Model name: model_name=SNAP_LiChenZheng_2019_NbTaWMo__MO_560387080449_000
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Mo
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=3.166686400771141
cohesive_energy=6.879122063701007
mass=95.95
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
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: 6.87704751902673 eV

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

Energy: 0.021175308791322837
Energy: 0.3001906327448813
Energy: 0.021175308791322837
Energy: 0.3001906327448813
Energy: 0.021175308791322837
Energy: 0.3001906327448813
Energy: 0.021175308791322837
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.7922361138001643
Energy: 0.61646089034079
Energy: 0.7922361138001643
Energy: 0.61646089034079
Energy: 0.7922361138001643
Energy: 0.61646089034079
Energy: 0.7922361138001643
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.021175308791322837
Energy: 0.3001906327448813
Energy: 0.021175308791322837
Energy: 0.3001906327448813
Energy: 0.021175308791322837
Energy: 0.3001906327448813
Energy: 0.021175308791322837
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225
Energy: 0.61372145749162
Energy: 0.021175757805570225

minimum gb energy = 0.021175308791322837 eV
minimum distance =  2.74234858154078 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 2.1461551220029422
Energy: 2.1663133647680337
Energy: 2.1461551220029422
Energy: 2.1663133647680337
Energy: 2.1461551220029422
Energy: 2.1663133647680337
Energy: 2.1461551220029422
Energy: 2.155423193358215
Energy: 2.1017033315152185
Energy: 2.155423193194856
Energy: 2.1017033315152185
Energy: 2.1554231933741597
Energy: 2.101703331519205
Energy: 2.155423193354229
Energy: 2.0169771337863875
Energy: 2.0207958458598028
Energy: 2.0169771337863875
Energy: 2.0207958618569966
Energy: 2.0169771337863875
Energy: 2.020795887639767
Energy: 2.0169771337863875
Energy: 2.014845012846624
Energy: 2.1511373285199675
Energy: 2.014845012846624
Energy: 2.151137328515982
Energy: 2.014845012846624
Energy: 2.1511373285119957
Energy: 2.014845012846624
Energy: 2.014833697952048
Energy: 2.1532867719433066
Energy: 2.014833697952048
Energy: 2.1532867719433066
Energy: 2.014833697952048
Energy: 2.1532867719433066
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Energy: 2.0181025285713208
Energy: 2.15443141400997
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Energy: 2.1544313158115376
Energy: 2.0181025285713208
Energy: 2.1544314419681507
Energy: 2.0181025285713208
Energy: 2.0975245619868006
Energy: 2.1342332919021683
Energy: 2.0975245619868006
Energy: 2.1342332918941964
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Energy: 2.134233291898182
Energy: 2.0975245619868006
Energy: 2.0637123189401816
Energy: 2.1631728695404093
Energy: 2.0637123189401816
Energy: 2.1631728695404093
Energy: 2.0637123189401816
Energy: 2.1631728695404093
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Energy: 2.0637172283126066
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Energy: 2.1430383898111924
Energy: 2.0637172283126066
Energy: 2.1430383898470677
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Energy: 1.9936924594400376
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Energy: 1.9936924594400376
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Energy: 2.0788917476688846
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Energy: 2.014533302379942
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Energy: 2.0552198847071934
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Energy: 2.0552198847071934
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Energy: 2.067190496497684
Energy: 2.1583646981856566
Energy: 2.067190496497684
Energy: 2.1583646981856566
Energy: 2.067190496497684
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Energy: 2.0737115532352006
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Energy: 2.019910248511344
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Energy: 2.1740353508732673
Energy: 2.0148325265193967
Energy: 2.1740353508732673
Energy: 2.0148325265193967
Energy: 2.1740353508732673
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Energy: 2.0742272851932406
Energy: 2.021713620180395
Energy: 2.0742272851932406
Energy: 2.021713620180395
Energy: 2.0742272851932406
Energy: 2.021713620180395
Energy: 2.1085662200667095
Energy: 2.0782534029863555
Energy: 2.108566207312773
Energy: 2.078253601108417
Energy: 2.1085662066912274
Energy: 2.0782536278673533
Energy: 2.1085662436859556
Energy: 2.018108644008439
Energy: 2.0737036409450793
Energy: 2.018108644008439
Energy: 2.07370351563309
Energy: 2.018108644008439
Energy: 2.073703731820274
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Energy: 2.1241036241966875
Energy: 2.130321232153841
Energy: 2.1241036298027027
Energy: 2.1303212441308452
Energy: 2.1241036262207698
Energy: 2.1303212451906477
Energy: 2.1241036290655595
Energy: 2.124103534576543
Energy: 2.054857576071122
Energy: 2.124103534098425
Energy: 2.054857571174347
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Energy: 2.054857585203264
Energy: 2.124103534405212
Energy: 2.0791966496275216
Energy: 1.9937044452404322
Energy: 2.079196649623536
Energy: 1.9937044452404322
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Energy: 1.9937044452404322
