Model name: model_name=EAM_Dynamo_ZhouJohnsonWadley_2004NISTretabulation_CuTa__MO_950828638160_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=3.6149601638317113
cohesive_energy=3.540273359423524
mass=63.546
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=90.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[1.4503143217463098e-19, 2.16689583218598e-19, 2.71519271987346e-19, 3.1480047157822197e-19, 3.5145987514077595e-19, 3.8389113456620394e-19, 4.1236982423555394e-19, 4.36995279100134e-19, 4.58172849848346e-19, 4.76381587293756e-19, 4.920412617144719e-19, 5.05497943263438e-19, 5.1704002373477395e-19, 5.26912636153482e-19, 5.35336880895054e-19, 5.42503416978936e-19, 5.485740642451619e-19, 5.536769968244519e-19, 5.579019366083099e-19, 5.61301755425658e-19, 5.639036902792739e-19, 5.65733375995302e-19, 5.66814845223252e-19, 5.671689262593659e-19, 5.667908125737419e-19, 5.65577964861804e-19, 5.63434252525512e-19, 5.60266749320094e-19, 5.557069546197299e-19, 5.4941040044811e-19, 5.410550493017999e-19, 5.30285217968052e-19, 5.16698760111732e-19, 4.998310445089799e-19, 4.7913893328087e-19, 4.53949512241122e-19, 4.23389595124206e-19, 3.8624953857145196e-19, 3.40835841880722e-19, 2.84831757639252e-19, 2.15207569832148e-19, 1.2810571777772818e-19, 1.84601189592846e-20, -1.210229755318044e-19, -3.02069576044458e-19, -5.43416657660316e-19, -8.71540830126882e-19, -1.3221818476187938e-18, -1.9495926153165598e-18, -2.8463148556000197e-18]
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: 0.013653608047431903
Energy: 0.09635855356595607
Energy: 0.5506407650752183
Energy: 0.01409298231319528
Energy: 0.09635855356780292
Energy: 0.5324526120325951
Energy: 0.0963585535671757
Energy: 0.5324526120595661
Energy: 0.5506407650758107
Energy: 0.0963585535665833
Energy: 0.013653608047431903
Energy: 0.0963585535665833
Energy: 0.01409298231319528
Energy: 0.5324526120515863
Energy: 0.0963585535683953
Energy: 0.5324526120614129

minimum gb energy = 0.013653608047431903 eV
minimum distance =  2.50862444469678 Angstroms
sigma value = 1


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

Energy: 1.0769613851372173
Energy: 0.7687594810837965
Energy: 0.7695774691174395
Energy: 0.7066037151854929
Energy: 0.7199274790249849
Energy: 0.7762155638492858
Energy: 0.7204558805295056
Energy: 0.7762155638485251
Energy: 0.7698777574490359
Energy: 0.7690921877494291
Energy: 1.1678383709920324
Energy: 0.7690921877486685
Energy: 0.7211770628074499
Energy: 0.719625817200282
Energy: 0.7203751403154364
Energy: 0.7196258171987607
Energy: 1.0014162225874241
Energy: 0.7196385457832714
Energy: 0.7208291962805017
Energy: 0.7196385457832714
Energy: 0.7582553759091675
Energy: 0.7706996617383975
Energy: 0.7204922736591182
Energy: 0.7706996617399189
Energy: 0.7573717808053013
Energy: 0.7688406603135874
Energy: 1.000860098030215
Energy: 0.7688406603113054
Energy: 0.757619372217663
Energy: 0.7996970891973523
Energy: 0.7826378937138052
Energy: 0.7996970891981131
Energy: 0.86749621266298
Energy: 0.788055715193437
Energy: 0.7717019342651075
Energy: 0.788055715193437
Energy: 0.7902042744879496
Energy: 0.7930964486901562
Energy: 0.7721558834730171
Energy: 0.7930964486901562
Energy: 0.7689691222809201
Energy: 0.7874865557712251
Energy: 0.8670659522536128
Energy: 0.7874865557704643
Energy: 0.7568281738704914
Energy: 0.7864757469009559
Energy: 0.7809117456368792
Energy: 0.7864757469009559
Energy: 0.7717081331333479
Energy: 0.7685957339680402
Energy: 0.734237103003216
Energy: 0.7685957339672795
Energy: 0.7560798297956766
Energy: 0.7692566940710841
Energy: 0.7343288923593077
Energy: 0.7692566940718447
Energy: 0.7338575715934739
Energy: 0.7193028646972638
Energy: 0.7193207126634165
Energy: 0.7193028646965031
Energy: 0.7037126033808064
Energy: 0.720479882570488
Energy: 0.7200920166512714
Energy: 0.7204798825712487
Energy: 0.7687717817788537
Energy: 0.7682986545372283
Energy: 0.7029214983329236
Energy: 0.7682986545372283
Energy: 0.7204654769553064
Energy: 0.7198515904677789
Energy: 0.7339542541861117
Energy: 0.7198515904693003
Energy: 0.7198722514694083
Energy: 0.7697438437953698
Energy: 0.7715218699204299
Energy: 0.7697438437930876
Energy: 0.7555068342811148
Energy: 0.7194631460962702
Energy: 0.7212232133411011
Energy: 0.7194631460962702
Energy: 0.7235135528068879
Energy: 0.7210172582321844
Energy: 0.754269319446474
Energy: 0.7210172582321844
Energy: 0.7210475090177806
Energy: 0.7199755344128069
Energy: 0.7576343792950834
Energy: 0.7199755344120462
Energy: 0.7550569946048461
Energy: 0.7702362068958961
Energy: 0.7553726759540053
Energy: 0.7702362068958961
Energy: 0.7825650949717854
Energy: 0.7695430545396332
Energy: 0.7595211453864265
Energy: 0.7695430545381119
Energy: 0.772613131304628
Energy: 0.7884347829021151
Energy: 0.8673437742097235
Energy: 0.7884347829005937
Energy: 0.7733323352497767
Energy: 0.7858967168651632
Energy: 0.7918015950690559
Energy: 0.7858967168659239
Energy: 0.8684879677307829
Energy: 0.7874643537654044
Energy: 0.7691213791319806
Energy: 0.7874643537654044
Energy: 0.780122829268847
Energy: 0.7871376247253522
Energy: 0.7569722827730009
Energy: 0.7871376247238308
Energy: 0.7338606965238198
Energy: 0.7684599069631729
Energy: 0.7715308980005644
Energy: 0.7684599069646944
Energy: 0.733871848088213
Energy: 0.7690238433815137
Energy: 0.7569652904082954
Energy: 0.7690238433799925
Energy: 0.7188343150714319
Energy: 0.7193805064881243
Energy: 0.7336221785587399
Energy: 0.7193805064873638
Energy: 0.7201162101167141
Energy: 0.7199852665068001
Energy: 0.7037520480218893
Energy: 0.7199852665068001
Energy: 0.7029279990294472
Energy: 0.7216500981523348
Energy: 0.7689149844725739
Energy: 0.7216500981523348

minimum gb energy = 0.7029214983329236 eV
minimum distance =  2.28173361087648 Angstroms
sigma value = 1


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

Energy: 1.2254494751850786
Energy: 0.8108897753280504
Energy: 0.8121581737587945
Energy: 0.7384894392013368
Energy: 0.7548115898728764
Energy: 0.8129284431365751
Energy: 0.7549101170018215
Energy: 0.8129284431357077
Energy: 0.8095120235284567
Energy: 0.8110982943335611
Energy: 1.1257951623558358
Energy: 0.8110982943309591
Energy: 0.7573487260219052
Energy: 0.7552701123326071
Energy: 0.7545236517409156
Energy: 0.7552701123308725
Energy: 0.7550124844677367
Energy: 0.7557423368731311
Energy: 0.7571798329414858
Energy: 0.7557423368800698
Energy: 0.7981073273032134
Energy: 0.8428837318694432
Energy: 0.7559980208091532
Energy: 0.8428837318737799
Energy: 0.8002823874019271
Energy: 0.8156525876315293
Energy: 0.9492310815115877
Energy: 0.8156525876297946
Energy: 0.7972150831257638
Energy: 0.8162117577592024
Energy: 0.8223071053094403
Energy: 0.8162117577600697
Energy: 0.7981567325257786
Energy: 0.8352214490530255
Energy: 0.8084706934600372
Energy: 0.835221449056495
Energy: 0.8212823098353764
Energy: 0.841220907958169
Energy: 0.7989843474997629
Energy: 0.8412209079651075
Energy: 0.775379059440298
Energy: 0.8151629104002772
Energy: 0.8244649402676534
Energy: 0.815162910402879
Energy: 0.7752532441376843
Energy: 0.8165751803588328
Energy: 0.7971851979062203
Energy: 0.8165751803675062
Energy: 0.7559133361958295
Energy: 0.7553441758874556
Energy: 0.7744451971419268
Energy: 0.7553441758865883
Energy: 0.7544771374171936
Energy: 0.7549430892672194
Energy: 0.7343760542723922
Energy: 0.7549430892654848
Energy: 0.7333653991232628
Energy: 0.8105682113191716
Energy: 0.8107864301730865
Energy: 0.8105682113226409
Energy: 0.7746449930812934
Energy: 0.7550939727022774
Energy: 0.7546634739328344
Energy: 0.7550939727074812
Energy: 0.8111811698761981
Energy: 0.8117471773275537
Energy: 0.755072626869908
Energy: 0.8117471773249518
Energy: 0.7571419372639447
Energy: 0.7554682201893362
Energy: 0.7956392166219455
Energy: 0.7554682201884688
Energy: 0.7554704666518988
Energy: 0.7581278650225179
Energy: 0.7569752818227852
Energy: 0.7581278650285892
Energy: 0.798515703916632
Energy: 0.755515926156534
Energy: 0.7553337447019164
Energy: 0.7555159261470327
Energy: 0.7970293425658233
Energy: 0.8170523008364404
Energy: 0.7956338951671065
Energy: 0.8170523008312365
Energy: 0.7956049472917816
Energy: 0.8164672647465823
Energy: 0.8232180755770127
Energy: 0.8164672647457148
Energy: 0.7992547201927753
Energy: 0.8354819802621116
Energy: 0.8084883497117937
Energy: 0.8354819802647135
Energy: 0.7989012670054595
Energy: 0.8344678858911693
Energy: 0.7983792432179151
Energy: 0.8344678858911693
Energy: 0.775376985781981
Energy: 0.8151432950902031
Energy: 0.8248336250554424
Energy: 0.8151432950936723
Energy: 0.775245482796792
Energy: 0.8156739270972563
Energy: 0.7977390566502811
Energy: 0.8156739270929196
Energy: 0.7554688810095145
Energy: 0.7560377928796231
Energy: 0.773897180601346
Energy: 0.7560377928848271
Energy: 0.7543728472884638
Energy: 0.7549439793679792
Energy: 0.7341776020608125
Energy: 0.7549439793688465
Energy: 0.7333075225728349
Energy: 0.7574834776237512
Energy: 0.8111982800829364
Energy: 0.7574834776280879

minimum gb energy = 0.7333075225728349 eV
minimum distance =  2.28820316518829 Angstroms
sigma value = 25


