Model name: model_name=EAM_Dynamo_MendelevHanSon_2007_VFe__MO_249706810527_005
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855312779545784
cohesive_energy=4.013297914062382
mass=55.845
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: 0.0 eV

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

Energy: 0.01522893625222937
Energy: 0.4985058662832398
Energy: 0.015228936252617009
Energy: 0.4985058662820313
Energy: 0.015228936252617009
Energy: 0.49850586628282934
Energy: 0.015228936252617009
Energy: 0.01615843831560076
Energy: 0.5890520062612807
Energy: 0.01615843831480268
Energy: 0.5890520062608702
Energy: 0.01615843831560076
Energy: 0.5890520062612807
Energy: 0.01615843831441504
Energy: 0.417868757267155
Energy: 0.5311564812735404
Energy: 0.4178687572615228
Energy: 0.5311564145716381
Energy: 0.41786875726795314
Energy: 0.5311564029381141
Energy: 0.4178687572659465
Energy: 0.016158438316809284
Energy: 0.5890520062596846
Energy: 0.0161584383160112
Energy: 0.5890520062604826
Energy: 0.016158438317219723
Energy: 0.589052006260072
Energy: 0.01615843831560076
Energy: 0.015228936252617009
Energy: 0.49850586628162086
Energy: 0.01522893625302745
Energy: 0.4985058662824417
Energy: 0.015228936252617009
Energy: 0.4985058662824417
Energy: 0.01522893625302745
Energy: 0.0161584383160112
Energy: 0.5890520062608702
Energy: 0.01615843831521312
Energy: 0.589052006260072
Energy: 0.016158438316421643
Energy: 0.5890520062612807
Energy: 0.01615843831560076

minimum gb energy = 0.01522893625222937 eV
minimum distance =  2.46832457533479 Angstroms
sigma value = 5


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

Energy: 1.2780334187230324
Energy: 1.680665019325155
Energy: 1.2780334187283813
Energy: 1.680665019326136
Energy: 1.2780334187225424
Energy: 1.6806650193246648
Energy: 1.278033418727891
Energy: 1.2528818301433235
Energy: 1.2160262341641856
Energy: 1.252881830142343
Energy: 1.2160262341695791
Energy: 1.252881830144304
Energy: 1.2160262341646761
Energy: 1.2528818301418527
Energy: 1.1776042723262483
Energy: 1.2065467518981479
Energy: 1.177604272330661
Energy: 1.2065467519010897
Energy: 1.177604272325758
Energy: 1.2065467518976576
Energy: 1.1776042723311513
Energy: 1.1736575112581755
Energy: 1.249659945862296
Energy: 1.1736575112532723
Energy: 1.2496599458573927
Energy: 1.173657511257685
Energy: 1.2496599458559219
Energy: 1.173657511250821
Energy: 1.1607504539517086
Energy: 1.2535433916891
Energy: 1.1607504539477862
Energy: 1.253543391697925
Energy: 1.1607504539517086
Energy: 1.2535433916964542
Energy: 1.1607504539477862
Energy: 1.2783061489526464
Energy: 1.3329313515051675
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Energy: 1.3329313515090897
Energy: 1.2783061489497491
Energy: 1.3329313515051675
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Energy: 1.2549112964112732
Energy: 1.286505450191533
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Energy: 1.2865054501861843
Energy: 1.2549112964098024
Energy: 1.2865054501925135
Energy: 1.2549112964122537
Energy: 1.204516596243326
Energy: 1.2929764531694774
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Energy: 1.2929764531734
Energy: 1.2045165962457776
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Energy: 1.1528228830932965
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Energy: 1.2434693735182218
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Energy: 1.1832923821242562
Energy: 1.23486674979822
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Energy: 1.2870370760696828
Energy: 1.27943508294135
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Energy: 1.2794350829462529
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Energy: 1.1611813150537988
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Energy: 1.313925983845931
Energy: 1.3068251302764575
Energy: 1.3139259838449504
Energy: 1.3068251302764575
Energy: 1.313925983845931
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Energy: 1.3139259838444601
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Energy: 1.1801650157241175
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Energy: 1.3031368314015017
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Energy: 1.1853717956812055
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Energy: 1.1936431951395665
Energy: 1.2686588183002998
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Energy: 1.2763640416123947
Energy: 1.2388907191990095
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Energy: 1.2388907191994998
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Energy: 1.3627730154120108
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Energy: 1.3627730154120108
Energy: 1.2878924066988184
Energy: 1.1586193294577751
Energy: 1.262462608729047
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Energy: 1.26246260873444
Energy: 1.1586193294582654
Energy: 1.2624626087275759
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Energy: 1.3074005566445175
Energy: 1.2600017074167698
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Energy: 1.2600017074148087
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Energy: 1.26000170741726
Energy: 1.3074005566440272
Energy: 1.1773814229744055
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Energy: 1.1773814229748958
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Energy: 1.1984013513277698
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Energy: 1.3254358033623992
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Energy: 1.177693238407117
Energy: 1.186148268894693
Energy: 1.1776932384056462
Energy: 1.186148268900086
Energy: 1.1776932384080978
Energy: 1.186148268894693
Energy: 1.177693238405156
Energy: 1.157280078899864
Energy: 1.253287340215844
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Energy: 1.2532873402192761
Energy: 1.1572800789003543
Energy: 1.253287340214373
Energy: 1.157280078899864
Energy: 1.1602067952119492
Energy: 1.2893947619210966
Energy: 1.1602067952129298
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Energy: 1.1602067952119492
Energy: 1.2893947619215869
Energy: 1.1602067952090074
Energy: 1.261268582933576
Energy: 1.2791804943531457
Energy: 1.261268582935537
Energy: 1.2791804943565779
Energy: 1.2612685829330856
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Energy: 1.261268582935537
Energy: 1.2137732276236242
Energy: 1.3039762823520897
Energy: 1.2137732276211726
Energy: 1.3039762823491925
Energy: 1.2137732276221531
Energy: 1.303976282349683
Energy: 1.2137732276197017
Energy: 1.192871120328171
Energy: 1.2784044315925487
Energy: 1.1928711203242486
Energy: 1.2784044315837237
Energy: 1.192871120328171
Energy: 1.2784044315940197
Energy: 1.1928711203242486
Energy: 1.269439105936854
Energy: 1.2607166571616144
Energy: 1.2694391059324412
Energy: 1.2607166571552406
Energy: 1.2694391059358732
Energy: 1.2607166571616144
Energy: 1.2694391059324412
Energy: 1.1685140545721162
Energy: 1.174737802463395
Energy: 1.1685140545691746
Energy: 1.1747378024629047
Energy: 1.168514054571626
Energy: 1.1747378024629047
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Energy: 1.3089271543769845
Energy: 1.2031066208377055
Energy: 1.3089271543696301
Energy: 1.2031066208377055
Energy: 1.3089271543750234
Energy: 1.2199105127983132
Energy: 1.2230066498390064
Energy: 1.2199105127968424
Energy: 1.223006649839987
Energy: 1.2199105127973324
Energy: 1.2230066498375354
Energy: 1.2199105127963519
Energy: 1.2564397937293568
Energy: 1.3053650965825796
Energy: 1.256439793728376
Energy: 1.3053650965855212
Energy: 1.2564397937313179
Energy: 1.3053650965830699
Energy: 1.256439793729847
Energy: 1.1833046132948644
Energy: 1.2666996138267197
Energy: 1.183304613297806
Energy: 1.266699613834074
Energy: 1.183304613294374
Energy: 1.2666996138267197
Energy: 1.183304613297806
Energy: 1.182892384479665
Energy: 1.2700640773331144
Energy: 1.1828923844870196
Energy: 1.2700640773350755
Energy: 1.1828923844811359
Energy: 1.2700640773336047
Energy: 1.1828923844865291
Energy: 1.1737277882373864
Energy: 1.2374547976703465
Energy: 1.1737277882373864
Energy: 1.2374547976659338
Energy: 1.1737277882378767
Energy: 1.237454797669366
Energy: 1.173727788238367
Energy: 1.2002687999217958
Energy: 1.2400235645256752
Energy: 1.2002687999149317
Energy: 1.2400235645261657
Energy: 1.2002687999208153
Energy: 1.2400235645256752
Energy: 1.200268799915422

