Model name: model_name=EAM_Dynamo_AcklandTichyVitek_1987_Ni__MO_977363131043_005
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Ni
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.52422046661377
cohesive_energy=4.459348122686658
mass=58.6934
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=180.0
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: 0.01815315157270064
Energy: 0.8574742849252089
Energy: 0.01815315157270064
Energy: 0.8574742849252089
Energy: 0.01815315157270064
Energy: 0.8574742849255023
Energy: 0.8574742849258322
Energy: 0.8545485178606318
Energy: 0.8574742849252089
Energy: 0.8545485178606318
Energy: 0.8574742849258322
Energy: 0.8545485178606318
Energy: 0.01815315157270064
Energy: 0.8574742849255023
Energy: 0.01815315157270064
Energy: 0.857474284924879
Energy: 0.01815315157270064
Energy: 0.8574742849255023
Energy: 0.8574742849252089
Energy: 0.8545485178603018
Energy: 0.8574742849255023
Energy: 0.8545485178609252
Energy: 0.8574742849255023
Energy: 0.8545485178606318
Energy: 0.01815315157270064
Energy: 0.8574742849255023
Energy: 0.01815315157270064
Energy: 0.8574742849258322
Energy: 0.01815315157270064
Energy: 0.8574742849258322
Energy: 0.8574742849258322
Energy: 0.8545485178606318
Energy: 0.8574742849258322
Energy: 0.8545485178609252
Energy: 0.8574742849252089
Energy: 0.8545485178609252

minimum gb energy = 0.01815315157270064 eV
minimum distance =  2.4609784786319 Angstroms
sigma value = 1


========================================
theta = 20.049975724151484
========================================

Energy: 1.1704381903480585
Energy: 1.276884483287781
Energy: 1.1704381903488525
Energy: 1.2768844832869868
Energy: 1.1704381903464698
Energy: 1.276884483287781
Energy: 1.2934577165538066
Energy: 1.1170878606042367
Energy: 1.2934577165538066
Energy: 1.1170878606042367
Energy: 1.2934577165530123
Energy: 1.1170878606042367
Energy: 1.159209000372972
Energy: 1.202086635371163
Energy: 1.1592090003697948
Energy: 1.202086635371163
Energy: 1.1592090003721778
Energy: 1.202086635371163
Energy: 1.2770291776756812
Energy: 1.1271771958119068
Energy: 1.2770291776732985
Energy: 1.127177195812701
Energy: 1.2770291776756812
Energy: 1.127177195812701
Energy: 1.1886135861868465
Energy: 1.2510967791341974
Energy: 1.1886135861876408
Energy: 1.2510967791334031
Energy: 1.1886135861876408
Energy: 1.2510967791334031
Energy: 1.1759729926517386
Energy: 1.114323841707103
Energy: 1.1759729926525329
Energy: 1.114323841707103
Energy: 1.1759729926509441
Energy: 1.1143238417078976
Energy: 1.1981255222739822
Energy: 1.2028929660551695
Energy: 1.1981255222723934
Energy: 1.2028929660543752
Energy: 1.1981255222755707
Energy: 1.202892966055964
Energy: 1.1886028175410341
Energy: 1.240102411738462
Energy: 1.1886028175410341
Energy: 1.240102411738462
Energy: 1.1886028175418284
Energy: 1.2401024117392563
Energy: 1.211045592461064
Energy: 1.1580988487230164
Energy: 1.2110455924602699
Energy: 1.1580988487238106
Energy: 1.2110455924594754
Energy: 1.1580988487222221
Energy: 1.0930752992070163
Energy: 1.3005770278093667
Energy: 1.0930752992070163
Energy: 1.3005770278093667
Energy: 1.093075299208605
Energy: 1.3005770278093667
Energy: 1.2626729555731475
Energy: 1.1122875550378406
Energy: 1.2626729555731475
Energy: 1.1122875550378406
Energy: 1.2626729555715588
Energy: 1.1122875550378406
Energy: 1.1055129540682127
Energy: 1.274713159338806
Energy: 1.1055129540674187
Energy: 1.2747131593403944
Energy: 1.1055129540674187
Energy: 1.274713159338806
Energy: 1.2965904021889674
Energy: 1.0662952987541239
Energy: 1.2965904021881731
Energy: 1.0662952987541239
Energy: 1.2965904021873789
Energy: 1.0662952987541239
Energy: 1.119351544052888
Energy: 1.2013033018036414
Energy: 1.1193515440536823
Energy: 1.2013033018044357
Energy: 1.119351544052888
Energy: 1.201303301802847
Energy: 1.3173514422150043
Energy: 1.10137437170203
Energy: 1.3173514422157986
Energy: 1.10137437170203
Energy: 1.31735144221421
Energy: 1.1013743717012354
Energy: 1.3380058831659187
Energy: 1.2084195144121357
Energy: 1.338005883166713
Energy: 1.2084195144121357
Energy: 1.338005883166713
Energy: 1.2084195144113414
Energy: 1.2009424424375181
Energy: 1.1626701360340523
Energy: 1.2009424424359296
Energy: 1.1626701360340523
Energy: 1.2009424424375181
Energy: 1.1626701360348466
Energy: 1.226718324885269
Energy: 1.152573178660745
Energy: 1.2267183248812978
Energy: 1.152573178659951
Energy: 1.2267183248844749
Energy: 1.152573178659951
Energy: 1.1484631150816211
Energy: 1.1257463154581908
Energy: 1.148463115076855
Energy: 1.1257463154597795
Energy: 1.148463115079238
Energy: 1.1257463154605738
Energy: 1.211594681657919
Energy: 1.1141313188610262
Energy: 1.2115946816603018
Energy: 1.1141313188602318
Energy: 1.2115946816587133
Energy: 1.1141313188602318
Energy: 1.1395798406649287
Energy: 1.2899750259866163
Energy: 1.1395798406649287
Energy: 1.2899750259866163
Energy: 1.1395798406649287
Energy: 1.2899750259866163
Energy: 1.282948295077987
Energy: 1.1607118458417622
Energy: 1.282948295077987
Energy: 1.1607118458417622
Energy: 1.2829482950787812
Energy: 1.1607118458425565
Energy: 1.1186373531212421
Energy: 1.2923392637518007
Energy: 1.1186373531204479
Energy: 1.2923392637518007
Energy: 1.1186373531212421
Energy: 1.2923392637518007

minimum gb energy = 1.0662952987541239 eV
minimum distance =  2.24200661841823 Angstroms
sigma value = 33


========================================
theta = 22.84350731792459
========================================

Energy: 1.1622221220344098
Energy: 1.2740390121721585
Energy: 1.162222122033958
Energy: 1.2740390121721585
Energy: 1.1622221220348616
Energy: 1.2740390121717067
Energy: 1.2777053499040667
Energy: 1.1369386626405775
Energy: 1.277705349905874
Energy: 1.1369386626432882
Energy: 1.2777053499036148
Energy: 1.1369386626441917
Energy: 1.0790197609387766
Energy: 1.1796128119597147
Energy: 1.0790197609369696
Energy: 1.1796128119601663
Energy: 1.079019760938325
Energy: 1.1796128119601663
Energy: 1.2187797635091173
Energy: 1.1681212759860489
Energy: 1.218779763509569
Energy: 1.1681212759851454
Energy: 1.2187797635100208
Energy: 1.168121275985597
Energy: 1.1324561691800967
Energy: 1.1672758043764069
Energy: 1.132456169177386
Energy: 1.1672758043768587
Energy: 1.1324561691791932
Energy: 1.1672758043759548
Energy: 1.188245864050312
Energy: 1.0791163858118424
Energy: 1.1882458640512155
Energy: 1.0791163858100352
Energy: 1.1882458640512155
Energy: 1.079116385810939
Energy: 1.221166690119414
Energy: 1.162494614923134
Energy: 1.2211666901189622
Energy: 1.1624946149226822
Energy: 1.2211666901203178
Energy: 1.1624946149222306
Energy: 1.053817522119242
Energy: 1.2662373393971387
Energy: 1.0538175221219526
Energy: 1.26623733939759
Energy: 1.053817522121501
Energy: 1.266237339398042
Energy: 1.2078631972269973
Energy: 1.0826591884795078
Energy: 1.2078631972279006
Energy: 1.082659188479056
Energy: 1.2078631972265454
Energy: 1.082659188479056
Energy: 1.0621852417583264
Energy: 1.2199498442263466
Energy: 1.0621852417578745
Energy: 1.2199498442263466
Energy: 1.0621852417592301
Energy: 1.2199498442304129
Energy: 1.2562832426085186
Energy: 1.0640271545191937
Energy: 1.2562832426076151
Energy: 1.0640271545200972
Energy: 1.2562832426076151
Energy: 1.0640271545191937
Energy: 1.078871701845942
Energy: 1.1688362973398376
Energy: 1.0788717018463936
Energy: 1.1688362973398376
Energy: 1.0788717018463936
Energy: 1.1688362973393858
Energy: 1.2900278723242316
Energy: 1.0524523656170293
Energy: 1.290027872323328
Energy: 1.0524523656165772
Energy: 1.2900278723246836
Energy: 1.0524523656165772
Energy: 1.1621964346706823
Energy: 1.2205225359115652
Energy: 1.1621964346688751
Energy: 1.2205225359115652
Energy: 1.1621964346706823
Energy: 1.220522535912017
Energy: 1.2137115969616818
Energy: 1.1726701782377935
Energy: 1.2137115969598746
Energy: 1.1726701782377935
Energy: 1.2137115969603265
Energy: 1.1726701782382452
Energy: 1.0412022779806729
Energy: 1.1781481885719722
Energy: 1.0412022779811247
Energy: 1.1781481885724239
Energy: 1.0412022779806729
Energy: 1.1781481885719722
Energy: 1.16855725563974
Energy: 1.1675934036320879
Energy: 1.16855725563974
Energy: 1.1675934036325395
Energy: 1.1685572556419987
Energy: 1.167593403631636
Energy: 1.200728152697963
Energy: 1.0790951708553123
Energy: 1.2007281526984146
Energy: 1.0790951708566678
Energy: 1.2007281526970592
Energy: 1.079095170858434
Energy: 1.170249071580519
Energy: 1.2162732935901899
Energy: 1.1702490715800673
Energy: 1.2162732935892862
Energy: 1.1702490715809706
Energy: 1.2162732935906417
Energy: 1.2201673546058223
Energy: 1.1645900323640532
Energy: 1.2201673546058223
Energy: 1.1645900323649567
Energy: 1.2201673546049185
Energy: 1.1645900323640532
Energy: 1.0512045036132267
Energy: 1.2782485809544841
Energy: 1.0512045036105162
Energy: 1.2782485809540323
Energy: 1.0512045036141304
Energy: 1.2782485809540323
Energy: 1.1776149556471438
Energy: 1.0829197537226172
Energy: 1.1776149556494029
Energy: 1.0829197537221653
Energy: 1.1776149556457882
Energy: 1.0829197537226172
Energy: 1.0619690816863565
Energy: 1.2393595496458587
Energy: 1.06196908168726
Energy: 1.2393595496467624
Energy: 1.0619690816877116
Energy: 1.2393595496449554
Energy: 1.2177895314160736
Energy: 1.1285685134119467
Energy: 1.2177895314165252
Energy: 1.1285685134119467
Energy: 1.2177895314156217
Energy: 1.128568513411043
Energy: 1.0786003651233689
Energy: 1.2280777833555585
Energy: 1.0786003651265315
Energy: 1.2280777833569139
Energy: 1.0786003651238205
Energy: 1.2280777833569139
Energy: 1.2246715536250092
Energy: 1.1744152492487168
Energy: 1.224671553625461
Energy: 1.1744152492487168
Energy: 1.2246715536250092
Energy: 1.1744152492487168
Energy: 1.2247216493415014
Energy: 1.1744043757456644
Energy: 1.2247216493433084
Energy: 1.1744043757456644
Energy: 1.2247216493428565
Energy: 1.1744043757447609
Energy: 1.0785629957657001
Energy: 1.228135462693111
Energy: 1.0785629957702183
Energy: 1.2281354626935628
Energy: 1.0785629957647969
Energy: 1.2281354626940144
Energy: 1.217822876462787
Energy: 1.1285936581815743
Energy: 1.2178228764632388
Energy: 1.1285936581820262
Energy: 1.2178228764636907
Energy: 1.1285936581820262
Energy: 1.062003044638079
Energy: 1.2393264598385025
Energy: 1.062003044638531
Energy: 1.2393264598389544
Energy: 1.062003044638079
Energy: 1.2393264598385025
Energy: 1.1781547979653264
Energy: 1.0827172113143275
Energy: 1.1781547979617122
Energy: 1.0827172113143275
Energy: 1.1781547979648748
Energy: 1.0827172113147794
Energy: 1.051260413317761
Energy: 1.2783972979177036
Energy: 1.051260413317761
Energy: 1.2783972979177036
Energy: 1.0512604133173094
Energy: 1.2783972979177036
Energy: 1.2200028310698827
Energy: 1.164569405387776
Energy: 1.2200028310689788
Energy: 1.164569405387776
Energy: 1.2200028310712379
Energy: 1.164569405387776
Energy: 1.1702365140438429
Energy: 1.216564569451924
Energy: 1.1702365140424877
Energy: 1.216564569452376
Energy: 1.1702365140420359
Energy: 1.216564569451924
Energy: 1.2008380404081227
Energy: 1.0790448274048225
Energy: 1.2008380404085743
Energy: 1.079044827403467
Energy: 1.200838040409437
Energy: 1.079044827403467
Energy: 1.1685469055451532
Energy: 1.1675973728685818
Energy: 1.1685469055447015
Energy: 1.16759737286813
Energy: 1.1685469055437978
Energy: 1.16759737286813
Energy: 1.0412699227973747
Energy: 1.1778850833743588
Energy: 1.0412699227973747
Energy: 1.177885083373907
Energy: 1.0412699227964715
Energy: 1.1778850833743588
Energy: 1.2136018202458594
Energy: 1.1727125756294767
Energy: 1.2136018202458594
Energy: 1.1727125756303804
Energy: 1.2136018202454075
Energy: 1.1727125756299286
Energy: 1.1623933571119034
Energy: 1.2204933872254735
Energy: 1.1623933571096443
Energy: 1.2204933872254735
Energy: 1.1623933571109997
Energy: 1.2204933872259254
Energy: 1.2897528426723388
Energy: 1.0524670310035549
Energy: 1.2897528426727904
Energy: 1.052467031002651
Energy: 1.2897528426723388
Energy: 1.052467031002651
Energy: 1.078871933539148
Energy: 1.168836269188424
Energy: 1.0788719335405035
Energy: 1.1688362691879723
Energy: 1.078871933539148
Energy: 1.168836269188424

minimum gb energy = 1.0412022779806729 eV
minimum distance =  2.29566045855585 Angstroms
sigma value = 51


========================================
theta = 26.525352016609688
========================================