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

Energy: 1.2506465529830202
Energy: 0.8671474706978978
Energy: 0.8679456374901341
Energy: 0.8167563264993916
Energy: 0.8049604737349333
Energy: 0.8600007424858549
Energy: 0.8064149091538547
Energy: 0.8600007424868631
Energy: 0.867638317754903
Energy: 0.8667178869833798
Energy: 1.122073983909904
Energy: 0.8667178869833798
Energy: 0.8055777246142091
Energy: 0.861567754121028
Energy: 0.8061519622680308
Energy: 0.8615677541200198
Energy: 0.7825316591073959
Energy: 0.806663234373632
Energy: 0.806851192438195
Energy: 0.806663234373632
Energy: 0.8388632271139059
Energy: 0.9041626407020811
Energy: 0.8064777895694033
Energy: 0.9041626407020811
Energy: 0.8445255128316562
Energy: 0.884399310348444
Energy: 0.9269930203214348
Energy: 0.8843993103474357
Energy: 0.8367564698233406
Energy: 0.8847781057237196
Energy: 0.8349108265416876
Energy: 0.8847781057227113
Energy: 0.9083929903987764
Energy: 0.8813156727798771
Energy: 0.8113511385439355
Energy: 0.8813156727798771
Energy: 0.8384953457406106
Energy: 0.8812667208871019
Energy: 0.828032005543906
Energy: 0.8812667208860936
Energy: 0.8122543000809294
Energy: 0.8527086032565572
Energy: 0.8515523427358053
Energy: 0.8527086032565572
Energy: 0.7850859237703106
Energy: 0.8238141392050652
Energy: 0.8218899265093683
Energy: 0.8238141392060734
Energy: 0.7731665563142032
Energy: 0.7740391801127752
Energy: 0.7644944597661438
Energy: 0.7740391801127752
Energy: 0.7739308730701311
Energy: 0.7655743860912148
Energy: 0.8220757619259454
Energy: 0.7655743860922231
Energy: 0.782357181475155
Energy: 0.9121440925092759
Energy: 0.9137775266761172
Energy: 0.9121440925092759
Energy: 0.8120397486497685
Energy: 0.8229900943011975
Energy: 0.825152189508308
Energy: 0.8229900943022057
Energy: 0.8055032551061339
Energy: 0.8197210909538564
Energy: 0.7820965559653849
Energy: 0.8197210909558728
Energy: 0.8064566614316512
Energy: 0.8200368127419108
Energy: 0.8253179381225222
Energy: 0.820036812742919
Energy: 0.9270182807235103
Energy: 0.8799726101830424
Energy: 0.8470001066011422
Energy: 0.8799726101840507
Energy: 0.8061421508825533
Energy: 0.8801548591273448
Energy: 0.8438417512334231
Energy: 0.8801548591313778
Energy: 0.8109279393072263
Energy: 0.8850194486561479
Energy: 0.904138840368259
Energy: 0.8850194486561479
Energy: 0.8116462794223946
Energy: 0.8850041364974598
Energy: 0.8436828329790909
Energy: 0.8850041364964516
Energy: 0.8033675214492293
Energy: 0.8052720634611842
Energy: 0.8123488280168196
Energy: 0.8052720634591677
Energy: 0.8041041451796529
Energy: 0.8052514887022069
Energy: 0.7845260153426808
Energy: 0.8052514887032152
Energy: 0.8116565002233564
Energy: 0.8371066467013041
Energy: 0.8666231860478754
Energy: 0.8371066467033205

minimum gb energy = 0.7644944597661438 eV
minimum distance =  2.27989891023906 Angstroms
sigma value = 9


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

Energy: 1.0979852955068008
Energy: 0.9073771360924946
Energy: 0.9079675650694572
Energy: 0.7998645190351631
Energy: 0.8400293661506019
Energy: 0.886907789674049
Energy: 0.8401325030502201
Energy: 0.886907789674049
Energy: 0.9072118041967618
Energy: 0.9073077202377845
Energy: 0.9045345204220145
Energy: 0.9073077202389872
Energy: 0.8350551540510149
Energy: 0.8874450025790979
Energy: 0.8394065391036287
Energy: 0.8874450025778952
Energy: 0.8351804494999541
Energy: 0.842728788411854
Energy: 0.8385585221366383
Energy: 0.8427287884130567
Energy: 0.833755477806666
Energy: 0.8421173470840204
Energy: 0.8405375247783293
Energy: 0.8421173470900342
Energy: 0.8811702899071878
Energy: 0.9447570451114796
Energy: 0.8392568940628041
Energy: 0.9447570451126822
Energy: 0.8408270013236233
Energy: 0.9413651851451773
Energy: 0.8415905305938164
Energy: 0.9413651851451773
Energy: 0.8401906566403975
Energy: 0.8435053286540241
Energy: 0.7923723231740337
Energy: 0.8435053286564297
Energy: 0.8404557530648645
Energy: 0.8432597098663155
Energy: 0.7924878084629409
Energy: 0.8432597098663155
Energy: 0.7906307878722785
Energy: 0.9062827329579413
Energy: 0.9057764237989488
Energy: 0.9062827329567386
Energy: 0.8748890561728649
Energy: 0.8427807249081802
Energy: 0.8403077705580004
Energy: 0.8427807249081802
Energy: 0.9077503157940489
Energy: 0.9070599274369018
Energy: 0.904901673072271
Energy: 0.9070599274369018
Energy: 0.9070295194160085
Energy: 0.8882501144404745
Energy: 0.9056670544573076
Energy: 0.8882501144404745
Energy: 0.8355381605345171
Energy: 0.8364253451206514
Energy: 0.8395959305779744
Energy: 0.8364253451170429
Energy: 0.8339715404569182
Energy: 0.84299545953537
Energy: 0.8392173163370149
Energy: 0.84299545953537
Energy: 0.8729492549276516
Energy: 0.9470159191554262
Energy: 0.8385379928262245
Energy: 0.9470159191554262
Energy: 0.8714413157943172
Energy: 0.944451827318785
Energy: 0.840225224660016
Energy: 0.9444518273163794
Energy: 0.8400565133459124
Energy: 0.8438425780529267
Energy: 0.7923080127878784
Energy: 0.8438425780541294
Energy: 0.8403097412536316
Energy: 0.843249842720112
Energy: 0.7926560856505709
Energy: 0.8432498427213149
Energy: 0.7902129884805762
Energy: 0.8343436794094964
Energy: 0.9059002108487236
Energy: 0.8343436794131046

minimum gb energy = 0.7902129884805762 eV
minimum distance =  2.31366282191526 Angstroms
sigma value = 25


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

Energy: 0.9877558014691418
Energy: 0.9603786520898084
Energy: 0.9608044072717024
Energy: 0.8240808317915786
Energy: 0.9604152742157807
Energy: 0.8871609739956906
Energy: 0.8397641680316131
Energy: 0.8871609739956906
Energy: 0.9599499692863108
Energy: 0.9601178934782979
Energy: 0.967036389957802
Energy: 0.9601178934782979
Energy: 0.9610975828597718
Energy: 0.8879623197340485
Energy: 0.839311316566121
Energy: 0.8879623197355361
Energy: 0.8349149126313536
Energy: 0.8398251632548157
Energy: 0.8416602459946763
Energy: 0.8398251632548157
Energy: 0.8179852006162317
Energy: 0.8409452444689307
Energy: 0.8372738068123694
Energy: 0.840945244470418
Energy: 0.8143446248488065
Energy: 0.8392721905731955
Energy: 0.8402813330943164
Energy: 0.8392721905746827
Energy: 0.814932170601702
Energy: 0.8887110075585718
Energy: 0.8421135171752396
Energy: 0.8887110075570844
Energy: 0.9580571029962412
Energy: 0.9584404957601518
Energy: 1.0949062315193352
Energy: 0.9584404957601518
Energy: 0.9608181926547739
Energy: 0.8912854718661819
Energy: 0.9552179874113857
Energy: 0.8912854718661819
Energy: 0.9678876409286559
Energy: 0.9595148067548255
Energy: 0.964778305230962
Energy: 0.9595148067548255
Energy: 0.9573517095302719
Energy: 0.8898167711275083
Energy: 0.958871331446891
Energy: 0.8898167711275083
Energy: 0.8381259504865259
Energy: 0.8213747199721239
Energy: 0.8350577694186881
Energy: 0.8213747199721239
Energy: 0.8408646070732103
Energy: 0.8396564177656267
Energy: 0.8198885628111963
Energy: 0.8396564177686018
Energy: 0.8401841577114999
Energy: 0.9252331279581539
Energy: 0.8149151150167037
Energy: 0.9252331279596414
Energy: 0.8384952171931088
Energy: 0.8390642600654743
Energy: 0.8148785934081757
Energy: 0.8390642600639868
Energy: 1.0934204731706676
Energy: 0.8197282317125076
Energy: 0.9568518200060411
Energy: 0.8197282317125076

minimum gb energy = 0.8143446248488065 eV
minimum distance =  2.35634832979402 Angstroms
sigma value = 17