minimum gb energy = 1.1528228830932965 eV
minimum distance =  2.25874861412332 Angstroms
sigma value = 401


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

Energy: 1.3597520149765743
Energy: 1.382725060092981
Energy: 1.3597520149788
Energy: 1.3827250600902488
Energy: 1.3597520149765743
Energy: 1.3827250600979897
Energy: 1.3597520149749045
Energy: 1.2647210326972664
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Energy: 1.3429878977964402
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Energy: 1.2066745481932402
Energy: 1.196623522279622
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Energy: 1.1870833060880188
Energy: 1.3208622429259236
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Energy: 1.2629760800581626
Energy: 1.2803419718850753
Energy: 1.3497615467031177
Energy: 1.280341971882849
Energy: 1.3497615467014479
Energy: 1.280341971882849
Energy: 1.349761546707013
Energy: 1.2803419718778402
Energy: 1.2708045835469433
Energy: 1.352084103845915
Energy: 1.2708045835502824
Energy: 1.352084103842576
Energy: 1.2708045835525086
Energy: 1.3520841038453586
Energy: 1.2708045835536217
Energy: 1.2181065003171034
Energy: 1.2781399202376709
Energy: 1.2181065003176599
Energy: 1.2781399202382273
Energy: 1.218106500318773
Energy: 1.2781399202371142
Energy: 1.2181065003159903
Energy: 1.2403911518469704
Energy: 1.2806542323635368
Energy: 1.240391151844188
Energy: 1.2806542323640933
Energy: 1.24039115184864
Energy: 1.2806542323635368
Energy: 1.2403911518530926
Energy: 1.2020164545894219
Energy: 1.2225024131616937
Energy: 1.202016454585526
Energy: 1.2225024131594675
Energy: 1.2020164545888654
Energy: 1.2225024131616937
Energy: 1.2020164545860827
Energy: 1.1979488251500303
Energy: 1.2249829546825663
Energy: 1.1979488251461343
Energy: 1.2249829546731557
Energy: 1.1979488251500303
Energy: 1.2249829546820095
Energy: 1.1979488251466912
Energy: 1.273154311371898
Energy: 1.3470799528432678
Energy: 1.2731543113724546
Energy: 1.347079952841598
Energy: 1.2731543113757937
Energy: 1.3470799528443806
Energy: 1.2731543113741242
Energy: 1.2012627602023174
Energy: 1.2286878312315073
Energy: 1.2012627602084391
Energy: 1.228687831235403
Energy: 1.2012627602028738
Energy: 1.2286878312303942
Energy: 1.2012627602089958

minimum gb energy = 1.1870833060863493 eV
minimum distance =  2.27345913754166 Angstroms
sigma value = 311