Energy: 1.1317708118385097
Energy: 1.163895860351558
Energy: 1.1317708118385097
Energy: 1.163895860351558
Energy: 1.1317708118395564
Energy: 1.163895860351558
Energy: 1.2533269331065093
Energy: 1.150462978381338
Energy: 1.253326933107556
Energy: 1.150462978381338
Energy: 1.253326933107556
Energy: 1.1504629783823845
Energy: 1.131391100956991
Energy: 1.1897543404343107
Energy: 1.131391100956991
Energy: 1.1897543404343107
Energy: 1.131391100956991
Energy: 1.189754340433264
Energy: 1.1336910738021349
Energy: 1.0900178296678955
Energy: 1.1336910738021349
Energy: 1.0900178296678955
Energy: 1.1336910738021349
Energy: 1.0900178296678955
Energy: 1.1985084960676824
Energy: 1.1629594041380624
Energy: 1.1985084960666355
Energy: 1.1629594041380624
Energy: 1.1985084960676824
Energy: 1.1629594041380624
Energy: 1.1882132181829028
Energy: 1.1147228809385414
Energy: 1.1882132181829028
Energy: 1.1147228809385414
Energy: 1.1882132181829028
Energy: 1.1147228809385414
Energy: 1.1635372507556496
Energy: 1.1150191398040514
Energy: 1.1635372507556496
Energy: 1.1150191398030045
Energy: 1.163537250754603
Energy: 1.1150191398030045
Energy: 1.1409027909787235
Energy: 1.2056223431157984
Energy: 1.1409027909787235
Energy: 1.2056223431147515
Energy: 1.1409027909787235
Energy: 1.2056223431157984
Energy: 1.281521504694983
Energy: 1.0891810750565853
Energy: 1.281521504694983
Energy: 1.0891810750565853
Energy: 1.281521504694983
Energy: 1.0891810750565853
Energy: 1.0843628808016086
Energy: 1.351590647336663
Energy: 1.0843628808005619
Energy: 1.351590647336663
Energy: 1.0843628808016086
Energy: 1.351590647336663
Energy: 1.269162276457242
Energy: 1.0799405126030015
Energy: 1.269162276457242
Energy: 1.0799405126030015
Energy: 1.269162276457242
Energy: 1.0799405126030015
Energy: 1.130692461685758
Energy: 1.175036576236377
Energy: 1.130692461685758
Energy: 1.17503657623533
Energy: 1.130692461686805
Energy: 1.175036576236377
Energy: 1.2377955277345334
Energy: 1.1366723705598867
Energy: 1.23779552773558
Energy: 1.13667237055884
Energy: 1.2377955277345334
Energy: 1.13667237055884
Energy: 1.1704021787922996
Energy: 1.1552561819517955
Energy: 1.1704021787912529
Energy: 1.1552561819507488
Energy: 1.1704021787922996
Energy: 1.1552561819517955
Energy: 1.132918776527491
Energy: 1.1142643932295508
Energy: 1.132918776527491
Energy: 1.1142643932305976
Energy: 1.132918776527491
Energy: 1.1142643932295508
Energy: 1.200308055866967
Energy: 1.1188622320941268
Energy: 1.200308055866967
Energy: 1.1188622320951738
Energy: 1.200308055866967
Energy: 1.1188622320951738
Energy: 1.1886576643451103
Energy: 1.249084379714185
Energy: 1.1886576643461573
Energy: 1.249084379714185
Energy: 1.1886576643451103
Energy: 1.249084379714185
Energy: 1.1790616025980232
Energy: 1.1166645515001714
Energy: 1.1790616025980232
Energy: 1.1166645515001714
Energy: 1.1790616025980232
Energy: 1.1166645515001714

minimum gb energy = 1.0799405126030015 eV
minimum distance =  2.22554052145293 Angstroms
sigma value = 19


========================================
theta = 31.586338096527925
========================================

Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 1.0724657779665074
Energy: 1.0283905390233519
Energy: 1.0724657779665074
Energy: 1.028390539023973
Energy: 1.0724657779665074
Energy: 1.028390539023973
Energy: 0.9816467091056353
Energy: 1.0217532158508817
Energy: 0.9816467091056353
Energy: 1.0217532158515028
Energy: 0.9816467091062562
Energy: 1.0217532158515028
Energy: 1.0285633092403783
Energy: 0.9817006293962899
Energy: 1.0285633092397577
Energy: 0.9817006293956688
Energy: 1.0285633092403783
Energy: 0.9817006293962899
Energy: 0.953424905060934
Energy: 0.9224545802815168
Energy: 0.953424905061555
Energy: 0.9224545802815168
Energy: 0.9534249050603132
Energy: 0.9224545802815168
Energy: 0.9536143466368523
Energy: 0.9225109390704299
Energy: 0.9536143466356105
Energy: 0.922510939071051
Energy: 0.9536143466374732
Energy: 0.922510939071051
Energy: 1.0285702010666935
Energy: 0.9816811363963109
Energy: 1.0285702010685562
Energy: 0.981681136396932
Energy: 1.0285702010679354
Energy: 0.981681136396932
Energy: 0.9817840959673862
Energy: 1.0216629801065653
Energy: 0.9817840959686283
Energy: 1.0216629801053232
Energy: 0.9817840959680072
Energy: 1.0216629801059443
Energy: 1.0712132885784014
Energy: 1.0283951608205495
Energy: 1.0712132885784014
Energy: 1.0283951608199287
Energy: 1.0712132885784014
Energy: 1.0283951608205495
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 0.92347277810217
Energy: 1.0272713226150374
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 1.0724657779658868
Energy: 1.0283905390233519
Energy: 1.0724657779665074
Energy: 1.028390539023973
Energy: 1.0724657779658868
Energy: 1.028390539023973
Energy: 0.9816467091062562
Energy: 1.0217532158515028
Energy: 0.9816467091043934
Energy: 1.0217532158515028
Energy: 0.9816467091043934
Energy: 1.0217532158508817
Energy: 1.0285633092403783
Energy: 0.9817006293956688
Energy: 1.0285633092403783
Energy: 0.9817006293962899
Energy: 1.0285633092409994
Energy: 0.9817006293962899
Energy: 0.9534249050603132
Energy: 0.9224545802821379
Energy: 0.9534249050603132
Energy: 0.9224545802815168
Energy: 0.953424905060934
Energy: 0.9224545802821379
Energy: 0.9536143466374732
Energy: 0.922510939071051
Energy: 0.9536143466362312
Energy: 0.9225109390698092
Energy: 0.9536143466368523
Energy: 0.9225109390698092
Energy: 1.0285702010673143
Energy: 0.9816811363963109
Energy: 1.0285702010679354
Energy: 0.9816811363963109
Energy: 1.0285702010673143
Energy: 0.981681136396932
Energy: 0.9817840959673862
Energy: 1.0216629801059443
Energy: 0.9817840959680072
Energy: 1.0216629801059443
Energy: 0.9817840959680072
Energy: 1.0216629801059443
Energy: 1.0712132885784014
Energy: 1.0283951608199287
Energy: 1.0712132885784014
Energy: 1.0283951608199287
Energy: 1.0712132885790222
Energy: 1.0283951608199287
Energy: 0.9234727781015492
Energy: 1.0272713226156585
Energy: 0.92347277810217
Energy: 1.0272713226150374
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 1.0724657779652658
Energy: 1.028390539023973
Energy: 1.0724657779665074
Energy: 1.028390539023973
Energy: 1.0724657779658868
Energy: 1.0283905390233519
Energy: 0.9816467091043934
Energy: 1.0217532158508817
Energy: 0.9816467091043934
Energy: 1.0217532158508817
Energy: 0.9816467091050144
Energy: 1.0217532158508817
Energy: 1.0285633092403783
Energy: 0.9817006293962899
Energy: 1.0285633092403783
Energy: 0.9817006293956688
Energy: 1.0285633092403783
Energy: 0.9817006293962899
Energy: 0.953424905061555
Energy: 0.9224545802815168
Energy: 0.953424905061555
Energy: 0.922454580280896
Energy: 0.9534249050596922
Energy: 0.9224545802815168
Energy: 0.9536143466362312
Energy: 0.9225109390704299
Energy: 0.9536143466368523
Energy: 0.9225109390698092
Energy: 0.9536143466368523
Energy: 0.9225109390704299
Energy: 1.0285702010691773
Energy: 0.9816811363963109
Energy: 1.0285702010673143
Energy: 0.9816811363956902
Energy: 1.0285702010666935
Energy: 0.9816811363963109
Energy: 0.9817840959680072
Energy: 1.0216629801059443
Energy: 0.981784095969249
Energy: 1.0216629801053232
Energy: 0.9817840959680072
Energy: 1.0216629801059443
Energy: 1.0712132885771595
Energy: 1.0283951608199287
Energy: 1.0712132885777803
Energy: 1.0283951608199287
Energy: 1.0712132885784014
Energy: 1.0283951608205495
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 0.92347277810217
Energy: 1.0272713226156585
Energy: 0.9234727781015492
Energy: 1.0272713226156585
Energy: 1.0724657779658868
Energy: 1.0283905390233519
Energy: 1.0724657779652658
Energy: 1.028390539023973
Energy: 1.0724657779671285
Energy: 1.0283905390233519
Energy: 0.9816467091037725
Energy: 1.0217532158508817
Energy: 0.9816467091043934
Energy: 1.0217532158515028
Energy: 0.9816467091062562
Energy: 1.0217532158508817

minimum gb energy = 0.922454580280896 eV
minimum distance =  2.33242469849419 Angstroms
sigma value = 27


========================================
theta = 38.94244126898138
========================================

Energy: 0.9523032756619262
Energy: 0.94248908170625
Energy: 0.9523032756619262
Energy: 0.94248908170625
Energy: 0.9523032756619262
Energy: 0.94248908170625
Energy: 1.1471533841484713
Energy: 0.9634755166326362
Energy: 1.1471533841484713
Energy: 0.9634755166326362
Energy: 1.1471533841484713
Energy: 0.9634755166311153
Energy: 1.041446502763886
Energy: 1.0975038162433641
Energy: 1.041446502765407
Energy: 1.0975038162433641
Energy: 1.041446502763886
Energy: 1.0975038162433641
Energy: 1.1690941773719303
Energy: 0.9268886175846929
Energy: 1.1690941773719303
Energy: 0.9268886175846929
Energy: 1.1690941773719303
Energy: 0.9268886175862138
Energy: 1.1685939786243507
Energy: 0.9210296335075175
Energy: 1.1685939786243507
Energy: 0.9210296335090384
Energy: 1.1685939786228297
Energy: 0.9210296335075175
Energy: 1.201343391791574
Energy: 1.204235299856784
Energy: 1.201343391791574
Energy: 1.204235299856784
Energy: 1.2013433917900527
Energy: 1.204235299856784
Energy: 1.056490791202186
Energy: 0.9634725380180079
Energy: 1.056490791202186
Energy: 0.9634725380180079
Energy: 1.056490791202186
Energy: 0.9634725380180079
Energy: 0.9520228776754949
Energy: 0.9426911693629193
Energy: 0.9520228776770159
Energy: 0.9426911693644401
Energy: 0.9520228776754949
Energy: 0.9426911693629193
Energy: 1.1462655993888138
Energy: 1.0416181004987006
Energy: 1.1462655993888138
Energy: 1.0416181004971798
Energy: 1.1462655993888138
Energy: 1.0416181004971798
Energy: 1.2813117762999364
Energy: 1.0828382698636525
Energy: 1.2813117762999364
Energy: 1.0828382698636525
Energy: 1.2813117762999364
Energy: 1.0828382698636525
Energy: 1.0098294367411047
Energy: 0.9217295240141966
Energy: 1.0098294367395835
Energy: 0.9217295240141966
Energy: 1.0098294367411047
Energy: 0.9217295240141966
Energy: 1.1872103238821063
Energy: 1.117968695739296
Energy: 1.1872103238821063
Energy: 1.117968695739296
Energy: 1.1872103238821063
Energy: 1.117968695739296

minimum gb energy = 0.9210296335075175 eV
minimum distance =  2.21007368085107 Angstroms
sigma value = 9


========================================
theta = 44.00342734889962
========================================

Energy: 1.0144470979734712
Energy: 1.0515898390846328
Energy: 1.0144470979760352
Energy: 1.0515898390795049
Energy: 1.014447097973044
Energy: 1.0515898390863425
Energy: 0.9742204827620632
Energy: 0.9591326134566178
Energy: 0.9742204827616359
Energy: 0.9591326134570454
Energy: 0.9742204827620632
Energy: 0.9591326134566178
Energy: 0.918192639172497
Energy: 1.2372489222010168
Energy: 0.9181926391720698
Energy: 1.2372489222010168
Energy: 0.9181926391733518
Energy: 1.2372489222010168
Energy: 0.8853372906235832
Energy: 0.8539295760315877
Energy: 0.8853372906248654
Energy: 0.8539295760315877
Energy: 0.8853372906248654
Energy: 0.8539295760315877
Energy: 0.9785533265377256
Energy: 1.0589971000702294
Energy: 0.9785533265402897
Energy: 1.0589971000698022
Energy: 0.9785533265377256
Energy: 1.0589971000677043
Energy: 1.01094632405546
Energy: 0.9962579205711084
Energy: 1.010946324058024
Energy: 0.9962579205706811
Energy: 1.0109463240550327
Energy: 0.9962579205711084
Energy: 0.9028209703387394
Energy: 1.0535976972822527
Energy: 0.9028209703400214
Energy: 1.05359769728268
Energy: 0.9028209703387394
Energy: 1.05359769728268
Energy: 0.842509664260336
Energy: 1.0812207786064614
Energy: 0.8425096642624728
Energy: 1.0812207786068886
Energy: 0.8425096642611909
Energy: 1.0812207786068886
Energy: 1.04270644295107
Energy: 1.0634212131714054
Energy: 1.0427064429489334
Energy: 1.0634212131714054
Energy: 1.04270644295107
Energy: 1.063421213170978
Energy: 1.0772368622571973
Energy: 1.1727466350733162
Energy: 1.0772368622597224
Energy: 1.1727466350737437
Energy: 1.077236862258868
Energy: 1.1727466350733162
Energy: 0.8844234757794827
Energy: 0.8577370038359795
Energy: 0.88442347577991
Energy: 0.8577370038364066
Energy: 0.8844234757777732
Energy: 0.8577370038359795
Energy: 1.0607152659866084
Energy: 0.9881807011641944
Energy: 1.0607152659857535
Energy: 0.9881807011641944
Energy: 1.0607152659866084
Energy: 0.9881807011637671
Energy: 1.0150706272568168
Energy: 0.9956774535092792
Energy: 1.015070627255107
Energy: 0.9956774535084244
Energy: 1.0150706272559618
Energy: 0.995677453507997
Energy: 0.9904134861493623
Energy: 0.9059575791100929
Energy: 0.9904134861455548
Energy: 0.905957579108811
Energy: 0.9904134861493623
Energy: 0.9059575791079564
Energy: 0.8646212728123153
Energy: 0.9534845432735959
Energy: 0.8646212728144521
Energy: 0.9534845432753053
Energy: 0.8646212728135974
Energy: 0.95348454327616
Energy: 0.9543819609890812
Energy: 1.0138910866816557
Energy: 0.9543819609873719
Energy: 1.0138910866816557
Energy: 0.9543819609882266
Energy: 1.0138910866816557
Energy: 1.1673735833072927
Energy: 0.8684992565013803
Energy: 1.1673735833072927
Energy: 0.8684992565013803
Energy: 1.1673735833060108
Energy: 0.8684992565000983
Energy: 0.8782879926378473
Energy: 0.9027926980962163
Energy: 0.8782879926305823
Energy: 0.9027926980970711
Energy: 0.8782879926382745
Energy: 0.9027926980962163
Energy: 0.8407217045010222
Energy: 1.2889891762572498
Energy: 0.8407217045010222
Energy: 1.2889891762572498
Energy: 0.8407217044993128
Energy: 1.2889891762572498
Energy: 1.233061942668799
Energy: 1.0291678015726111
Energy: 1.2330619426645644
Energy: 1.0291678015721837
Energy: 1.2330619426692262
Energy: 1.0291678015734658
Energy: 0.840758100206211
Energy: 1.2890755082310714
Energy: 0.8407581002049288
Energy: 1.2890755082314986
Energy: 0.8407581002083475
Energy: 1.2890755082314986
Energy: 0.8783537655578393
Energy: 0.9027613048185302
Energy: 0.8783537655586938
Energy: 0.9027613048189187
Energy: 0.8783537655574118
Energy: 0.9027613048193461
Energy: 1.1674680690131138
Energy: 0.8678884492488641
Energy: 1.1674680690126864
Energy: 0.8678884492488641
Energy: 1.1674680690126864
Energy: 0.8678884492484368
Energy: 0.954218206561148
Energy: 1.064127889572755
Energy: 0.9542182065602932
Energy: 1.0641278895723278
Energy: 0.95421820656243
Energy: 1.0641278895723278
Energy: 0.8646312488538409
Energy: 0.953522539255386
Energy: 0.8646312488538409
Energy: 0.9535225392558133
Energy: 0.8646312488538409
Energy: 0.953522539255386
Energy: 0.9904569396126819
Energy: 0.9941544622648502
Energy: 0.9904569396113999
Energy: 0.9941544622652775
Energy: 0.9904569396131093
Energy: 0.9941544622648502
Energy: 1.0167370935006956
Energy: 0.9959663187677645
Energy: 1.0167370935028324
Energy: 0.9959663187677645
Energy: 1.0167370935028324
Energy: 0.9959663187677645
Energy: 1.060690173779778
Energy: 0.918066597744508
Energy: 1.0606901737793508
Energy: 0.9180665977440806
Energy: 1.060690173779778
Energy: 0.9180665977440806
Energy: 0.8844490321584089
Energy: 0.8576923817931272
Energy: 0.8844490321575541
Energy: 0.8576923817931272
Energy: 0.8844490321579814
Energy: 0.8576923817931272
Energy: 1.077211530541594
Energy: 1.1271479395847526
Energy: 1.0772115305424488
Energy: 1.1271479395847526
Energy: 1.0772115305420213
Energy: 1.1271479395843251
Energy: 1.0430284350176922
Energy: 1.0542033706654457
Energy: 1.0430284350189745
Energy: 1.0542033706654457
Energy: 1.0430284350181196
Energy: 1.0542033706654457
Energy: 0.8425589320928403
Energy: 1.081368542525702
Energy: 0.8425589320915581
Energy: 1.0813685425261292
Energy: 0.8425589320919855
Energy: 1.081368542525702
Energy: 0.9027802239881555
Energy: 1.053162950819583
Energy: 0.9027802239894375
Energy: 1.0531629508191553
Energy: 0.9027802239868734
Energy: 1.05316295082001
Energy: 1.010807633687228
Energy: 0.9962908269468901
Energy: 1.0108076336868006
Energy: 0.9962908269468901
Energy: 1.0108076336863732
Energy: 0.9962908269460354
Energy: 0.9783071767220715
Energy: 1.0011190584257728
Energy: 0.9783071767233534
Energy: 1.0011190584253453
Energy: 0.9783071767229262
Energy: 1.0011190584291914
Energy: 0.885355611427838
Energy: 0.8539553009325687
Energy: 0.8853556114291202
Energy: 0.8539553009317141
Energy: 0.8853556114291202
Energy: 0.8539553009304319
Energy: 0.9181995926636447
Energy: 1.237295603635459
Energy: 0.91819959266279
Energy: 1.2372956036346046
Energy: 0.9181995926644994
Energy: 1.2372956036346046
Energy: 0.9740983124331007
Energy: 0.9591611064816097
Energy: 0.9740983124360922
Energy: 0.9591611064816097
Energy: 0.9740983124343827
Energy: 0.9591611064816097
Energy: 1.014447097973044
Energy: 1.051589839083351
Energy: 1.0144470979756082
Energy: 1.0515898390790772
Energy: 1.0144470979738984
Energy: 1.0515898390816414
Energy: 0.9742204827642
Energy: 1.0782413296658642
Energy: 0.9742204827646274
Energy: 1.0782413296662916
Energy: 0.9742204827633452
Energy: 1.0782413296667188
Energy: 0.918192639175916
Energy: 1.2372489222031535
Energy: 0.9181926391750612
Energy: 1.2372489222031535
Energy: 0.9181926391750612
Energy: 1.237248922203581
Energy: 0.8853372906334123
Energy: 0.8539295760345793
Energy: 0.8853372906291389
Energy: 0.8539295760354338
Energy: 0.8853372906304209
Energy: 0.8539295760341519
Energy: 0.9785533265325975
Energy: 1.058997100073221
Energy: 0.9785533265364437
Energy: 1.058997100073221
Energy: 0.9785533265313153
Energy: 1.0589971000727936