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

Energy: 1.3557547576860427
Energy: 1.0624952645597414
Energy: 1.0618595939416897
Energy: 0.9732179410171651
Energy: 0.8578199382011948
Energy: 0.9114763998104299
Energy: 0.9966187923892373
Energy: 0.9114763998020057
Energy: 0.9058903955247057
Energy: 0.9060648703730702
Energy: 1.0627078140702824
Energy: 0.9060648703713852
Energy: 0.9063410414564979
Energy: 0.906937401655843
Energy: 0.9065774713813495
Energy: 0.9069374016575279
Energy: 0.9057939053337779
Energy: 0.9409979874327549
Energy: 0.84235811747377
Energy: 0.9409979874327549
Energy: 0.9040545494909886
Energy: 0.8984312807157865
Energy: 0.9056600991268041
Energy: 0.898431280714944
Energy: 0.963107086545325
Energy: 0.9041143491468324
Energy: 0.902543174235768
Energy: 0.9041143491459901
Energy: 1.1499525488553775
Energy: 0.9083549774300388
Energy: 0.8605329974608311
Energy: 0.9083549774300388
Energy: 1.066742173517571
Energy: 1.0589453741931336
Energy: 1.0608615649932156
Energy: 1.0589453741922914
Energy: 1.056193360136551
Energy: 0.9651661435386925
Energy: 0.907381622605178
Energy: 0.9651661435378501
Energy: 0.9029890711120998
Energy: 0.8611389766664038
Energy: 0.8549564418823994
Energy: 0.8611389766680887
Energy: 0.9705636445728586
Energy: 0.85724818337284
Energy: 0.8613342459484867
Energy: 0.85724818337284
Energy: 0.9640584069876671
Energy: 0.8585734042574137
Energy: 0.8592119432084654
Energy: 0.858573404254044
Energy: 0.964728538195689
Energy: 0.8564999730128995
Energy: 0.8560632447256169
Energy: 0.8564999730128995
Energy: 1.059611625835365
Energy: 0.9760901209220443
Energy: 1.146627423146864
Energy: 0.9760901209203595
Energy: 1.0707207783476265
Energy: 1.0605109617492092
Energy: 1.1488696359779935
Energy: 1.0605109617475243
Energy: 1.0577629667481772
Energy: 0.9041504767044218
Energy: 0.9048806184918284
Energy: 0.9041504766993672
Energy: 1.0573843837469896
Energy: 0.9042034334971898
Energy: 0.9029045634653642
Energy: 0.9042034334971898
Energy: 0.9045859335192412
Energy: 0.9399954380608174
Energy: 0.9060010177554544
Energy: 0.9399954380591324
Energy: 0.9347625839015404
Energy: 0.8976710436103961
Energy: 0.9057090622496519
Energy: 0.8976710436095536
Energy: 0.9036992942893148
Energy: 0.9050798611858266
Energy: 1.058670339966083
Energy: 0.9050798611875114
Energy: 0.9051128718381602
Energy: 0.9060906833304141
Energy: 0.9632069361931345
Energy: 0.9060906833295717
Energy: 0.9969121815041443
Energy: 0.9679129974376605
Energy: 0.9956181102296245
Energy: 0.9679129974385028
Energy: 1.0596740582760502
Energy: 1.0596903742168164
Energy: 1.0593527089699182
Energy: 1.0596903742168164
Energy: 0.8626650990338354
Energy: 0.8577853773285058
Energy: 1.0606083618763935
Energy: 0.8577853773301906
Energy: 0.8619641853014915
Energy: 0.8572322164763636
Energy: 0.9025778396954117
Energy: 0.8572322165260664
Energy: 0.8545763649500133
Energy: 0.8590480151186027
Energy: 0.9733057434424139
Energy: 0.8590480151169179
Energy: 0.85985050351041
Energy: 0.8576945291001746
Energy: 0.9640785369562034
Energy: 0.8576945291001746
Energy: 0.8585062751598949
Energy: 0.9064310448834948
Energy: 0.9643301580989494
Energy: 0.9064310448851798
Energy: 1.1511081948614146
Energy: 1.060705366627931
Energy: 1.0607617010716923
Energy: 1.0607053666270885

minimum gb energy = 0.84235811747377 eV
minimum distance =  2.31979886841146 Angstroms
sigma value = 53


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

Energy: 1.2410088072471477
Energy: 0.9860939207795137
Energy: 0.9847527795524496
Energy: 0.8078975150995921
Energy: 0.963039727090295
Energy: 0.8606378074406007
Energy: 0.9650731729096773
Energy: 0.8606378074406007
Energy: 0.9824398991354641
Energy: 0.9677401429058629
Energy: 0.9696333460955003
Energy: 0.9677401429078022
Energy: 0.9686714095221743
Energy: 0.8615396423266471
Energy: 0.9672906835524725
Energy: 0.8615396423266471
Energy: 0.9757670219482951
Energy: 0.8607818441273234
Energy: 0.8020101840861972
Energy: 0.8607818441273234
Energy: 0.9671171393948622
Energy: 0.862265646324778
Energy: 0.805463410177828
Energy: 0.862265646324778
Energy: 1.1219176208119566
Energy: 0.965569094561867
Energy: 0.9639873145066374
Energy: 0.965569094561867
Energy: 1.1219562683879158
Energy: 0.8624585873232036
Energy: 0.9715305182684444
Energy: 0.8624585873213081
Energy: 0.9676840602990748
Energy: 0.9670470188935896
Energy: 0.9701092335815308
Energy: 0.9670470188916502
Energy: 0.9631537529143941
Energy: 0.8624693002260121
Energy: 0.9652897399250622
Energy: 0.8624693002260121
Energy: 0.9760682190115444
Energy: 0.8648012123388634
Energy: 0.8068472778620901
Energy: 0.8648012123388634
Energy: 0.9667129559182595
Energy: 0.8610086780751939
Energy: 0.7981366730054538
Energy: 0.8610086780732545
Energy: 1.1220640740295567
Energy: 0.8638007124454395
Energy: 0.9708175638322816
Energy: 0.8638007124454395

minimum gb energy = 0.7981366730054538 eV
minimum distance =  2.34089837101865 Angstroms
sigma value = 9


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

Energy: 1.2091160488286197
Energy: 1.1099066740155459
Energy: 1.1129980502539585
Energy: 0.9956293221765808
Energy: 0.8825852251537126
Energy: 0.8815445878972107
Energy: 1.079335274775531
Energy: 0.8815445878972107
Energy: 0.8825872945757162
Energy: 0.8824120061591801
Energy: 1.0668910188440301
Energy: 0.8824120061577445
Energy: 0.8818372635579257
Energy: 0.8821165259886762
Energy: 1.1513323477418898
Energy: 0.8821165259886762
Energy: 0.8802988084588803
Energy: 0.8810018171302461
Energy: 1.147615398331925
Energy: 0.8810018171288104
Energy: 0.8803477007585282
Energy: 0.8815004741877933
Energy: 1.1529534221048845
Energy: 0.8815004741899467
Energy: 1.0803743229111642
Energy: 1.0678307726850031
Energy: 1.0772272437954433
Energy: 1.0678307726842855
Energy: 1.0776204145670834
Energy: 0.9817407652309322
Energy: 1.0691444816752744
Energy: 0.9817407652309322
Energy: 0.9330620356225696
Energy: 0.9931545379362084
Energy: 0.9544713014725321
Energy: 0.9931545379347728
Energy: 0.8821527267401817
Energy: 0.9763051563897759
Energy: 1.0685525935378457
Energy: 0.9763051563904938
Energy: 0.9328255301980357
Energy: 0.9342140905228675
Energy: 1.0164410036249312
Energy: 0.9342140905235853
Energy: 0.941307264715347
Energy: 0.9330674637104528
Energy: 1.146030116547874
Energy: 0.9330674637097349
Energy: 1.0809176961743199
Energy: 0.9330165726157936
Energy: 0.9470040871553876
Energy: 0.9330165726157936
Energy: 1.0841429854955118
Energy: 0.9320495888052474
Energy: 0.9327233979622043
Energy: 0.9320495888066829
Energy: 1.0692336912493494
Energy: 0.9447286388802686
Energy: 0.9367574961757167
Energy: 0.9447286388795507
Energy: 0.9878791956193318
Energy: 0.9924789412384445
Energy: 0.9377973051215671
Energy: 0.9924789412377265
Energy: 1.0703434248039603
Energy: 0.8822375058325347
Energy: 0.9354297915678436
Energy: 0.8822375058339702
Energy: 1.071761355680102
Energy: 1.0688911008311552
Energy: 1.2066622594541079
Energy: 1.0688911008297195
Energy: 1.084331937540272
Energy: 0.8813709356988643
Energy: 0.9364374660408717
Energy: 0.8813709356974286
Energy: 1.122016848979049
Energy: 0.8833113868003983
Energy: 0.8826580269255495
Energy: 0.8833113867996805
Energy: 1.158875186015402
Energy: 0.8819112636237304
Energy: 0.8811006618926892
Energy: 0.881911263621577
Energy: 1.14744859671803
Energy: 0.8809853565935132
Energy: 0.8798715297251202
Energy: 0.8809853565935132
Energy: 1.1476272525113853
Energy: 0.8815973950737052
Energy: 0.8797810657999345
Energy: 0.8815973950722695
Energy: 1.0780948462530264
Energy: 1.0696471172089055
Energy: 1.0812279068361101
Energy: 1.069647117206752
Energy: 1.070117090092115
Energy: 0.9838691502649791
Energy: 1.0772399195190805
Energy: 0.9838691502656969
Energy: 0.9423922529296229
Energy: 0.9903159045929413
Energy: 0.9320675624970932
Energy: 0.9903159045936591
Energy: 1.0700079423557742
Energy: 0.9631510233006947
Energy: 0.8821678321981037
Energy: 0.9631510233006947
Energy: 1.0160457605601376
Energy: 0.9247651951799785
Energy: 0.9319864597247395
Energy: 0.9247651951792607
Energy: 1.147118435252667
Energy: 0.9395183127333818
Energy: 0.939842210145094
Energy: 0.9395183127348173
Energy: 0.9482394714610655
Energy: 0.9235770751466174
Energy: 1.0783937752762929
Energy: 0.9235770751466174
Energy: 0.9345996227018001
Energy: 0.9327270266937088
Energy: 1.0655188552661499
Energy: 0.932727026692991
Energy: 0.9345432845963857
Energy: 0.9261695783910451
Energy: 1.0703243724199734
Energy: 0.926169578391763
Energy: 0.9397073819682789
Energy: 0.9903495515538412
Energy: 0.9876105646372286
Energy: 0.9903495515538412
Energy: 0.9337973533842592
Energy: 0.8831540123314034
Energy: 0.9904003231508202
Energy: 0.8831540123306856
Energy: 1.1468088265960898
Energy: 1.0689610059063885
Energy: 1.0700994172288738
Energy: 1.0689610059071064

minimum gb energy = 0.8797810657999345 eV
minimum distance =  2.28389404070707 Angstroms
sigma value = 73