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

Energy: 1.2219688689475798
Energy: 1.265765643519029
Energy: 1.2219688689462944
Energy: 1.265765643520957
Energy: 1.2219688689462944
Energy: 1.265765643522242
Energy: 1.2219688689462944
Energy: 1.2162728983629865
Energy: 1.2064274592634723
Energy: 1.2162728983661995
Energy: 1.2064274592621869
Energy: 1.2162728983655569
Energy: 1.2064274592653998
Energy: 1.216272898364914
Energy: 1.1510600315339394
Energy: 1.2751784152282537
Energy: 1.151060031534582
Energy: 1.2751784152269685
Energy: 1.1510600315332968
Energy: 1.2751784152269685
Energy: 1.1510600315352246
Energy: 1.3241776407791495
Energy: 1.3138782912451143
Energy: 1.3241776407797923
Energy: 1.3138782912419011
Energy: 1.3241776407804349
Energy: 1.3138782912419011
Energy: 1.3241776407804349
Energy: 1.2744493279494253
Energy: 1.3673785714494238
Energy: 1.274449327950068
Energy: 1.3673785714500666
Energy: 1.2744493279513531
Energy: 1.3673785714481386
Energy: 1.2744493279519957
Energy: 1.2380506010841825
Energy: 1.3754617859503044
Energy: 1.2380506010848251
Energy: 1.3754617859541602
Energy: 1.2380506010867531
Energy: 1.375461785950947
Energy: 1.2380506010841825
Energy: 1.2534902103808936
Energy: 1.3698670467766176
Energy: 1.2534902103808936
Energy: 1.3698670467766176
Energy: 1.2534902103834642
Energy: 1.369867046775975
Energy: 1.253490210382179
Energy: 1.3255358996104198
Energy: 1.328920819198993
Energy: 1.3255358996097772
Energy: 1.328920819202206
Energy: 1.3255358996091344
Energy: 1.3289208192015636
Energy: 1.3255358996104198
Energy: 1.273707190067213
Energy: 1.3243177527451975
Energy: 1.273707190067213
Energy: 1.3243177527451975
Energy: 1.273707190065928
Energy: 1.3243177527445547
Energy: 1.273707190065928
Energy: 1.136786286897796
Energy: 1.2756674053657897
Energy: 1.136786286899724
Energy: 1.2756674053638617
Energy: 1.136786286897796
Energy: 1.2756674053638617
Energy: 1.1367862868984386
Energy: 1.148496973308756
Energy: 1.2797806362919497
Energy: 1.1484969733113266
Energy: 1.2797806362893789
Energy: 1.148496973308756
Energy: 1.2797806362938775
Energy: 1.1484969733100414
Energy: 1.3526461927205042
Energy: 1.361144116428568
Energy: 1.352646192722432
Energy: 1.3611441164292106
Energy: 1.3526461927217897
Energy: 1.3611441164304958
Energy: 1.3526461927237174
Energy: 1.3001569630575427
Energy: 1.2999566089978374
Energy: 1.3001569630556147
Energy: 1.29995660899848
Energy: 1.3001569630588279
Energy: 1.2999566089952668
Energy: 1.3001569630569
Energy: 1.2283649501962777
Energy: 1.2761950227829582
Energy: 1.2283649501975336
Energy: 1.2761950227803875
Energy: 1.228364950195635
Energy: 1.2761950227803875
Energy: 1.2283649501975336
Energy: 1.2876271425826915
Energy: 1.3102875843700885
Energy: 1.2876271425826915
Energy: 1.3102875843733017
Energy: 1.287627142582049
Energy: 1.310287584372659
Energy: 1.287627142582049
Energy: 1.2166739002800562
Energy: 1.3171119732080667
Energy: 1.2166739002800562
Energy: 1.3171119732048535
Energy: 1.2166739002781286
Energy: 1.3171119732093521
Energy: 1.216673900278771
Energy: 1.2145353635822298
Energy: 1.2081612531157115
Energy: 1.2145353635841576
Energy: 1.208161253116997
Energy: 1.2145353635822298
Energy: 1.2081612531189247
Energy: 1.2145353635828724
Energy: 1.1555943775824606
Energy: 1.2631638297194014
Energy: 1.1555943775824606
Energy: 1.263163829718759
Energy: 1.1555943775843884
Energy: 1.2631638297194014
Energy: 1.1555943775805326
Energy: 1.343482692377357
Energy: 1.3714447509743688
Energy: 1.396176859829264
Energy: 1.3714447509737262
Energy: 1.3718799030685513
Energy: 1.371444750975654
Energy: 1.3718799030679087
Energy: 1.274454773771688
Energy: 1.337571062959924
Energy: 1.2744547737710454
Energy: 1.3375710629618516
Energy: 1.2744547737729732
Energy: 1.3375710629592812
Energy: 1.2744547737723306
Energy: 1.253375717494622
Energy: 1.2525889188858115
Energy: 1.253375717494622
Energy: 1.252588918884526
Energy: 1.2533757174952649
Energy: 1.2525889188877393
Energy: 1.2533757174959075
Energy: 1.269108153594466
Energy: 1.3260354646103676
Energy: 1.2691081535906104
Energy: 1.3260354646142236
Energy: 1.2691081535925384
Energy: 1.3260354646142236
Energy: 1.2691081535918958
Energy: 1.2762262395158417
Energy: 1.2700113653069847
Energy: 1.3851713147266025
Energy: 1.270011365305057
Energy: 1.2892635553424399
Energy: 1.270011365306342
Energy: 1.2892635553424399
Energy: 1.271722842266961
Energy: 1.3104442195751862
Energy: 1.271722842266961
Energy: 1.3104442195777568
Energy: 1.2717228422663185
Energy: 1.3104442195739008
Energy: 1.271722842266961
Energy: 1.146482207053958
Energy: 1.2661192374400223
Energy: 1.1464822070507448
Energy: 1.26611923744195
Energy: 1.1464822070546004
Energy: 1.26611923744195
Energy: 1.1464822070546004
Energy: 1.259963160288867
Energy: 1.3483849891127981
Energy: 1.2599631602882244
Energy: 1.3483849891108701
Energy: 1.2599631602875818
Energy: 1.3483849891108701
Energy: 1.2599631602875818
Energy: 1.2962411639740468
Energy: 1.3267518767921596
Energy: 1.2962411639753322
Energy: 1.3267518767921596
Energy: 1.3391868559905875
Energy: 1.326751876791517
Energy: 1.3367563924093901
Energy: 1.3149444815886704
Energy: 1.4167165442232832
Energy: 1.3149444815905984
Energy: 1.4167165442245682
Energy: 1.314944481589313
Energy: 1.4167165442232832
Energy: 1.314944481589313
Energy: 1.2545370882098292
Energy: 1.2554717402301343
Energy: 1.2545370882091866
Energy: 1.2554717402282063
Energy: 1.2545370882072586
Energy: 1.2554717402288489
Energy: 1.2545370882053308
Energy: 1.273857337459512
Energy: 1.3662882010375375
Energy: 1.2738573374588986
Energy: 1.3662882010394655
Energy: 1.2738573374576132
Energy: 1.3662882010375375
Energy: 1.2738573374601545
Energy: 1.3207315434185658
Energy: 1.317272732523155
Energy: 1.3616587249782786
Energy: 1.3172727325244404
Energy: 1.3050933074338422
Energy: 1.3172727325244404
Energy: 1.3050933074319144
Energy: 1.1481278402639545
Energy: 1.2675964717558579
Energy: 1.1481278402639545
Energy: 1.26759647175393
Energy: 1.1481278402645971
Energy: 1.26759647175393
Energy: 1.1481278402665251
Energy: 1.1621766156961928
Energy: 1.1673710466086928
Energy: 1.1621766156955504
Energy: 1.167371046606765
Energy: 1.1621766156994058
Energy: 1.1673710466061225
Energy: 1.1621766156981206
Energy: 1.3243357970823344
Energy: 1.3644458609032415
Energy: 1.3243357970823344
Energy: 1.364445860902599
Energy: 1.3243357970836198
Energy: 1.364445860905812
Energy: 1.3243357970816918
Energy: 1.3465418834013416
Energy: 1.3941750271528726
Energy: 1.3465418834026266
Energy: 1.3941750271515876
Energy: 1.3465418834026266
Energy: 1.3941750271528726
Energy: 1.3465418834013416
Energy: 1.2235267372665006
Energy: 1.2821236117983443
Energy: 1.2235267372690712
Energy: 1.282123611798987
Energy: 1.2235267372684284
Energy: 1.2821236117977017
Energy: 1.223526737265858