minimum gb energy = 0.8407217044993128 eV
minimum distance =  2.29022180344536 Angstroms
sigma value = 57


========================================
theta = 50.47880364135782
========================================

Energy: 0.4377689855660127
Energy: 0.45218100688813645
Energy: 0.4377689855669855
Energy: 0.45218100688813645
Energy: 0.4377689855660127
Energy: 0.4521810068891092
Energy: 0.553034442349575
Energy: 0.43898238064489725
Energy: 0.553034442349575
Energy: 0.43898238064489725
Energy: 0.553034442349575
Energy: 0.43898238064489725
Energy: 0.4857333975692437
Energy: 0.5533724555694299
Energy: 0.48573339757021655
Energy: 0.5533724555704027
Energy: 0.48573339757021655
Energy: 0.5533724555684572
Energy: 0.45186324958905333
Energy: 0.4373009507878555
Energy: 0.4518632495900261
Energy: 0.4373009507878555
Energy: 0.4518632495900261
Energy: 0.43730095078688275
Energy: 0.5523365372974042
Energy: 0.5603273995332427
Energy: 0.5523365372974042
Energy: 0.5603273995342155
Energy: 0.5523365372983771
Energy: 0.5603273995332427
Energy: 0.4376056188113358
Energy: 0.48665492258584386
Energy: 0.4376056188123086
Energy: 0.48665492258487114
Energy: 0.437605618810363
Energy: 0.48665492258487114
Energy: 0.4376297628018838
Energy: 0.4866505856988551
Energy: 0.4376297628018838
Energy: 0.4866505856988551
Energy: 0.4376297628018838
Energy: 0.4866505856998279
Energy: 0.552406826985006
Energy: 0.5602581305302465
Energy: 0.5524068269840333
Energy: 0.5602581305312193
Energy: 0.552406826985006
Energy: 0.5602581305312193
Energy: 0.45185840349160966
Energy: 0.4372931384437171
Energy: 0.4518584034925824
Energy: 0.4372931384446899
Energy: 0.45185840349160966
Energy: 0.4372931384446899
Energy: 0.4857310792806157
Energy: 0.5535955819901482
Energy: 0.4857310792806157
Energy: 0.5535955819901482
Energy: 0.4857310792796429
Energy: 0.5535955819901482
Energy: 0.5529816903167813
Energy: 0.43882239780321597
Energy: 0.5529816903158086
Energy: 0.4388223978041887
Energy: 0.5529816903167813
Energy: 0.4388223978041887
Energy: 0.4377689855660127
Energy: 0.45218100688813645
Energy: 0.4377689855660127
Energy: 0.45218100688813645
Energy: 0.4377689855660127
Energy: 0.45218100688813645
Energy: 0.5530344423486022
Energy: 0.43898238064489725
Energy: 0.553034442349575
Energy: 0.43898238064489725
Energy: 0.5530344423486022
Energy: 0.43898238064489725
Energy: 0.48573339757021655
Energy: 0.5533724555694299
Energy: 0.48573339757021655
Energy: 0.5533724555713755
Energy: 0.48573339757021655
Energy: 0.5533724555694299
Energy: 0.4518632495900261
Energy: 0.4373009507878555
Energy: 0.4518632495900261
Energy: 0.43730095078688275
Energy: 0.45186324958905333
Energy: 0.43730095078688275
Energy: 0.5523365372974042
Energy: 0.5603273995342155
Energy: 0.5523365372974042
Energy: 0.5603273995342155
Energy: 0.5523365372974042
Energy: 0.5603273995342155
Energy: 0.4376056188113358
Energy: 0.48665492258487114
Energy: 0.437605618810363
Energy: 0.4866549225838983
Energy: 0.4376056188123086
Energy: 0.4866549225838983
Energy: 0.4376297628018838
Energy: 0.4866505856988551
Energy: 0.4376297628018838
Energy: 0.4866505856988551
Energy: 0.43762976280285654
Energy: 0.4866505856988551
Energy: 0.5524068269840333
Energy: 0.5602581305312193
Energy: 0.552406826985006
Energy: 0.5602581305302465
Energy: 0.552406826985006
Energy: 0.5602581305302465

minimum gb energy = 0.4372931384437171 eV
minimum distance =  2.40661948171282 Angstroms
sigma value = 11


========================================
theta = 55.8767054592047
========================================

Energy: 0.8698238094475108
Energy: 1.0240216925692562
Energy: 0.869823809448936
Energy: 1.0240216925692562
Energy: 0.8698238094496485
Energy: 1.0240216925692562
Energy: 0.9698737856931381
Energy: 0.8990355937258637
Energy: 0.9698737856924255
Energy: 0.8990355937272889
Energy: 0.9698737856931381
Energy: 0.8990355937258637
Energy: 0.9274414963813177
Energy: 1.0704370452054623
Energy: 0.9274414963834555
Energy: 1.070437045206175
Energy: 0.9274414963813177
Energy: 1.07043704520475
Energy: 1.0045359765572568
Energy: 0.8213991758086852
Energy: 1.0045359765565443
Energy: 0.8213991758093977
Energy: 1.0045359765572568
Energy: 0.8213991758086852
Energy: 0.8408625150514476
Energy: 0.8446075113268808
Energy: 0.84086251505216
Energy: 0.8446075113268808
Energy: 0.8408625150514476
Energy: 0.8446075113268808
Energy: 0.8644232778930883
Energy: 0.9055063114926369
Energy: 0.8644232778923756
Energy: 0.9055063114947748
Energy: 0.8644232778930883
Energy: 0.9055063114933494
Energy: 0.7806218435604795
Energy: 1.0132754424799355
Energy: 0.7806218435597669
Energy: 1.013275442480648
Energy: 0.7806218435604795
Energy: 1.013275442480648
Energy: 0.9534409083846067
Energy: 0.8034169713041512
Energy: 0.9534409083838943
Energy: 0.8034169713055763
Energy: 0.9534409083846067
Energy: 0.8034169713041512
Energy: 0.9540604986838807
Energy: 0.8283375640997016
Energy: 0.9540604986845934
Energy: 0.8283375640989891
Energy: 0.9540604986860185
Energy: 0.8283375640989891
Energy: 0.7901025981105356
Energy: 1.0784341205988066
Energy: 0.790102598109823
Energy: 1.0784341205988066
Energy: 0.7901025981111834
Energy: 1.0784341205988066
Energy: 1.0664975194280735
Energy: 1.1767041568850507
Energy: 1.0664975194273607
Energy: 1.1767041568850507
Energy: 1.0664975194294986
Energy: 1.1767041568850507
Energy: 0.8423379619501102
Energy: 0.8181104123760995
Energy: 0.8423379619493978
Energy: 0.818110412375387
Energy: 0.8423379619501102
Energy: 0.818110412375387
Energy: 0.8552419160694323
Energy: 0.8353701242504348
Energy: 0.8552419160700803
Energy: 0.835370124249722
Energy: 0.8552419160694323
Energy: 0.835370124249722
Energy: 0.9655478857935293
Energy: 1.040843177944567
Energy: 0.9655478857935293
Energy: 1.040843177944567
Energy: 0.9655478857935293
Energy: 1.0408431779452798
Energy: 0.9617279511491825
Energy: 0.9665016457751422
Energy: 0.9617279511498953
Energy: 0.9665016457751422
Energy: 0.9617279511506079
Energy: 0.9665016457758547
Energy: 0.8787347891975403
Energy: 0.8637754437681862
Energy: 0.8787347891989654
Energy: 0.8637754437674734
Energy: 0.8787347891968278
Energy: 0.8637754437674734
Energy: 0.9568417475574794
Energy: 0.8974287514247892
Energy: 0.9568417475574794
Energy: 0.8974287514240766
Energy: 0.9568417475567668
Energy: 0.8974287514247892
Energy: 1.1258528765785223
Energy: 1.0886279079429138
Energy: 1.1258528765792348
Energy: 1.0886279079429138
Energy: 1.12585287657781
Energy: 1.0886279079422012
Energy: 1.0050883371620858
Energy: 0.8215902990327995
Energy: 1.0050883371613732
Energy: 0.8215902990327995
Energy: 1.0050883371606607
Energy: 0.8215902990327995
Energy: 0.8425010457341808
Energy: 0.9617577043323622
Energy: 0.8425010457327555
Energy: 0.9617577043323622
Energy: 0.8425010457327555
Energy: 0.9617577043323622
Energy: 0.8206557032173867
Energy: 0.903268816919983
Energy: 0.8206557032173867
Energy: 0.9032688169192704
Energy: 0.8206557032173867
Energy: 0.9032688169192704
Energy: 0.9342198813188448
Energy: 0.9787749240190435
Energy: 0.9342198813195574
Energy: 0.9787749240197563
Energy: 0.93421988132027
Energy: 0.9787749240197563
Energy: 0.9560239242601903
Energy: 0.9950493034501471
Energy: 0.9560239242587653
Energy: 0.9950493034494345
Energy: 0.9560239242609029
Energy: 0.9950493034494345
Energy: 1.0488872060270082
Energy: 0.8363332049135661
Energy: 1.048887206029146
Energy: 0.8363332049135661
Energy: 1.0488872060270082
Energy: 0.8363332049135661
Energy: 0.8213569285565869
Energy: 1.0437737986208206
Energy: 0.8213569285537365
Energy: 1.0437737986215332
Energy: 0.8213569285565869
Energy: 1.0437737986208206
Energy: 1.2017720765830762
Energy: 1.0852511706445034
Energy: 1.2017720765823632
Energy: 1.0852511706445034
Energy: 1.2017720765837885
Energy: 1.0852511706452161

minimum gb energy = 0.7806218435597669 eV
minimum distance =  2.22237312893527 Angstroms
sigma value = 41


========================================
theta = 58.99241699313286
========================================