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

Energy: 1.1465226934715609
Energy: 1.001317575801294
Energy: 1.056929699123704
Energy: 0.8872351434793565
Energy: 0.8886853337991673
Energy: 0.8895842371537246
Energy: 1.0077623982612312
Energy: 0.8895842371537246
Energy: 0.8844425082673624
Energy: 0.8879635145900995
Energy: 0.9957076300311036
Energy: 0.8879635145900995
Energy: 0.8844188843327633
Energy: 0.8885632404801557
Energy: 1.1237444364002183
Energy: 0.8885632404801557
Energy: 0.8839575245199046
Energy: 0.8883892639682842
Energy: 1.1159638445598197
Energy: 0.8883892639671453
Energy: 0.8875403149181287
Energy: 0.8883393246502467
Energy: 1.1157913183439174
Energy: 0.8883393246491078
Energy: 0.9981996759505093
Energy: 1.001996309389878
Energy: 1.0059227879739772
Energy: 1.0019963093887392
Energy: 1.0003738921150058
Energy: 0.9558373409379314
Energy: 1.0009058914053994
Energy: 0.9558373409390701
Energy: 0.9994564496872148
Energy: 0.9564124801361777
Energy: 1.0019696932991502
Energy: 0.9564124801361777
Energy: 0.8884806620328086
Energy: 0.957413459732712
Energy: 0.9993343931835298
Energy: 0.957413459732712
Energy: 0.9986562407924806
Energy: 0.9550976369437935
Energy: 1.0070953866025973
Energy: 0.9550976369437935
Energy: 1.0065009598387948
Energy: 1.002577802820476
Energy: 1.1114741557403558
Energy: 1.002577802819337
Energy: 0.9975528099940058
Energy: 0.8893501631664603
Energy: 0.8884596856508447
Energy: 0.8893501631653216
Energy: 0.9971097204975692
Energy: 0.8881829914466701
Energy: 0.8841688063092602
Energy: 0.8881829914466701
Energy: 1.1232281703208338
Energy: 0.8884435378628345
Energy: 0.8845091078181082
Energy: 0.8884435378628345
Energy: 1.1161390901710093
Energy: 0.8881995454236578
Energy: 0.884260055138223
Energy: 0.8881995454225189
Energy: 1.113872215577553
Energy: 0.8906130466871609
Energy: 0.8889297891671354
Energy: 0.8906130466871609
Energy: 1.0089936711627983
Energy: 1.0096410526796467
Energy: 0.9984535220251337
Energy: 1.0096410526785078
Energy: 0.9980909740477208
Energy: 0.9544301592164435
Energy: 1.002597645818517
Energy: 0.9544301592164435
Energy: 0.9982494366791989
Energy: 0.9577469723763631
Energy: 1.0027188809449434
Energy: 0.9577469723763631
Energy: 0.9981107247329818
Energy: 0.9600691342211323
Energy: 0.8857494447411042
Energy: 0.9600691342199934
Energy: 1.1111776853086721
Energy: 1.0009137999684938
Energy: 0.9983493678341322
Energy: 1.0009137999696327

minimum gb energy = 0.8839575245199046 eV
minimum distance =  2.28945477369574 Angstroms
sigma value = 7


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

Energy: 1.5687576948279476
Energy: 1.007206130041671
Energy: 1.0792602313033806
Energy: 0.9174807005766192
Energy: 0.9052670686524042
Energy: 0.912335218523564
Energy: 1.1180106656313604
Energy: 0.9123352185300063
Energy: 0.9033065170354986
Energy: 0.9053552755196151
Energy: 1.0093028631000556
Energy: 0.9053552755180047
Energy: 0.9026742438577808
Energy: 0.9063530688430984
Energy: 1.1187058979693547
Energy: 0.9063530688439037
Energy: 0.9047627014196077
Energy: 0.906105682144435
Energy: 1.0880625676279922
Energy: 0.9061056821404085
Energy: 1.0209235345012704
Energy: 0.9074942577932811
Energy: 1.0865750719690193
Energy: 0.9074942578037497
Energy: 1.116154668538226
Energy: 0.9051542375125736
Energy: 0.9075471104700741
Energy: 0.9051542375101578
Energy: 1.1187550324833346
Energy: 0.9088892990979828
Energy: 0.906331360451997
Energy: 0.9088892990971774
Energy: 1.1169639428553135
Energy: 0.9092154747112352
Energy: 0.9070913408428842
Energy: 0.90921547471043
Energy: 1.1031347480889124
Energy: 0.9074905699140422
Energy: 0.9040546781343045
Energy: 0.907490569916458
Energy: 1.1217930330417232
Energy: 0.9707342257292441
Energy: 1.019816156710036
Energy: 0.9707342257308545
Energy: 1.0024842546525219
Energy: 1.0062617321675968
Energy: 1.1153703108329287
Energy: 1.0062617321724285
Energy: 1.0020307749048276
Energy: 0.9666376835723589
Energy: 1.006361210822087
Energy: 0.9666376835788011
Energy: 1.0023662885995068
Energy: 0.9663113925935517
Energy: 0.9152296742436973
Energy: 0.9663113925863042
Energy: 1.007903981497339
Energy: 0.9661639892438201
Energy: 0.9140003150362853
Energy: 0.9661639892414042
Energy: 1.1408903380179063
Energy: 1.0059829591621645
Energy: 1.0028309084544875
Energy: 1.0059829591669964
Energy: 1.1444573201589827
Energy: 0.9710391613593997
Energy: 1.1207520378260372
Energy: 0.9710391613610103
Energy: 0.9041890744835941
Energy: 0.908237715098358
Energy: 1.0104523875275824
Energy: 0.9082377150999686
Energy: 0.9052924067904313
Energy: 0.9091878347911375
Energy: 1.1178597469971232
Energy: 0.9091878347935535
Energy: 0.906675267404531
Energy: 0.9086313745983887
Energy: 1.145277860916177
Energy: 0.9086313745927517
Energy: 0.9074533251726871
Energy: 0.9052648598547132
Energy: 1.0907824193482536
Energy: 0.9052648598506866
Energy: 1.120496523566607
Energy: 0.9074981575142712
Energy: 1.0211695947048822
Energy: 0.9074981575142712
Energy: 1.1167096314780234
Energy: 0.9059948839765495
Energy: 0.9043980334961703
Energy: 0.905994883977355
Energy: 1.1191295574979054
Energy: 0.906476388306198
Energy: 0.903503780389806
Energy: 0.906476388306198
Energy: 1.10115361579263
Energy: 0.9060575228785274
Energy: 0.9033410741657661
Energy: 0.9060575228777221
Energy: 1.086573277504957
Energy: 0.9115443673345732
Energy: 0.905862168113761
Energy: 0.9115443673321573
Energy: 1.005989871082301
Energy: 1.0061251796383293
Energy: 1.3349533321238982
Energy: 1.0061251796359132
Energy: 1.0023140213238404
Energy: 0.9672970967675467
Energy: 1.0087212426173322
Energy: 0.967297096762715
Energy: 1.0104974977117713
Energy: 0.9667670139736322
Energy: 1.002443367706271
Energy: 0.9667670139872855
Energy: 1.0062711091555132
Energy: 0.9706182972065271
Energy: 0.9149409894296572
Energy: 0.970618297208943
Energy: 1.1407622328848168
Energy: 1.003821789236442
Energy: 1.002800748833325
Energy: 1.0038217892380528

minimum gb energy = 0.9026742438577808 eV
minimum distance =  2.27366976766938 Angstroms
sigma value = 29


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

Energy: 0.8626450116129292
Energy: 0.9366198133557274
Energy: 0.8854887131150503
Energy: 0.8659191267599712
Energy: 0.8829166792623885
Energy: 0.951656365807543
Energy: 0.8799318106798749
Energy: 0.9516563658072625
Energy: 0.8763384533021048
Energy: 0.9333876722692868
Energy: 0.8651941702663892
Energy: 0.933387672271749
Energy: 0.8702431519151869
Energy: 0.8788757454583251
Energy: 0.8781468621583814
Energy: 0.8788757454591355
Energy: 0.8761905807272987
Energy: 0.8822823918461311
Energy: 0.868570420457231
Energy: 0.8822823918409262
Energy: 0.8777969412107126
Energy: 0.9428378818301313
Energy: 0.8700138435456126
Energy: 0.9428378818296014
Energy: 0.8648991612554073
Energy: 0.9313967289881361
Energy: 0.8761372724373162
Energy: 0.9313967289867646
Energy: 0.8793615533606598
Energy: 0.8837664733587903
Energy: 0.8753989689773096
Energy: 0.8837664733675484
Energy: 0.8719576686692434
Energy: 0.8795314649332
Energy: 0.8787161060059799
Energy: 0.8795314649315481

minimum gb energy = 0.8626450116129292 eV
minimum distance =  2.31305921818623 Angstroms
sigma value = 5


