Model name: model_name=EMT_Asap_Standard_JacobsenStoltzeNorskov_1996_Cu__MO_396616545191_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.592786550521851
cohesive_energy=3.511869165642938
mass=63.546
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: -1.33896745442359e-24 eV

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

Energy: 0.016842212457724978
Energy: 0.4467130820864163
Energy: 0.24746832576011724
Energy: 0.4467075926440912
Energy: 0.016842212457955415
Energy: 0.4467130820864163
Energy: 0.24746832576037647
Energy: 0.452469843601757
Energy: 0.017071233810749775
Energy: 0.25165621864348403
Energy: 0.01718480533366926
Energy: 0.452469843601757
Energy: 0.01707123381100901
Energy: 0.25165621864348403
Energy: 0.016842212457724978
Energy: 0.44671308208615707
Energy: 0.24746832576011724
Energy: 0.4467075926440912
Energy: 0.016842212457724978
Energy: 0.44671308208615707
Energy: 0.24746832576011724
Energy: 0.452469843601757
Energy: 0.01707123381100901
Energy: 0.25165621864348403
Energy: 0.0171848053339285
Energy: 0.452469843601757
Energy: 0.01707123381100901
Energy: 0.25165621864348403
Energy: 0.016842212457724978
Energy: 0.44671308208615707
Energy: 0.24746832576011724
Energy: 0.4467075926440912
Energy: 0.016842212457724978
Energy: 0.44671308208615707
Energy: 0.24746832576011724
Energy: 0.452469843601757
Energy: 0.017071233810749775
Energy: 0.25165621864322485
Energy: 0.0171848053339285
Energy: 0.452469843601757
Energy: 0.017071233810749775
Energy: 0.25165621864322485

minimum gb energy = 0.016842212457724978 eV
minimum distance =  2.52079986337542 Angstroms
sigma value = 5


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

Energy: 1.1047358419386863
Energy: 1.0625531547946967
Energy: 1.0692571321986513
Energy: 1.0621371091801592
Energy: 1.1047358419386863
Energy: 1.0625531547946967
Energy: 1.0692571321986513
Energy: 1.01779968836533
Energy: 1.0279174389338754
Energy: 1.0735916997562052
Energy: 1.0410506315481962
Energy: 1.01779968836533
Energy: 1.0279174389338754
Energy: 1.0735916997562052
Energy: 1.0150522306496674
Energy: 1.0184712179210718
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Energy: 1.04072817593728
Energy: 1.0150522306496674
Energy: 1.0184712179210718
Energy: 1.0650806827253156
Energy: 1.0971156554530166
Energy: 1.0291898786678766
Energy: 1.1252527950498545
Energy: 1.0403205617075408
Energy: 1.0971156554530166
Energy: 1.0291898786678766
Energy: 1.1252527950498545
Energy: 1.023303215265421
Energy: 1.0096379992758608
Energy: 1.0872601549955836
Energy: 1.008718804772068
Energy: 1.023303215265421
Energy: 1.0096379992758608
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Energy: 1.057101942806701
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Energy: 1.050778289857929
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Energy: 1.057101942806701
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Energy: 1.0110714640776837
Energy: 1.0298086943638
Energy: 1.0735418106254884
Energy: 1.0305908736903644
Energy: 1.0110714640776837
Energy: 1.0298086943638
Energy: 1.0735418106254884
Energy: 1.0137879894728143
Energy: 1.0170094695567673
Energy: 1.0402900751244855
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Energy: 1.0137879894728143
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Energy: 1.0383600130803934
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Energy: 0.9986712704753787
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Energy: 1.071837470767818
Energy: 1.0146957702618082
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Energy: 1.075137363583413
Energy: 1.045526567207883
Energy: 1.1084957863375993
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Energy: 1.0122317540853332
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Energy: 1.0581658251465946
Energy: 1.1213322296345891
Energy: 1.0682857294099373
Energy: 1.0709588111576538
Energy: 1.0581658251465946
Energy: 1.0173018356628494
Energy: 1.036788726808224
Energy: 1.05294712431403
Energy: 1.0415948141347446
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Energy: 1.036788726808224
Energy: 1.05294712431403
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Energy: 1.0090212909104108
Energy: 1.0325137799948536
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Energy: 1.0217775977290706
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Energy: 1.0384451558355838
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Energy: 1.0647345707976972
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Energy: 1.0287825054812612
Energy: 1.0729558580275094
Energy: 1.0628580847928617
Energy: 1.0252747939097924
Energy: 1.0287825054812612
Energy: 1.0729558580275094
Energy: 1.0775127046661244
Energy: 1.0171969570683825
Energy: 1.0540763158913784
Energy: 1.0206207190714227
Energy: 1.077512704669221
Energy: 1.0171969570683825
Energy: 1.0540763158913784
Energy: 1.0630788457679372
Energy: 1.0815796099366355
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Energy: 1.0805290150873725
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Energy: 1.0615421559036113
Energy: 1.032352633598894
Energy: 1.1038213509758965
Energy: 1.0215416238691324
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Energy: 1.1168116684553704
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Energy: 1.0165940852664839
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Energy: 1.0307566898905896
Energy: 1.0100462915096053
Energy: 1.0160421176950143
Energy: 1.0610503845293637
Energy: 1.021126600202505
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Energy: 1.0839394769483226
Energy: 1.0291513647298154
Energy: 1.0236443888547764
Energy: 1.0305511201233493
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Energy: 0.9986013326248702
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Energy: 1.0900979537177822
Energy: 1.0218998469705083
Energy: 0.9986013326248702
Energy: 1.0390728988718574
Energy: 1.0900979537177822
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Energy: 1.0245929171404267
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Energy: 1.009501964615309
Energy: 1.013211394705047
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Energy: 1.100085198915694
Energy: 1.0557017569855212
Energy: 1.0504069763263053
Energy: 1.055363706273063
Energy: 1.0457668870747678
Energy: 1.0557017569855212
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Energy: 1.055363706273063
Energy: 1.0680240824718363
Energy: 1.035260672717885
Energy: 1.0503359808812776
Energy: 1.0399468191528631
Energy: 1.0680240824718363
Energy: 1.035260672717885
Energy: 1.0503359808812776
Energy: 1.071596902513071
Energy: 1.0263182005831581
Energy: 1.0785985643812546
Energy: 1.0667606201670436
Energy: 1.071596902513071
Energy: 1.0263182005831581
Energy: 1.0785985643812546
Energy: 1.067452561551865
Energy: 1.017730390577286
Energy: 1.0723831095517502
Energy: 1.033247851133555
Energy: 1.067452561551865
Energy: 1.017730390577286
Energy: 1.0723831095517502
Energy: 1.1080062767808008
Energy: 1.046341203990404
Energy: 1.049696567706478
Energy: 1.0823627510412734
Energy: 1.1080062767808008
Energy: 1.046341203990404
Energy: 1.049696567706478
Energy: 1.0648859002108082
Energy: 1.0257316619010772
Energy: 1.072209985796211
Energy: 1.02516522811006
Energy: 1.0648859002108082
Energy: 1.0257316619010772
Energy: 1.072209985796211
Energy: 0.9987479950920207
Energy: 1.0344598930673266
Energy: 1.1543000607094922
Energy: 1.034989007540645
Energy: 0.9987479950920207
Energy: 1.0344598930673266
Energy: 1.1543000607094922
Energy: 1.02388147157174
Energy: 1.0692028354023169
Energy: 1.0599050546360478
Energy: 1.0619170585065394
Energy: 1.02388147157174
Energy: 1.0692028354023169
Energy: 1.0599050546360478
Energy: 0.9985898521878556
Energy: 1.0238589360153603
Energy: 1.0701924402208731
Energy: 1.0223745486963975
Energy: 0.9985898521878556
Energy: 1.0238589360153603
Energy: 1.0701924402208731