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Energy: 2.0452497300376034
Energy: 2.0028922931229864
Energy: 2.0452497421779663
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Energy: 2.045248272508292
Energy: 2.0028922931229864
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Energy: 2.085942356155561
Energy: 2.16316401610143
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Energy: 2.16316401610143
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Energy: 2.1583591716164765
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Energy: 2.0975218217656098
Energy: 2.134231359684601
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Energy: 2.134231359684601
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Energy: 2.134231359684601
Energy: 2.0975218217656098
Energy: 2.208285900252301
Energy: 2.244894535036799
Energy: 2.208285900252301
Energy: 2.2448945357061056
Energy: 2.208285900252301
Energy: 2.2448945361085597
Energy: 2.208285900252301
Energy: 1.9985666323303368
Energy: 2.1532735548811903
Energy: 2.041230719977681
Energy: 2.1532735548811903
Energy: 2.014827716692136
Energy: 2.1532735548811903
Energy: 2.014827716692136
Energy: 2.2554416050219257
Energy: 2.1597209034888847
Energy: 2.2554416050219257
Energy: 2.1597209034888847
Energy: 2.2554416050219257
Energy: 2.1597209034888847
Energy: 2.2554416050219257
Energy: 2.0169798737604387
Energy: 2.019118188115658
Energy: 2.0169798737604387
Energy: 2.0191181976024204
Energy: 2.0169798737604387
Energy: 2.0191181966980043
Energy: 2.0169798737604387
Energy: 2.1433238527843543
Energy: 2.3465265235957546
Energy: 2.1433238527843543
Energy: 2.3465247308386057
Energy: 2.1433238527843543
Energy: 2.3465247303604877
Energy: 2.1433238527843543
Energy: 2.0536773634956553
Energy: 2.2176664403238937
Energy: 2.0536773634956553
Energy: 2.2176664403238937
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Energy: 2.2176664403238937
Energy: 2.0536773634956553
Energy: 2.1006603478415276
Energy: 2.0219203423518786
Energy: 2.1006603374902104
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Energy: 2.1006603381556035
Energy: 2.021920337028806
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Energy: 2.0169807011718577
Energy: 2.0191180621263167
Energy: 2.0169807011718577
Energy: 2.0191180621263167
Energy: 2.0169807011718577
Energy: 2.0191180621263167
Energy: 2.0169807011718577
Energy: 2.0148372341120915
Energy: 2.1565770297540245
Energy: 2.0148372341120915
Energy: 2.1565770137727753
Energy: 2.0148372341120915
Energy: 2.1565770293754873
Energy: 2.0148372341120915
Energy: 2.014825707843397
Energy: 2.1532932725521037
Energy: 2.0148257078274523
Energy: 2.153293269512066
Energy: 2.0148257078274523
Energy: 2.153293267061686
Energy: 2.0148257078553553
Energy: 2.097525149129471
Energy: 2.134227844215306
Energy: 2.097525149129471
Energy: 2.1342278424223466
Energy: 2.097525149129471
Energy: 2.1342278440957947
Energy: 2.097525149129471
Energy: 2.060704492421985
Energy: 2.154432528043928
Energy: 2.0607042650586456
Energy: 2.1544339086712285
Energy: 2.0607044938842405
Energy: 2.1544339177037903
Energy: 2.060704492712827
Energy: 2.0637079380965457
Energy: 2.163168542856123
Energy: 2.0637079380965457
Energy: 2.163168542856123
Energy: 2.0637079380965457
Energy: 2.163168542856123
Energy: 2.0637079380965457
Energy: 2.0637103550350138
Energy: 2.2674005521231755
Energy: 2.0637103550509583
Energy: 2.2674005521231755
Energy: 2.063710355046972
Energy: 2.2674005521231755
Energy: 2.0637103550350138
Energy: 2.0118563621308
Energy: 1.9936893853258533
Energy: 2.0118563621308
Energy: 1.9936893853258533
Energy: 2.0118563621308
Energy: 1.9936893853258533
Energy: 2.0118563621308
Energy: 2.156511964246831
Energy: 2.094056763131728
Energy: 2.1565119643305395
Energy: 2.094056763131728
Energy: 2.156511964246831
Energy: 2.094056763131728
Energy: 2.156511964246831
Energy: 2.0552187104417112
Energy: 2.055367402499702
Energy: 2.0552187104417112
Energy: 2.0553674025116604
Energy: 2.0552187104417112
Energy: 2.0553674025395634
Energy: 2.0552187104417112
Energy: 2.078886668805873
Energy: 2.105682491338254
Energy: 2.078886668805873
Energy: 2.1056824924419035
Energy: 2.078886668805873
Energy: 2.1056824798951737
Energy: 2.078886668805873
Energy: 2.0199106140840373
Energy: 2.0737041941729197
Energy: 2.0199106140840373
Energy: 2.0737041941729197
Energy: 2.0199106140840373
Energy: 2.0737041941729197
Energy: 2.0199106140840373
Energy: 2.014843061352731
Energy: 2.082093312440903
Energy: 2.014843061352731
Energy: 2.082093312440903
Energy: 2.014843061352731
Energy: 2.082093312440903
Energy: 2.014843061352731
Energy: 2.0217258966316356
Energy: 2.07423972598724
Energy: 2.0217258966316356
Energy: 2.0742410735324484
Energy: 2.0217258966316356
Energy: 2.074241151115797
Energy: 2.0217258966316356
Energy: 2.018112287208215
Energy: 2.0739698123465913
Energy: 2.018112287208215
Energy: 2.0739698123465913
Energy: 2.018112287208215
Energy: 2.0739698123465913
Energy: 2.018112287208215

minimum gb energy = 1.9936893853258533 eV
minimum distance =  2.43488968536952 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 2.42679232141978
Energy: 2.2025874188293955
Energy: 2.42679232141978
Energy: 2.2025874188293955
Energy: 2.42679232141978
Energy: 2.2025874188293955
Energy: 2.42679232141978