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

Energy: 1.3534836511331998
Energy: 0.8575059793906238
Energy: 1.025300416273756
Energy: 0.8366123091564888
Energy: 0.9929995995048946
Energy: 0.8557543573529259
Energy: 1.0045890148461114
Energy: 0.8557543573529259
Energy: 1.0035949231298305
Energy: 0.9279709892728556
Energy: 1.0070140572512378
Energy: 0.9279709892720949
Energy: 0.9579497871300142
Energy: 0.9329919146750565
Energy: 0.9943185888910064
Energy: 0.93299191467886
Energy: 0.9244171139669317
Energy: 0.8536928564376561
Energy: 0.9605782946311011
Energy: 0.8536928564376561
Energy: 0.8544206423150468
Energy: 0.8544902121223467
Energy: 0.9612607692167259
Energy: 0.8544902121238681
Energy: 0.8524217901593089
Energy: 0.852662845443296
Energy: 0.9951811329415455
Energy: 0.8526628454410139
Energy: 0.8618504638384524
Energy: 0.8570056311796141
Energy: 1.081556209552553
Energy: 0.8570056311818961
Energy: 0.9752168529421185
Energy: 0.879763110195945
Energy: 1.0546590280020314
Energy: 0.879763110195945
Energy: 1.1489195764617695
Energy: 0.8380110388797583
Energy: 0.8444392814711105
Energy: 0.8380110388820404
Energy: 0.9754202272211446
Energy: 0.8356568857478641
Energy: 0.8373828842032419
Energy: 0.8356568857478641
Energy: 1.0688210503511155
Energy: 0.8361644515702603
Energy: 0.8352691739621536
Energy: 0.8361644515672175
Energy: 1.0780159077997091
Energy: 0.835995889027875
Energy: 0.8484298141645032
Energy: 0.8359958890248322
Energy: 0.9195744184392175
Energy: 0.8274073314146002
Energy: 1.0806810391971404
Energy: 0.8274073314153608
Energy: 0.9155436532919463
Energy: 0.8229864561579753
Energy: 1.104912897939982
Energy: 0.8229864561511636
Energy: 0.9151232860343373
Energy: 0.8238032501147129
Energy: 0.8727598049729471
Energy: 0.8238032501154737
Energy: 0.8813846768926719
Energy: 0.824220936461168
Energy: 0.8714762072847798
Energy: 0.8242209364573646
Energy: 1.0413622263664704
Energy: 0.8261956397737868
Energy: 0.8730041498331388
Energy: 0.8261956397737868
Energy: 1.0582435702098691
Energy: 0.9009033874838773
Energy: 0.8764003729081262
Energy: 0.9009033874793133
Energy: 1.035643308281969
Energy: 0.9683611957744057
Energy: 0.9576332519990489
Energy: 0.9683611957774486
Energy: 0.9537043208237518
Energy: 0.8639554816673719
Energy: 0.8760522670299014
Energy: 0.863955481664329
Energy: 0.9608083287991032
Energy: 0.8603779860463585
Energy: 0.8605126385785326
Energy: 0.8603779860471192
Energy: 1.0886548709624377
Energy: 0.8596949209339672
Energy: 0.8607985734851126
Energy: 0.8596949209301638
Energy: 1.0798896410141947
Energy: 0.8623215926396289
Energy: 0.869891739645709
Energy: 0.8623215926434323
Energy: 1.071061504316806
Energy: 0.9450966775148775
Energy: 0.8795254574529338
Energy: 0.945096677518681
Energy: 0.8341005823525139
Energy: 0.8323897741605536
Energy: 1.14920402879292
Energy: 0.8323897741552289
Energy: 0.8342481550624986
Energy: 0.8308494792032707
Energy: 0.881964845135136
Energy: 0.8308494792032707
Energy: 0.8292708277770475
Energy: 0.8314013037771691
Energy: 0.937634307817099
Energy: 0.8314013037802118
Energy: 0.8291722571716763
Energy: 0.8302196725893308
Energy: 1.0794799352530224
Energy: 0.8302196725893308
Energy: 1.1061186054344005
Energy: 0.8775114632465123
Energy: 0.8791054390905281
Energy: 0.8775114632442303
Energy: 1.0792814636726868
Energy: 0.853638186255657
Energy: 0.8571572888350645
Energy: 0.8536381862533748
Energy: 0.9936948960940245
Energy: 0.8529268786835552
Energy: 0.8566208917620622
Energy: 0.8529268786827945
Energy: 0.8628535345387942
Energy: 0.8523354829269214
Energy: 0.8526597643174232
Energy: 0.8523354829292036

minimum gb energy = 0.8229864561511636 eV
minimum distance =  2.26784962917282 Angstroms
sigma value = 1


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

Energy: 1.3435334722018308
Energy: 0.805239601366221
Energy: 0.9855618307375379
Energy: 0.7744359389729529
Energy: 0.8070383697554285
Energy: 0.8068875403664915
Energy: 1.012682056367071
Energy: 0.8068875403664915
Energy: 1.0134613475357284
Energy: 0.9002240131577937
Energy: 1.0157176853597327
Energy: 0.9002240131609491
Energy: 0.83078533237198
Energy: 0.901120491041006
Energy: 1.0005790042271892
Energy: 0.9011204910420577
Energy: 0.8042690925250882
Energy: 0.8032947196507607
Energy: 1.020419645610817
Energy: 0.8032947196518124
Energy: 0.8024890695390937
Energy: 0.8040721764872605
Energy: 0.9959359559985684
Energy: 0.8040721764841051
Energy: 0.8008407362970847
Energy: 0.8025500769520049
Energy: 1.0016564062870772
Energy: 0.8025500769520049
Energy: 0.8107805365246538
Energy: 0.8095860492393815
Energy: 1.1653122170427634
Energy: 0.8095860492393815
Energy: 1.0014044668631363
Energy: 0.8452045334843183
Energy: 1.1649133048534104
Energy: 0.8452045334811628
Energy: 1.0089702665698954
Energy: 0.8102815601910252
Energy: 0.8082510402653517
Energy: 0.8102815601910252
Energy: 1.002601040014091
Energy: 0.8029247773874988
Energy: 0.8011348651865082
Energy: 0.8029247773832916
Energy: 1.1611712886989662
Energy: 0.813901057665837
Energy: 0.8034197702716794
Energy: 0.8139010576647852
Energy: 1.1612171632220312
Energy: 0.8035129248377205
Energy: 0.8033637898660819
Energy: 0.8035129248387723
Energy: 0.9998381868961795
Energy: 0.9011727262777135
Energy: 1.0144760643331514
Energy: 0.9011727262808689
Energy: 0.8319449544525478
Energy: 0.8990787083858167
Energy: 1.0134713457389193
Energy: 0.8990787083858167
Energy: 0.8309429522813898
Energy: 0.8055675368192405
Energy: 1.0026524938048265
Energy: 0.8055675368160852
Energy: 0.8030028268259148
Energy: 0.8042856416551097
Energy: 1.0102898492097225
Energy: 0.8042856416572134
Energy: 0.8209739301965098
Energy: 0.8089905533007138
Energy: 0.9998720635833996
Energy: 0.8089905533007138
Energy: 0.8009843082817789
Energy: 0.803137031456035
Energy: 1.1651109678392035
Energy: 0.8031370314539314
Energy: 0.8047610125583161
Energy: 0.8159317934631788
Energy: 1.1657428000890615
Energy: 0.8159317934610752
Energy: 1.0097602150014793
Energy: 0.8416605493188275
Energy: 1.0025592538569155
Energy: 0.8416605493177756
Energy: 1.0109629716724298
Energy: 0.8054996346348853
Energy: 0.8078094089282665
Energy: 0.8054996346380406
Energy: 1.0016876034424507
Energy: 0.8030903482798815
Energy: 0.8028851555602027
Energy: 0.8030903482840887
Energy: 1.1615180572415333
Energy: 0.8037453458209614
Energy: 0.8023051723826055
Energy: 0.8037453458220131

minimum gb energy = 0.7744359389729529 eV
minimum distance =  2.28911880596812 Angstroms
sigma value = 17


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

Energy: 1.4512200758305187
Energy: 0.8021508435510489
Energy: 0.9871717520944377
Energy: 0.777879584964908
Energy: 0.796878952256675
Energy: 0.7986391473672179
Energy: 0.9290361355508729
Energy: 0.7986391473672179
Energy: 1.032814089306253
Energy: 0.7953558144279608
Energy: 0.9562837300226374
Energy: 0.7953558144266606
Energy: 1.0402597300810965
Energy: 0.842260678429031
Energy: 0.9198265393208225
Energy: 0.842260678429031
Energy: 0.9027595359866835
Energy: 0.7768927465199341
Energy: 1.0485000702606657
Energy: 0.7768927465199341
Energy: 0.7778245289430357
Energy: 0.7767836302505758
Energy: 1.0356217124947338
Energy: 0.7767836302512259
Energy: 0.7775533611269856
Energy: 0.7763696209185283
Energy: 0.8140993461867153
Energy: 0.776369620916578
Energy: 0.7849885115371624
Energy: 0.7786326121255329
Energy: 0.9125803332275672
Energy: 0.7786326121255329
Energy: 1.0451005537159346
Energy: 0.7795311701418882
Energy: 1.0316232535169527
Energy: 0.7795311701418882
Energy: 0.9650498532814106
Energy: 0.8453318696029966
Energy: 0.9419532338503497
Energy: 0.8453318696016964
Energy: 1.0409744888038976
Energy: 0.7949570934756731
Energy: 0.8104222256916758
Energy: 0.7949570934769733
Energy: 1.045105296418942
Energy: 0.8105536774451081
Energy: 0.9226138593346956
Energy: 0.8105536774496587
Energy: 1.0358094797732973
Energy: 0.7946956411470796
Energy: 0.7951019391399166
Energy: 0.7946956411477297
Energy: 0.9308936806941648
Energy: 0.7947953717346871
Energy: 0.7968235684411193
Energy: 0.7947953717366372
Energy: 1.0897426158758408
Energy: 0.7973877391638929
Energy: 0.8043965056618897
Energy: 0.7973877391632428
Energy: 1.0447341993372883
Energy: 0.7957614629125809
Energy: 0.7982507588140694
Energy: 0.7957614629119307
Energy: 0.7952453282620131
Energy: 0.9025537731418212
Energy: 0.9960377168296931
Energy: 0.9025537731418212
Energy: 0.7946783189167315
Energy: 0.7945731725815828
Energy: 1.0449372461070767
Energy: 0.7945731725809327
Energy: 0.8096479548287786
Energy: 0.8013338471033106
Energy: 0.9232691085854802
Energy: 0.8013338471039607
Energy: 0.7967083500671844
Energy: 0.7947306309487523
Energy: 0.914669004181253
Energy: 0.7947306309520028
Energy: 0.9468467235547663
Energy: 0.7971876886940918
Energy: 0.7957414268036882
Energy: 0.7971876886973422
Energy: 0.9556215255476047
Energy: 0.8013522673756307
Energy: 1.0840335571225663
Energy: 0.8013522673814816
Energy: 0.920101024745325
Energy: 0.8401657996000365
Energy: 1.0916389990888633
Energy: 0.8401657995987363
Energy: 1.048260133901118
Energy: 0.7779849017077363
Energy: 0.9020134477803777
Energy: 0.7779849017051358
Energy: 1.043182662478296
Energy: 0.7766099096922461
Energy: 0.7769009937109436
Energy: 0.7766099096961465
Energy: 0.9217200304059643
Energy: 0.7773127151943424
Energy: 0.7801680216229707
Energy: 0.7773127151936923
Energy: 0.91500093789323
Energy: 0.7799580786727607
Energy: 0.7859017076875654
Energy: 0.7799580786695102
Energy: 0.9229610173373318
Energy: 0.7793852642819628
Energy: 1.0490852355150864
Energy: 0.7793852642813127
Energy: 0.929030872254754
Energy: 0.8440945661602328
Energy: 0.9561438258840718
Energy: 0.8440945661602328
Energy: 0.8115859600946185
Energy: 0.7949392778780752
Energy: 1.0393010407816832
Energy: 0.7949392778728744
Energy: 0.9206918896836714
Energy: 0.7952660384058192
Energy: 1.034800774510047
Energy: 0.7952660384084195
Energy: 0.7945787825060885
Energy: 0.7948717335380372
Energy: 1.0346934776614127
Energy: 0.7948717335380372
Energy: 0.7945829450687533
Energy: 0.7940718719093847
Energy: 0.9321311377592775
Energy: 0.7940718719067843
Energy: 0.8028268058411905
Energy: 0.7992489641182999
Energy: 1.0892917866562897
Energy: 0.7992489641196001
Energy: 0.9365220758712304
Energy: 0.81912731732196
Energy: 1.0445852080532683
Energy: 0.8191273173245602
Energy: 1.2870697724815752
Energy: 0.8062504823800813
Energy: 0.7960625416419818
Energy: 0.8062504823807314
Energy: 1.0422463495835719
Energy: 0.794520640612625
Energy: 0.7951290163277538
Energy: 0.794520640612625
Energy: 1.032048773991678
Energy: 0.8011581709555882
Energy: 0.7963832810080759
Energy: 0.8011581709549381

minimum gb energy = 0.776369620916578 eV
minimum distance =  2.28971497832199 Angstroms
sigma value = 89