minimum gb energy = 0.9985898521878556 eV
minimum distance =  2.27429547363717 Angstroms
sigma value = 401


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

Energy: 1.0651667614542937
Energy: 1.0587333625362643
Energy: 1.071045967611661
Energy: 1.053307691306124
Energy: 1.0651667614542937
Energy: 1.0587333625362643
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Energy: 1.0590870715681209
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Energy: 1.05310964739069
Energy: 1.061478079099253
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Energy: 1.0361813024957305
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Energy: 1.115599833993498
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Energy: 1.0440866062756773
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Energy: 1.0440866062756773
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Energy: 1.0548920438598057
Energy: 1.067169358593611
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Energy: 1.0103358793444348
Energy: 1.025195552424749
Energy: 1.0974153385468377
Energy: 1.0473082812311487
Energy: 1.010335879344115
Energy: 1.025195552424749
Energy: 1.0974153385468377
Energy: 1.01472503827157
Energy: 1.0281730043665447
Energy: 1.0805738788219885
Energy: 1.0361137153228912
Energy: 1.01472503827157
Energy: 1.0281730043661612
Energy: 1.080573878821669
Energy: 1.0363176298083707
Energy: 1.0523352601775386
Energy: 1.0621653395376942
Energy: 1.0295181912464393
Energy: 1.0363176298087542
Energy: 1.0523352601775386
Energy: 1.0621653395380777
Energy: 1.035981599267366
Energy: 1.063735300178401
Energy: 1.0976581904468707
Energy: 1.031225728250305
Energy: 1.035981599267366
Energy: 1.063735300178401
Energy: 1.0976581904468707
Energy: 1.0151825753591952
Energy: 1.0411836354245447
Energy: 1.1221668916630456
Energy: 1.056297688162373
Energy: 1.015182575359515
Energy: 1.0411836354245447
Energy: 1.1221668916630456
Energy: 1.0261526514826034
Energy: 1.0352547039820763
Energy: 1.157885919868537
Energy: 1.0373126509452522
Energy: 1.0261526514826034
Energy: 1.0352547039820763
Energy: 1.157885919868537
Energy: 1.0302087231887287
Energy: 1.0587333625359447
Energy: 1.0590870715678014
Energy: 1.053307691306124
Energy: 1.0302087231887287
Energy: 1.0587333625362643
Energy: 1.0590870715678014
Energy: 1.019872965828497
Energy: 1.0318527233890902
Energy: 1.0607693771378262
Energy: 1.0419576832798803
Energy: 1.0198729658288166
Energy: 1.0318527233887065
Energy: 1.0607693771382096

minimum gb energy = 1.010335879344115 eV
minimum distance =  2.27067630682253 Angstroms
sigma value = 311