Energy: 2.131627638488104
Energy: 2.1045963122596283
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Energy: 2.104597297307584
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Energy: 2.1045963728859074
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Energy: 2.1256336442412125
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Energy: 2.1012100656076553
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Energy: 2.1012100656076553
Energy: 2.225622974368939
Energy: 2.1012100656076553
Energy: 2.225622974368939
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Energy: 2.1940122017280506
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Energy: 2.1708611544032275
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Energy: 2.1708611544032275
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Energy: 2.0935868261435564
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Energy: 2.1012100656076553
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Energy: 2.170859749778245
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Energy: 2.194015089377439
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Energy: 2.194017387891143
Energy: 2.1708604263612914
Energy: 2.194017387891143
Energy: 2.1708604263612914
Energy: 2.101216239454035
Energy: 2.194012723876349
Energy: 2.101216239454446
Energy: 2.194012723876349
Energy: 2.101216239454035
Energy: 2.194012723876349
Energy: 2.101216239454035
Energy: 2.1012081183358164
Energy: 2.2158614924884836
Energy: 2.1012081183358164
Energy: 2.2158614924884836
Energy: 2.1012081183358164
Energy: 2.2158614924884836
Energy: 2.1012081183358164
Energy: 2.1256343935360094
Energy: 2.099961561056006
Energy: 2.1256343935360094
Energy: 2.099961561056006
Energy: 2.1256343935360094
Energy: 2.0999615610555122
Energy: 2.1256343935360094
Energy: 2.134709682153183
Energy: 2.095332193637115
Energy: 2.134709682153183
Energy: 2.0953321227214112
Energy: 2.134709682153183
Energy: 2.0953320882175244
Energy: 2.134709682153183
Energy: 2.42679232141978
Energy: 2.2025874188293955
Energy: 2.42679232141978
Energy: 2.2025874188293955
Energy: 2.42679232141978
Energy: 2.2025874188293955
Energy: 2.42679232141978
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Energy: 2.131627638488104
Energy: 2.1045971045943053
Energy: 2.131627638488104
Energy: 2.1045963158311545
Energy: 2.131627638488104
Energy: 2.1256336442412125
Energy: 2.095328271011947
Energy: 2.1256336442412125
Energy: 2.0953286740125634
Energy: 2.1256336442412125
Energy: 2.0953286518112493
Energy: 2.1256336442412125
Energy: 2.1012100656076553
Energy: 2.225622974368939
Energy: 2.1012100656076553
Energy: 2.225622974368939
Energy: 2.1012100656076553
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Energy: 2.1012100656076553
Energy: 2.101216192545481
Energy: 2.1940122017280506
Energy: 2.101216192545481
Energy: 2.1940122017280506
Energy: 2.101216192545481
Energy: 2.1940122017280506
Energy: 2.101216192545481
Energy: 2.1708611544032275
Energy: 2.1940168400713564
Energy: 2.1708611544032275
Energy: 2.1940168400713564
Energy: 2.1708611544032275
Energy: 2.1940168400713564
Energy: 2.1708611544032275
Energy: 2.170859749778245
Energy: 2.1940154096110933
Energy: 2.170859749778245
Energy: 2.1940154096110933
Energy: 2.170859749778245
Energy: 2.1940154096110933
Energy: 2.170859749778245
Energy: 2.1708613947717126
Energy: 2.1940152246131146
Energy: 2.1708613947717126
Energy: 2.1940152246131146
Energy: 2.1708613947717126
Energy: 2.1940152246131146
Energy: 2.1708613947717126
Energy: 2.170862105912449
Energy: 2.1940177363987092
Energy: 2.170862105912449
Energy: 2.1940177363987092
Energy: 2.170862105912449
Energy: 2.1940177363987092
Energy: 2.170862105912449
Energy: 2.101217017897322
Energy: 2.194012723876349
Energy: 2.101217017897322
Energy: 2.194012723876349
Energy: 2.101217017897322
Energy: 2.194012723876349
Energy: 2.101217017897322
Energy: 2.1012091403121413
Energy: 2.2158614924884836
Energy: 2.1012091403121413
Energy: 2.2158614924884836
Energy: 2.1012091403121413
Energy: 2.2158614924884836
Energy: 2.1012091403121413
Energy: 2.1256343935360094
Energy: 2.0999615610555122
Energy: 2.1256343935360094
Energy: 2.0999615610555122
Energy: 2.1256343935360094
Energy: 2.0999615610555122
Energy: 2.1256343935360094
Energy: 2.0935868261435564
Energy: 2.0953321116358916
Energy: 2.0935868261435564
Energy: 2.0953320385908785
Energy: 2.0935868261435564
Energy: 2.0953320119229764
Energy: 2.0935868261435564
Energy: 2.2257842101250236
Energy: 2.1459286640960507
Energy: 2.2257842101250236
Energy: 2.1459286640960507
Energy: 2.2257842101250236
Energy: 2.1459286640960507
Energy: 2.2257842101250236
Energy: 2.0864530892040594
Energy: 2.1045993582089015
Energy: 2.0864530892040594
Energy: 2.1045969493020094
Energy: 2.0864530892040594
Energy: 2.104597195718248
Energy: 2.0864530892040594

minimum gb energy = 2.0864530892040594 eV
minimum distance =  2.44906869417778 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 2.140050100548733
Energy: 2.214986765206785
Energy: 2.140050100548733
Energy: 2.214986765206785
Energy: 2.140050100548733
Energy: 2.214986765206785
Energy: 2.140050100548733
Energy: 2.1961318552423763
Energy: 2.116413198350614
Energy: 2.1961318552423763
Energy: 2.116413198350614
Energy: 2.1961318552423763
Energy: 2.116413198350614
Energy: 2.196131855241854