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

Energy: 1.560268709868244
Energy: 0.7275418111393018
Energy: 0.7270041481516283
Energy: 0.7509127932450659
Energy: 0.7269041069265271
Energy: 0.8003429194645709
Energy: 0.7269789968953733
Energy: 0.8003429194645709
Energy: 0.7199646581247774
Energy: 0.8002466368566026
Energy: 0.7436893201503204
Energy: 0.8002466368549018
Energy: 0.7206238495746238
Energy: 0.8007179824182367
Energy: 0.7244269801907154
Energy: 0.8007179824182367
Energy: 0.7236992112068251
Energy: 0.7251821296954154
Energy: 0.7385888198058828
Energy: 0.7251821296954154
Energy: 0.7243165882341942
Energy: 0.7242137315596838
Energy: 0.7377668667868021
Energy: 0.7242137315596838
Energy: 0.7235991550232801
Energy: 0.7231491755893293
Energy: 0.7258335651691464
Energy: 0.7231491755910303
Energy: 0.7261284978767709
Energy: 0.7282177373597096
Energy: 0.7183155911191331
Energy: 0.7282177373597096
Energy: 0.7284562998602093
Energy: 0.7269242704513887
Energy: 0.7185482098379843
Energy: 0.7269242704513887
Energy: 0.7423529820420048
Energy: 0.8017129283832445
Energy: 0.7273590537709024
Energy: 0.8017129283849453
Energy: 0.7257758134749391
Energy: 0.8026073642034648
Energy: 0.7177314401475474
Energy: 0.8026073642034648
Energy: 0.7371471095009593
Energy: 0.7239701998533133
Energy: 0.7263667434478827
Energy: 0.7239701998533133
Energy: 0.7398573323202146
Energy: 0.7263069727507412
Energy: 0.7274813621790269
Energy: 0.7263069727507412
Energy: 0.7257212255096733
Energy: 0.7226567901958046
Energy: 0.7222045963894825
Energy: 0.7226567901958046
Energy: 0.7182405826064953
Energy: 0.7253956801018576
Energy: 0.7260542708215469
Energy: 0.7253956801035586

minimum gb energy = 0.7177314401475474 eV
minimum distance =  2.31003465250241 Angstroms
sigma value = 13


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

Energy: 1.3643340593382172
Energy: 0.6881690405668105
Energy: 0.9049097148108831
Energy: 0.681882031982582
Energy: 0.8230470041473065
Energy: 0.6867253535518933
Energy: 0.8352689007131257
Energy: 0.6867253535490416
Energy: 0.6901180571431322
Energy: 0.6847630823366877
Energy: 0.8473837793926713
Energy: 0.68476308233241
Energy: 0.9991806568084795
Energy: 0.6892136797312057
Energy: 0.8258336670600676
Energy: 0.6892136797304927
Energy: 0.8308328088949303
Energy: 0.6869536443326966
Energy: 0.827344643079636
Energy: 0.6869536443326966
Energy: 0.828656866197348
Energy: 0.6860566705288847
Energy: 0.8237502846765068
Energy: 0.6860566705274589
Energy: 0.8278801371353366
Energy: 0.6856682127547019
Energy: 0.8236744970987496
Energy: 0.6856682127582666
Energy: 0.8286553334792576
Energy: 0.6844155862583777
Energy: 0.8448598179131938
Energy: 0.6844155862519613
Energy: 0.6836284172008268
Energy: 0.6881468519070362
Energy: 0.8303068189186146
Energy: 0.6881468519120267
Energy: 0.6839068754368057
Energy: 0.6852125482761068
Energy: 0.8288070741308291
Energy: 0.6852125482725422
Energy: 0.6864191715581772
Energy: 0.6845824210845689
Energy: 1.364568354828524
Energy: 0.6845824210845689
Energy: 0.8242021386051778
Energy: 0.6844434892572773
Energy: 0.8291433623484745
Energy: 0.6844434892644066
Energy: 0.828905531218773
Energy: 0.7262501875593776
Energy: 0.8232296181732451
Energy: 0.7262501875636553
Energy: 0.8261743141902861
Energy: 0.7282769276886613
Energy: 0.9998510255323564
Energy: 0.7282769276929388
Energy: 0.8348485195362109
Energy: 0.6877972153641418
Energy: 0.827111482272959
Energy: 0.687797215360642
Energy: 0.8333955779795221
Energy: 0.6866526432894065
Energy: 0.6913749128804836
Energy: 0.6866526432915453
Energy: 0.8236386768527578
Energy: 0.6852384650208777
Energy: 0.6885882401663266
Energy: 0.6852384650208777
Energy: 0.6952116153129343
Energy: 0.6848107709515334
Energy: 0.687110661759352
Energy: 0.6848107709543851
Energy: 0.9524320847368197
Energy: 0.688047056518977
Energy: 0.823270268044126
Energy: 0.688047056517551
Energy: 0.8278758763036084
Energy: 0.6840003486423512
Energy: 0.8507937982686261
Energy: 0.6840003486437769
Energy: 1.0127187933527395
Energy: 0.6855197435885975
Energy: 0.8232091609807594
Energy: 0.6855197435850329
Energy: 0.8276241956518602
Energy: 0.7392769587686295
Energy: 0.8234782502078434
Energy: 0.7392769587771849
Energy: 0.8305972293436038
Energy: 0.6879567458889913
Energy: 0.8280259995703523
Energy: 0.6879567458897043
Energy: 0.6904145619846338
Energy: 0.6842029525291429
Energy: 0.8263981500207547
Energy: 0.6842029525334206
Energy: 0.825010416285315
Energy: 0.6856301001576508
Energy: 0.8343380394297258
Energy: 0.6856301001597896
Energy: 0.6862077065596663
Energy: 0.684204416131601
Energy: 0.8334531038087618
Energy: 0.6842044161344527
Energy: 0.6844974654675904
Energy: 0.683910477587473
Energy: 0.8259790321752382
Energy: 0.6839104775896119
Energy: 0.6848347763750513
Energy: 0.6878476343302762
Energy: 0.6953623043768826
Energy: 0.6878476343295631
Energy: 0.8227856227149847
Energy: 0.6841146615987258
Energy: 0.9538027726551214
Energy: 0.6841146615972998
Energy: 0.8512794079179234
Energy: 0.7290014998096886
Energy: 0.8228246854755276
Energy: 0.729001499805411
Energy: 0.9657088221337593
Energy: 0.7256908350463952
Energy: 1.0139568067100904
Energy: 0.7256908350428304
Energy: 0.8328910199485176
Energy: 0.6856565933541483
Energy: 0.8226230313011974
Energy: 0.6856565933463059
Energy: 0.8355461927870934
Energy: 0.6885405828533776
Energy: 0.6925512860747675
Energy: 0.6885405828590812
Energy: 0.966319742376627
Energy: 0.6839736807996364
Energy: 0.6846096268076817
Energy: 0.6839736808024881
Energy: 0.952149710284679
Energy: 0.6855869322636704
Energy: 0.6894606005793105
Energy: 0.6855869322643835

minimum gb energy = 0.681882031982582 eV
minimum distance =  2.30096151206736 Angstroms
sigma value = 37


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

Energy: 1.179043299173407
Energy: 0.6259639082031292
Energy: 0.624913758359367
Energy: 0.6250990039323311
Energy: 0.8600665694538776
Energy: 0.624169889303897
Energy: 0.8566721379101856
Energy: 0.624169889303897
Energy: 1.087159830117299
Energy: 0.7022353026843821
Energy: 0.8634920659720894
Energy: 0.7022353026843821
Energy: 1.0865841685755857
Energy: 0.6250242001483849
Energy: 0.8607059291894502
Energy: 0.6250242001459317
Energy: 0.633575790248882
Energy: 0.7044091897494418
Energy: 0.8593843898200518
Energy: 0.7044091897494418
Energy: 0.7587568872804568
Energy: 0.6246083869953213
Energy: 0.8572968696718111
Energy: 0.6246083869928681
Energy: 0.6243982618630157
Energy: 0.6229762747332358
Energy: 0.8596494567203583
Energy: 0.6229762747332358
Energy: 0.6320948952094425
Energy: 0.6235933672470915
Energy: 0.8534619774460138
Energy: 0.6235933672470915
Energy: 0.6241621471571418
Energy: 0.627146851603995
Energy: 0.8527009268826974
Energy: 0.627146851603995
Energy: 0.6225373373057576
Energy: 0.6242468472146401
Energy: 0.7561773098187659
Energy: 0.6242468472158667
Energy: 0.6249137584035239
Energy: 0.6259639083097862
Energy: 1.179043299173407
Energy: 0.6259639083269585
Energy: 0.8566721379101856
Energy: 0.6241698893051236
Energy: 0.7560245038948141
Energy: 0.624169889303897
Energy: 0.8634920659732882
Energy: 0.7022353026843821
Energy: 1.087159830117299
Energy: 0.7022353026843821
Energy: 0.8607059291906768
Energy: 0.6250242001471583
Energy: 1.086584168584172
Energy: 0.6250242001483849
Energy: 0.8593843898200518
Energy: 0.7044091897494418
Energy: 0.633575790236616
Energy: 0.7044091897494418
Energy: 0.7542191045941355
Energy: 0.6246083869928681
Energy: 0.8634227823627552
Energy: 0.6246083869928681
Energy: 0.8596494567203583
Energy: 0.6229762747332358
Energy: 0.6243982618630157
Energy: 0.6229762747344624
Energy: 0.8534619773834858
Energy: 0.623593367248318
Energy: 0.6320948952094425
Energy: 0.623593367248318
Energy: 0.8527009268937367
Energy: 0.627146851603995
Energy: 0.6241621471571418
Energy: 0.627146851603995
Energy: 0.8608566230822833
Energy: 0.6242468472158667
Energy: 0.6225373373057576
Energy: 0.6242468472158667

minimum gb energy = 0.6225373373057576 eV
minimum distance =  2.31517368037438 Angstroms
sigma value = 25