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

Energy: 1.1078922823879767
Energy: 1.0513817913662715
Energy: 1.1303137777192203
Energy: 1.0424730406345448
Energy: 1.1078922823879767
Energy: 1.0513817913662715
Energy: 1.1303137777196264
Energy: 1.0965116617314654
Energy: 1.0748142099805598
Energy: 1.0666292087898992
Energy: 1.0797429833756256
Energy: 1.0965116617314654
Energy: 1.0748142099805598
Energy: 1.0666292087898992
Energy: 1.0585221022745435
Energy: 1.083252272977072
Energy: 1.1170668491820879
Energy: 1.059361032065856
Energy: 1.0585221022745435
Energy: 1.083252272977072
Energy: 1.1170668491820879
Energy: 1.0447581787399018
Energy: 1.0583412335745477
Energy: 1.142332396946152
Energy: 1.0540598064090436
Energy: 1.0447581787399018
Energy: 1.0583412335745477
Energy: 1.1423323969457462
Energy: 1.0615831283540154
Energy: 1.0484983608708984
Energy: 1.1146503383516524
Energy: 1.058579198988924
Energy: 1.0615831283536095
Energy: 1.0484983608708984
Energy: 1.1146503383516524
Energy: 1.0490243733226343
Energy: 1.025973498464233
Energy: 1.0681486775252185
Energy: 1.058176287730501
Energy: 1.0490243733226343
Energy: 1.025973498464233
Energy: 1.0681486775252185
Energy: 1.05579788618422
Energy: 1.0433179358434959
Energy: 1.0927227811429816
Energy: 1.0743650636864814
Energy: 1.055797886183814
Energy: 1.0433179358434959
Energy: 1.0927227811429816
Energy: 1.048314505479462
Energy: 1.0419389483972372
Energy: 1.1484877263733253
Energy: 1.0426467702256037
Energy: 1.048314505479462
Energy: 1.0419389483972372
Energy: 1.1484877263733253
Energy: 1.0392197777325007
Energy: 1.0450752458880914
Energy: 1.1398350438895681
Energy: 1.0420072849134947
Energy: 1.0392197777325007
Energy: 1.0450752458880914
Energy: 1.1398350438895681
Energy: 1.045055909299691
Energy: 1.0595526296251914
Energy: 1.1210263312595394
Energy: 1.044124194007636
Energy: 1.0450559093000968
Energy: 1.0595526296251914
Energy: 1.1210263312595394
Energy: 1.0836682543942797
Energy: 1.0373630159574594
Energy: 1.0875440024772647
Energy: 1.0401155540336569
Energy: 1.0836682543942797
Energy: 1.0373630159574594
Energy: 1.0875440024772647
Energy: 1.0772363471598843
Energy: 1.070994712573216
Energy: 1.08411707941414
Energy: 1.0687637991423862
Energy: 1.0772363471598843
Energy: 1.070994712573216
Energy: 1.08411707941414
Energy: 1.0723301018928337
Energy: 1.051224649753061
Energy: 1.1070485902779001
Energy: 1.0759264519451774
Energy: 1.0723301018924278
Energy: 1.051224649753061
Energy: 1.1070485902779001
Energy: 1.045502038577562
Energy: 1.0755046429323645
Energy: 1.0804652518458493
Energy: 1.0589593238849804
Energy: 1.045502038577562
Energy: 1.0755046429327704
Energy: 1.0804652518458493
Energy: 1.075637198002956
Energy: 1.0581441834258911
Energy: 1.097426661727952
Energy: 1.0534027065949634
Energy: 1.075637198002956
Energy: 1.0581441834258911
Energy: 1.097426661727546
Energy: 1.0679796479052395
Energy: 1.068735331839842
Energy: 1.097945321923328
Energy: 1.0638731289761079
Energy: 1.0679796479052395
Energy: 1.068735331839842
Energy: 1.0979453219229218
Energy: 1.0974510168689697
Energy: 1.0266317596458985
Energy: 1.0751405905420124
Energy: 1.0705013609266043
Energy: 1.0974510168689697
Energy: 1.0266317596454928
Energy: 1.075140590542418
Energy: 1.045824764050217
Energy: 1.0440340988562158
Energy: 1.073650104230807
Energy: 1.0746339483955385
Energy: 1.045824764050217
Energy: 1.0440340988562158
Energy: 1.073650104230807
Energy: 1.0582641612663037
Energy: 1.0421400387296993
Energy: 1.1017298403897962
Energy: 1.0429679009635326
Energy: 1.0582641612663037
Energy: 1.0421400387292936
Energy: 1.1017298403897962
Energy: 1.0480972829638946
Energy: 1.047030688388545
Energy: 1.1482328537495559
Energy: 1.0418821199789594
Energy: 1.0480972829638946
Energy: 1.047030688388545
Energy: 1.1482328537491502
Energy: 1.0386875704417657
Energy: 1.0608486776265795
Energy: 1.0917431945348932
Energy: 1.0434229173106349
Energy: 1.0386875704413596
Energy: 1.0608486776265795
Energy: 1.0917431945348932
Energy: 1.0456109248917462
Energy: 1.0322533485443008
Energy: 1.068861301135219
Energy: 1.0397367432551672
Energy: 1.0456109248917462
Energy: 1.0322533485443008
Energy: 1.068861301135219
Energy: 1.1127528442867876
Energy: 1.058484604844186
Energy: 1.0639551566314278
Energy: 1.0480012488310364
Energy: 1.1127528442867876
Energy: 1.058484604844186
Energy: 1.0639551566314278
Energy: 1.0596423775459864
Energy: 1.037895524624472
Energy: 1.1409265862539009
Energy: 1.0582490892549614
Energy: 1.0596423775463923
Energy: 1.037895524624472
Energy: 1.1409265862539009
Energy: 1.0597764299161196
Energy: 1.0594830657763403
Energy: 1.1408942404570839
Energy: 1.0753634192993866
Energy: 1.0597764299161196
Energy: 1.0594830657763403
Energy: 1.1290747392151566
Energy: 1.0719670701684239
Energy: 1.052267561885881
Energy: 1.0536432953717447
Energy: 1.07220133945257
Energy: 1.0719670701684239
Energy: 1.0522675618854749
Energy: 1.0536432953717447
Energy: 1.0845786509294146
Energy: 1.041924031167775
Energy: 1.1670034776714944
Energy: 1.0424064093368954
Energy: 1.0845786509294146
Energy: 1.041924031167775
Energy: 1.1670034776714944
Energy: 1.1063355112414794
Energy: 1.0368471439343947
Energy: 1.0879730207092937
Energy: 1.0718336311895447
Energy: 1.1063355112410735
Energy: 1.0368471439343947
Energy: 1.0879730207092937
Energy: 1.0600075633810393
Energy: 1.0754442103085193
Energy: 1.1173006664415022
Energy: 1.0723025825522348
Energy: 1.0600075633810393
Energy: 1.0754442103085193
Energy: 1.1173006664415022
Energy: 1.0489125681601974
Energy: 1.0361465887624164
Energy: 1.145381040656662
Energy: 1.0394898230928293
Energy: 1.0489125681601974
Energy: 1.0361465887624164
Energy: 1.145381040656662
Energy: 1.0765937994783048
Energy: 1.0484505075582429
Energy: 1.0985688788013679
Energy: 1.0647432530385608
Energy: 1.0765937994783048
Energy: 1.0484505075582429
Energy: 1.0985688788017738
Energy: 1.0451226679524017
Energy: 1.0564660693284114
Energy: 1.057599474533637
Energy: 1.0312242263657376
Energy: 1.0451226679524017
Energy: 1.0564660693284114
Energy: 1.057599474533637
Energy: 1.0386875061935048
Energy: 1.0427792993632925
Energy: 1.0869479827335062
Energy: 1.0590605065037013
Energy: 1.0386875061935048
Energy: 1.0427792993632925
Energy: 1.0869479827335062
Energy: 1.0481757910091265
Energy: 1.041921173310184
Energy: 1.125039517330204
Energy: 1.0559538471256784
Energy: 1.0481757910091265
Energy: 1.041921173310184
Energy: 1.1250395173297978
Energy: 1.057004184643744
Energy: 1.0429700240665987
Energy: 1.1397075713786484
Energy: 1.0493668235619136
Energy: 1.057004184643744
Energy: 1.0429700240665987
Energy: 1.1397075713782425
Energy: 1.0442975715257465
Energy: 1.0595051860371851
Energy: 1.1155595518823382
Energy: 1.043962799218245
Energy: 1.0442975715257465
Energy: 1.0595051860371851
Energy: 1.1155595518823382