Energy: 0.9647834607598633
Energy: 0.9154487396747557
Energy: 0.9647834607604251
Energy: 0.9154487396747557
Energy: 0.9647834607604251
Energy: 0.9154487396747557
Energy: 1.007389303322048
Energy: 1.02573075574981
Energy: 1.007389303322048
Energy: 1.02573075574981
Energy: 1.007389303322048
Energy: 1.02573075574981
Energy: 0.9318690241164396
Energy: 1.2116278086083128
Energy: 0.9318690241158778
Energy: 1.2116278086088743
Energy: 0.9318690241175628
Energy: 1.2116278086088743
Energy: 0.9352239585855258
Energy: 0.9039480587532287
Energy: 0.9352239585866491
Energy: 0.9039480587532287
Energy: 0.9352239585872107
Energy: 0.9039480587537904
Energy: 0.8881837905374409
Energy: 0.9348874056066407
Energy: 0.8881837905363178
Energy: 0.9348874056072023
Energy: 0.8881837905374409
Energy: 0.9348874056072023
Energy: 0.9526191862028759
Energy: 1.0881845686154974
Energy: 0.9526191862000677
Energy: 1.0881845686149356
Energy: 0.9526191862028759
Energy: 1.0881845686154974
Energy: 0.8814812588260461
Energy: 1.0532118241004735
Energy: 0.8814812588254846
Energy: 1.0532118241027202
Energy: 0.8814812588237996
Energy: 1.0532118241010353
Energy: 0.9251408023040492
Energy: 0.9038902227574578
Energy: 0.9251408023068575
Energy: 0.9038902227580194
Energy: 0.9251408023057341
Energy: 0.9038902227574578
Energy: 0.9117821620169325
Energy: 0.9285492499570651
Energy: 0.911782162016371
Energy: 0.9285492499570651
Energy: 0.9117821620152476
Energy: 0.9285492499570651
Energy: 0.9387139635527281
Energy: 1.0526767094339007
Energy: 0.9387139635521665
Energy: 1.052676709433339
Energy: 0.9387139635521665
Energy: 1.052676709433339
Energy: 0.9474277462553415
Energy: 1.0418423770075063
Energy: 0.9474277462559033
Energy: 1.0418423770075063
Energy: 0.9474277462553415
Energy: 1.0418423770075063
Energy: 0.9074427311881302
Energy: 0.9109484423521987
Energy: 0.9074427311864454
Energy: 0.9109484423516371
Energy: 0.9074427311875687
Energy: 0.9109484423499523
Energy: 0.9211564216607798
Energy: 0.9046438673024569
Energy: 0.9211564216613414
Energy: 0.9046438673035802
Energy: 0.9211564216613414
Energy: 0.9046438673024569
Energy: 0.8428021709580695
Energy: 1.0365399440357885
Energy: 0.8428021709580695
Energy: 1.036539944036912
Energy: 0.8428021709580695
Energy: 1.0365399440363503
Energy: 0.9356918345472038
Energy: 0.9734626144646498
Energy: 0.9356918345455189
Energy: 0.9734626144652115
Energy: 0.935691834549961
Energy: 0.9734626144652115
Energy: 0.8882515636880922
Energy: 0.9777882911665319
Energy: 0.8882515636875304
Energy: 0.9777882911670934
Energy: 0.8882515636869688
Energy: 0.9777882911670934
Energy: 0.9221893072288678
Energy: 0.9045198309545782
Energy: 0.9221893072288678
Energy: 0.9045198309545782
Energy: 0.9221893072288678
Energy: 0.9045198309545782
Energy: 0.9314476569392949
Energy: 1.2132463113378618
Energy: 0.9314476569387331
Energy: 1.2132463113378618
Energy: 0.9314476569392949
Energy: 1.2132463113373
Energy: 0.984180165340579
Energy: 1.0176457173080082
Energy: 0.9841801653394557
Energy: 1.0176457173080082
Energy: 0.984180165340579
Energy: 1.0176457173080082
Energy: 0.9515598152247036
Energy: 0.9203221169725697
Energy: 0.9515598152247036
Energy: 0.9203221169736929
Energy: 0.9515598152247036
Energy: 0.9203221169725697
Energy: 0.9117253878276886
Energy: 1.0739383022301716
Energy: 0.9117253878288119
Energy: 1.0739383022301716
Energy: 0.9117253878276886
Energy: 1.0739383022301716
Energy: 0.9356174851211645
Energy: 1.2009263240275587
Energy: 0.9356174851211645
Energy: 1.2009263240275587
Energy: 0.9356174851200413
Energy: 1.2009263240275587
Energy: 0.9353132379233967
Energy: 0.8931932055322043
Energy: 0.93531323792452
Energy: 0.8931932055322043
Energy: 0.9353132379233967
Energy: 0.8931932055316427
Energy: 0.8889045446947905
Energy: 1.0890908559385057
Energy: 0.8889045446931056
Energy: 1.0890908559385057
Energy: 0.8889045446947905
Energy: 1.0890908559385057
Energy: 0.8917961519567535
Energy: 1.0866103070301232
Energy: 0.891796151957877
Energy: 1.0866103070301232
Energy: 0.8917961519573152
Energy: 1.0866103070301232
Energy: 0.8737286794241486
Energy: 0.874850259424321
Energy: 0.8737286794235869
Energy: 0.874850259424321
Energy: 0.8737286794247103
Energy: 0.8748502594248827
Energy: 0.8823929763416619
Energy: 0.8921074100299275
Energy: 0.882392976339977
Energy: 0.8921074100304892
Energy: 0.8823929763416619
Energy: 0.8921074100304892
Energy: 0.9118607438448973
Energy: 0.9392900946462309
Energy: 0.9118607438482671
Energy: 0.939290094644546
Energy: 0.9118607438454588
Energy: 0.9392900946467927
Energy: 0.9357026381511369
Energy: 0.9107987117643663
Energy: 0.9357026381528216
Energy: 0.9107987117643663
Energy: 0.9357026381511369
Energy: 0.9107987117654897
Energy: 1.1123214974074742
Energy: 0.8493662217737028
Energy: 1.112321497409159
Energy: 0.8493662217742644
Energy: 1.1123214974074742
Energy: 0.8493662217737028
Energy: 0.8696516217947309
Energy: 0.8791480295871176
Energy: 0.8696516217964159
Energy: 0.8791480295882407
Energy: 0.8696516217958541
Energy: 0.8791480295882407
Energy: 0.923155848827748
Energy: 0.9075749817068199
Energy: 0.9231558488283097
Energy: 0.9075749817068199
Energy: 0.9231558488288713
Energy: 0.9075749817062584
Energy: 0.8918296496650412
Energy: 1.0075113749824458
Energy: 0.8918296496627945
Energy: 1.007511374981884
Energy: 0.8918296496639179
Energy: 1.007511374981884

minimum gb energy = 0.8428021709580695 eV
minimum distance =  2.22805360307742 Angstroms
sigma value = 33


========================================
theta = 62.439396894736774
========================================

Energy: 0.9948981525434774
Energy: 0.9466794135944152
Energy: 0.9948981525434774
Energy: 0.946679413595562
Energy: 0.9948981525431191
Energy: 0.9466794135939853
Energy: 1.0361249985824688
Energy: 0.9488136083658991
Energy: 1.0361249985821104
Energy: 0.9488136083651109
Energy: 1.0361249985844756
Energy: 0.9488136083658991
Energy: 0.9999134623883673
Energy: 1.148839059304343
Energy: 0.9999134623930973
Energy: 1.1488390593035545
Energy: 0.9999134623891556
Energy: 1.1488390593039846
Energy: 1.069909468039779
Energy: 0.9489064426398682
Energy: 1.069909468040209
Energy: 0.9489064426402266
Energy: 1.0699094680417855
Energy: 0.9489064426398682
Energy: 0.9419127417411945
Energy: 0.9165798350336835
Energy: 0.9419127417372528
Energy: 0.9165798350372669
Energy: 0.9419127417399761
Energy: 0.9165798350352602
Energy: 1.1071918863779926
Energy: 0.9208417910073932
Energy: 1.107191886377563
Energy: 0.9208417910073932
Energy: 1.1071918863791392
Energy: 0.9208417910073932
Energy: 1.064507037279004
Energy: 1.0538401007726332
Energy: 1.0645070372809389
Energy: 1.0538401007729914
Energy: 1.064507037279004
Energy: 1.0538401007737799
Energy: 1.084361534024003
Energy: 1.0230207009707788
Energy: 1.0843615340247912
Energy: 1.0230207009723555
Energy: 1.0843615340235728
Energy: 1.0230207009719254
Energy: 0.9797119973375628
Energy: 0.9686612602220032
Energy: 0.9797119973351978
Energy: 0.9686612602220032
Energy: 0.9797119973351978
Energy: 0.9686612602212148
Energy: 1.1536398802267092
Energy: 0.9407518743824753
Energy: 1.1536398802279275
Energy: 0.9407518743824753
Energy: 1.1536398802243442
Energy: 0.9407518743824753
Energy: 1.0734603597289614
Energy: 1.0751419005171714
Energy: 1.0734603597269547
Energy: 1.0751419005191063
Energy: 1.0734603597289614
Energy: 1.0751419005171714
Energy: 0.9927067232263116
Energy: 0.9478492423264162
Energy: 0.9927067232384947
Energy: 0.9478492423264162
Energy: 0.9927067232313997
Energy: 0.9478492423256277
Energy: 0.9713051622733362
Energy: 0.9807889271025579
Energy: 0.9713051622745544
Energy: 0.9807889271041345
Energy: 0.9713051622741246
Energy: 0.9807889271057111
Energy: 1.1076958570469568
Energy: 1.0850269811459465
Energy: 1.1076958570469568
Energy: 1.0850269811459465
Energy: 1.107695857047745
Energy: 1.0850269811455167
Energy: 1.12118786259512
Energy: 1.0765220148584242
Energy: 1.1211878625954783
Energy: 1.0765220148584242
Energy: 1.1211878625927547
Energy: 1.076522014858066
Energy: 0.9682537913302705
Energy: 1.124208038381716
Energy: 0.968253791329482
Energy: 1.124208038381286
Energy: 0.968253791331417
Energy: 1.1242080383828625
Energy: 0.977428312211291
Energy: 0.9440197944172621
Energy: 0.977428312211291
Energy: 0.9440197944180504
Energy: 0.9774283122235459
Energy: 0.9440197944172621
Energy: 0.9461675011213868
Energy: 1.067811130503739
Energy: 0.9461675011229633
Energy: 1.0678111305033806
Energy: 0.9461675011210284
Energy: 1.0678111305033806
Energy: 1.1467609322132177
Energy: 1.3567234991014823
Energy: 1.1467609322119996
Energy: 1.356723499101052
Energy: 1.1467609322119996
Energy: 1.356723499101052
Energy: 1.2192603984072117
Energy: 0.972839967866502
Energy: 1.219260398405635
Energy: 0.9728399678661437
Energy: 1.2192603984064232
Energy: 0.9728399678669318
Energy: 0.9473933285579741
Energy: 0.9952938140018931
Energy: 0.9473933285576158
Energy: 0.9952938140026814
Energy: 0.9473933285576158
Energy: 0.9952938140018931
Energy: 0.9505092341307371
Energy: 1.0372440964395602
Energy: 0.9505092341307371
Energy: 1.0372440964411367
Energy: 0.9505092341311672
Energy: 1.0372440964371952
Energy: 1.1076477187810514
Energy: 0.9296078408482981
Energy: 1.1076477187791163
Energy: 0.9296078408479398
Energy: 1.107647718780693
Energy: 0.9296078408479398
Energy: 0.9464551526137865
Energy: 0.9723575668805718
Energy: 0.9464551526122098
Energy: 0.9723575668801419
Energy: 0.9464551526126399
Energy: 0.9723575668829368
Energy: 0.9173878051171783
Energy: 0.9441943096747968
Energy: 0.9173878051175366
Energy: 0.9441943096740085
Energy: 0.9173878051195432
Energy: 0.9441943096740085
Energy: 0.9199608289027756
Energy: 1.024262202688415
Energy: 0.9199608289027756
Energy: 1.0242622026978752
Energy: 0.9199608289035641
Energy: 1.0242622027046118
Energy: 1.0398896270712226
Energy: 1.0645740730898745
Energy: 1.0398896270696458
Energy: 1.0645740730898745
Energy: 1.0398896270712226
Energy: 1.0645740730898745
Energy: 0.9903229140670179
Energy: 0.9504814570816198
Energy: 0.9903229140693829
Energy: 0.9504814570816198
Energy: 0.9903229140673762
Energy: 0.9504814570816198
Energy: 0.9721499983888273
Energy: 0.9808801654561149
Energy: 0.9721499983872505
Energy: 0.9808801654565449
Energy: 0.9721499983892571
Energy: 0.9808801654565449
Energy: 0.9453762310287122
Energy: 1.1590805548995649
Energy: 0.9453762310291421
Energy: 1.1590805548995649
Energy: 0.9453762310299305
Energy: 1.1590805548995649
Energy: 1.0656726006896213
Energy: 0.9195378505239046
Energy: 1.0656726006900512
Energy: 0.9195378505239046
Energy: 1.0656726006896213
Energy: 0.9195378505223281
Energy: 0.9463738130371856
Energy: 0.9933431319952624
Energy: 0.9463738130384038
Energy: 0.9933431319987738
Energy: 0.9463738130371856
Energy: 0.9933431319908904
Energy: 0.9862969699979914
Energy: 0.9736341717268913
Energy: 0.9862969700082398
Energy: 0.9736341717268913
Energy: 0.9862969700093864
Energy: 0.9736341717273214
Energy: 1.084364970880176
Energy: 1.1084927317005882
Energy: 1.0843649708793874
Energy: 1.1084927316998
Energy: 1.084364970880176
Energy: 1.10849273170023
Energy: 1.0866631366853727
Energy: 1.1071029872013998
Energy: 1.0866631366826494
Energy: 1.1071029872013998
Energy: 1.0866631366850146
Energy: 1.1071029872021878
Energy: 0.9692604681001159
Energy: 0.9736376641577206
Energy: 0.9692604681084291
Energy: 0.9736376641573622
Energy: 0.9692604681032693
Energy: 0.9736376641569322
Energy: 0.946359121789052
Energy: 0.973001773772354
Energy: 0.9463591217918469
Energy: 0.9730017737767257
Energy: 0.9463591217906285
Energy: 0.973001773777514
Energy: 1.065893845527295
Energy: 0.919810084999605
Energy: 1.065893845527295
Energy: 0.919810084999605
Energy: 1.0658938455276534
Energy: 0.9198100849992468
Energy: 0.9450891166877802
Energy: 1.1591499724078784
Energy: 0.9450891166846269
Energy: 1.1591499724078784
Energy: 0.9450891166857737
Energy: 1.1591499724078784
Energy: 0.9720867781975512
Energy: 0.9809096862842626
Energy: 0.9720867781947562
Energy: 0.980909686283116
Energy: 0.9720867781955445
Energy: 0.9809096862826858
Energy: 0.990274155786855
Energy: 0.9505007014498384
Energy: 0.9902741557872133
Energy: 0.9505007014490502
Energy: 0.9902741557875717
Energy: 0.9505007014490502
Energy: 1.0397175880275853
Energy: 1.0645936821455837
Energy: 1.03971758802995
Energy: 1.0645936821452255
Energy: 1.0397175880288034
Energy: 1.0645936821455837
Energy: 0.9199583038035284
Energy: 1.0248286900722592
Energy: 0.9199583038063234
Energy: 1.0248286900698942
Energy: 0.9199583038023819
Energy: 1.0248286900675292
Energy: 0.9174829229331835
Energy: 0.9442046767470603
Energy: 0.9174829229296717
Energy: 0.9442046767478485
Energy: 0.9174829229320368
Energy: 0.9442046767474901
Energy: 0.9465163765972557
Energy: 0.9721507617863986
Energy: 0.9465163765964673
Energy: 0.9721507617863986
Energy: 0.9465163765972557
Energy: 0.9721507617852518
Energy: 1.1079478322983876
Energy: 0.9298363450751476
Energy: 1.107947832298746
Energy: 0.9298363450747893
Energy: 1.107947832299176
Energy: 0.9298363450759359
Energy: 0.9505245297808763
Energy: 1.0373736542321745
Energy: 0.9505245297840297
Energy: 1.0373736542325331
Energy: 0.9505245297843881
Energy: 1.0373736542317447

minimum gb energy = 0.9165798350336835 eV
minimum distance =  2.21892028856407 Angstroms
sigma value = 67


========================================
theta = 70.52877936550931
========================================

Energy: 0.962237266007138
Energy: 0.9795758415176905
Energy: 0.962237266007138
Energy: 0.9795758415176905
Energy: 0.962237266007138
Energy: 0.9795758415176905
Energy: 0.9536496175855309
Energy: 0.7795739172725485
Energy: 0.9536496175855309
Energy: 0.7795739172725485
Energy: 0.9536496175855309
Energy: 0.7795739172725485
Energy: 1.042747448885423
Energy: 1.426274363586241
Energy: 1.042747448885423
Energy: 1.426274363586241
Energy: 1.042747448885423
Energy: 1.426274363586241
Energy: 0.95362636332084
Energy: 0.7796945648021175
Energy: 0.95362636332084
Energy: 0.7796945648021175
Energy: 0.95362636332084
Energy: 0.7796945648021175
Energy: 0.9622372660045038
Energy: 0.9795758415150563
Energy: 0.9622372660045038
Energy: 0.9795758415150563
Energy: 0.9622372660045038
Energy: 0.9795758415150563
Energy: 0.9536496175881652
Energy: 0.7795739172725485
Energy: 0.9536496175881652
Energy: 0.7795739172725485
Energy: 0.9536496175855309
Energy: 0.7795739172725485
Energy: 1.042747448885423
Energy: 1.426274363586241
Energy: 1.0427474488827886
Energy: 1.426274363586241
Energy: 1.042747448885423
Energy: 1.426274363586241

minimum gb energy = 0.7795739172725485 eV
minimum distance =  2.30982323250414 Angstroms
sigma value = 3