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

Energy: 1.4320243209882073
Energy: 0.5588063759682393
Energy: 0.7984244501380553
Energy: 0.5625242565775093
Energy: 0.9512341084185819
Energy: 0.5564434263203514
Energy: 0.7483685996568099
Energy: 0.556443426321309
Energy: 1.2675770488329468
Energy: 0.5553228269667452
Energy: 0.7513740489576659
Energy: 0.5553228269677031
Energy: 0.9729020742907947
Energy: 0.5616725217047579
Energy: 0.7477612519393846
Energy: 0.5616725217047579
Energy: 0.9480802367844641
Energy: 0.6209349466559848
Energy: 0.9499633225211849
Energy: 0.6209349466569425
Energy: 0.9404181422520876
Energy: 0.6179531849659932
Energy: 1.1065628101565763
Energy: 0.6179531849659932
Energy: 0.943016066835141
Energy: 0.620657482609878
Energy: 0.9484070582908628
Energy: 0.620657482609878
Energy: 0.7473547793888681
Energy: 0.5611101896890506
Energy: 1.1014484187665536
Energy: 0.5611101896890506
Energy: 0.7512557127852275
Energy: 0.5555289666146477
Energy: 1.10458471184403
Energy: 0.5555289666156055
Energy: 0.752128275391415
Energy: 0.5561984829128331
Energy: 1.1047208599500766
Energy: 0.5561984829137909
Energy: 0.5563422424755663
Energy: 0.5604202247491636
Energy: 1.202867144453033
Energy: 0.5604202247472481
Energy: 0.559038877333086
Energy: 0.5560393441193646
Energy: 0.950753555437286
Energy: 0.5560393441203224
Energy: 0.5572286194629786
Energy: 0.5550971816021055
Energy: 0.9395557532741841
Energy: 0.5550971816030632
Energy: 0.5685672484240484
Energy: 0.562623507447172
Energy: 0.9388432813997268
Energy: 0.5626235074490875
Energy: 0.7516630168882371
Energy: 0.5550923471100346
Energy: 0.9486577582676186
Energy: 0.5550923471100346
Energy: 0.7521718043443132
Energy: 0.5565746680603432
Energy: 0.9430470621705089
Energy: 0.5565746680593855
Energy: 0.9480342576230979
Energy: 0.5580377345504105
Energy: 0.9404170897564064
Energy: 0.5580377345494526
Energy: 0.7640299588934332
Energy: 0.6220702745102246
Energy: 0.9478074692074975
Energy: 0.6220702745092668
Energy: 1.10366018716545
Energy: 0.6186848080846787
Energy: 0.9431357415929263
Energy: 0.6186848080846787
Energy: 0.9491995991197516
Energy: 0.6184461593958062
Energy: 0.9408651552692804
Energy: 0.6184461593948485
Energy: 1.2039801831573247
Energy: 0.5594501577587366
Energy: 0.7537756462315314
Energy: 0.5594501577539476
Energy: 0.9501220169334673
Energy: 0.5544919991753515
Energy: 0.5559081275567348
Energy: 0.5544919991763094
Energy: 1.1014646649123983
Energy: 0.5583036173991968
Energy: 0.7474972242260306
Energy: 0.5583036173982391
Energy: 1.0999206664992778
Energy: 0.5573267245362317
Energy: 0.5622289642560577
Energy: 0.5573267245371893
Energy: 0.9491758138307043
Energy: 0.5548379908584792
Energy: 0.5554170488691041
Energy: 0.5548379908575214
Energy: 1.2603045004748747
Energy: 0.5568555669431834
Energy: 0.5606878876913854
Energy: 0.5568555669441412

minimum gb energy = 0.5544919991753515 eV
minimum distance =  2.31449169070851 Angstroms
sigma value = 41


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

Energy: 1.6937309619212673
Energy: 0.5111332899327538
Energy: 0.7620884678945179
Energy: 0.5196774428253006
Energy: 1.1257256863784506
Energy: 0.5111197263463566
Energy: 0.6753562034116284
Energy: 0.511119726347927
Energy: 1.1394891917623813
Energy: 0.5096950533018088
Energy: 0.675966378810497
Energy: 0.5096950532994532
Energy: 1.1803111341689416
Energy: 0.5121923348959911
Energy: 0.8186844866593448
Energy: 0.5121923348952059
Energy: 1.1250366024763867
Energy: 0.5089785921324415
Energy: 0.979858124935389
Energy: 0.5089785921332267
Energy: 1.1857803059381107
Energy: 0.5105533759161742
Energy: 0.9760307056339448
Energy: 0.5105533759208857
Energy: 1.1908950328000611
Energy: 0.5640523605666021
Energy: 1.069582556612842
Energy: 0.5640523605689577
Energy: 0.9850983541245537
Energy: 0.5108965280787443
Energy: 1.051315738327503
Energy: 0.5108965280795296
Energy: 0.90441827167828
Energy: 0.5102637525866569
Energy: 1.2537798604178512
Energy: 0.5102637525874422
Energy: 0.9024928027623798
Energy: 0.5102545141501059
Energy: 1.1112587196515278
Energy: 0.5102545141461797
Energy: 0.6714171668025775
Energy: 0.508323261325212
Energy: 1.4940862767785996
Energy: 0.5083232613236416
Energy: 0.6733200419177411
Energy: 0.5073296997249103
Energy: 1.1117169530741364
Energy: 0.5073296997296216
Energy: 0.6620482448387256
Energy: 0.5068527234743844
Energy: 1.1838579247963088
Energy: 0.50685272347674
Energy: 0.5985376854439608
Energy: 0.5099830876218012
Energy: 1.1270147550605916
Energy: 0.509983087621016
Energy: 0.5920243253049308
Energy: 0.5079989266344764
Energy: 1.1227689450062859
Energy: 0.5079989266313355
Energy: 0.5949672179499798
Energy: 0.5071001633162736
Energy: 1.1140629764056458
Energy: 0.5071001633115623
Energy: 0.7542742913869377
Energy: 0.5100680573674274
Energy: 1.1131925983007804
Energy: 0.5100680573650717
Energy: 0.7586754182341705
Energy: 0.5046184852943855
Energy: 1.1171932144449317
Energy: 0.504618485292815
Energy: 0.7530988247981658
Energy: 0.5075325593736435
Energy: 1.187093678707172
Energy: 0.5075325593712877
Energy: 0.9662652121448007
Energy: 0.5056466400551735
Energy: 1.1850755534289201
Energy: 0.5056466400575291
Energy: 1.0316400715395244
Energy: 0.5603175167868734
Energy: 1.1132397074366769
Energy: 0.5603175167829473
Energy: 0.9659298616239649
Energy: 0.5050387606281855
Energy: 1.1918861548797859
Energy: 0.5050387606289708
Energy: 1.2586943289035177
Energy: 0.5601395987033442
Energy: 1.1835762840743198
Energy: 0.5601395987017738
Energy: 1.0506568548413295
Energy: 0.5617080825710545
Energy: 0.9761236870220135
Energy: 0.5617080825663432
Energy: 1.1236792667756736
Energy: 0.5652315278898616
Energy: 0.9327160622825051
Energy: 0.5652315278890765
Energy: 1.3243686752158303
Energy: 0.511188679212583
Energy: 0.9746600864116566
Energy: 0.511188679212583
Energy: 1.1849697671267683
Energy: 0.5134342461297241
Energy: 0.6728356401538804
Energy: 0.5134342461242274
Energy: 1.1245123460679816
Energy: 0.509051198523513
Energy: 0.6790659623796309
Energy: 0.509051198520372
Energy: 1.1259806810276303
Energy: 0.5133909542300034
Energy: 0.6776481218027767
Energy: 0.5133909542323234
Energy: 1.3232023690631851
Energy: 0.5124285734521645
Energy: 0.5186972923999138
Energy: 0.5124285734467036
Energy: 1.1256316140412692
Energy: 0.5092437024284434
Energy: 0.5100073606427491
Energy: 0.5092437024292286
Energy: 1.1860586030591
Energy: 0.5114747545913696
Energy: 0.5190496030068503
Energy: 0.511474754596081

minimum gb energy = 0.504618485292815 eV
minimum distance =  2.30853678172925 Angstroms
sigma value = 15