Energy: 2.1270523156397076
Energy: 2.253946126035192
Energy: 2.1270523156397076
Energy: 2.253946126035192
Energy: 2.1270523156397076
Energy: 2.253946126035192
Energy: 2.1270523156397076
Energy: 2.253457222071747
Energy: 2.3374274717581396
Energy: 2.253457222071747
Energy: 2.3374274717581396
Energy: 2.253457222071747
Energy: 2.3374274717581396
Energy: 2.253457222071747
Energy: 2.31583713836042
Energy: 2.2449537015731327
Energy: 2.31583713836042
Energy: 2.2449537015731327
Energy: 2.31583713836042
Energy: 2.2449537015731327
Energy: 2.31583713836042
Energy: 2.244554976953511
Energy: 2.420337079136065
Energy: 2.244554976953511
Energy: 2.420337079136065
Energy: 2.244554976953511
Energy: 2.420337079136065
Energy: 2.244554976953511
Energy: 2.259542229824227
Energy: 2.4190081883007184
Energy: 2.259542229824227
Energy: 2.4190081883007184
Energy: 2.259542229824227
Energy: 2.4190081883007184
Energy: 2.259542229824227
Energy: 2.3158315491751686
Energy: 2.214852918205905
Energy: 2.3158315491751686
Energy: 2.214852918205905
Energy: 2.3158315491751686
Energy: 2.214852918205905
Energy: 2.3158315491751686
Energy: 2.3158357217117667
Energy: 2.2148606020757757
Energy: 2.3158357217117667
Energy: 2.2148606020757757
Energy: 2.3158357217117667
Energy: 2.2148606020757757
Energy: 2.3158357217117667
Energy: 2.116409318391221
Energy: 2.2928289561701134
Energy: 2.116409318391221
Energy: 2.2928289561701134
Energy: 2.116409318391221
Energy: 2.2928289561701134
Energy: 2.116409318391221
Energy: 2.1358467288419427
Energy: 2.292812403716941
Energy: 2.1358467288419427
Energy: 2.292812403716941
Energy: 2.1358467288419427
Energy: 2.292812403716941
Energy: 2.1358467288419427
Energy: 2.2794959324655193
Energy: 2.303562700122813
Energy: 2.2794959324655193
Energy: 2.303562700122813
Energy: 2.2794959324655193
Energy: 2.303562700122813
Energy: 2.2794959324655193
Energy: 2.2154417243373627
Energy: 2.279281570499222
Energy: 2.2154417243373627
Energy: 2.279281570499222
Energy: 2.2154417243373627
Energy: 2.279281570499222
Energy: 2.2154417243373627
Energy: 2.227130007478026
Energy: 2.2654712336451275
Energy: 2.227130007478026
Energy: 2.2654712336451275
Energy: 2.227130007478026
Energy: 2.2654712336451275
Energy: 2.227130007478026
Energy: 2.2860351001812065
Energy: 2.462351543762668
Energy: 2.2860351001801615
Energy: 2.462351543762668
Energy: 2.2860351001812065
Energy: 2.462351543762668
Energy: 2.2860351001812065
Energy: 2.140058620565909
Energy: 2.2762927490393263
Energy: 2.140058620565909
Energy: 2.2762927490393263
Energy: 2.140058620565909
Energy: 2.2762927490393263
Energy: 2.140058620565909
Energy: 2.1652911287717953
Energy: 2.1646669932758953
Energy: 2.1652911287717953
Energy: 2.1646669932758953
Energy: 2.1652911287717953
Energy: 2.1646669932758953
Energy: 2.1652911287717953
Energy: 2.133059175522305
Energy: 2.116404226960229
Energy: 2.133059175522305
Energy: 2.116404226960229
Energy: 2.133059175522305
Energy: 2.116404226960229
Energy: 2.133059175522305
Energy: 2.367204650263195
Energy: 2.378030912052785
Energy: 2.367204650263195
Energy: 2.378030912052785
Energy: 2.407176539472622
Energy: 2.378030912052785
Energy: 2.3598899486862286
Energy: 2.3158321624454885
Energy: 2.394877138809106
Energy: 2.3158321624454885
Energy: 2.394877138809106
Energy: 2.3158321624454885
Energy: 2.394877138809106
Energy: 2.3158321624454885
Energy: 2.2614064645599874
Energy: 2.238897601637123
Energy: 2.2614064645599874
Energy: 2.238897601637123
Energy: 2.2614064645599874
Energy: 2.238897601637123
Energy: 2.2614064645599874
Energy: 2.2210398033826064
Energy: 2.321246700636861
Energy: 2.2210398033826064
Energy: 2.321246700636861
Energy: 2.2210398033826064
Energy: 2.321246700636861
Energy: 2.2210398033826064
Energy: 2.2167305103392443
Energy: 2.2149889046633144
Energy: 2.2167305103392443
Energy: 2.2149889046633144
Energy: 2.2167305103392443
Energy: 2.2149889046633144
Energy: 2.2167305103392443
Energy: 2.2997882098206968
Energy: 2.426050482648808
Energy: 2.2997882098206968
Energy: 2.426050482648808
Energy: 2.2997882098206968
Energy: 2.426050482648808
Energy: 2.2997882098206968
Energy: 2.127062821981486
Energy: 2.1652923507423503
Energy: 2.127062821981486
Energy: 2.1652923507423503
Energy: 2.127062821981486
Energy: 2.1652923507423503
Energy: 2.127062821981486
Energy: 2.243808414230971
Energy: 2.311124580940525
Energy: 2.243808414230971
Energy: 2.311124580940525
Energy: 2.243808414230971
Energy: 2.311124580940525
Energy: 2.243808414230971
Energy: 2.324826702897572
Energy: 2.2449532268629424
Energy: 2.324826702897572
Energy: 2.2449532268629424
Energy: 2.324826702897572
Energy: 2.2449532268629424
Energy: 2.324826702897572
Energy: 2.317200473070863
Energy: 2.471215819260137
Energy: 2.317200473070863
Energy: 2.471215819260137
Energy: 2.317200473070863
Energy: 2.471215819260137
Energy: 2.317200473070863
Energy: 2.259550581588236
Energy: 2.2341605358397807
Energy: 2.259550581588236
Energy: 2.2341605358397807
Energy: 2.259550581588236
Energy: 2.234160535839258
Energy: 2.259550581588236
Energy: 2.339499839316514
Energy: 2.399472785730827
Energy: 2.339499839316514
Energy: 2.399472785730827
Energy: 2.339499839316514
Energy: 2.399472785730827
Energy: 2.339499839316514
Energy: 2.3158328943490774
Energy: 2.2148577832766465
Energy: 2.3158328943490774
Energy: 2.2148577832766465