========================================
theta = 77.88488253796277
========================================

Energy: 1.173475452403487
Energy: 1.126000292356025
Energy: 1.1734754524070716
Energy: 1.126000292356025
Energy: 1.1734754524070716
Energy: 1.126000292356025
Energy: 1.1386623534814795
Energy: 1.0884783329505001
Energy: 1.1386623534850644
Energy: 1.0884783329505001
Energy: 1.1386623534850644
Energy: 1.0884783329505001
Energy: 1.0507355325791738
Energy: 1.3144998667068502
Energy: 1.0507355325827585
Energy: 1.3144998667068502
Energy: 1.0507355325827585
Energy: 1.3144998667032652
Energy: 1.1633099442033832
Energy: 1.1464570771699896
Energy: 1.1633099441997983
Energy: 1.1464570771699896
Energy: 1.163309944206968
Energy: 1.1464570771699896
Energy: 1.0880323048147584
Energy: 1.1309376970405058
Energy: 1.0880323048147584
Energy: 1.1309376970405058
Energy: 1.0880323048147584
Energy: 1.1309376970405058
Energy: 1.047278237020741
Energy: 1.1476173400260328
Energy: 1.047278237020741
Energy: 1.1476173400260328
Energy: 1.047278237020741
Energy: 1.1476173400260328
Energy: 1.1073241054675573
Energy: 1.2080586524542791
Energy: 1.1073241054639726
Energy: 1.2080586524542791
Energy: 1.1073241054639726
Energy: 1.2080586524542791
Energy: 1.0890395158674944
Energy: 1.1353979639554541
Energy: 1.0890395158674944
Energy: 1.1353979639554541
Energy: 1.0890395158674944
Energy: 1.1353979639554541
Energy: 1.1153801989462266
Energy: 1.1332637433402457
Energy: 1.1153801989462266
Energy: 1.1332637433402457
Energy: 1.1153801989462266
Energy: 1.1332637433402457
Energy: 1.1076119470031955
Energy: 1.2324994601697734
Energy: 1.1076119470067802
Energy: 1.2324994601697734
Energy: 1.1076119470031955
Energy: 1.2324994601697734
Energy: 1.2356887536555445
Energy: 1.257638149800091
Energy: 1.2356887536555445
Energy: 1.257638149800091
Energy: 1.2356887536519596
Energy: 1.257638149800091
Energy: 1.0875289129567753
Energy: 1.0803521925314437
Energy: 1.0875289129567753
Energy: 1.0803521925278585
Energy: 1.0875289129639452
Energy: 1.0803521925314437
Energy: 1.1598414831728603
Energy: 1.1131262963458972
Energy: 1.1598414831764452
Energy: 1.1131262963458972
Energy: 1.1598414831728603
Energy: 1.1131262963458972
Energy: 1.1809775877815885
Energy: 1.2899962368917073
Energy: 1.1809775877815885
Energy: 1.2899962368917073
Energy: 1.1809775877815885
Energy: 1.2899962368917073
Energy: 1.331027299324924
Energy: 1.1566168039384674
Energy: 1.3310272993213392
Energy: 1.1566168039384674
Energy: 1.3310272993213392
Energy: 1.1566168039384674
Energy: 1.1720022000308634
Energy: 1.1058475695033854
Energy: 1.1720022000308634
Energy: 1.1058475695033854
Energy: 1.1720022000308634
Energy: 1.1058475695033854
Energy: 1.1856423010645034
Energy: 1.078620654512259
Energy: 1.1856423010645034
Energy: 1.078620654512259
Energy: 1.1856423010645034
Energy: 1.078620654512259
Energy: 1.1276121590138704
Energy: 1.3447586111806094
Energy: 1.1276121590138704
Energy: 1.3447586111806094
Energy: 1.1276121590138704
Energy: 1.3447586111806094
Energy: 1.2250048636192756
Energy: 1.0413829239204808
Energy: 1.2250048636228605
Energy: 1.0413829239240657
Energy: 1.2250048636228605
Energy: 1.0413829239204808
Energy: 1.0874656687129685
Energy: 1.1744335082188233
Energy: 1.0874656687201383
Energy: 1.1744335082188233
Energy: 1.0874656687165534
Energy: 1.1744335082188233
Energy: 1.1464072638386356
Energy: 1.1490004839349137
Energy: 1.1464072638386356
Energy: 1.1490004839349137
Energy: 1.1464072638386356
Energy: 1.1490004839349137
Energy: 1.1138933020566744
Energy: 1.3097594329698743
Energy: 1.1138933020530897
Energy: 1.3097594329698743
Energy: 1.1138933020566744
Energy: 1.3097594329698743
Energy: 1.30392381682635
Energy: 1.0124333631380542
Energy: 1.3039238168228304
Energy: 1.0124333631380542
Energy: 1.3039238168228304
Energy: 1.0124333631380542
Energy: 1.1384615496429613
Energy: 1.2231441642451586
Energy: 1.1384615496429613
Energy: 1.2231441642451586
Energy: 1.1384615496429613
Energy: 1.2231441642523284
Energy: 1.147870206080019
Energy: 1.1489936375787708
Energy: 1.147870206080019
Energy: 1.1489936375787708
Energy: 1.147870206080019
Energy: 1.1489936375787708
Energy: 1.1780406775514354
Energy: 1.232884518698741
Energy: 1.1780406775514354
Energy: 1.232884518698741
Energy: 1.1780406775514354
Energy: 1.232884518698741
Energy: 1.2422247228832546
Energy: 1.099060225855034
Energy: 1.2422247228832546
Energy: 1.099060225855034
Energy: 1.2422247228832546
Energy: 1.099060225855034
Energy: 1.1551634309779588
Energy: 1.1216175139319742
Energy: 1.1551634309779588
Energy: 1.1216175139319742
Energy: 1.1551634309779588
Energy: 1.1216175139319742
Energy: 1.1643829827422558
Energy: 1.0786860254063368
Energy: 1.1643829827422558
Energy: 1.0786860254063368
Energy: 1.1643829827422558
Energy: 1.0786860254063368
Energy: 1.2650524942672787
Energy: 1.0464624947382086
Energy: 1.2650524942636938
Energy: 1.0464624947382086
Energy: 1.2650524942672787
Energy: 1.0464624947346237
Energy: 1.3129393934730182
Energy: 1.143800597847943
Energy: 1.3129393934730182
Energy: 1.143800597847943
Energy: 1.3129393934730182
Energy: 1.143800597847943
Energy: 1.1706576391700665
Energy: 1.0922813594043899
Energy: 1.1706576391664814
Energy: 1.0922813594079748
Energy: 1.1706576391664814
Energy: 1.0922813594079748
Energy: 1.1571873442200165
Energy: 1.1169792900151079
Energy: 1.1571873442236014
Energy: 1.1169792900151079
Energy: 1.1571873442200165
Energy: 1.1169792900186928
Energy: 1.3090806632088903
Energy: 1.101268798397493
Energy: 1.3090806632088903
Energy: 1.101268798397493
Energy: 1.3090806632088903
Energy: 1.101268798397493
Energy: 1.1384165290564972
Energy: 1.2305029634338485
Energy: 1.1384165290529125
Energy: 1.2305029634338485
Energy: 1.1384165290564972
Energy: 1.2305029634338485
Energy: 1.1629517917091956
Energy: 1.1493570615720075
Energy: 1.1629517917163654
Energy: 1.1493570615720075
Energy: 1.1629517917091956
Energy: 1.1493570615720075
Energy: 1.136892378478104
Energy: 1.1397869830097944
Energy: 1.136892378478104
Energy: 1.1397869830097944
Energy: 1.136892378478104
Energy: 1.1397869830097944
Energy: 1.3640618749227247
Energy: 1.0234299164314038
Energy: 1.3640618749263096
Energy: 1.0234299164314038
Energy: 1.3640618749227247
Energy: 1.0234299164314038
Energy: 1.02880504102231
Energy: 1.3499706079352032
Energy: 1.02880504102231
Energy: 1.3499706079316183
Energy: 1.02880504102231
Energy: 1.3499706079352032
Energy: 1.1499454491286116
Energy: 1.1493420584018306
Energy: 1.1499454491286116
Energy: 1.1493420584018306
Energy: 1.1499454491286116
Energy: 1.1493420584018306
Energy: 1.0903115527367842
Energy: 1.141844420980195
Energy: 1.0903115527367842
Energy: 1.141844420980195
Energy: 1.0903115527367842
Energy: 1.141844420980195
Energy: 1.4040896913849228
Energy: 1.1075491471253516
Energy: 1.4040896913920926
Energy: 1.1075491471253516
Energy: 1.4040896913885077
Energy: 1.1075491471253516
Energy: 1.1079387689743643
Energy: 1.3440083939706033
Energy: 1.1079387689743643
Energy: 1.344008393974188
Energy: 1.107938768977949
Energy: 1.3440083939706033
Energy: 1.1908726264471592
Energy: 1.0939476845235039
Energy: 1.190872626450744
Energy: 1.0939476845235039
Energy: 1.1908726264471592
Energy: 1.0939476845270888
Energy: 1.175361436973503
Energy: 1.1293636483867564
Energy: 1.175361436973503
Energy: 1.1293636483867564
Energy: 1.175361436977088
Energy: 1.1293636483867564
Energy: 1.3098665786114474
Energy: 1.1844716022693107
Energy: 1.3098665786114474
Energy: 1.1844716022693107
Energy: 1.3098665786114474
Energy: 1.1844716022693107
Energy: 1.07061957269077
Energy: 1.2898452778474063
Energy: 1.070619572687185
Energy: 1.2898452778474063
Energy: 1.070619572687185
Energy: 1.2898452778474063
Energy: 1.1607347646954564
Energy: 1.1160687869505022
Energy: 1.1607347646954564
Energy: 1.1160687869505022
Energy: 1.1607347646954564
Energy: 1.1160687869505022
Energy: 1.0904292917439293
Energy: 1.1343652014056709
Energy: 1.0904292917475142
Energy: 1.1343652014056709
Energy: 1.0904292917439293
Energy: 1.1343652014056709
Energy: 1.2320245789020448
Energy: 1.2770982751649733
Energy: 1.2320245789020448
Energy: 1.2770982751649733
Energy: 1.2320245789020448
Energy: 1.2770982751685582
Energy: 1.067335366382243
Energy: 1.2347609533517494
Energy: 1.067335366382243
Energy: 1.2347609533517494
Energy: 1.067335366382243
Energy: 1.2347609533517494

minimum gb energy = 1.0124333631380542 eV
minimum distance =  2.13415264664725 Angstroms
sigma value = 81


========================================
theta = 80.63108442154517
========================================

Energy: 1.0233892809968235
Energy: 1.0192471815809163
Energy: 1.0233892809968235
Energy: 1.0192471815809163
Energy: 1.0233892809968235
Energy: 1.0192471815814084
Energy: 0.9531820819882243
Energy: 1.108361691944207
Energy: 0.9531820819877324
Energy: 1.1083616919432229
Energy: 0.9531820819897006
Energy: 1.1083616919427308
Energy: 1.2143440427257635
Energy: 1.319820594526839
Energy: 1.2143440427262553
Energy: 1.319820594526839
Energy: 1.2143440427262553
Energy: 1.319820594526839
Energy: 1.1291751602313307
Energy: 1.1916768774274726
Energy: 1.1291751602308389
Energy: 1.1916768774274726
Energy: 1.129175160231823
Energy: 1.1916768774279647
Energy: 1.166495163713678
Energy: 1.1925434361778693
Energy: 1.166495163713678
Energy: 1.1925434361778693
Energy: 1.166495163713678
Energy: 1.1925434361778693
Energy: 1.0189519121386117
Energy: 1.129572751619275
Energy: 1.0189519121381196
Energy: 1.129572751619767
Energy: 1.0189519121381196
Energy: 1.129572751619275
Energy: 1.1004797184871462
Energy: 1.097172879420959
Energy: 1.1004797184856703
Energy: 1.0971728794199749
Energy: 1.1004797184851784
Energy: 1.097172879420959
Energy: 1.0991216213604702
Energy: 1.1935148566198404
Energy: 1.0991216213599782
Energy: 1.1935148566173803
Energy: 1.0991216213604702
Energy: 1.1935148566188563
Energy: 1.0905328350349954
Energy: 1.0907724864570565
Energy: 1.0905328350354873
Energy: 1.0907724864560722
Energy: 1.0905328350359793
Energy: 1.0907724864565642
Energy: 1.091172696709061
Energy: 1.4468808461466725
Energy: 1.0911726967070927
Energy: 1.4468808461471643
Energy: 1.0911726967080768
Energy: 1.4468808461471643
Energy: 1.098950398138014
Energy: 1.0983162752702962
Energy: 1.0989503981370299
Energy: 1.0983162752698041
Energy: 1.0989503981389979
Energy: 1.0983162752698041
Energy: 1.0246824595486206
Energy: 1.0191623817316546
Energy: 1.0246824595491124
Energy: 1.0191623817321467
Energy: 1.0246824595491124
Energy: 1.0191623817316546
Energy: 1.0064804767311153
Energy: 1.1140558266241534
Energy: 1.0064804767316071
Energy: 1.1140558266221854
Energy: 1.0064804767316071
Energy: 1.1140558266246454
Energy: 1.192116145061772
Energy: 1.3171009026238412
Energy: 1.1921161450622642
Energy: 1.3171009026233493
Energy: 1.1921161450632483
Energy: 1.3171009026233493
Energy: 1.317497045386491
Energy: 1.0965606206821918
Energy: 1.3174970453855068
Energy: 1.0965606206821918
Energy: 1.3174970453859989
Energy: 1.096560620682684
Energy: 1.1081027323394645
Energy: 0.973377937495814
Energy: 1.1081027323394645
Energy: 0.9733779374938458
Energy: 1.1081027323399566
Energy: 0.9733779374953219
Energy: 1.0238671031286228
Energy: 1.025905118974372
Energy: 1.023867103129115
Energy: 1.025905118974372
Energy: 1.023867103129115
Energy: 1.025905118974864
Energy: 0.9818415215102525
Energy: 1.050011067588156
Energy: 0.9818415215092684
Energy: 1.050011067588156
Energy: 0.9818415215107444
Energy: 1.0500110675876642
Energy: 1.31619352378377
Energy: 1.2180087301797136
Energy: 1.31619352378377
Energy: 1.2180087301802054
Energy: 1.316193523784754
Energy: 1.2180087301802054
Energy: 1.0925677280916222
Energy: 1.0954154075644846
Energy: 1.092567728090638
Energy: 1.0954154075639926
Energy: 1.092567728090146
Energy: 1.0954154075639926
Energy: 1.1954954832984166
Energy: 1.1141823516232774
Energy: 1.1954954832989084
Energy: 1.1141823516257374
Energy: 1.1954954832984166
Energy: 1.1141823516262295
Energy: 1.1305865560655026
Energy: 1.0949788791270632
Energy: 1.1305865560640265
Energy: 1.094978879126571
Energy: 1.1305865560640265
Energy: 1.094978879126571
Energy: 1.1305457986162089
Energy: 1.0949856650710243
Energy: 1.1305457986167007
Energy: 1.0949856650715164
Energy: 1.1305457986167007
Energy: 1.0949856650715164
Energy: 1.195468205915022
Energy: 1.1145007911342184
Energy: 1.195468205913054
Energy: 1.1145007911342184
Energy: 1.195468205914038
Energy: 1.1145007911332343
Energy: 1.0925732588679218
Energy: 1.0954297710295626
Energy: 1.0925732588679218
Energy: 1.0954297710300545
Energy: 1.0925732588684138
Energy: 1.0954297710300545
Energy: 1.3163881545905336
Energy: 1.2180074828848382
Energy: 1.3163881545905336
Energy: 1.2180074828853302
Energy: 1.3163881545920095
Energy: 1.2180074828853302
Energy: 0.9817496741940348
Energy: 1.0508408557452869
Energy: 0.9817496741950187
Energy: 1.0508408557452869
Energy: 0.9817496741930508
Energy: 1.0508408557452869
Energy: 1.0239201451165478
Energy: 1.025926923891569
Energy: 1.0239201451161004
Energy: 1.025926923891077
Energy: 1.0239201451170399
Energy: 1.025926923891077
Energy: 1.0991051195946016
Energy: 0.9737245197224886
Energy: 1.0991051195960777
Energy: 0.9737245197264249
Energy: 1.0991051195941097
Energy: 0.9737245197219967
Energy: 1.317687050447129
Energy: 1.0962494970350953
Energy: 1.317687050447129
Energy: 1.0962494970360794
Energy: 1.317687050447129
Energy: 1.0962494970360794
Energy: 1.1920733507469996
Energy: 1.3168698551939204
Energy: 1.1920733507474919
Energy: 1.3168698551934284
Energy: 1.1920733507469996
Energy: 1.3168698551934284
Energy: 0.9526143615770851
Energy: 1.1137316537977762
Energy: 0.9526143615770851
Energy: 1.1137316537977762
Energy: 0.9526143615770851
Energy: 1.1137316537977762
Energy: 1.0245675244153065
Energy: 1.0190213630243448
Energy: 1.0245675244157986
Energy: 1.0190213630253289
Energy: 1.0245675244157986
Energy: 1.0190213630253289
Energy: 1.0992074251325872
Energy: 1.098189195031789
Energy: 1.099207425131111
Energy: 1.098189195031297
Energy: 1.0992074251320954
Energy: 1.098189195031297
Energy: 1.0911961410300854
Energy: 1.4469461358032625
Energy: 1.0911961410295936
Energy: 1.4469461358037543
Energy: 1.0911961410305775
Energy: 1.4469461358037543
Energy: 1.0905287082227348
Energy: 1.0907935150429562
Energy: 1.090528708221259
Energy: 1.0907935150424644
Energy: 1.0905287082222428
Energy: 1.0907935150429562
Energy: 1.0987028511120378
Energy: 1.1933884549545055
Energy: 1.0987028511100696
Energy: 1.1933884549554896
Energy: 1.098702851111054
Energy: 1.1933884549545055
Energy: 1.1004776839394903
Energy: 1.097092065990005
Energy: 1.1004776839394903
Energy: 1.0970920659904972
Energy: 1.1004776839394903
Energy: 1.097092065990005