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

Energy: 1.3680371999329717
Energy: 0.4712263818429529
Energy: 0.7238492339959429
Energy: 0.47625662420557824
Energy: 1.2436486645489175
Energy: 0.4684668635312353
Energy: 0.6058076574434769
Energy: 0.4684668635325657
Energy: 1.475087017505299
Energy: 0.46803435055145487
Energy: 0.6096379493909286
Energy: 0.4680343505507896
Energy: 1.2463068256424947
Energy: 0.47087944098974605
Energy: 0.758325421038475
Energy: 0.4708794409884156
Energy: 1.2412080583682596
Energy: 0.46549413281265734
Energy: 0.8741550625588372
Energy: 0.4654941328159834
Energy: 1.2401606450416485
Energy: 0.4660863966837391
Energy: 0.8696877854340347
Energy: 0.4660863966837391
Energy: 0.9966260393500131
Energy: 0.4721519948927802
Energy: 1.1156779185612087
Energy: 0.47215199489144977
Energy: 1.11933409414367
Energy: 0.5127675844952458
Energy: 0.8753100873847451
Energy: 0.5127675844952458
Energy: 0.9952452563873238
Energy: 0.510305664665761
Energy: 1.1145698591557136
Energy: 0.5103056646650959
Energy: 0.9941441689083501
Energy: 0.6187787766955798
Energy: 1.2436633623866284
Energy: 0.6187787766949147
Energy: 0.8756454814138763
Energy: 0.47035940838842144
Energy: 1.2097714489283702
Energy: 0.47035940838842144
Energy: 0.7510811129849939
Energy: 0.46539464522346674
Energy: 1.3541217872747342
Energy: 0.4653946452228015
Energy: 0.8703706965763045
Energy: 0.4660012100870551
Energy: 1.3560268559619137
Energy: 0.4660012100903811
Energy: 0.6133098576458151
Energy: 0.4707850286907297
Energy: 1.1249640233223384
Energy: 0.4707850286907297
Energy: 0.6086720658720622
Energy: 0.46651765668558814
Energy: 1.2407997285617496
Energy: 0.4665176566842577
Energy: 0.6112798992807796
Energy: 0.4702536495587694
Energy: 1.3563187061328377
Energy: 0.4702536495587694
Energy: 0.4737926211190586
Energy: 0.46989334207143985
Energy: 1.3621848010644668
Energy: 0.46989334207210504
Energy: 0.46598498128913945
Energy: 0.4661154468890838
Energy: 1.2396090430802345
Energy: 0.46611544688642287
Energy: 0.47151236973768723
Energy: 0.46961345522216597
Energy: 1.241743515011593
Energy: 0.46961345522216597
Energy: 0.6119700626954506
Energy: 0.47108544158943233
Energy: 1.242832232824719
Energy: 0.4710854415900975
Energy: 0.6071791842105634
Energy: 0.46657601275464333
Energy: 1.240120641815518
Energy: 0.466576012756639
Energy: 0.6133746832112387
Energy: 0.47006048335887746
Energy: 1.245383459932769
Energy: 0.47006048335887746
Energy: 0.8693451556419449
Energy: 0.4664166671663676
Energy: 1.2370616564524155
Energy: 0.4664166671683633
Energy: 0.8776323288009089
Energy: 0.46540229991455007
Energy: 1.2408449319178214
Energy: 0.46540229991521526
Energy: 0.8763777095034629
Energy: 0.4698589626004715
Energy: 1.0489385826195827
Energy: 0.46985896259714544
Energy: 1.1179598549358845
Energy: 0.6209014600571474
Energy: 1.2439977763071288
Energy: 0.6209014600577523
Energy: 0.8718560900273187
Energy: 0.510830424856256
Energy: 1.1155821244367348
Energy: 0.5108304248589167
Energy: 1.120341078073358
Energy: 0.5133453463161776
Energy: 1.0026167516662678
Energy: 0.5133453463148472
Energy: 1.1202389175191072
Energy: 0.4682153368878177
Energy: 1.116153135154063
Energy: 0.4682153369044479
Energy: 1.1165469649834538
Energy: 0.4664077439137594
Energy: 0.8703734958300159
Energy: 0.4664077439110986
Energy: 1.2396768758589118
Energy: 0.46536381573692004
Energy: 0.7509236080081924
Energy: 0.46536381573558966
Energy: 1.1234989291937483
Energy: 0.4719372693441061
Energy: 0.8762871009336112
Energy: 0.4719372693434409
Energy: 1.3566167635675708
Energy: 0.46815864733276086
Energy: 0.6111275433017141
Energy: 0.46815864733276086
Energy: 1.2403011724245523
Energy: 0.467937857681152
Energy: 0.6097136467271425
Energy: 0.4679378576831476
Energy: 1.235968217976994
Energy: 0.4693962667194164
Energy: 0.475048152754981
Energy: 0.4693962667187512
Energy: 1.2428084148805707
Energy: 0.4695438874348638
Energy: 0.46771343620508565
Energy: 0.469543887435529
Energy: 1.2496669843226809
Energy: 0.4697838893043498
Energy: 0.4690121773537197
Energy: 0.469783889301689

minimum gb energy = 0.46536381573558966 eV
minimum distance =  2.31213015589041 Angstroms
sigma value = 85


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

Energy: 1.4713032155378816
Energy: 0.42283079798071815
Energy: 0.4218475682540302
Energy: 0.43870167404165866
Energy: 1.3178155931154325
Energy: 0.4216434245966293
Energy: 0.5436218822645631
Energy: 0.4216434245972062
Energy: 1.3099674424221266
Energy: 0.42100379940123484
Energy: 0.5473647880305466
Energy: 0.42100379940123484
Energy: 1.0934340706050885
Energy: 0.42366015168487836
Energy: 0.7752734795867046
Energy: 0.4236601516854553
Energy: 1.3161782184544906
Energy: 0.41984949282645023
Energy: 0.7783442983696978
Energy: 0.41984949282645023
Energy: 1.0978382997742393
Energy: 0.42059872560235706
Energy: 0.7750986758302715
Energy: 0.42059872560293404
Energy: 1.0950741683266174
Energy: 0.4210491725232433
Energy: 0.9948981384764212
Energy: 0.42104917252382024
Energy: 1.2055612812405907
Energy: 0.4206724702385324
Energy: 0.7756525356422721
Energy: 0.42067247024026316
Energy: 1.0970824468157148
Energy: 0.42095511309041184
Energy: 0.9902536448138219
Energy: 0.42095511309560424
Energy: 1.0968323463372998
Energy: 0.4937881573477824
Energy: 1.2037704051368865
Energy: 0.4937881573489363
Energy: 0.9911061522623359
Energy: 0.4209781443934747
Energy: 1.0593346240769337
Energy: 0.42097814439174397
Energy: 0.881725908702506
Energy: 0.4206280537626699
Energy: 1.2038814834197487
Energy: 0.42062805375170803
Energy: 0.990356321144385
Energy: 0.42013914450906986
Energy: 1.2038831949948936
Energy: 0.42013914450906986
Energy: 0.7753065554153337
Energy: 0.4218087914350858
Energy: 0.9873180031747729
Energy: 0.42180879143277805
Energy: 0.663708468041436
Energy: 0.41979950350439565
Energy: 1.3151478719963887
Energy: 0.4197995035055495
Energy: 0.7774854763061735
Energy: 0.4219482497877402
Energy: 1.2011122169295605
Energy: 0.4219482497883172
Energy: 0.5446030229129517
Energy: 0.42484541033648426
Energy: 1.2011404046637943
Energy: 0.4248454103376381
Energy: 0.5426447048498674
Energy: 0.4197954375293761
Energy: 1.3147215144172129
Energy: 0.419795437529953
Energy: 0.5435034677736639
Energy: 0.4202350226413846
Energy: 1.3083591538048012
Energy: 0.42023502264311546
Energy: 0.4228926972251043
Energy: 0.4241132392129927
Energy: 1.3084937100393634
Energy: 0.4241132392124158
Energy: 0.42093933996251315
Energy: 0.4201175491864903
Energy: 1.3157591087411247
Energy: 0.42011754918706723
Energy: 0.4239872898961596
Energy: 0.4214994688908274
Energy: 1.3060932478586338
Energy: 0.4214994688908274
Energy: 0.5467835973397674
Energy: 0.4222551225338863
Energy: 1.3090710023428382
Energy: 0.4222551225338863
Energy: 0.5446720512218268
Energy: 0.4199147996927266
Energy: 1.3169792558904945
Energy: 0.4199147996933036
Energy: 0.543599046603166
Energy: 0.42026283811238396
Energy: 1.093600395071794
Energy: 0.42026283811007625
Energy: 0.7747755087381971
Energy: 0.4203073467428956
Energy: 1.3102385591683745
Energy: 0.4203073467428956
Energy: 0.7768624772196647
Energy: 0.4202066214628019
Energy: 1.310129796221419
Energy: 0.4202066214628019
Energy: 0.7753377436058022
Energy: 0.4223728376541029
Energy: 1.0953894719253787
Energy: 0.4223728376546798
Energy: 0.990628866731555
Energy: 0.4200115678992605
Energy: 1.3183555106827598
Energy: 0.42001156790041433
Energy: 0.9919972190498543
Energy: 0.42090009790161004
Energy: 1.0977330814818673
Energy: 0.4209000979004562
Energy: 1.1048035849037596
Energy: 0.4926881689642136
Energy: 0.8798239613753855
Energy: 0.49268816896536743
Energy: 0.9891748222953783
Energy: 0.4925202231241351
Energy: 1.1042772673856438
Energy: 0.4925202231241351
Energy: 1.2058968498218012
Energy: 0.42093254358137855
Energy: 0.882459565776959
Energy: 0.420932543576763
Energy: 1.3153855115737831
Energy: 0.41980593608220207
Energy: 0.8839592416473097
Energy: 0.419805936083356
Energy: 1.0562806349857325
Energy: 0.42340738903141306
Energy: 0.7751825972778312
Energy: 0.4234073890331439
Energy: 1.315064491794916
Energy: 0.4200644486313574
Energy: 0.7781252782327284
Energy: 0.4200644486250112
Energy: 1.311187271112351
Energy: 0.4204490768874727
Energy: 0.7749004700789844
Energy: 0.4204490768874727
Energy: 1.2013025861254278
Energy: 0.42005483215418327
Energy: 0.5438104878846732
Energy: 0.42005483215360634
Energy: 1.3166883770196922
Energy: 0.4198140855685106
Energy: 0.5448058503075485
Energy: 0.4198140855685106
Energy: 1.30905491345326
Energy: 0.4227244129775448
Energy: 0.5476686102115413
Energy: 0.4227244129775448
Energy: 1.1996545712337898
Energy: 0.4242923196449635
Energy: 0.42004483950503063
Energy: 0.42429231964554043
Energy: 1.3156419912617123
Energy: 0.4199781069376247
Energy: 0.4204121829202413
Energy: 0.4199781069376247
Energy: 1.3058644715967542
Energy: 0.4201240892817123
Energy: 0.4226919097231983
Energy: 0.4201240892822893

minimum gb energy = 0.4197954375293761 eV
minimum distance =  2.3177721178245 Angstroms
sigma value = 113


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

Energy: 0.015447294104661852
Energy: 0.37801181307777326
Energy: 1.1903010844732334
Energy: 0.01643932915541284
Energy: 0.9020237612178058
Energy: 0.10361522034761939
Energy: 0.9037885951506301
Energy: 0.1036152203484818
Energy: 0.016163892122551555
Energy: 0.10235988108027202
Energy: 0.9026659934909881
Energy: 0.10235988107985314
Energy: 0.01716142047095157
Energy: 0.10436005934577053
Energy: 0.9020158673741516
Energy: 0.10436005934793884
Energy: 0.9046198580869859
Energy: 0.10353234419335043
Energy: 0.9050178292665045
Energy: 0.10353234419248805
Energy: 0.015949654170844253
Energy: 0.10207715521856371
Energy: 0.9023573873582685
Energy: 0.10207715521942613

minimum gb energy = 0.015447294104661852 eV
minimum distance =  2.52279902215822 Angstroms
sigma value = 1