Energy: 2.3158328943490774
Energy: 2.2148577832766465
Energy: 2.3158328943490774
Energy: 2.1164070726391184
Energy: 2.294062742519158
Energy: 2.1164070726391184
Energy: 2.2940627425186357
Energy: 2.1164070726391184
Energy: 2.294062742519158
Energy: 2.1164070726391184
Energy: 2.135857250959844
Energy: 2.1302406135161767
Energy: 2.135857250959844
Energy: 2.1302406135161767
Energy: 2.135857250959844
Energy: 2.1302406135161767
Energy: 2.135857250959844
Energy: 2.301838327584723
Energy: 2.381514513719087
Energy: 2.3018383275842003
Energy: 2.381514513719087
Energy: 2.301838327585245
Energy: 2.381514513719087
Energy: 2.301838327583678
Energy: 2.366504553638188
Energy: 2.43809356282525
Energy: 2.366504553638188
Energy: 2.43809356282525
Energy: 2.366504553638188
Energy: 2.43809356282525
Energy: 2.366504553638188
Energy: 2.209750114596972
Energy: 2.2595506376075067
Energy: 2.209750114596972
Energy: 2.2595506376075067
Energy: 2.209750114596972
Energy: 2.2595506376075067
Energy: 2.209750114596972

minimum gb energy = 2.116404226960229 eV
minimum distance =  2.43213916387046 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 2.220448423391177
Energy: 2.301221062776078
Energy: 2.220448423391177
Energy: 2.301221062776078
Energy: 2.220448423391177
Energy: 2.301221062776078
Energy: 2.220448423391177
Energy: 2.305116896267787
Energy: 2.140480472684836
Energy: 2.305116896267787
Energy: 2.140480472684836
Energy: 2.305116896267787
Energy: 2.140480472684836
Energy: 2.305116896267787
Energy: 2.158408062275657
Energy: 2.1891839124591788
Energy: 2.158408062275657
Energy: 2.1891839124591788
Energy: 2.158408062275657
Energy: 2.1891839124591788
Energy: 2.158408062275657
Energy: 2.373778276174873
Energy: 2.14049104650722
Energy: 2.373778276174873
Energy: 2.14049104650722
Energy: 2.373778276174873
Energy: 2.14049104650722
Energy: 2.373778276174873
Energy: 2.305254431161462
Energy: 2.1365955506990097
Energy: 2.305254431161462
Energy: 2.1365955506990097
Energy: 2.305254431161462
Energy: 2.1365955506990097
Energy: 2.305254431161462
Energy: 2.3229495278477406
Energy: 2.1836218177449753
Energy: 2.3229495278477406
Energy: 2.1836218177449753
Energy: 2.3229495278477406
Energy: 2.1836218177449753
Energy: 2.3229495278477406
Energy: 2.305939448322779
Energy: 2.1836145246020995
Energy: 2.3477390153962077
Energy: 2.1836145246020995
Energy: 2.3607652439201723
Energy: 2.1836145246020995
Energy: 2.2524212585274728
Energy: 2.206069327735689
Energy: 2.2240386793939275
Energy: 2.206069327735689
Energy: 2.2240386793939275
Energy: 2.206069327735689
Energy: 2.2240386793939275
Energy: 2.206069327735689
Energy: 2.265915177794635
Energy: 2.2281605269342597
Energy: 2.265915177794635
Energy: 2.2281605269342597
Energy: 2.265915177794635
Energy: 2.2281605269342597
Energy: 2.265915177794635
Energy: 2.1689187342453327
Energy: 2.3012220399622763
Energy: 2.1689187342453327
Energy: 2.3012220399622763
Energy: 2.1689187342453327
Energy: 2.3012220399622763
Energy: 2.1689187342453327
Energy: 2.347699715500881
Energy: 2.1848995396868633
Energy: 2.360762152407367
Energy: 2.1848995396868633
Energy: 2.360762152407367
Energy: 2.1848995396868633
Energy: 2.360762152407367
Energy: 2.158420318755011
Energy: 2.136600065976232
Energy: 2.158420318755011
Energy: 2.136600065976232
Energy: 2.158420318755011
Energy: 2.136600065976232
Energy: 2.158420318755011
Energy: 2.1401044918439327
Energy: 2.143077990944075
Energy: 2.1401044918439327
Energy: 2.143077990944075
Energy: 2.1401044918439327
Energy: 2.143077990944075
Energy: 2.1401044918439327
Energy: 2.163020890190212
Energy: 2.1365957609221033
Energy: 2.163020890190212
Energy: 2.1365957609221033
Energy: 2.163020890190212
Energy: 2.1365957609221033
Energy: 2.163020890190212
Energy: 2.2748567779221545
Energy: 2.227523460124968
Energy: 2.274856777921538
Energy: 2.227523460124968
Energy: 2.2748567779221545
Energy: 2.227523460124968
Energy: 2.2309918630979415
Energy: 2.168921818592644
Energy: 2.1836641265007914
Energy: 2.168921818592644
Energy: 2.1836641265007914
Energy: 2.168921818592644
Energy: 2.1836641265007914
Energy: 2.168921818592644
Energy: 2.183616615130201
Energy: 2.2203334287754206
Energy: 2.183616615130201
Energy: 2.2203334287754206
Energy: 2.183616615130201
Energy: 2.2203334287754206
Energy: 2.183616615130201
Energy: 2.2060805675094612
Energy: 2.2240503360262354
Energy: 2.2060805675094612
Energy: 2.2240503360262354
Energy: 2.2060805675094612
Energy: 2.2240503360262354
Energy: 2.2060805675094612
Energy: 2.305130593463804
Energy: 2.183649826298395
Energy: 2.3051305934644204
Energy: 2.183649826298395
Energy: 2.305130593463804
Energy: 2.183649826298395
Energy: 2.305130593463804
Energy: 2.168918307346731
Energy: 2.301217013547043
Energy: 2.168918307346731
Energy: 2.301217013547043
Energy: 2.168918307346731
Energy: 2.301217013547043
Energy: 2.168918307346731
Energy: 2.305126693364306
Energy: 2.139313119637226
Energy: 2.305126693364306
Energy: 2.139313119637226
Energy: 2.305126693364306
Energy: 2.139313119637226
Energy: 2.305126693364306
Energy: 2.158422923350574
Energy: 2.1366220704733863
Energy: 2.158422923350574
Energy: 2.1366220704733863
Energy: 2.158422923350574
Energy: 2.1366220704733863
Energy: 2.158422923350574
Energy: 2.4098827191754024
Energy: 2.1366088806816483
Energy: 2.4098827191754024
Energy: 2.1366088806816483