minimum gb energy = 0.9526143615770851 eV
minimum distance =  2.26255177277264 Angstroms
sigma value = 43


========================================
theta = 82.945868617881
========================================

Energy: 1.1755178877832628
Energy: 1.148409707049302
Energy: 1.1755178877826586
Energy: 1.148409707049302
Energy: 1.1755178877832628
Energy: 1.1484097070499064
Energy: 1.1674690025147172
Energy: 1.0877569999685281
Energy: 1.1674690025147172
Energy: 1.0877569999685281
Energy: 1.1674690025153216
Energy: 1.0877569999691326
Energy: 1.0652960877590807
Energy: 1.3100056579572075
Energy: 1.0652960877572675
Energy: 1.3100056579578117
Energy: 1.0652960877578717
Energy: 1.3100056579572075
Energy: 1.1458179703913085
Energy: 1.1405351663107695
Energy: 1.1458179703913085
Energy: 1.1405351663107695
Energy: 1.1458179703913085
Energy: 1.1405351663107695
Energy: 1.1239770196283319
Energy: 1.1454839496896405
Energy: 1.1239770196295402
Energy: 1.145483949690245
Energy: 1.1239770196283319
Energy: 1.1454839496896405
Energy: 1.101286944688904
Energy: 1.2109104543551488
Energy: 1.1012869446876954
Energy: 1.2109104543551488
Energy: 1.101286944688904
Energy: 1.210910454355753
Energy: 1.276195204815264
Energy: 1.2233599790538037
Energy: 1.2761952048158682
Energy: 1.2233599790538037
Energy: 1.276195204817077
Energy: 1.2233599790531993
Energy: 1.1158700023843484
Energy: 1.148935752286202
Energy: 1.1158700023843484
Energy: 1.1489357522855979
Energy: 1.1158700023849528
Energy: 1.1489357522868067
Energy: 1.1759067653855753
Energy: 1.127230560357585
Energy: 1.1759067653861797
Energy: 1.127230560357585
Energy: 1.175906765384971
Energy: 1.1272305603581896
Energy: 1.0178276975764846
Energy: 1.2418679991732082
Energy: 1.0178276975776934
Energy: 1.2418679991732082
Energy: 1.0178276975758804
Energy: 1.2418679991732082
Energy: 1.2864836204230143
Energy: 1.1534076287340207
Energy: 1.2864836204242232
Energy: 1.153407628733416
Energy: 1.2864836204236187
Energy: 1.1534076287340207
Energy: 1.1159691605687805
Energy: 1.1704457810755116
Energy: 1.1159691605705935
Energy: 1.170445781076116
Energy: 1.115969160569989
Energy: 1.1704457810755116
Energy: 1.136230360586326
Energy: 1.1315965615708192
Energy: 1.1362303605851172
Energy: 1.1315965615708192
Energy: 1.1362303605857218
Energy: 1.1315965615708192
Energy: 1.066500034352658
Energy: 1.3617642130510446
Energy: 1.066500034352658
Energy: 1.3617642130510446
Energy: 1.066500034354471
Energy: 1.3617642130504404
Energy: 1.1660920089742528
Energy: 1.0611391451897008
Energy: 1.1660920089736484
Energy: 1.0611391451897008
Energy: 1.1660920089742528
Energy: 1.0611391451897008
Energy: 1.1581611650845907
Energy: 1.1421705329094736
Energy: 1.1581611650839863
Energy: 1.142170532910078
Energy: 1.1581611650845907
Energy: 1.1421705329094736
Energy: 1.1863823816219308
Energy: 1.0890410573962481
Energy: 1.1863823816207222
Energy: 1.0890410573962481
Energy: 1.1863823816213266
Energy: 1.0890410573962481
Energy: 1.3063177496743998
Energy: 1.1110465807560466
Energy: 1.3063177496750042
Energy: 1.1110465807560466
Energy: 1.3063177496743998
Energy: 1.1110465807548375
Energy: 1.2690188801274598
Energy: 1.0999949240078606
Energy: 1.2690188801280642
Energy: 1.0999949240078606
Energy: 1.2690188801286684
Energy: 1.0999949240078606
Energy: 1.1881160057637603
Energy: 1.0855150275252796
Energy: 1.1881160057637603
Energy: 1.0855150275246752
Energy: 1.1881160057637603
Energy: 1.0855150275252796
Energy: 1.159293874927449
Energy: 1.2385775742012162
Energy: 1.159293874927449
Energy: 1.2385775742018206
Energy: 1.1592938749268447
Energy: 1.2385775742018206
Energy: 1.1980420033671118
Energy: 1.0792577539586712
Energy: 1.1980420033671118
Energy: 1.0792577539586712
Energy: 1.1980420033659032
Energy: 1.0792577539580666
Energy: 1.1718591919202668
Energy: 1.1713864397277913
Energy: 1.1718591919202668
Energy: 1.1713864397283957
Energy: 1.1718591919196624
Energy: 1.171386439729
Energy: 1.1343342450104068
Energy: 1.1316516887643746
Energy: 1.1343342450098024
Energy: 1.1316516887649788
Energy: 1.1343342450104068
Energy: 1.1316516887649788
Energy: 1.1170494815389986
Energy: 1.14245418874173
Energy: 1.1170494815377898
Energy: 1.1424541887423345
Energy: 1.1170494815396033
Energy: 1.1424541887423345
Energy: 1.3013654110048405
Energy: 1.0943680624573329
Energy: 1.3013654110042359
Energy: 1.094368062457937
Energy: 1.3013654110042359
Energy: 1.0943680624567282
Energy: 1.1365206424144236
Energy: 1.0876410606584472
Energy: 1.1365206424162368
Energy: 1.0876410606578426
Energy: 1.1365206424144236
Energy: 1.0876410606590514
Energy: 1.1772968570985527
Energy: 1.1122039554374177
Energy: 1.177296857099157
Energy: 1.1122039554374177
Energy: 1.177296857099157
Energy: 1.1122039554368135
Energy: 1.116958892864744
Energy: 1.1518233758277359
Energy: 1.1169588928635354
Energy: 1.1518233758277359
Energy: 1.1169588928653484
Energy: 1.1518233758277359
Energy: 1.2173947065113064
Energy: 1.2731386107053035
Energy: 1.2173947065100974
Energy: 1.2731386107053035
Energy: 1.2173947065100974
Energy: 1.2731386107053035
Energy: 1.1326484094269398
Energy: 1.2046251917203397
Energy: 1.1326484094281484
Energy: 1.2046251917197353
Energy: 1.132648409427544
Energy: 1.2046251917197353

minimum gb energy = 1.0178276975758804 eV
minimum distance =  2.19374416826228 Angstroms
sigma value = 57


========================================
theta = 86.6277133165661
========================================

Energy: 1.1813706648472089
Energy: 1.045353003335073
Energy: 1.1813706648464264
Energy: 1.045353003335073
Energy: 1.1813706648472089
Energy: 1.045353003335073
Energy: 1.1211686115029313
Energy: 1.0721477663633374
Energy: 1.1211686115037138
Energy: 1.0721477663633374
Energy: 1.1211686115037138
Energy: 1.0721477663625547
Energy: 1.083337005892929
Energy: 1.2041031611267952
Energy: 1.083337005892929
Energy: 1.2041031611267952
Energy: 1.083337005892929
Energy: 1.2041031611267952
Energy: 1.4014105219846895
Energy: 1.1411737088787735
Energy: 1.401410521983907
Energy: 1.141173708877991
Energy: 1.4014105219854722
Energy: 1.1411737088787735
Energy: 1.4911749594167676
Energy: 1.1200159099646756
Energy: 1.4911749594159849
Energy: 1.1200159099646756
Energy: 1.4911749594175499
Energy: 1.1200159099646756
Energy: 1.0846880159374659
Energy: 1.2014539474195167
Energy: 1.0846880159390309
Energy: 1.2014539474195167
Energy: 1.0846880159382484
Energy: 1.2014539474195167
Energy: 1.1578505568709736
Energy: 1.098067407506312
Energy: 1.1578505568725384
Energy: 1.098067407506312
Energy: 1.1578505568717559
Energy: 1.098067407506312
Energy: 1.17077469307004
Energy: 1.062860519417344
Energy: 1.1707746930692575
Energy: 1.062860519417344
Energy: 1.17077469307004
Energy: 1.062860519417344
Energy: 1.1621408799321495
Energy: 1.0727475290316932
Energy: 1.162140879929802
Energy: 1.0727475290316932
Energy: 1.162140879929802
Energy: 1.0727475290316932
Energy: 0.9195955958467922
Energy: 1.1513425055836637
Energy: 0.9195955958460096
Energy: 1.1513425055836637
Energy: 0.9195955958467922
Energy: 1.1513425055836637
Energy: 1.1324200802553601
Energy: 1.152612932188788
Energy: 1.1324200802522302
Energy: 1.152612932188788
Energy: 1.1324200802553601
Energy: 1.152612932188788
Energy: 1.1833800666491563
Energy: 1.1391421382194176
Energy: 1.1833800666499388
Energy: 1.1391421382194176
Energy: 1.1833800666475913
Energy: 1.139142138218635
Energy: 1.1084287290616803
Energy: 1.0725395390122239
Energy: 1.1084287290616803
Energy: 1.0725395390122239
Energy: 1.1084287290624273
Energy: 1.0725395390122239
Energy: 1.1564361559204606
Energy: 1.0929479088784093
Energy: 1.1564361559188956
Energy: 1.0929479088784093
Energy: 1.156436155921243
Energy: 1.0929479088784093
Energy: 1.1595559806646898
Energy: 1.0219504941724107
Energy: 1.1595559806631248
Energy: 1.0219504941731934
Energy: 1.1595559806639073
Energy: 1.0219504941731934
Energy: 1.1622645787029628
Energy: 1.0842023541771215
Energy: 1.1622645787045276
Energy: 1.0842023541771215
Energy: 1.1622645786998327
Energy: 1.0842023541771215
Energy: 1.1203895038312033
Energy: 1.117716849515513
Energy: 1.1203895038288914
Energy: 1.117716849515513
Energy: 1.1203895038312033
Energy: 1.1177168495147303
Energy: 1.1706175044498368
Energy: 1.0384366951809252
Energy: 1.1706175044498368
Energy: 1.0384366951817077
Energy: 1.1706175044498368
Energy: 1.0384366951817077
Energy: 1.1225114087355412
Energy: 1.117788349639774
Energy: 1.122511408736324
Energy: 1.1177883496405567
Energy: 1.122511408736324
Energy: 1.117788349639774
Energy: 1.1622906571810092
Energy: 1.0842024206607301
Energy: 1.162290657181792
Energy: 1.0842024206607301
Energy: 1.162290657181792
Energy: 1.0842024206607301
Energy: 1.1595069250931704
Energy: 1.0222672093319844
Energy: 1.1595069250931704
Energy: 1.0222672093319844
Energy: 1.159506925092388
Energy: 1.0222672093312017
Energy: 1.156374922734584
Energy: 1.0464285442298324
Energy: 1.156374922734584
Energy: 1.04642854422905
Energy: 1.156374922734584
Energy: 1.04642854422905
Energy: 1.1085140666110438
Energy: 1.0725385409197343
Energy: 1.1085140666118263
Energy: 1.0725385409197343
Energy: 1.1085140666118263
Energy: 1.0725385409197343
Energy: 1.18330356634786
Energy: 1.139147118220364
Energy: 1.18330356634786
Energy: 1.1391471182211466
Energy: 1.1833035663502074
Energy: 1.1391471182195816

minimum gb energy = 0.9195955958460096 eV
minimum distance =  2.227940459747 Angstroms
sigma value = 17


========================================
theta = 93.3722866834339
========================================

Energy: 1.1026744807597528
Energy: 1.0783179347996243
Energy: 1.1026744807597528
Energy: 1.078317934798518
Energy: 1.1026744807597528
Energy: 1.0783179347996243
Energy: 1.0297272234868982
Energy: 1.0841928521117514
Energy: 1.029727223488005
Energy: 1.0841928521117514
Energy: 1.029727223488005
Energy: 1.0841928521117514
Energy: 1.0159048154476689
Energy: 1.1561779691153575
Energy: 1.0159048154465624
Energy: 1.1561779691153575
Energy: 1.0159048154465624
Energy: 1.1561779691153575
Energy: 1.0546191245191125
Energy: 1.1240446224773997
Energy: 1.0546191245180059
Energy: 1.1240446224773997
Energy: 1.0546191245180059
Energy: 1.1240446224773997
Energy: 1.0857656943150342
Energy: 1.0999151030218046
Energy: 1.0857656943150342
Energy: 1.0999151030218046
Energy: 1.0857656943150342
Energy: 1.0999151030218046
Energy: 0.9543065666436343
Energy: 1.0845776280881565
Energy: 0.9543065666436343
Energy: 1.0845776280881565
Energy: 0.9543065666436343
Energy: 1.0845776280892632
Energy: 1.1002809469829282
Energy: 0.9629843677502143
Energy: 1.100280946984035
Energy: 0.9629843677502143
Energy: 1.1002809469829282
Energy: 0.9629843677513209
Energy: 1.0548805895550522
Energy: 1.1116286900779255
Energy: 1.0548805895539455
Energy: 1.1116286900768189
Energy: 1.0548805895550522
Energy: 1.1116286900768189
Energy: 0.9846745536958941
Energy: 1.0866391496052785
Energy: 0.9846745536958941
Energy: 1.0866391496052785
Energy: 0.9846745536958941
Energy: 1.0866391496052785
Energy: 1.0691197146699642
Energy: 1.0528384464727498
Energy: 1.0691197146688578
Energy: 1.0528384464727498
Energy: 1.0691197146688578
Energy: 1.0528384464716432
Energy: 1.1316918085176042
Energy: 1.0570583757610421
Energy: 1.1316918085176042
Energy: 1.0570583757610421
Energy: 1.1316918085176042
Energy: 1.0570583757610421
Energy: 1.1037908683845148
Energy: 1.0840790744128552
Energy: 1.1037908683845148
Energy: 1.0840790744128552
Energy: 1.1037908683834081
Energy: 1.0840790744139617
Energy: 0.8969466979287848
Energy: 1.1383972144891799
Energy: 0.8969466979287848
Energy: 1.1383972144891799
Energy: 0.8969466979276782
Energy: 1.1383972144891799
Energy: 1.0360594974570634
Energy: 0.9970219954060049
Energy: 1.0360594974570634
Energy: 0.9970219954060049
Energy: 1.0360594974570634
Energy: 0.9970219954060049
Energy: 1.06707029299833
Energy: 1.142479485543646
Energy: 1.0670702929994365
Energy: 1.142479485543646
Energy: 1.0670702929994365
Energy: 1.142479485543646
Energy: 1.0638386966037248
Energy: 1.0834032845058992
Energy: 1.0638386966048317
Energy: 1.0834032845058992
Energy: 1.0638386966037248
Energy: 1.0834032845058992
Energy: 1.0353274677936424
Energy: 0.9990081063101917
Energy: 1.0353274677936424
Energy: 0.9990081063101917
Energy: 1.0353274677936424
Energy: 0.9990081063090849

minimum gb energy = 0.8969466979276782 eV
minimum distance =  2.25842589982021 Angstroms
sigma value = 17