minimum gb energy = 1.136786286897796 eV
minimum distance =  2.21187659607683 Angstroms
sigma value = 39


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

Energy: 1.2030289176606113
Energy: 1.2322318152848926
Energy: 1.2030289176590945
Energy: 1.2322318152856513
Energy: 1.2030289176606113
Energy: 1.2322318152856513
Energy: 1.2030289176590945
Energy: 1.2534859877139148
Energy: 1.1317872104236715
Energy: 1.253485987712398
Energy: 1.1317872104259465
Energy: 1.2534859877139148
Energy: 1.1317872104236715
Energy: 1.2534859877116395
Energy: 1.1946708497850491
Energy: 1.1537695400856147
Energy: 1.194670849788841
Energy: 1.1537695400856147
Energy: 1.1946708497850491
Energy: 1.1537695400848564
Energy: 1.194670849788841
Energy: 1.2535898403220394
Energy: 1.140720548669613
Energy: 1.2535898403227979
Energy: 1.1407205486673377
Energy: 1.2535898403235564
Energy: 1.140720548669613
Energy: 1.253589840321281
Energy: 1.261687584590455
Energy: 1.131964510415131
Energy: 1.2616875845896962
Energy: 1.1319645104120974
Energy: 1.2616875845912132
Energy: 1.1319645104158895
Energy: 1.261687584590455
Energy: 1.2531208525430535
Energy: 1.1320538877987893
Energy: 1.253120852542295
Energy: 1.1320538878010644
Energy: 1.2531208525430535
Energy: 1.1320538877995479
Energy: 1.253120852542295
Energy: 1.2924426848887145
Energy: 1.1536313784087275
Energy: 1.316551489689796
Energy: 1.1536313784049355
Energy: 1.3175143865142092
Energy: 1.1536313784087275
Energy: 1.2070076984777582
Energy: 1.2271565669239393
Energy: 1.1486696284018565
Energy: 1.2271565669239393
Energy: 1.1486696284026148
Energy: 1.2271565669246973
Energy: 1.1486696284026148
Energy: 1.2271565669231805
Energy: 1.2762126271706673
Energy: 1.1320438630811798
Energy: 1.2762126271676335
Energy: 1.1320438630811798
Energy: 1.276212627171426
Energy: 1.1320438630811798
Energy: 1.276212627168392
Energy: 1.2021332728597862
Energy: 1.2328187383565414
Energy: 1.2021332728620615
Energy: 1.2328187383618503
Energy: 1.2021332728597862
Energy: 1.232818738361092
Energy: 1.20213327286282
Energy: 1.2521639581462476
Energy: 1.152266616978343
Energy: 1.299322112197834
Energy: 1.1522666169798599
Energy: 1.2616533776486056
Energy: 1.152266616978343
Energy: 1.3046033758370883
Energy: 1.2091145032573363
Energy: 1.148569057655788
Energy: 1.209114503258853
Energy: 1.1485690576504795
Energy: 1.2091145032573363
Energy: 1.14856905765503
Energy: 1.209114503258853
Energy: 1.3156489098495328
Energy: 1.1386056686768664
Energy: 1.3156489098525321
Energy: 1.1386056686768664
Energy: 1.3156489098510498
Energy: 1.1386056686768664
Energy: 1.3156489098525321
Energy: 1.208949352790359
Energy: 1.1489067654367051
Energy: 1.2089493527933926
Energy: 1.1489067654389804
Energy: 1.2089493527911173
Energy: 1.1489067654374638
Energy: 1.2089493527933926
Energy: 1.2737410320822709
Energy: 1.215169160718026
Energy: 1.3097164176684764
Energy: 1.2151691607172677
Energy: 1.2800427814884747
Energy: 1.2151691607187844
Energy: 1.2605616095438348
Energy: 1.2090416113754565
Energy: 1.1488285944280505
Energy: 1.2090416113731812
Energy: 1.1488285944288086
Energy: 1.2090416113746982
Energy: 1.148828594427292
Energy: 1.2090416113731812
Energy: 1.3156781421326351
Energy: 1.1385693067733036
Energy: 1.315678142135669
Energy: 1.1385693067748204
Energy: 1.3156781421341521
Energy: 1.138569306772545
Energy: 1.3156781421364274
Energy: 1.2089742236744774
Energy: 1.1485372129556255
Energy: 1.2089742236744774
Energy: 1.1485372129525915
Energy: 1.2089742236744774
Energy: 1.148537212954867
Energy: 1.208974223673719
Energy: 1.2201976493969
Energy: 1.15225682151546
Energy: 1.2201976493969
Energy: 1.15225682151546
Energy: 1.2201976493969
Energy: 1.1522568215169768
Energy: 1.2201976493969
Energy: 1.2021165680986912
Energy: 1.2327606878788875
Energy: 1.2021165681009662
Energy: 1.2327606878781292
Energy: 1.2021165680979327
Energy: 1.2327606878804047
Energy: 1.2021165681009662
Energy: 1.2762929067464037
Energy: 1.132077110754762
Energy: 1.2762929067471622
Energy: 1.1320771107540035
Energy: 1.2762929067464037
Energy: 1.132077110754762
Energy: 1.276292906750196
Energy: 1.2272727032357735
Energy: 1.1486470144736403
Energy: 1.2272727032372903
Energy: 1.1486470144721235
Energy: 1.2272727032357735
Energy: 1.1486470144728822
Energy: 1.2272727032365318
Energy: 1.256391619472299
Energy: 1.1534206521867867
Energy: 1.2085404174986192
Energy: 1.153420652183753
Energy: 1.2085404175031698
Energy: 1.1534206521875447
Energy: 1.2085404174993777
Energy: 1.252799710881161
Energy: 1.1320406373198608
Energy: 1.2527997108804025
Energy: 1.1320406373160687
Energy: 1.252799710881161
Energy: 1.1320406373191023
Energy: 1.2527997108796438
Energy: 1.261615709303021
Energy: 1.1319623805738386
Energy: 1.261615709304538
Energy: 1.1319623805753554
Energy: 1.261615709303021
Energy: 1.1319623805738386
Energy: 1.2616157093037792
Energy: 1.2530490277033046
Energy: 1.14120914133685
Energy: 1.2530490277010293
Energy: 1.1412091413391252
Energy: 1.2530490277101305
Energy: 1.14120914133685
Energy: 1.2530490276979955
Energy: 1.1946946375820913
Energy: 1.1537896886370096
Energy: 1.1946946375820913
Energy: 1.1537896886385266
Energy: 1.1946946375820913
Energy: 1.1537896886362513
Energy: 1.1946946375820913
Energy: 1.251249148652785
Energy: 1.1318232358235771
Energy: 1.2512491486520265
Energy: 1.1318232358243356
Energy: 1.2512491486535433
Energy: 1.1318232358243356
Energy: 1.2512491486535433
Energy: 1.2030289176621278
Energy: 1.2322318152848926
Energy: 1.2030289176606113
Energy: 1.2322318152848926
Energy: 1.2030289176621278
Energy: 1.2322318152848926
Energy: 1.2030289176598525
Energy: 1.2534859877146733
Energy: 1.1317872104221542
Energy: 1.2534859877131563
Energy: 1.1317872104259465
Energy: 1.2534859877154316
Energy: 1.1317872104221542
Energy: 1.253485987712398