Energy: 2.4098827191754024
Energy: 2.1366088806816483
Energy: 2.4098827191754024
Energy: 2.3051294808479295
Energy: 2.136617754034369
Energy: 2.3051294808479295
Energy: 2.136617754034369
Energy: 2.3051294808479295
Energy: 2.136617754034369
Energy: 2.3051294808479295
Energy: 2.322949632226476
Energy: 2.1836093383743647
Energy: 2.322949632226476
Energy: 2.1836093383743647
Energy: 2.322949632226476
Energy: 2.1836093383743647
Energy: 2.322949632226476
Energy: 2.305135987441864
Energy: 2.218312014595185
Energy: 2.305135987441864
Energy: 2.218312014595185
Energy: 2.305135987441864
Energy: 2.218312014595185
Energy: 2.305135987441864
Energy: 2.206072940438904
Energy: 2.2240695511550745
Energy: 2.206072940438904
Energy: 2.2240695511550745
Energy: 2.206072940438904
Energy: 2.2240695511550745
Energy: 2.206072940438904
Energy: 2.305135961018962
Energy: 2.2281658983803854
Energy: 2.305135961018962
Energy: 2.2281658983803854
Energy: 2.305135961018962
Energy: 2.2281658983803854
Energy: 2.305135961018962
Energy: 2.220448423391177
Energy: 2.301221062776078
Energy: 2.220448423391177
Energy: 2.301221062776078
Energy: 2.220448423391177
Energy: 2.301221062776078
Energy: 2.220448423391177
Energy: 2.305116896267787
Energy: 2.140480472684836
Energy: 2.305116896267787
Energy: 2.140480472684836
Energy: 2.305116896267787
Energy: 2.140480472684836
Energy: 2.305116896267787

minimum gb energy = 2.1365955506990097 eV
minimum distance =  2.50393014371459 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 2.137400453952182
Energy: 2.1835678174516513
Energy: 2.137400453952182
Energy: 2.1835678174516513
Energy: 2.137400453952182
Energy: 2.1835678174516513
Energy: 2.137400453952182
Energy: 2.0159503518827306
Energy: 2.0181163672375706
Energy: 2.0159503518827306
Energy: 2.0181163672375706
Energy: 2.0159503518827306
Energy: 2.0181163672375706
Energy: 2.0159503518827306
Energy: 1.9990416998912544
Energy: 2.13118669500526
Energy: 1.9990416998912544
Energy: 2.13118669500526
Energy: 1.9990416998912544
Energy: 2.13118669500526
Energy: 1.9990416998912544
Energy: 2.0260299305659553
Energy: 2.0181249264788037
Energy: 2.0260299305659553
Energy: 2.0181249264788037
Energy: 2.0260299305659553
Energy: 2.0181249264788037
Energy: 2.0260299305659553
Energy: 2.0018113740928465
Energy: 1.9922289839733132
Energy: 2.0018113740928465
Energy: 1.9922289839733132
Energy: 2.0018113740928465
Energy: 1.9922289839733132
Energy: 2.0018113740928465
Energy: 2.026060991971478
Energy: 2.05000792665441
Energy: 2.026060991971478
Energy: 2.05000792665441
Energy: 2.026060991971478
Energy: 2.05000792665441
Energy: 2.026060991971478
Energy: 1.9717018894241252
Energy: 2.101281311638062
Energy: 1.9717018894241252
Energy: 2.101281311638062
Energy: 1.9717018894241252
Energy: 2.101281311638062
Energy: 1.9717018894241252
Energy: 2.0311159474001794
Energy: 2.0321119667614433
Energy: 2.0311159474001794
Energy: 2.0321119667614433
Energy: 2.0311159474001794
Energy: 2.0321119667614433
Energy: 2.0311159474001794
Energy: 2.035889482187632
Energy: 2.021119056954511
Energy: 2.035889482187632
Energy: 2.021119056954511
Energy: 2.035889482187632
Energy: 2.021119056954511
Energy: 2.035889482187632
Energy: 2.013969235633023
Energy: 2.1230590098417346
Energy: 2.013969235633023
Energy: 2.1230590098417346
Energy: 2.013969235633023
Energy: 2.1230590098417346
Energy: 2.013969235633023
Energy: 1.9715889612122697
Energy: 2.0321217854627913
Energy: 1.9715889612122697
Energy: 2.0321217854627913
Energy: 1.9715889612122697
Energy: 2.0321217854627913
Energy: 1.9715889612122697
Energy: 1.9986907613123848
Energy: 2.026738845374204
Energy: 1.9986907613123848
Energy: 2.026738845374204
Energy: 1.9986907613123848
Energy: 2.026738845374204
Energy: 1.9986907613123848
Energy: 2.01395420238159
Energy: 2.021130249131474
Energy: 2.01395420238159
Energy: 2.021130249131474
Energy: 2.01395420238159
Energy: 2.021130249131474
Energy: 2.01395420238159
Energy: 1.9990398743880022
Energy: 2.356686506520569
Energy: 1.9990398743880022
Energy: 2.356686506520569
Energy: 1.9990398743880022
Energy: 2.35668650651982
Energy: 1.9990398743880022
Energy: 2.031865639281339
Energy: 2.032111288636202
Energy: 2.031865639281339
Energy: 2.032111288636202
Energy: 2.031865639281339
Energy: 2.032111288636202
Energy: 2.031865639281339
Energy: 2.053909037586098
Energy: 2.0680262964809777
Energy: 2.0539090375868465
Energy: 2.0680262964809777
Energy: 2.0539090375868465
Energy: 2.0680262964809777
Energy: 2.053909037586098
Energy: 2.067414662326504
Energy: 2.021145485188237
Energy: 2.067414662326504
Energy: 2.021145485188237
Energy: 2.067414662326504
Energy: 2.021145485188237
Energy: 2.067414662326504
Energy: 2.069601567070994
Energy: 2.3566608179008317
Energy: 2.069601567070994
Energy: 2.3566608179008317
Energy: 2.069601567070994
Energy: 2.3566608179008317
Energy: 2.069601567070994
Energy: 2.031116658607909
Energy: 2.03211629703569
Energy: 2.031116658607909
Energy: 2.03211629703569
Energy: 2.031116658607909
Energy: 2.03211629703569
Energy: 2.031116658607909
Energy: 1.9986903220722625
Energy: 1.9922140668196313
Energy: 1.9986903220722625
Energy: 1.9922140668196313
Energy: 1.9986903220722625
Energy: 1.9922140668196313
Energy: 1.9986903220722625
Energy: 2.0139389250300685
Energy: 2.1215242384620776
Energy: 2.0139389250300685