minimum gb energy = 1.025973498464233 eV
minimum distance =  2.30401320658539 Angstroms
sigma value = 39


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

Energy: 1.039509743418377
Energy: 1.0626426736541759
Energy: 1.1243284166725847
Energy: 1.0625462000506138
Energy: 1.039509743418377
Energy: 1.0626426736536967
Energy: 1.1243284166725847
Energy: 1.0285314513259467
Energy: 1.0470507574819679
Energy: 0.990258520444952
Energy: 1.0428750540341964
Energy: 1.0285314513259467
Energy: 1.0470507574819679
Energy: 0.990258520444952
Energy: 1.0404267372387217
Energy: 0.9798800247564639
Energy: 1.0621081961151388
Energy: 1.032714614516109
Energy: 1.0404267372387217
Energy: 0.9798800247564639
Energy: 1.062108196115618
Energy: 1.029244775686707
Energy: 1.0673547513111725
Energy: 1.0019186111041132
Energy: 1.0629716386022272
Energy: 1.029244775686707
Energy: 1.0673547513111725
Energy: 1.0019186111041132
Energy: 1.0960867892427735
Energy: 1.032452465399089
Energy: 1.0306984436113351
Energy: 1.0326538060546286
Energy: 1.0960867892432524
Energy: 1.032452465399568
Energy: 1.0306984436108562
Energy: 1.0285055063214088
Energy: 1.0349843681347484
Energy: 1.0973892880054608
Energy: 1.0628636118459094
Energy: 1.0285055063214088
Energy: 1.0349843681347484
Energy: 1.0973892880054608
Energy: 1.087570569852802
Energy: 1.0323898608038429
Energy: 1.055641948225882
Energy: 1.0327658982952947
Energy: 1.087570569852802
Energy: 1.0323898608038429
Energy: 1.055641948225882
Energy: 1.0283074253970803
Energy: 0.9888451762727417
Energy: 1.1328557585150418
Energy: 0.9887754221519416
Energy: 1.0283074253970803
Energy: 0.9888451762727417
Energy: 1.1328557585150418
Energy: 1.0875088470726784
Energy: 1.0327404037371974
Energy: 1.0798375007472496
Energy: 1.0324572488797112
Energy: 1.0875088470721992
Energy: 1.0327404037371974
Energy: 1.0809543507228945
Energy: 1.0287576889158712
Energy: 1.0628936865567176
Energy: 1.0951959356629541
Energy: 1.0347692574899825
Energy: 1.0287576889158712
Energy: 1.0628936865567176
Energy: 1.0951959356629541
Energy: 1.096347053789605
Energy: 1.0327264972701218
Energy: 1.088405321269211
Energy: 1.0324836602320009
Energy: 1.096347053788647
Energy: 1.0327264972701218
Energy: 1.08840532126969
Energy: 1.0292718128838045
Energy: 1.0629743639112412
Energy: 1.0018674018417584
Energy: 1.0670995564578516
Energy: 1.0292718128833256
Energy: 1.0629743639117204
Energy: 1.0018674018417584
Energy: 1.040439164644694
Energy: 1.032692922360769
Energy: 1.1193903971472534
Energy: 0.9798516058649434
Energy: 1.040439164644694
Energy: 1.032692922360769
Energy: 1.1193903971472534
Energy: 1.0285197632956276
Energy: 1.0432209094779417
Energy: 0.9903300428528885
Energy: 1.0425214273244485
Energy: 1.0285197632956276
Energy: 1.0432209094779417
Energy: 0.9903300428524094
Energy: 1.039509743418377
Energy: 1.0626426736541759
Energy: 1.1243284166725847
Energy: 1.0625462000506138
Energy: 1.039509743418377
Energy: 1.0626426736536967
Energy: 1.124406993278423
Energy: 1.0285314513259467
Energy: 1.0470507574814891
Energy: 0.990258520444952
Energy: 1.0428750540341964
Energy: 1.0285314513259467
Energy: 1.0470507574814891
Energy: 0.990258520444952
Energy: 1.0404267372387217
Energy: 0.9798800247564639
Energy: 1.062108196115618
Energy: 1.032714614516109
Energy: 1.0404267372387217
Energy: 0.9798800247564639
Energy: 1.062108196115618
Energy: 1.029244775686707
Energy: 1.0673547513111725
Energy: 1.0019186111041132
Energy: 1.0629716386017483
Energy: 1.029244775686707
Energy: 1.0673547513111725
Energy: 1.0019186111041132
Energy: 1.0960867892432524
Energy: 1.032452465399089
Energy: 1.0306984436113351
Energy: 1.0326538060546286
Energy: 1.0960867892432524
Energy: 1.032452465399089
Energy: 1.0306984436113351
Energy: 1.0285055063214088
Energy: 1.0349843681347484
Energy: 1.0973892880054608
Energy: 1.0628636118459094
Energy: 1.0285055063214088
Energy: 1.0349843681347484
Energy: 1.09738928800594
Energy: 1.0875705698523228
Energy: 1.0323898608038429
Energy: 1.055641948225882
Energy: 1.0327658982952947
Energy: 1.087570569852802
Energy: 1.0323898608038429
Energy: 1.055641948225882
Energy: 1.0283074253970803
Energy: 0.9888451762727417
Energy: 1.1328557585150418
Energy: 0.9887754221519416
Energy: 1.0283074253970803
Energy: 0.9888451762727417
Energy: 1.1328557585150418
Energy: 1.0875088470721992
Energy: 1.0327404037371974
Energy: 1.0798375007472496
Energy: 1.0324572488797112
Energy: 1.0875088470721992
Energy: 1.0327404037371974
Energy: 1.0798375007472496
Energy: 1.0287576889158712
Energy: 1.0628936865567176
Energy: 1.0951959356629541
Energy: 1.0347692574899825
Energy: 1.0287576889158712
Energy: 1.0628936865567176
Energy: 1.0951959356629541
Energy: 1.096347053789126
Energy: 1.0327264972696428
Energy: 1.088405321269211
Energy: 1.0324836602320009
Energy: 1.096347053789126
Energy: 1.0327264972701218
Energy: 1.088405321269211
Energy: 1.0292718128833256
Energy: 1.0629743639117204
Energy: 1.0018674018417584
Energy: 1.0670995564578516
Energy: 1.0292718128838045
Energy: 1.0629743639117204
Energy: 1.0018674018417584
Energy: 1.0404391646442148
Energy: 1.032692922360769
Energy: 1.1193903971472534
Energy: 0.9798516058649434
Energy: 1.040439164644694
Energy: 1.03269292236029
Energy: 1.1193903971472534
Energy: 1.0285197632956276
Energy: 1.0432209094779417
Energy: 0.9903300428528885
Energy: 1.0425214273244485
Energy: 1.0285197632956276
Energy: 1.0432209094774625
Energy: 0.9903300428528885
Energy: 1.039509743418377
Energy: 1.0626426736536967
Energy: 1.1243284166725847
Energy: 1.062546200050135
Energy: 1.0395097434188563
Energy: 1.0626426736536967
Energy: 1.124406993278423
Energy: 1.0285314513259467
Energy: 1.0470507574819679
Energy: 0.990258520444952
Energy: 1.0428750540341964
Energy: 1.0285314513259467
Energy: 1.0470507574814891
Energy: 0.990258520444952

minimum gb energy = 0.9798516058649434 eV
minimum distance =  2.33088040058257 Angstroms
sigma value = 21