========================================
theta = 97.054131382119
========================================

Energy: 1.0654037409595885
Energy: 1.0474443011784198
Energy: 1.0654037409583064
Energy: 1.047444301178847
Energy: 1.065403740960443
Energy: 1.0474443011784198
Energy: 0.9919777615082185
Energy: 0.9667400627417313
Energy: 0.9919777615056543
Energy: 0.9667400627417313
Energy: 0.9919777615077912
Energy: 0.9667400627413038
Energy: 0.9358011929682676
Energy: 0.9482531108229039
Energy: 0.9358011929678403
Energy: 0.9482531108224765
Energy: 0.9358011929665583
Energy: 0.9482531108233313
Energy: 1.0033296485140157
Energy: 0.9016460691622955
Energy: 1.0033296485170073
Energy: 0.9016460691627229
Energy: 1.0033296485148704
Energy: 0.9016460691614407
Energy: 0.9965813759962158
Energy: 1.0377964950015512
Energy: 0.9965813759953609
Energy: 1.0377964950015512
Energy: 0.9965813759974976
Energy: 1.037796495001124
Energy: 0.9169122833517379
Energy: 0.9441031288518539
Energy: 0.9169122833496012
Energy: 0.9441031288522813
Energy: 0.9169122833504557
Energy: 0.9441031288522813
Energy: 1.029922295352304
Energy: 0.8908282776483405
Energy: 1.0299222953531584
Energy: 0.8908282776479133
Energy: 1.029922295352304
Energy: 0.8908282776483405
Energy: 1.0167875553995098
Energy: 1.0738682555979269
Energy: 1.0167875554012193
Energy: 1.0738682555974994
Energy: 1.0167875554025012
Energy: 1.0738682555974994
Energy: 0.9079596196810182
Energy: 1.0693309756960958
Energy: 0.9079596196805908
Energy: 1.0693309756960958
Energy: 0.9079596196797363
Energy: 1.0693309756960958
Energy: 0.9914811063178794
Energy: 0.8424274716720912
Energy: 0.9914811063153155
Energy: 0.8424274716703818
Energy: 0.991481106312324
Energy: 0.8424274716699545
Energy: 1.0059706472043557
Energy: 1.0451283582321733
Energy: 1.005970647206065
Energy: 1.0451283582330282
Energy: 1.0059706472056378
Energy: 1.0451283582338826
Energy: 0.9396105246535104
Energy: 1.0539047522631542
Energy: 0.9396105246513737
Energy: 1.0539047522635814
Energy: 0.9396105246539378
Energy: 1.0539047522631542
Energy: 1.0118596167541605
Energy: 0.9703019749770545
Energy: 1.0118596167541605
Energy: 0.9703019749770545
Energy: 1.011859616754588
Energy: 0.970301974977909
Energy: 1.0872732248209591
Energy: 0.9676253410852421
Energy: 1.0872732248222412
Energy: 0.9676253410852421
Energy: 1.0872732248235233
Energy: 0.9676253410852421
Energy: 1.0589354602820575
Energy: 1.0416562163996381
Energy: 1.05893546028163
Energy: 1.0416562163996381
Energy: 1.0589354602799208
Energy: 1.0416562164000656
Energy: 0.9770827503075652
Energy: 1.0634935544510644
Energy: 0.97708275030842
Energy: 1.0634935544510644
Energy: 0.9770827503092747
Energy: 1.063493554450637
Energy: 0.9622900092497589
Energy: 0.9022430322711658
Energy: 0.962290009248477
Energy: 0.9022430322707384
Energy: 0.9622900092471949
Energy: 0.9022430322707384
Energy: 1.0119885326526141
Energy: 1.0373009465572154
Energy: 1.01198853265646
Energy: 1.0373009465572154
Energy: 1.0119885326530413
Energy: 1.0373009465567882
Energy: 1.009502706851278
Energy: 1.0268316471117032
Energy: 1.0095027068529874
Energy: 1.0268316471121304
Energy: 1.0095027068517053
Energy: 1.0268316471121304
Energy: 0.9612614036409489
Energy: 0.8442482408859089
Energy: 0.9612614036452225
Energy: 0.8442482408850543
Energy: 0.9612614036422309
Energy: 0.8442482408854817
Energy: 1.0094743690945254
Energy: 1.0263085997162191
Energy: 1.0094743690932433
Energy: 1.0263085997166463
Energy: 1.0094743690928158
Energy: 1.0263085997153643
Energy: 1.0113175314759149
Energy: 1.0376821371538698
Energy: 1.0113175314767695
Energy: 1.0376821371534424
Energy: 1.0113175314742056
Energy: 1.0376821371538698
Energy: 0.9622211660347505
Energy: 0.9023820325996178
Energy: 0.9622211660364598
Energy: 0.9023820326004723
Energy: 0.9622211660356051
Energy: 0.902382032600045
Energy: 0.9770868903033931
Energy: 1.094277462851945
Energy: 0.9770868902978377
Energy: 1.094277462851945
Energy: 0.977086890300829
Energy: 1.094277462851945
Energy: 1.0588891110055179
Energy: 1.0417057219993986
Energy: 1.058889111004663
Energy: 1.041705721998544
Energy: 1.0588891110063723
Energy: 1.041705721998544
Energy: 1.0902957542391398
Energy: 0.9674760271414388
Energy: 1.0902957542425586
Energy: 0.9674760271414388
Energy: 1.0902957542408491
Energy: 0.9674760271414388
Energy: 1.011214231082596
Energy: 0.9703436823122016
Energy: 1.0112142310830234
Energy: 0.9703436823122016
Energy: 1.011214231080032
Energy: 0.9703436823117743
Energy: 0.93992586227962
Energy: 1.044078476971326
Energy: 0.939925862280902
Energy: 1.0440784769717537
Energy: 0.9399258622791927
Energy: 1.0440784769726081
Energy: 1.00595648067192
Energy: 1.0461495610248996
Energy: 1.0059564806727745
Energy: 1.0461495610248996
Energy: 1.00595648067192
Energy: 1.046149561025754
Energy: 0.9917742369312735
Energy: 0.8427493034582387
Energy: 0.9917742369317009
Energy: 0.8427493034590933
Energy: 0.991774236935547
Energy: 0.842749303457384
Energy: 0.9081301444940527
Energy: 1.0694260803151774
Energy: 0.9081301444914887
Energy: 1.0694260803151774
Energy: 0.9081301444927705
Energy: 1.0694260803151774
Energy: 1.0168340818335042
Energy: 1.0738619420343989
Energy: 1.0168340818322221
Energy: 1.0738619420343989
Energy: 1.0168340818347863
Energy: 1.0738619420339715
Energy: 1.0300320085982804
Energy: 0.8762799699485205
Energy: 1.030032008596998
Energy: 0.8762799699502299
Energy: 1.0300320085982804
Energy: 0.8762799699472383
Energy: 0.9158783429649059
Energy: 0.9116073172981471
Energy: 0.9158783429657605
Energy: 0.9116073172985745
Energy: 0.9158783429644786
Energy: 0.9116073172990019
Energy: 0.996765263070882
Energy: 1.037852093772617
Energy: 0.9967652630700272
Energy: 1.0378520937713351
Energy: 0.9967652630700272
Energy: 1.0378520937721896
Energy: 1.0033101969212572
Energy: 1.058085441219186
Energy: 1.0033101969191207
Energy: 1.058085441219186
Energy: 1.00331019692083
Energy: 1.058085441219613
Energy: 0.9359410689297244
Energy: 0.9481897094942919
Energy: 0.9359410689275877
Energy: 0.9481897094934371
Energy: 0.9359410689275877
Energy: 0.9481897094925825
Energy: 0.9919298023948598
Energy: 0.9667126007888444
Energy: 0.9919298023931504
Energy: 0.9667126007884169
Energy: 0.9919298023948598
Energy: 0.9667126007884169
Energy: 1.0654037409608703
Energy: 1.047444301180129
Energy: 1.0654037409591612
Energy: 1.0474443011805565
Energy: 1.0654037409621524
Energy: 1.047444301180129
Energy: 0.9919777615103552
Energy: 1.006425721252654
Energy: 0.9919777615082185
Energy: 1.006425721252654
Energy: 0.9919777615129193
Energy: 1.0064257212522265
Energy: 0.9358011929652763
Energy: 0.9482531108250406
Energy: 0.9358011929652763
Energy: 0.9482531108250406
Energy: 0.9358011929652763
Energy: 0.9482531108250406
Energy: 1.00332964851658
Energy: 0.9016460691661417
Energy: 1.0033296485191439
Energy: 0.9016460691669964
Energy: 1.003329648515725
Energy: 0.9016460691665691
Energy: 0.9965813759970703
Energy: 1.0377964950015512
Energy: 0.9965813759940789
Energy: 1.0377964950019787
Energy: 0.9965813759970703
Energy: 1.0377964950028333

minimum gb energy = 0.8424274716699545 eV
minimum distance =  2.19086797682962 Angstroms
sigma value = 57


========================================
theta = 99.36891557845483
========================================

Energy: 1.0176695688624824
Energy: 0.9765092678136014
Energy: 1.0176695688610906
Energy: 0.9765092678142971
Energy: 1.0176695688638742
Energy: 0.9765092678122097
Energy: 0.9142368718169592
Energy: 0.9219343976609157
Energy: 0.9142368718162636
Energy: 0.9219343976609157
Energy: 0.9142368718176552
Energy: 0.92193439766022
Energy: 0.8951076524873607
Energy: 0.9040935200692913
Energy: 0.8951076524845775
Energy: 0.9040935200692913
Energy: 0.8951076524873607
Energy: 0.904093520069987
Energy: 0.9596721875130516
Energy: 0.8554928116827335
Energy: 0.9596721875165309
Energy: 0.8554928116827335
Energy: 0.9596721875144434
Energy: 0.8554928116827335
Energy: 0.9138980241196061
Energy: 0.9638047523000228
Energy: 0.9138980241182145
Energy: 0.9638047523000228
Energy: 0.913898024120302
Energy: 0.9638047523000228
Energy: 0.8539541274878039
Energy: 0.9021850020207319
Energy: 0.8539541274871081
Energy: 0.9021850020214276
Energy: 0.8539541274857163
Energy: 0.9021850020200358
Energy: 0.9528451095083574
Energy: 0.8435556446943572
Energy: 0.9528451095090533
Energy: 0.8435556446929655
Energy: 0.9528451095097492
Energy: 0.8435556446943572
Energy: 0.9555918381728477
Energy: 0.9712188733144748
Energy: 0.9555918381728477
Energy: 0.971218873313083
Energy: 0.9555918381721518
Energy: 0.971218873313779
Energy: 0.8147340567203631
Energy: 0.9171248115121378
Energy: 0.8147340567217547
Energy: 0.9171248115142252
Energy: 0.8147340567189714
Energy: 0.9171248115128335
Energy: 0.9252186448179583
Energy: 0.8243264058026963
Energy: 0.9252186448193499
Energy: 0.8243264058033923
Energy: 0.9252186448193499
Energy: 0.8243264058040882
Energy: 0.9530872843043191
Energy: 1.0184544096666612
Energy: 0.9530872843057108
Energy: 1.0184544096666612
Energy: 0.9530872843036233
Energy: 1.0184544096666612
Energy: 0.8366631429989304
Energy: 0.9591927171899262
Energy: 0.8366631429989304
Energy: 0.9591927171906222
Energy: 0.8366631429975387
Energy: 0.9591927171913179
Energy: 0.9257963487311106
Energy: 0.8883237234379511
Energy: 0.925796348733198
Energy: 0.8883237234379511
Energy: 0.925796348733198
Energy: 0.8883237234379511
Energy: 0.9664813005882541
Energy: 0.9499402002624691
Energy: 0.9664813005896457
Energy: 0.9499402002617733
Energy: 0.9664813005889498
Energy: 0.9499402002624691
Energy: 0.8822925173805932
Energy: 0.9997770970533204
Energy: 0.8822925173798972
Energy: 0.9997770970540163
Energy: 0.882292517381289
Energy: 0.9997770970540163
Energy: 0.9448812688365602
Energy: 0.9258583114716055
Energy: 0.9448812688358644
Energy: 0.9258583114716055
Energy: 0.9448812688351688
Energy: 0.9258583114716055
Energy: 1.018022911516985
Energy: 0.9264010072579495
Energy: 1.018022911516985
Energy: 0.9264010072579495
Energy: 1.0180229115162893
Energy: 0.9264010072572536
Energy: 0.9508631682730025
Energy: 0.9952157756589477
Energy: 0.9508631682757858
Energy: 0.9952157756582519
Energy: 0.9508631682736983
Energy: 0.9952157756589477
Energy: 0.9052857251923159
Energy: 0.9685604673387403
Energy: 0.9052857251944033
Energy: 0.9685604673387403
Energy: 0.9052857251930115
Energy: 0.9685604673380446
Energy: 0.9203480752468592
Energy: 0.8538298618570098
Energy: 0.9203480752496425
Energy: 0.8538298618570098
Energy: 0.9203480752482508
Energy: 0.8538298618577055
Energy: 0.9535156501959501
Energy: 0.9665109034257428
Energy: 0.9535156501938626
Energy: 0.9665109034257428
Energy: 0.9535156501959501
Energy: 0.9665109034257428
Energy: 0.9493829242386509
Energy: 0.9690745554470034
Energy: 0.9493829242372591
Energy: 0.9690745554490909
Energy: 0.9493829242393466
Energy: 0.9690745554470034
Energy: 0.8965768076622481
Energy: 0.8375317270850334
Energy: 0.8965768076629439
Energy: 0.8375317270850334
Energy: 0.8965768076622481
Energy: 0.8375317270850334
Energy: 0.8308782252389059
Energy: 0.9881029394811367
Energy: 0.8308782252396018
Energy: 0.9881029394811367
Energy: 0.8308782252396018
Energy: 0.9881029394811367
Energy: 0.9422877282213795
Energy: 0.9926364381657115
Energy: 0.9422877282213795
Energy: 0.9926364381657115
Energy: 0.9422877282220752
Energy: 0.9926364381657115
Energy: 0.9968133594693825
Energy: 0.8360774990565234
Energy: 0.9968133594700783
Energy: 0.8360774990558274
Energy: 0.9968133594686865
Energy: 0.8360774990565234
Energy: 0.8063523858081104
Energy: 0.9690515583034566
Energy: 0.8063523858074145
Energy: 0.9690515583034566
Energy: 0.8063523858074145
Energy: 0.9690515583027608

minimum gb energy = 0.8063523858074145 eV
minimum distance =  2.1798311649567 Angstroms
sigma value = 43