Energy: 2.1215242384620776
Energy: 2.0139389250300685
Energy: 2.1215242384620776
Energy: 2.0139389250300685
Energy: 1.971715398011523
Energy: 2.1012879891344522
Energy: 1.971715398011523
Energy: 2.1012879891344522
Energy: 1.971715398011523
Energy: 2.1012879891344522
Energy: 1.971715398011523
Energy: 2.0062830607875624
Energy: 2.0321209966493186
Energy: 2.0062830607875624
Energy: 2.0321209966493186
Energy: 2.0062830607875624
Energy: 2.0321209966493186
Energy: 2.0062830607875624
Energy: 2.013927552038179
Energy: 1.9922138436078312
Energy: 2.013927552038179
Energy: 1.9922138436078312
Energy: 2.013927552038179
Energy: 1.9922138436078312
Energy: 2.013927552038179
Energy: 2.014018445156708
Energy: 2.089023883352133
Energy: 2.014018445156708
Energy: 2.089023883352133
Energy: 2.014018445156708
Energy: 2.089023883352133
Energy: 2.014018445156708

minimum gb energy = 1.9715889612122697 eV
minimum distance =  2.50485506517581 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 1.860407192861152
Energy: 1.9026031130564975
Energy: 1.860407192861152
Energy: 1.9026031130564975
Energy: 1.860407192861152
Energy: 1.9026031130564975
Energy: 1.860407192861152
Energy: 1.8363893302859704
Energy: 1.8041460765990878
Energy: 1.8363894779467393
Energy: 1.8041460765990878
Energy: 1.8363879081495875
Energy: 1.8041460765990878
Energy: 1.8363894971913515
Energy: 1.829471577327022
Energy: 1.7976668464239454
Energy: 1.829471577327022
Energy: 1.7976668464239454
Energy: 1.829471577327022
Energy: 1.7976668464239454
Energy: 1.829471577327022
Energy: 1.788830187205615
Energy: 1.790271316158191
Energy: 1.788830187205615
Energy: 1.790271316158191
Energy: 1.788830187205615
Energy: 1.790271316158191
Energy: 1.788830187205615
Energy: 1.7897877577574584
Energy: 1.84399427069688
Energy: 1.7897877577574584
Energy: 1.84399427069688
Energy: 1.7897877577574584
Energy: 1.84399427069688
Energy: 1.7897877577574584
Energy: 1.7888059975877049
Energy: 1.780860610782544
Energy: 1.7888059975877049
Energy: 1.7808606132378908
Energy: 1.7888059975877049
Energy: 1.7808606196601036
Energy: 1.7888059975877049
Energy: 1.7536277109553222
Energy: 1.787365919542199
Energy: 1.7536277109553222
Energy: 1.787365919542199
Energy: 1.7536277109553222
Energy: 1.787365919542199
Energy: 1.7536277109553222
Energy: 1.7778969385183605
Energy: 1.7529927969607595
Energy: 1.7778969385183605
Energy: 1.7529927969607595
Energy: 1.7778969385183605
Energy: 1.7529927969607595
Energy: 1.7778969385183605
Energy: 1.758188347581937
Energy: 1.77782681261934
Energy: 1.758188347581937
Energy: 1.77782681261934
Energy: 1.758188347581937
Energy: 1.77782681261934
Energy: 1.758188347581937
Energy: 1.8118730378132941
Energy: 1.7114500681257234
Energy: 1.8118730378132941
Energy: 1.7114500681257234
Energy: 1.8118730378132941
Energy: 1.7114500681257234
Energy: 1.8118730378132941
Energy: 1.7484543351258914
Energy: 1.7508953010149073
Energy: 1.7484543351258914
Energy: 1.7508953010149073
Energy: 1.7484543351258914
Energy: 1.7508953010149073
Energy: 1.7484543351258914
Energy: 1.7394549250315623
Energy: 1.782814167842846
Energy: 1.7394549250315623
Energy: 1.782814167842846
Energy: 1.7394549250315623
Energy: 1.782814167842846
Energy: 1.7394549250315623
Energy: 1.7454054819024543
Energy: 1.7840529798559719
Energy: 1.7454054819024543
Energy: 1.7840529798559719
Energy: 1.7454054819024543
Energy: 1.7840529798559719
Energy: 1.7454054819024543
Energy: 1.7844082587143741
Energy: 1.7114498672112943
Energy: 1.7844082587143741
Energy: 1.7114498672112943
Energy: 1.7844082587143741
Energy: 1.7114498672112943
Energy: 1.7844082587143741
Energy: 1.7547929108446978
Energy: 1.7353908154181592
Energy: 1.7547929108446978
Energy: 1.7353908154181592
Energy: 1.7547929108446978
Energy: 1.7353908154181592
Energy: 1.7547929108446978
Energy: 1.7326484286774222
Energy: 1.8815512461822725
Energy: 1.7326484286774222
Energy: 1.8815512461822725
Energy: 1.7326484286774222
Energy: 1.8815512461822725
Energy: 1.7326484286774222
Energy: 1.7011494041229025
Energy: 1.7108080164105839
Energy: 1.7011494041229025
Energy: 1.7108080164105839
Energy: 1.7011494041229025
Energy: 1.7108080164105839
Energy: 1.7011494041229025
Energy: 1.727560615552332
Energy: 1.735885987547602
Energy: 1.727560615552332
Energy: 1.735885987547602
Energy: 1.727560615552332
Energy: 1.735885987547602
Energy: 1.727560615552332
Energy: 1.7652918202310535
Energy: 1.7083642283213238
Energy: 1.7652918202310535
Energy: 1.7083642283213238
Energy: 1.7652918202310535
Energy: 1.7083642283213238
Energy: 1.7652918202310535
Energy: 1.7402191925325097
Energy: 1.743916657405242
Energy: 1.7402191925325097
Energy: 1.743916657405242
Energy: 1.7402191925325097
Energy: 1.743916657405242
Energy: 1.7402191925325097
Energy: 1.750074271984524
Energy: 1.710807565329112
Energy: 1.750074271984524
Energy: 1.710807565329112
Energy: 1.750074271984524
Energy: 1.710807565329112
Energy: 1.750074271984524
Energy: 1.7428022806976962
Energy: 1.7275503012891424
Energy: 1.7428022806976962
Energy: 1.7275503012891424
Energy: 1.7428022806976962
Energy: 1.7275503012891424
Energy: 1.7428022806976962
Energy: 1.765288923576448
Energy: 1.7793613505061123
Energy: 1.765288923576448
Energy: 1.7793613503098429
Energy: 1.765288923576448
Energy: 1.7793613502388237
Energy: 1.765288923576448
Energy: 1.727058861234526