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

Energy: 1.0811903989842424
Energy: 1.0992419870759615
Energy: 1.149441976791919
Energy: 1.0992965842694804
Energy: 1.0811903989842424
Energy: 1.0992419870759615
Energy: 1.1494419767925006
Energy: 1.0900366016582015
Energy: 1.0393997659619623
Energy: 0.9836599621618778
Energy: 1.0395345977069068
Energy: 1.0900366016582015
Energy: 1.0393997659619623
Energy: 0.9836599621618778
Energy: 1.0814789088418906
Energy: 1.0242779680335978
Energy: 1.0651194640780777
Energy: 1.0323686743171523
Energy: 1.0814789088418906
Energy: 1.0242779680335978
Energy: 1.0651194640780777
Energy: 1.0963536578876585
Energy: 1.0396380316126737
Energy: 1.0784462828716577
Energy: 1.0403339775407217
Energy: 1.0963536578876585
Energy: 1.0396380316126737
Energy: 1.0784462828716577
Energy: 1.0368639208893882
Energy: 1.0024074591301915
Energy: 1.06255731929255
Energy: 1.0709337585223828
Energy: 1.0368639208893882
Energy: 1.0024074591232133
Energy: 1.06255731929255
Energy: 1.0967582917005227
Energy: 1.0310565991378702
Energy: 1.0701316860897423
Energy: 1.0391659382795126
Energy: 1.0967582916999412
Energy: 1.0310565991378702
Energy: 1.0701316860897423
Energy: 1.081314331858547
Energy: 1.0024789806235184
Energy: 1.0624789102673537
Energy: 1.0531850690950475
Energy: 1.081314331858547
Energy: 1.0024789806229368
Energy: 1.0624789102673537
Energy: 1.0795025272856198
Energy: 1.03284341193892
Energy: 1.0686103215053209
Energy: 1.0390632246075056
Energy: 1.0795025272856198
Energy: 1.03284341193892
Energy: 1.0686103215053209
Energy: 1.0816773147941317
Energy: 1.0414537130520563
Energy: 1.0704942429344486
Energy: 1.0738688184612308
Energy: 1.0816773147941317
Energy: 1.0414537130520563
Energy: 1.0704942429344486
Energy: 1.0891426036374825
Energy: 1.0302060823524457
Energy: 1.0508782133838872
Energy: 1.0390854164990169
Energy: 1.0891426036374825
Energy: 1.0302060823524457
Energy: 1.0508782133838872
Energy: 1.0881543241366134
Energy: 1.0454297564203594
Energy: 1.0569452781906634
Energy: 1.0468955126464714
Energy: 1.0881543241366134
Energy: 1.0454297564203594
Energy: 1.0569452781906634
Energy: 0.9872258422365766
Energy: 1.0641278258957627
Energy: 1.0502877020031043
Energy: 1.001625406642682
Energy: 0.9872258422371579
Energy: 1.0641278258951812
Energy: 1.0502877020031043
Energy: 1.0893031957854833
Energy: 1.0472193790553626
Energy: 1.0567891515982122
Energy: 1.0400865425624735
Energy: 1.0893031957860648
Energy: 1.0472193790553626
Energy: 1.0567891515982122
Energy: 0.9872447763504196
Energy: 1.0648450171319401
Energy: 1.065084286056003
Energy: 1.0022381238961444
Energy: 0.9872447763504196
Energy: 1.0648450171319401
Energy: 1.065084286056003
Energy: 1.0865030848446553
Energy: 1.0004152300246099
Energy: 1.0502808834094928
Energy: 1.0401611487098537
Energy: 1.0865030848446553
Energy: 1.0004152300246099
Energy: 1.0502808834094928
Energy: 0.987719803963124
Energy: 1.1133385141261256
Energy: 1.04646158102098
Energy: 1.0487397655446735
Energy: 0.987719803963124
Energy: 1.1133385141261256
Energy: 1.04646158102098
Energy: 1.0871630883027432
Energy: 1.0002332363855073
Energy: 1.0612543733651965
Energy: 1.0375514706852103
Energy: 1.0871630883027432
Energy: 1.0002332363855073
Energy: 1.0612543733651965
Energy: 0.9876643955329751
Energy: 1.0443935750335283
Energy: 1.0453499430487028
Energy: 1.0803893283940098
Energy: 0.9876643955329751
Energy: 1.0443935750335283
Energy: 1.0453499430487028
Energy: 1.0816972715600917
Energy: 1.0004209126027384
Energy: 1.1206355833719717
Energy: 1.038399912869441
Energy: 1.0816972715600917
Energy: 1.0004209126027384
Energy: 1.1206355833719717
Energy: 0.9868098686630756
Energy: 1.0903106250443075
Energy: 1.0517808127984385
Energy: 1.090498174757369
Energy: 0.9868098686630756
Energy: 1.0903106250443075
Energy: 1.0517808127984385
Energy: 1.0816779032912742
Energy: 1.0384054622339902
Energy: 1.1206536593890468
Energy: 1.0005528080477015
Energy: 1.0816779032912742
Energy: 1.0384054622339902
Energy: 1.1206536593890468
Energy: 0.9876482972563334
Energy: 1.0805275891407804
Energy: 1.0451833714627343
Energy: 1.0444166826612813
Energy: 0.9876482972569149
Energy: 1.0805275891407804
Energy: 1.0451833714627343
Energy: 1.0871788105358609
Energy: 1.0375583246304614
Energy: 1.0691944377514462
Energy: 1.000240071367933
Energy: 1.0871788105358609
Energy: 1.037558324631043
Energy: 1.0691944377514462
Energy: 0.9877274781986232
Energy: 1.0486744406458606
Energy: 1.0461587183097314
Energy: 1.0961767761284447
Energy: 0.9877274781986232
Energy: 1.048674440645279
Energy: 1.0461587183097314
Energy: 1.0864579344379661
Energy: 1.040079991703472
Energy: 1.082933629892411
Energy: 1.0005086710482995
Energy: 1.0864579344379661
Energy: 1.040079991703472
Energy: 1.082933629892411

minimum gb energy = 0.9836599621618778 eV
minimum distance =  2.32617004895627 Angstroms
sigma value = 113