minimum gb energy = 1.1317872104221542 eV
minimum distance =  2.23388038646969 Angstroms
sigma value = 21


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

Energy: 1.2565535336142006
Energy: 1.2870019660048195
Energy: 1.2565535336132798
Energy: 1.2870019660029781
Energy: 1.2565535336132798
Energy: 1.2870019660048195
Energy: 1.2565535336132798
Energy: 1.1293761782879557
Energy: 1.1015010308517696
Energy: 1.129376178287035
Energy: 1.101501030850849
Energy: 1.1293761782879557
Energy: 1.1015010308517696
Energy: 1.129376178287035
Energy: 1.2683522354956507
Energy: 1.2130869098272001
Energy: 1.2683522354928884
Energy: 1.213086909825359
Energy: 1.2683522354956507
Energy: 1.2130869098272001
Energy: 1.2683522354928884
Energy: 1.1217284494099613
Energy: 1.1023968654966085
Energy: 1.1217284494090407
Energy: 1.1023968654938465
Energy: 1.1217284494090407
Energy: 1.1023968654947673
Energy: 1.1217284494099613
Energy: 1.059539865105672
Energy: 1.1461860920917908
Energy: 1.059539865105672
Energy: 1.146186092094553
Energy: 1.059539865105672
Energy: 1.1461860920927114
Energy: 1.059539865105672
Energy: 1.0783181878382242
Energy: 1.1067406557950572
Energy: 1.0783181878363823
Energy: 1.1067406557941366
Energy: 1.0783181878382242
Energy: 1.1067406557941366
Energy: 1.0783181878373032
Energy: 1.0775608731102353
Energy: 1.1733452033333065
Energy: 1.0775608731111561
Energy: 1.173345203332386
Energy: 1.0775608731102353
Energy: 1.173345203332386
Energy: 1.0775608731111561
Energy: 1.0592082630856956
Energy: 1.090214950879947
Energy: 1.0592082630847748
Energy: 1.0902149508808678
Energy: 1.0592082630856956
Energy: 1.090214950879947
Energy: 1.0592082630847748
Energy: 1.124493790337506
Energy: 1.09046378441648
Energy: 1.1244937903365855
Energy: 1.0904637844146383
Energy: 1.124493790337506
Energy: 1.0904637844155591
Energy: 1.1244937903365855
Energy: 1.0785430622472771
Energy: 1.149640687809225
Energy: 1.078543062246356
Energy: 1.1496406878018803
Energy: 1.0785430622472771
Energy: 1.1496406878119871
Energy: 1.078543062246356
Energy: 1.0787128873834182
Energy: 1.111339123751954
Energy: 1.0787128873861802
Energy: 1.111339123751954
Energy: 1.0787128873834182
Energy: 1.1113391237510335
Energy: 1.0787128873861802
Energy: 1.0594762873343502
Energy: 1.137324584642642
Energy: 1.0594762873334294
Energy: 1.1373245846417215
Energy: 1.0594762873343502
Energy: 1.137324584642642
Energy: 1.0594762873334294
Energy: 1.1159281558185576
Energy: 1.0949410924087823
Energy: 1.1159281558157954
Energy: 1.0949410924087823
Energy: 1.1159281558185576
Energy: 1.0949410924087823
Energy: 1.115928155816716
Energy: 1.1713299139005984
Energy: 1.1735280511480335
Energy: 1.1713299139033395
Energy: 1.1735280511682886
Energy: 1.1713299139051807
Energy: 1.1735280511471127
Energy: 1.1713299139024187
Energy: 1.126180551348623
Energy: 1.1105749409953187
Energy: 1.126180551348623
Energy: 1.1105749409934773
Energy: 1.126180551348623
Energy: 1.1105749409953187
Energy: 1.126180551348623
Energy: 1.2466899245579623
Energy: 1.2221299599058475
Energy: 1.2466899245588832
Energy: 1.2221299599086095
Energy: 1.2466899245579623
Energy: 1.2221299599076887
Energy: 1.2466899245588832
Energy: 1.1546660073707333
Energy: 1.1076840858787746
Energy: 1.1546660073688917
Energy: 1.1076840858778538
Energy: 1.1546660073707333
Energy: 1.1076840858787746
Energy: 1.1546660073688917
Energy: 1.1722117930411238
Energy: 1.173279098229618
Energy: 1.1722117930457272
Energy: 1.1732790982314596
Energy: 1.1722117930429652
Energy: 1.173279098229618
Energy: 1.1722117930448068
Energy: 1.155612044582815
Energy: 1.111760156597957
Energy: 1.1556120445809739
Energy: 1.1117601565988775
Energy: 1.155612044582815
Energy: 1.1117601565970363
Energy: 1.1556120445818947
Energy: 1.0594532535139345
Energy: 1.101669131743906
Energy: 1.059453253513014
Energy: 1.1016691317420646
Energy: 1.0594532535157761
Energy: 1.101669131743906
Energy: 1.059453253514855
Energy: 1.1156328739522348
Energy: 1.1671780325516734
Energy: 1.1156328739513142
Energy: 1.1671780325507526
Energy: 1.1156328739522348
Energy: 1.1671780325489114
Energy: 1.1156328739513142
Energy: 1.0776473832968732
Energy: 1.1711813680335499
Energy: 1.0776473832977942
Energy: 1.1711813680307879
Energy: 1.0776473832977942
Energy: 1.1711813680335499
Energy: 1.0776473832977942
Energy: 1.110625562804012
Energy: 1.1109415371190616
Energy: 1.1106255628049329
Energy: 1.1109415371199824
Energy: 1.1106255628058537
Energy: 1.1109415371190616
Energy: 1.1106255628049329
Energy: 1.1277870279552222
Energy: 1.1005992658102748
Energy: 1.127787027956143
Energy: 1.1005992658111958
Energy: 1.1277870279552222
Energy: 1.1005992658102748
Energy: 1.1277870279570639
Energy: 1.110441467556471
Energy: 1.168775243655215
Energy: 1.110441467557392
Energy: 1.1687752436533738
Energy: 1.110441467556471
Energy: 1.168775243655215
Energy: 1.110441467556471