Energy: 1.7270476461238708
Energy: 1.727058861234526
Energy: 1.7270476461071607
Energy: 1.727058861234526
Energy: 1.7270476461042743
Energy: 1.727058861234526
Energy: 1.8624566073805773
Energy: 1.7820779598422685
Energy: 1.8624566073805773
Energy: 1.7820779598422685
Energy: 1.8624566073805773
Energy: 1.7820779598422685
Energy: 1.8624566073805773
Energy: 1.7801800034095032
Energy: 1.7346930579930175
Energy: 1.7801800034095032
Energy: 1.7346930579930175
Energy: 1.7801800034095032
Energy: 1.7346930579930175
Energy: 1.7801800034095032
Energy: 1.8550232434379452
Energy: 1.9261183851416903
Energy: 1.8550232828353725
Energy: 1.9261183851416903
Energy: 1.8550232750873512
Energy: 1.9261183851416903
Energy: 1.8550233084705239
Energy: 1.7942247889650318
Energy: 1.9504096950249477
Energy: 1.7942247889650318
Energy: 1.9504096950249477
Energy: 1.7942247889650318
Energy: 1.9504096950249477
Energy: 1.7942247889650318
Energy: 1.9198092084284082
Energy: 1.8041494026026215
Energy: 1.9198092084284082
Energy: 1.8041494026026215
Energy: 1.9198092084284082
Energy: 1.8041494026026215
Energy: 1.9198092084284082
Energy: 1.8104202398913445
Energy: 1.734691758630872
Energy: 1.8104202398913445
Energy: 1.734691758630872
Energy: 1.8104202398913445
Energy: 1.734691758630872
Energy: 1.8104202398909648
Energy: 1.8070559169680602
Energy: 1.9261199912683395
Energy: 1.8070559169680602
Energy: 1.9261199629515695
Energy: 1.8070559169680602
Energy: 1.9261199758398977
Energy: 1.8070559169680602
Energy: 1.7270584505523379
Energy: 1.7830925094416825
Energy: 1.7270584505523379
Energy: 1.7830925094416825
Energy: 1.7270584505523379
Energy: 1.7830925094416825
Energy: 1.7270584505523379
Energy: 1.8624647953919184
Energy: 1.7799775927732064
Energy: 1.8624647953919184
Energy: 1.7799775927732064
Energy: 1.8624647953919184
Energy: 1.7799775927732064
Energy: 1.8624647953919184
Energy: 1.727542015425566
Energy: 1.7395968200674865
Energy: 1.727542015425566
Energy: 1.7395968200674865
Energy: 1.727542015425566
Energy: 1.7395968200674865
Energy: 1.727542015425566
Energy: 1.777892806195012
Energy: 1.8709816039572795
Energy: 1.777892806195012
Energy: 1.8709816030010726
Energy: 1.777892806195012
Energy: 1.870981603168099
Energy: 1.777892806195012
Energy: 1.7196433823097348
Energy: 1.736069316974723
Energy: 1.7196433823097348
Energy: 1.736069316974723
Energy: 1.7196433823097348
Energy: 1.736069316974723
Energy: 1.7196433823097348
Energy: 1.8842589642054883
Energy: 1.711451677654356
Energy: 1.8842589642054883
Energy: 1.711451677654356
Energy: 1.8842589642054883
Energy: 1.711451677654356
Energy: 1.8842589642054883
Energy: 1.7262440100786023
Energy: 1.7053523146778684
Energy: 1.7262440100786023
Energy: 1.7053523146778684
Energy: 1.7262440100786023
Energy: 1.7053523146778684
Energy: 1.7262440100781467
Energy: 1.7394593870148412
Energy: 1.7651049874639348
Energy: 1.7394593870148412
Energy: 1.7651049874639348
Energy: 1.7394593870148412
Energy: 1.7651049874639348
Energy: 1.7394593870148412
Energy: 1.7117165666841372
Energy: 1.758932711768157
Energy: 1.7117165666841372
Energy: 1.758932711768157
Energy: 1.7117165666841372
Energy: 1.758932711768157
Energy: 1.7117165666841372
Energy: 1.727565936002562
Energy: 1.7114513846236443
Energy: 1.727565936002562
Energy: 1.7114513846236443
Energy: 1.727565936002562
Energy: 1.7114513846236443
Energy: 1.727565936002562
Energy: 1.7405382820680875
Energy: 1.7083546129359928
Energy: 1.7405382820680875
Energy: 1.7083546129359928
Energy: 1.7405382820680875
Energy: 1.7083546129359928
Energy: 1.7405382820680875
Energy: 1.7326542904725413
Energy: 1.8815301877103325
Energy: 1.7326542904725413
Energy: 1.8815301877103325
Energy: 1.7326542904725413
Energy: 1.8815301877103325
Energy: 1.7326542904725413
Energy: 1.7117247169996885
Energy: 1.7108068979248978
Energy: 1.7117247169996885
Energy: 1.7108068979248978
Energy: 1.7117247169996885
Energy: 1.7108068979248978
Energy: 1.7117247169996885
Energy: 1.7275633574616969
Energy: 1.7358851804907884
Energy: 1.7275633574616969
Energy: 1.7358851804907884
Energy: 1.7275633574616969
Energy: 1.7358851804907884
Energy: 1.7275633574616969

minimum gb energy = 1.7011494041229025 eV
minimum distance =  2.51245631725776 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 3.8087348719183454
Energy: 1.9899914250413009
Energy: 3.381595979126367
Energy: 1.9899914250413009
Energy: 3.381598760937261
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 4.036625210504636
Energy: 1.9899914250413009
Energy: 3.4332491259455793
Energy: 1.9899914250413009
Energy: 4.036631984692434
Energy: 1.9899914250413009
Energy: 3.381596000391301
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 3.381597952505472
Energy: 1.9899914250413009
Energy: 3.381596038016047
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 3.4332491259455793
Energy: 1.9899914250413009
Energy: 3.3815975594233634
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.3815988339978977
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057516775
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 0.7892708324631735
Energy: 0.8023646057507354
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597
Energy: 1.9899914250413009
Energy: 3.1785627054271597

minimum gb energy = 0.7892708324631735 eV
minimum distance =  2.45476585187814 Angstroms
sigma value = 23