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

Energy: 1.0275821432863803
Energy: 1.123712556641224
Energy: 1.0823351841044475
Energy: 1.114903861182186
Energy: 1.0275821432863803
Energy: 1.123712556641224
Energy: 1.0823351841044475
Energy: 1.0937878103938312
Energy: 1.074859465978429
Energy: 0.997409257461985
Energy: 1.104701891160292
Energy: 1.0937878103938312
Energy: 1.074859465978429
Energy: 0.997409257461985
Energy: 1.059345516291017
Energy: 1.0938022714793874
Energy: 1.0819060592529093
Energy: 1.0563622513891358
Energy: 1.059345516291017
Energy: 1.0938022714793874
Energy: 1.0819060592529093
Energy: 1.02684423953315
Energy: 1.0722733002648464
Energy: 1.0172854204345156
Energy: 1.0734957489799195
Energy: 1.02684423953315
Energy: 1.0722733002648464
Energy: 1.0172854204345156
Energy: 1.0616884688330086
Energy: 1.0202128038230815
Energy: 1.059742282982702
Energy: 1.0371860442326364
Energy: 1.0616884688330086
Energy: 1.0202128038230815
Energy: 1.059742282982702
Energy: 1.0053359069216663
Energy: 1.0633396390601086
Energy: 1.065294518047888
Energy: 1.0322431262381222
Energy: 1.0053359069216663
Energy: 1.0633396390601086
Energy: 1.065294518047888
Energy: 1.0333893630078403
Energy: 1.0195309663350836
Energy: 1.1054628675694904
Energy: 1.0110201013720064
Energy: 1.0333893630045947
Energy: 1.0195309663350836
Energy: 1.1054628675662448
Energy: 0.9983897205991847
Energy: 1.00764427626456
Energy: 1.1360868663963752
Energy: 1.0245211995144696
Energy: 0.9983897205991847
Energy: 1.00764427626456
Energy: 1.1360868663963752
Energy: 1.0268761145317002
Energy: 1.0053036024101256
Energy: 1.1353196774921417
Energy: 0.9949801791758406
Energy: 1.0268761145317002
Energy: 1.0053036024101256
Energy: 1.1353196774921417
Energy: 0.9878548829036791
Energy: 1.0071447769522186
Energy: 1.0254690548643246
Energy: 1.0235995519276366
Energy: 0.9878548829036791
Energy: 1.0071447769489732
Energy: 1.0254690548643246
Energy: 1.0272754591683861
Energy: 1.0244832109756612
Energy: 1.1269107669648295
Energy: 1.0071580336297448
Energy: 1.0272754591683861
Energy: 1.0244832109756612
Energy: 1.1269107669648295
Energy: 0.9986965270499489
Energy: 1.0296802596458559
Energy: 1.0885524911348323
Energy: 1.0235344399132693
Energy: 0.9986965270499489
Energy: 1.0296802596458559
Energy: 1.0885524911348323
Energy: 1.001285178446105
Energy: 1.0455442165932671
Energy: 1.1542567141065594
Energy: 1.0322137750908118
Energy: 1.0012851784525367
Energy: 1.0455442165932671
Energy: 1.1542567141065594
Energy: 1.0444000988392574
Energy: 1.0703672911204414
Energy: 1.0897599597987564
Energy: 1.0893835766412492
Energy: 1.0444000988392574
Energy: 1.0703672911204414
Energy: 1.0897599597987564
Energy: 1.0011776752091843
Energy: 1.052536198466917
Energy: 1.0948896409883544
Energy: 1.0625108607743248
Energy: 1.00117767521243
Energy: 1.052536198466917
Energy: 1.0948896409883544
Energy: 1.0441468888509287
Energy: 1.029432966051023
Energy: 1.1059082522906492
Energy: 1.0379028669751196
Energy: 1.0441468888509287
Energy: 1.029432966051023
Energy: 1.1059082522906492
Energy: 1.0256584740268233
Energy: 1.0455195113631273
Energy: 1.1025915026911117
Energy: 0.9965422822882104
Energy: 1.0256584740235777
Energy: 1.0455195113631273
Energy: 1.1025915026943571
Energy: 0.9986992763961564
Energy: 0.994070665604416
Energy: 1.0800944158280068
Energy: 1.012934212253368
Energy: 0.9986992763929112
Energy: 0.994070665604416
Energy: 1.0800944158280068
Energy: 1.0349290194686558
Energy: 1.03706473721021
Energy: 1.1072259397266886
Energy: 1.033184381629903
Energy: 1.0349290194686558
Energy: 1.03706473721021
Energy: 1.1072259397266886
Energy: 0.9881680544921034
Energy: 1.00572833835195
Energy: 1.0498852682111843
Energy: 1.0154352007963834
Energy: 0.9881680544921034
Energy: 1.00572833835195
Energy: 1.0498852682111843
Energy: 1.0440899726781634
Energy: 1.0151360612750675
Energy: 1.0842742470150282
Energy: 1.0404130867282229
Energy: 1.0440899726781634
Energy: 1.0151360612750675
Energy: 1.0842742470150282
Energy: 0.9904107346136297
Energy: 1.0181251127876672
Energy: 1.069852771719336
Energy: 1.0065736916431594
Energy: 0.9904107346136297
Energy: 1.0181251127876672
Energy: 1.069852771719336
Energy: 1.045578642827314
Energy: 1.0349424869621777