minimum gb energy = 1.0592082630847748 eV
minimum distance =  2.27827556224224 Angstroms
sigma value = 113


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

Energy: 1.0584150795899305
Energy: 1.1078008817333669
Energy: 1.0584150795924998
Energy: 1.1078008817364497
Energy: 1.0584150795904443
Energy: 1.107800881732853
Energy: 1.058415079595583
Energy: 1.0259614210636672
Energy: 0.961281025842449
Energy: 1.0259614210590426
Energy: 0.9612810258445044
Energy: 1.0259614210621257
Energy: 0.961281025842449
Energy: 1.0259614210605843
Energy: 1.032844279178656
Energy: 0.9993808264726735
Energy: 1.0328442791699675
Energy: 0.9993808264731872
Energy: 1.0328442791801977
Energy: 0.9993808264726735
Energy: 1.0328442791704815
Energy: 0.9938420404524728
Energy: 0.9772559184102376
Energy: 0.9938420404488761
Energy: 0.9772559184097238
Energy: 0.9938420404529867
Energy: 0.9772559184107513
Energy: 0.9938420404509314
Energy: 0.9977808804044851
Energy: 1.0343944311502768
Energy: 0.9977808804024297
Energy: 1.034394431155415
Energy: 0.9977808804039712
Energy: 1.034394431156443
Energy: 0.9977808804019158
Energy: 0.9713043300088979
Energy: 0.9635130528177228
Energy: 0.9713043300027319
Energy: 0.9635130528187505
Energy: 0.9713043300078704
Energy: 0.9635130528182367
Energy: 0.9713043300011903
Energy: 0.9861233630736456
Energy: 0.98803305596666
Energy: 0.9861233630690212
Energy: 0.9880330559615216
Energy: 0.9861233630736456
Energy: 0.9880330559630631
Energy: 0.9861233630690212
Energy: 0.975398780377593
Energy: 0.945121950233809
Energy: 0.9753987803719407
Energy: 0.9451219502255875
Energy: 0.9753987803770792
Energy: 0.945121950233295
Energy: 0.9753987803709132
Energy: 0.9653692070605968
Energy: 0.9804250965563412
Energy: 0.9653692070626522
Energy: 0.9804250965594244
Energy: 0.96536920706368
Energy: 0.9804250965563412
Energy: 0.9653692070657353
Energy: 0.9720259768657117
Energy: 0.9291225878762346
Energy: 0.9720259768672532
Energy: 0.9291225878710961
Energy: 0.9720259768662254
Energy: 0.9291225878762346
Energy: 0.9720259768667393
Energy: 0.9601312177125032
Energy: 0.9445297578780603
Energy: 0.9601312177135308
Energy: 0.9445297578780603
Energy: 0.9601312177119893
Energy: 0.9445297578765187
Energy: 0.9601312177130171
Energy: 0.997447314239224
Energy: 0.9572140663567489
Energy: 0.9974473142448762
Energy: 0.9572140663562351
Energy: 0.9974473142402516
Energy: 0.9572140663567489
Energy: 0.9974473142448762
Energy: 0.9043045792220884
Energy: 0.9981782422083315
Energy: 0.9043045792241438
Energy: 0.998178242207304
Energy: 0.9043045792210608
Energy: 0.9981782422078178
Energy: 0.9043045792241438
Energy: 0.9593108627758317
Energy: 0.9284388364600994
Energy: 0.9593108627794286
Energy: 0.9284388364590719
Energy: 0.9593108627758317
Energy: 0.9284388364595857
Energy: 0.9593108627794286
Energy: 0.946726728339818
Energy: 0.9224086565019318
Energy: 0.9467267283413595
Energy: 0.9224086565009042
Energy: 0.946726728339818
Energy: 0.9224086565024457
Energy: 0.9467267283418732
Energy: 1.0173655826591865
Energy: 0.9990104281814886
Energy: 1.0173655826586727
Energy: 0.9990104281840578
Energy: 1.017365582658159
Energy: 0.999010428179947
Energy: 1.017365582657645
Energy: 0.9058055415493461
Energy: 0.9267836195631115
Energy: 0.9058055415493461
Energy: 0.9267836195625977
Energy: 0.9058055415508874
Energy: 0.9267836195625977
Energy: 0.9058055415498598
Energy: 0.9730434106415363
Energy: 0.9414658867249275
Energy: 0.9730434106369117
Energy: 0.9414658867249275
Energy: 0.9730434106415363
Energy: 0.9414658867228721
Energy: 0.9730434106369117
Energy: 0.9672977071874788
Energy: 0.9234308822159839
Energy: 0.9672977071818265
Energy: 0.9234308822185531
Energy: 0.967297707186451
Energy: 0.9234308822154701
Energy: 0.9672977071823403
Energy: 0.965644973127054
Energy: 1.0044998482416052
Energy: 0.9656449731296232
Energy: 1.0044998482405776
Energy: 0.9656449731265402
Energy: 1.0044998482400638
Energy: 0.9656449731306509
Energy: 0.9827367469304316
Energy: 0.926920805004195
Energy: 0.9827367469299179
Energy: 0.926920805003681
Energy: 0.9827367469304316
Energy: 0.9269208050052226
Energy: 0.9827367469294039
Energy: 0.9922758823814063
Energy: 0.9630807208255235
Energy: 0.9922758823772955
Energy: 0.963080720827065
Energy: 0.992275882382434
Energy: 0.9630807208260375
Energy: 0.9922758823778094
