
Energy: 0.5608548433486762
Energy: 0.6001672183861736
Energy: 0.8115303589889338
Energy: 0.7999910230086817
Energy: 0.49752557011018045
Energy: 0.7999910230086817
Energy: 0.5223880895772753
Energy: 0.8798266205129335
Energy: 0.4720305246566368
Energy: 0.8798266205129335
Energy: 0.8126789156989284
Energy: 0.9492560685895097
Energy: 0.49634339888562085
Energy: 0.9492560685895097
Energy: 0.680193581155509
Energy: 0.679654120828336
Energy: 0.47288538639062205
Energy: 0.6796541208271811
Energy: 0.9829053677901118
Energy: 0.8048237629645326
Energy: 0.4983794454164797
Energy: 0.8048237629633775
Energy: 0.7090447090406461
Energy: 0.9177280682731783
Energy: 0.4723564172128713
Energy: 0.9177280682731783
Energy: 0.9055357192133776
Energy: 0.9495469406371387
Energy: 0.4964632620962216
Energy: 0.9495469406371387
Energy: 0.6803064764117706
Energy: 0.6795703621997446
Energy: 0.47905901780335436
Energy: 0.6795703622003221
Energy: 0.8894132050425131
Energy: 0.8047631389738177
Energy: 0.49782918287413586
Energy: 0.8047631389743951
Energy: 0.5224268604943478
Energy: 0.964139297086496
Energy: 0.6069738968524296
Energy: 0.964139297086496
Energy: 0.659648578798553
Energy: 0.9483671906027618
Energy: 0.4963467508625934
Energy: 0.9483671906027618
Energy: 0.4959632660522361
Energy: 0.6991073831854745
Energy: 0.6057787261198274
Energy: 0.6991073831854745
Energy: 0.6502118139316572
Energy: 0.8043498989096951
Energy: 0.49831822832368394
Energy: 0.8043498989096951
Energy: 0.4975663858311427
Energy: 0.9279456178991928
Energy: 0.6081534064103097
Energy: 0.9279456178991928
Energy: 0.47706551105347295
Energy: 0.8395963533875895
Energy: 0.4975683069757437
Energy: 0.8395963533875895
Energy: 0.49596465708343185
Energy: 0.7539806737817262
Energy: 0.8117381656395644
Energy: 0.7539806737644286
Energy: 0.4708322060081718
Energy: 0.8660587505012398
Energy: 0.5248370540294027
Energy: 0.8660587505018172
Energy: 0.4978650899815366
Energy: 0.9257757287496571
Energy: 0.8122733527458434
Energy: 0.9257757287496571

minimum gb energy = 0.47078257086791403 eV
minimum distance =  2.27201442835853 Angstroms
sigma value = 113


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

Energy: 0.015499874567145258
Energy: 0.016166642704577603
Energy: 0.807125885771262
Energy: 0.01616664270546545
Energy: 0.8064062877132093
Energy: 0.25588582982674307
Energy: 0.255444825164236
Energy: 0.2558858298263238
Energy: 0.015499874567145258
Energy: 0.016166642705021526
Energy: 0.8071347065068789
Energy: 0.01616664270546545
Energy: 0.8064062877132093
Energy: 0.255885829827187
Energy: 0.255444825164236
Energy: 0.25588582982674307
Energy: 0.015499874567145258
Energy: 0.016166642704577603
Energy: 0.8070671937724275
Energy: 0.01616664270546545
Energy: 0.8064062877132093
Energy: 0.25588582982674307
Energy: 0.255444825164236
Energy: 0.2558858298263238

minimum gb energy = 0.015499874567145258 eV
minimum distance =  2.54253939048664 Angstroms
sigma value = 1