Energy: 1.0943378478372552
Energy: 1.0927905260132897
Energy: 1.045578642827314
Energy: 1.0349424869621777
Energy: 1.0943378478372552
Energy: 1.02578703543506
Energy: 1.0235804646009425
Energy: 1.1181376310732483
Energy: 1.0105249015672866
Energy: 1.02578703543506
Energy: 1.0235804646009425
Energy: 1.1181376310732483
Energy: 1.0687116167194393
Energy: 1.064031359354332
Energy: 1.0456756734870474
Energy: 1.1207760278375265
Energy: 1.0687116167194393
Energy: 1.064031359354332
Energy: 1.0456756734870474
Energy: 1.029190802142383
Energy: 1.0926596089142617
Energy: 1.1502335402140516
Energy: 1.0183037547814227
Energy: 1.029190802142383
Energy: 1.0926596089142617
Energy: 1.1502335402140516
Energy: 1.1299976031706482
Energy: 1.0614800248405574
Energy: 1.028172793751331
Energy: 1.152674213447472
Energy: 1.1299976031706482
Energy: 1.0614800248405574
Energy: 1.028172793751331
Energy: 1.056933132648721
Energy: 1.1081226831455606
Energy: 1.149904300545998
Energy: 1.066912695719011
Energy: 1.056933132648721
Energy: 1.1081226831455606
Energy: 1.149904300545998
Energy: 1.135130364060678
Energy: 1.0616789736122627
Energy: 1.0863128951663346
Energy: 1.1521611476623437
Energy: 1.135130364060678
Energy: 1.0616789736122627
Energy: 1.0863128951663346
Energy: 1.0295601266928092
Energy: 1.08972273213873
Energy: 1.1441465478945463
Energy: 1.0184381403860492
Energy: 1.0295601266928092
Energy: 1.08972273213873
Energy: 1.1441465478945463
Energy: 1.0622937697595052
Energy: 1.0606051840937254
Energy: 1.0807322948691578
Energy: 1.116125051519266
Energy: 1.0622937697595052
Energy: 1.0606051840937254
Energy: 1.0807322948724034
Energy: 1.035147642626971
Energy: 1.0210385443683991
Energy: 1.0791484682506491
Energy: 1.049466105079713
Energy: 1.035147642626971
Energy: 1.0210385443683991
Energy: 1.0791484682506491
Energy: 1.0466607421317005
Energy: 1.0378703375206866
Energy: 1.0261862961254395
Energy: 1.0564285756443228
Energy: 1.0466607421317005
Energy: 1.0378703375206866
Energy: 1.0261862961254395
Energy: 1.028736876654764
Energy: 1.0183264245199617
Energy: 1.0974818752496518
Energy: 1.023450337787322
Energy: 1.028736876654764
Energy: 1.0183264245199617
Energy: 1.0974818752496518
Energy: 1.0403801808151414
Energy: 1.0061020203853983
Energy: 1.1027201333801373
Energy: 1.061705400875786
Energy: 1.0403801808151414
Energy: 1.0061020203853983
Energy: 1.1027201333801373
Energy: 1.026617547092424
Energy: 1.0290959084009161
Energy: 1.09993218230971
Energy: 1.0171146107983093
Energy: 1.026617547092424
Energy: 1.0290959084009161
Energy: 1.09993218230971
Energy: 1.040260795213498
Energy: 1.0269527145621524
Energy: 1.0234808372622324
Energy: 1.0621938261495658
Energy: 1.0402607952167433
Energy: 1.0269527145621524
Energy: 1.0234808372654778
Energy: 1.0392019530931218
Energy: 1.0151561633542234
Energy: 1.0762659161615178
Energy: 1.0369937370277569
Energy: 1.0392019530931218
Energy: 1.0151561633542234
Energy: 1.0762659161615178
Energy: 1.0611831647033831
Energy: 1.0768877580363065
Energy: 1.0877828745470877
Energy: 1.0555045517604116
Energy: 1.0611831647033831
Energy: 1.0768877580363065
Energy: 1.0877828745470877
Energy: 1.039180946192878
Energy: 1.0758350928060032
Energy: 1.098916693667216
Energy: 1.0494613688580472
Energy: 1.039180946192878
Energy: 1.0758350928060032
Energy: 1.098916693667216
Energy: 1.0648299549142197
Energy: 1.05185877184112
Energy: 1.0876342469468903
Energy: 1.069500200477722
Energy: 1.0648299549142197
Energy: 1.05185877184112
Energy: 1.0876342469468903
Energy: 1.0397132567103615
Energy: 1.0361237382539839
Energy: 1.1350997642102052
Energy: 1.0351645482132688
Energy: 1.0397132567103615
Energy: 1.0361237382539839
Energy: 1.1350997642102052
Energy: 1.0431887442753753
Energy: 1.051794215379372
Energy: 1.0892748736482234
Energy: 1.0777849363522014
Energy: 1.0431887442753753
Energy: 1.051794215379372
Energy: 1.0892748736482234
Energy: 1.0558536235071585
Energy: 1.0430235427249273
Energy: 1.0955206269570938
Energy: 1.0015127938991422
Energy: 1.0558536235071585
Energy: 1.0430235427249273
Energy: 1.0955206269570938
Energy: 0.9973208980140857
Energy: 1.0613453117526042
Energy: 1.0818352509341485
Energy: 1.062613103939453
Energy: 0.9973208980108403
Energy: 1.0613453117526042
Energy: 1.0818352509341485