Energy: 0.9559750717347856
Energy: 1.0022392429965776
Energy: 0.955975071733244
Energy: 1.002239242995036
Energy: 0.9559750717337581
Energy: 1.0022392429965776
Energy: 0.9559750717342719
Energy: 0.9674222181147039
Energy: 1.03046617974925
Energy: 0.9674222181167592
Energy: 1.0304661796192958
Energy: 0.9674222181177868
Energy: 1.030466179653723
Energy: 0.9674222181167592
Energy: 0.9627425639130754
Energy: 0.9739961732013798
Energy: 0.9627425639418503
Energy: 0.9739961732008661
Energy: 0.9627425639629176
Energy: 0.9739961732013798
Energy: 0.9627425639387672
Energy: 1.0236018348405223
Energy: 0.969548494429021
Energy: 1.0236018348358977
Energy: 0.9695484944254241
Energy: 1.0236018348410363
Energy: 0.9695484944295347
Energy: 1.0236018348379532
Energy: 1.0237001878599796
Energy: 0.9598911141515528
Energy: 1.0237001878646044
Energy: 0.9598911141515528
Energy: 1.0237001878594658
Energy: 0.9598911141515528
Energy: 1.0237001878635765
Energy: 1.0290142648663974
Energy: 1.0757980737126234
Energy: 1.0290142648669114
Energy: 1.075798073739343
Energy: 1.0290142648663974
Energy: 1.0757980738209965
Energy: 1.0290142648663974
Energy: 1.004446467525284
Energy: 0.9621444604990116
Energy: 1.0044463125655596
Energy: 0.9621444604979837
Energy: 1.0044463865408126
Energy: 0.9621444604990116
Energy: 1.0044464733809353
Energy: 1.0145289792845646
Energy: 0.9696793152428449
Energy: 1.0145289792825094
Energy: 0.9696793152443864
Energy: 1.0145289792855923
Energy: 0.9696793152433587
Energy: 1.0145289792840508
Energy: 0.9833451119031095
Energy: 1.1206538036375238
Energy: 0.9833451118995126
Energy: 1.1206538036375238
Energy: 0.9833451119031095
Energy: 1.1206538036426623
Energy: 0.9833451119000264
Energy: 0.9674969326649479
Energy: 1.0067811453063236
Energy: 0.9674969326639203
Energy: 1.0067811451881878
Energy: 0.9674969326628925
Energy: 1.0067811452323776
Energy: 0.9674969326654619
Energy: 1.047994210860174
Energy: 0.9622016110041921
Energy: 1.0479942108596603
Energy: 0.9622016110036783
Energy: 1.0479942108596603
Energy: 0.962201611004706
Energy: 1.0479942108586326
Energy: 0.974776719270101
Energy: 0.9697625950686943
Energy: 0.9747767192788361
Energy: 0.9697625950743467
Energy: 0.9747767193091527
Energy: 0.9697625950712635
Energy: 0.974776719282947
Energy: 0.9794721462785241
Energy: 1.066270533377575
Energy: 0.9794721462774966
Energy: 1.066270533381686
Energy: 0.9794721462780104
Energy: 1.066270533378603
Energy: 0.9794721462780104
Energy: 0.9482479574914676
Energy: 0.9989849131817041
Energy: 0.9482479574950643
Energy: 0.9989849131688582
Energy: 0.9482479574914676
Energy: 0.9989849131298064
Energy: 0.9482479574950643
Energy: 0.9459086204629785
Energy: 0.9279430067578394
Energy: 0.9459086204562985
Energy: 0.9279430067547564
Energy: 0.9459086204634922
Energy: 0.9279430067578394
Energy: 0.945908620461437
Energy: 0.9694198888629427
Energy: 0.9233881370959767
Energy: 0.9694198888644843
Energy: 0.9233881370913523
Energy: 0.9694198888629427
Energy: 0.923388137094949
Energy: 0.969419888864998
Energy: 0.9560621010033301
Energy: 0.97693409188126
Energy: 0.9560621009956225
Energy: 0.9769340918807462
Energy: 0.9560621010017885
Energy: 0.97693409188126
Energy: 0.9560621009961363
Energy: 0.904652027031895
Energy: 1.0157835753778603
Energy: 0.9046520270324089
Energy: 1.0157835753742634
Energy: 0.9046520270308673
Energy: 1.0157835753814572
Energy: 0.904652027031895
Energy: 0.948317125552463
Energy: 0.9271835605207793
Energy: 0.9483171255539578
Energy: 0.9271835605197518
Energy: 0.948317125552463
Energy: 0.9271835605192378
Energy: 0.9483171255539578
Energy: 0.951070755570729
Energy: 0.9202549428661623
Energy: 0.9510707555686736
Energy: 0.9202549428641069
Energy: 0.951070755570729
Energy: 0.9202549428646207
Energy: 0.9510707555691875
Energy: 0.9402771414910013
Energy: 1.0595655763311835
Energy: 0.9402771414915152
Energy: 1.0595655763281007
Energy: 0.9402771414910013
Energy: 1.0595655763311835
Energy: 0.9402771414915152
Energy: 0.9069762422800267
Energy: 0.926407986793541
Energy: 0.906976242285679
Energy: 0.9264079867940551
Energy: 0.9069762422805406
Energy: 0.9264079867945688
Energy: 0.906976242285679
Energy: 0.9387336173629763
Energy: 0.939981330011747
Energy: 0.9387336173614348
Energy: 0.9399813300066086
Energy: 0.9387336173624626
Energy: 0.9399813300122607
Energy: 0.9387336173598932

minimum gb energy = 0.9043045792210608 eV
minimum distance =  2.26791472273435 Angstroms
sigma value = 365


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

Energy: 0.4056169935171658
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935160072
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 2.0831905192448907
Energy: 1.0719581621334209
Energy: 1.845361114432019
Energy: 1.0719581621334209
Energy: 1.845470415962718
Energy: 1.0719581621334209
Energy: 1.8455518665158395
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935171658
Energy: 0.3202043311378476
Energy: 0.40561699351484864
Energy: 0.3202043311401646
Energy: 0.4056169935171658
Energy: 2.3991902933716456
Energy: 1.0719581621334209
Energy: 2.270210903015736
Energy: 1.0719581621334209
Energy: 2.3987223247375247
Energy: 1.0719581621334209
Energy: 1.8455484555607804
Energy: 0.40561699351484864
Energy: 0.3202043311378476
Energy: 0.4056169935171658
Energy: 0.3202043311401646
Energy: 0.40561699351484864
Energy: 0.3202043311378476
Energy: 0.4056169935171658
Energy: 2.083190139062664
Energy: 1.0719581621334209
Energy: 2.0831883350574785
Energy: 1.0719581621334209
Energy: 1.8453428481560004
Energy: 1.0719581621334209
Energy: 1.845367400515822
Energy: 0.4056169935171658
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 0.3202043311401646
Energy: 0.40561699351832425
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 1.8453404854702173
Energy: 1.0719581621334209
Energy: 1.84553216702549
Energy: 1.0719581621334209
Energy: 1.8455845444989776
Energy: 1.0719581621345793
Energy: 1.8455635026866746
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935171658
Energy: 0.32020433113668906
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935171658
Energy: 2.083181844408758
Energy: 1.0719581621334209
Energy: 2.083180672215216
Energy: 1.0719581621334209
Energy: 2.083185116091479
Energy: 1.0719581621334209
Energy: 1.845584776123971
Energy: 0.40561699351484864
Energy: 0.3202043311378476
Energy: 0.40561699351832425
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 0.3202043311378476
Energy: 0.40561699351832425
Energy: 1.8455342129340666
Energy: 1.0719581621334209
Energy: 1.8453467583203904
Energy: 1.0719581621345793
Energy: 1.8453393137085892
Energy: 1.0719581621334209
Energy: 1.8453696791020315
Energy: 0.4056169935171658
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935171658
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 1.8454293306687275
Energy: 1.0719581621334209
Energy: 1.8455298053969287
Energy: 1.0719581621334209
Energy: 1.845597360325489
Energy: 1.0719581621334209
Energy: 1.8455395545028492
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935171658
Energy: 0.3202043311378476
Energy: 0.40561699351484864
Energy: 0.3202043311401646
Energy: 0.4056169935171658
Energy: 1.8455220938828636
Energy: 1.0719581621334209
Energy: 1.8455278766267664
Energy: 1.0719581621345793
Energy: 1.8455266691339682
Energy: 1.0719581621334209
Energy: 1.8455343316346284
Energy: 0.40561699351484864
Energy: 0.32020433113668906
Energy: 0.4056169935171658
Energy: 0.3202043311401646
Energy: 0.40561699351484864
Energy: 0.3202043311378476
Energy: 0.4056169935171658
Energy: 1.8454923897211342
Energy: 1.0719581621334209
Energy: 1.845350842419536
Energy: 1.0719581621334209
Energy: 1.8454175422918466
Energy: 1.0719581621334209
Energy: 1.8454929164259313
Energy: 0.4056169935171658
Energy: 0.3202043311390061
Energy: 0.40561699351484864
Energy: 0.3202043311390061
Energy: 0.4056169935171658
Energy: 0.3202043311401646
Energy: 0.40561699351484864
Energy: 1.84535259838286
Energy: 1.0719581621345793
Energy: 1.8453486523518068
Energy: 1.0719581621345793
Energy: 1.8454269885188606
Energy: 1.0719581621334209
Energy: 1.8453855377029018

minimum gb energy = 0.32020433113668906 eV
minimum distance =  2.24499877072516 Angstroms
sigma value = 23