minimum gb energy = 0.9878548829036791 eV
minimum distance =  2.30820365021659 Angstroms
sigma value = 365


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

Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.988850465583476
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9888504659316085
Energy: 1.000706306448475
Energy: 0.9036773717350551
Energy: 1.1971088255085856
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.1971088255085856
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 0.9888504667888188
Energy: 0.9036773717350551
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9888504669343647
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0665725204776937
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.066572520476962
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 0.9888504675231334
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717335917
Energy: 0.988850467752794
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0665725204703767
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0665725204696448
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0054350751168875
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0054350751168875
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 1.0665725204652545
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0665725204652545
Energy: 1.000706306448475
Energy: 0.9036773717343235
Energy: 1.0054350751168875
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 1.0054350751168875
Energy: 1.000706306448475
Energy: 0.9036773717343235
Energy: 0.9401203346513697
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346513697
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 1.0054350751168875
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 1.0054350751168875
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346513697
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717350551
Energy: 0.9401203346521014
Energy: 0.9036773717343235
Energy: 1.000706306448475
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014
Energy: 0.9036773717350551
Energy: 1.0007063064492066
Energy: 0.9036773717343235
Energy: 0.9401203346521014

minimum gb energy = 0.9036773717335917 eV
minimum distance =  2.40868245587937 Angstroms
sigma value = 23