========================================
theta = 102.11511746203723
========================================

Energy: 0.9647324029962117
Energy: 0.8792070094474631
Energy: 0.9647324029962117
Energy: 0.8792070094474631
Energy: 0.9647324029962117
Energy: 0.8792070094469562
Energy: 0.8046125076304615
Energy: 0.8804681334261159
Energy: 0.8046125076319826
Energy: 0.8804681334256089
Energy: 0.8046125076304615
Energy: 0.8804681334261159
Energy: 0.7762118772909179
Energy: 0.8364924031275304
Energy: 0.7762118772909179
Energy: 0.8364924031280373
Energy: 0.776211877289904
Energy: 0.8364924031275304
Energy: 0.8979266722552963
Energy: 0.7504329924557306
Energy: 0.8979266722552963
Energy: 0.7504329924557306
Energy: 0.8979266722537754
Energy: 0.7504329924557306
Energy: 0.8044251608512987
Energy: 0.8617113952541973
Energy: 0.8044251608502847
Energy: 0.8617113952541973
Energy: 0.8044251608502847
Energy: 0.8617113952547042
Energy: 0.738790173053482
Energy: 0.8148629150037879
Energy: 0.7387901730514541
Energy: 0.8148629150032809
Energy: 0.738790173052468
Energy: 0.8148629150042949
Energy: 0.8569390174107396
Energy: 0.7426027298792944
Energy: 0.8569390174102326
Energy: 0.7426027298787874
Energy: 0.8569390174102326
Energy: 0.7426027298772665
Energy: 0.8930532341119658
Energy: 0.8286546027459618
Energy: 0.893053234110445
Energy: 0.8286546027459618
Energy: 0.8930532341114589
Energy: 0.8286546027459618
Energy: 0.7133445698269536
Energy: 0.8035801660025259
Energy: 0.7133445698274608
Energy: 0.8035801660025259
Energy: 0.7133445698269536
Energy: 0.8035801660030328
Energy: 0.8665301401162236
Energy: 0.7206096399436878
Energy: 0.8665301401162236
Energy: 0.7206096399436878
Energy: 0.8665301401152097
Energy: 0.7206096399436878
Energy: 0.8342999927741087
Energy: 0.828547206249547
Energy: 0.8342999927736018
Energy: 0.828547206250054
Energy: 0.8342999927741087
Energy: 0.828547206250054
Energy: 0.6868490077933416
Energy: 0.8778949862023184
Energy: 0.6868490077938485
Energy: 0.8778949862002906
Energy: 0.6868490077928345
Energy: 0.8778949862018114
Energy: 0.862962087266427
Energy: 0.6893990965838119
Energy: 0.86296208726592
Energy: 0.6893990965838119
Energy: 0.86296208726592
Energy: 0.6893990965838119
Energy: 0.8349226013617612
Energy: 0.8650895018085881
Energy: 0.8349226013617612
Energy: 0.865089501809095
Energy: 0.8349226013617612
Energy: 0.865089501809095
Energy: 0.7141814629226134
Energy: 0.8678200716578471
Energy: 0.7141814629221064
Energy: 0.8678200716583541
Energy: 0.7141814629210924
Energy: 0.8678200716573402
Energy: 0.8450956788397818
Energy: 0.7335007718112203
Energy: 0.8450956788387679
Energy: 0.7335007718112203
Energy: 0.8450956788397818
Energy: 0.7335007718117272
Energy: 0.8535159607273954
Energy: 0.8764843718962743
Energy: 0.8535159607273954
Energy: 0.8764843718957673
Energy: 0.8535159607268885
Energy: 0.8764843718962743
Energy: 0.7247969325271988
Energy: 0.8608770984114443
Energy: 0.7247969325271988
Energy: 0.8608770984114443
Energy: 0.7247969325277058
Energy: 0.8608770984109374
Energy: 0.8156943700456932
Energy: 0.7706064182330824
Energy: 0.8156943700462002
Energy: 0.7706064182320684
Energy: 0.8156943700462002
Energy: 0.7706064182325754
Energy: 0.8977436940860518
Energy: 0.789167713318009
Energy: 0.8977436940860518
Energy: 0.789167713318009
Energy: 0.8977436940855448
Energy: 0.789167713318009
Energy: 0.771541302539436
Energy: 0.9200875235510738
Energy: 0.7715413025404498
Energy: 0.9200875235510738
Energy: 0.7715413025404498
Energy: 0.9200875235505668
Energy: 0.8519073070867988
Energy: 0.81449238230056
Energy: 0.8519073070873059
Energy: 0.8144923823010669
Energy: 0.8519073070867988
Energy: 0.8144923823010669
Energy: 0.9484928607702149
Energy: 0.8045459481085567
Energy: 0.9484928607692009
Energy: 0.8045459481085567
Energy: 0.9484928607707218
Energy: 0.8045459481085567
Energy: 0.8184155415739331
Energy: 0.9178948738309458
Energy: 0.818415541574947
Energy: 0.9178948738304388
Energy: 0.8184155415739331
Energy: 0.9178948738304388
Energy: 0.795895751103941
Energy: 0.7893992887242178
Energy: 0.795895751103941
Energy: 0.7893992887242178
Energy: 0.795895751103941
Energy: 0.7893992887237109
Energy: 0.8686028079850723
Energy: 0.7478686780205216
Energy: 0.8686028079855793
Energy: 0.7478686780205216
Energy: 0.8686028079850723
Energy: 0.7478686780205216
Energy: 0.820196690244393
Energy: 0.8611134892405327
Energy: 0.820196690244393
Energy: 0.8611134892405327
Energy: 0.8201966902448999
Energy: 0.8611134892405327
Energy: 0.7704244570814155
Energy: 0.7786072120705916
Energy: 0.7704244570809086
Energy: 0.7786072120710985
Energy: 0.7704244570814155
Energy: 0.7786072120710985
Energy: 0.856740866587814
Energy: 0.7142517909170504
Energy: 0.8567408665862931
Energy: 0.7142517909170504
Energy: 0.8567408665868002
Energy: 0.7142517909170504
Energy: 0.7129161341177803
Energy: 0.8299137146301098
Energy: 0.7129161341177803
Energy: 0.8299137146296026
Energy: 0.7129161341193014
Energy: 0.8299137146301098
Energy: 0.8240348175181299
Energy: 0.8395181029838614
Energy: 0.824034817517623
Energy: 0.8395181029838614
Energy: 0.8240348175186369
Energy: 0.8395181029833545
Energy: 0.8006514898631107
Energy: 0.703401317178575
Energy: 0.8006514898626038
Energy: 0.703401317179082
Energy: 0.8006514898641247
Energy: 0.703401317179082
Energy: 0.6972366750329203
Energy: 0.8420421698677155
Energy: 0.6972366750329203
Energy: 0.8420421698682227
Energy: 0.6972366750324593
Energy: 0.8420421698682227
Energy: 0.834515076346056
Energy: 0.8570554047940271
Energy: 0.834515076345042
Energy: 0.8570554047940271
Energy: 0.8345150763455489
Energy: 0.8570554047940271
Energy: 0.8978360182765114
Energy: 0.790980772660612
Energy: 0.8978360182765114
Energy: 0.790980772660612
Energy: 0.8978360182754974
Energy: 0.7909807726611191
Energy: 0.674377807882821
Energy: 0.8453535493564717
Energy: 0.674377807882821
Energy: 0.8453535493569787
Energy: 0.6743778078823138
Energy: 0.8453535493569787

minimum gb energy = 0.6743778078823138 eV
minimum distance =  2.1553636012455 Angstroms
sigma value = 81


========================================
theta = 109.47122063449069
========================================

Energy: 0.29915198434075757
Energy: 0.35746566270734675
Energy: 0.03165172059871751
Energy: 0.35746566270734675
Energy: 0.29915198434075757
Energy: 0.35746566270734675
Energy: 0.5053301916008895
Energy: 0.03355168208583659
Energy: 0.5053301915990268
Energy: 0.03355168208583659
Energy: 0.5053301916008895
Energy: 0.03355168208583659
Energy: 0.47795189413759087
Energy: 0.03240347892615605
Energy: 0.47795189413759087
Energy: 0.03240347892615605
Energy: 0.47795189413759087
Energy: 0.03240347892615605
Energy: 0.03165172059871751
Energy: 0.35746566270734675
Energy: 0.03165172059871751
Energy: 0.35746566270734675
Energy: 0.03165172059871751
Energy: 0.3574656627092095
Energy: 0.5053301916008895
Energy: 0.033551682078385534
Energy: 0.5053301916008895
Energy: 0.0335516820802483
Energy: 0.5053301916008895
Energy: 0.0335516820802483
Energy: 0.4779518941394536
Energy: 0.03240347892429329
Energy: 0.4779518941394536
Energy: 0.03240347892429329
Energy: 0.4779518941394536
Energy: 0.03240347892615605
Energy: 0.29915198433889484
Energy: 0.3574656627092095
Energy: 0.03165172059871751
Energy: 0.3574656627092095
Energy: 0.29915198434075757
Energy: 0.3574656627092095
Energy: 0.5053301916008895
Energy: 0.03355168207652278
Energy: 0.5053301915990268
Energy: 0.03355168207652278
Energy: 0.5053301916008895
Energy: 0.03355168207652278
Energy: 0.4779518941431792
Energy: 0.03240347892429329
Energy: 0.4779518941431792
Energy: 0.03240347892429329
Energy: 0.4779518941431792
Energy: 0.03240347892615605
Energy: 0.03165172059871751
Energy: 0.35746566270734675
Energy: 0.03165172059871751
Energy: 0.35746566270734675
Energy: 0.03165172059871751
Energy: 0.35746566270734675

minimum gb energy = 0.03165172059871751 eV
minimum distance =  2.44639252803837 Angstroms
sigma value = 3


========================================
theta = 117.56060310526324
========================================

Energy: 0.9531785781298172
Energy: 0.8021299712720047
Energy: 0.9531785781292598
Energy: 0.8021299712714473
Energy: 0.9531785781303748
Energy: 0.802129971272562
Energy: 0.7761202952477726
Energy: 0.8238508339117913
Energy: 0.7761202952483301
Energy: 0.8238508339117913
Energy: 0.7761202952483301
Energy: 0.8238508339117913
Energy: 0.7945011090071838
Energy: 0.8200754718930454
Energy: 0.7945011090077412
Energy: 0.820075471892488
Energy: 0.794501109008856
Energy: 0.8200754718930454
Energy: 0.8446655875438761
Energy: 0.7733084473442688
Energy: 0.8446655875427611
Energy: 0.7733084473448264
Energy: 0.8446655875438761
Energy: 0.7733084473448264
Energy: 0.7652369584190792
Energy: 0.7594990627052473
Energy: 0.7652369584168495
Energy: 0.7594990627052473
Energy: 0.7652369584190792
Energy: 0.7594990627046898
Energy: 0.8566475698718727
Energy: 0.8131819207665775
Energy: 0.8566475698707579
Energy: 0.8131819207665775
Energy: 0.8566475698724301
Energy: 0.8131819207665775
Energy: 0.8090902296773411
Energy: 0.7727009373332194
Energy: 0.8090902296767837
Energy: 0.7727009373332194
Energy: 0.8090902296767837
Energy: 0.7727009373332194
Energy: 0.7560176108360878
Energy: 0.8279783967680401
Energy: 0.7560176108366452
Energy: 0.8279783967680401
Energy: 0.7560176108360878
Energy: 0.8279783967674827
Energy: 0.8522124620694176
Energy: 0.8210491815193605
Energy: 0.8522124620699749
Energy: 0.8210491815188029
Energy: 0.8522124620699749
Energy: 0.8210491815188029
Energy: 0.8011755748497045
Energy: 0.713534254266827
Energy: 0.801175574849147
Energy: 0.7135342542662696
Energy: 0.8011755748502619
Energy: 0.713534254266827
Energy: 0.770840132737126
Energy: 0.8376841092683872
Energy: 0.7708401327360113
Energy: 0.8376841092689448
Energy: 0.7708401327360113
Energy: 0.8376841092689448
Energy: 0.8427463759519965
Energy: 0.8219823824669187
Energy: 0.8427463759480944
Energy: 0.8219823824669187
Energy: 0.8427463759514391
Energy: 0.8219823824663612
Energy: 0.8491623629052697
Energy: 0.6924059811961552
Energy: 0.8491623629069419
Energy: 0.6924059811961552
Energy: 0.8491623629069419
Energy: 0.6924059811950404
Energy: 0.7468570310757436
Energy: 0.8031525785548388
Energy: 0.746857031076301
Energy: 0.8031525785548388
Energy: 0.7468570310757436
Energy: 0.8031525785548388
Energy: 0.8033831404684321
Energy: 0.8400467329958029
Energy: 0.8033831404678746
Energy: 0.8400467329958029
Energy: 0.8033831404678746
Energy: 0.8400467329952457
Energy: 0.8296456553953414
Energy: 0.7563677898226666
Energy: 0.8296456553958987
Energy: 0.7563677898221092
Energy: 0.8296456553958987
Energy: 0.7563677898226666
Energy: 0.8077854026889256
Energy: 0.8278576721661507
Energy: 0.8077854026883683
Energy: 0.8278576721661507
Energy: 0.8077854026894832
Energy: 0.8278576721661507
Energy: 0.7888531829783572
Energy: 0.7873212843237305
Energy: 0.7888531829761275
Energy: 0.787321284323173
Energy: 0.7888531829777998
Energy: 0.787321284323173
Energy: 0.8329788402252934
Energy: 0.7658035056768389
Energy: 0.8329788402275231
Energy: 0.7658035056762815
Energy: 0.8329788402269657
Energy: 0.765803505675724
Energy: 0.7931042965650823
Energy: 0.8858264649980303
Energy: 0.7931042965639674
Energy: 0.8858264649974728
Energy: 0.7931042965639674
Energy: 0.8858264649974728
Energy: 0.8347038175191936
Energy: 0.8015854348161107
Energy: 0.8347038175208658
Energy: 0.8015854348155533
Energy: 0.8347038175197509
Energy: 0.8015854348155533
Energy: 0.8831224071189078
Energy: 0.8225825279308409
Energy: 0.8831224071194653
Energy: 0.8225825279308409
Energy: 0.8831224071189078
Energy: 0.8225825279308409
Energy: 0.8321373554813917
Energy: 0.8755097470096332
Energy: 0.8321373554813917
Energy: 0.8755097470096332
Energy: 0.8321373554813917
Energy: 0.8755097470096332
Energy: 0.7900746107033725
Energy: 0.7616318056071533
Energy: 0.7900746107044873
Energy: 0.7616318056071533
Energy: 0.7900746107039299
Energy: 0.7616318056065957
Energy: 0.83656894050643
Energy: 0.8088993808833056
Energy: 0.836568940507545
Energy: 0.808899380882748
Energy: 0.8365689405058725
Energy: 0.8088993808833056
Energy: 0.741907799292798
Energy: 0.8433254433669604
Energy: 0.7419077992939128
Energy: 0.8433254433669604
Energy: 0.7419077992939128
Energy: 0.8433254433664032
Energy: 0.8192329913742057
Energy: 0.780907960020822
Energy: 0.8192329913742057
Energy: 0.780907960020822
Energy: 0.8192329913753206
Energy: 0.780907960020822
Energy: 0.7965377299680488
Energy: 0.8367768296861868
Energy: 0.796537729966934
Energy: 0.8367768296867443
Energy: 0.7965377299680488
Energy: 0.8367768296861868
Energy: 0.702627372554499
Energy: 0.8268648509770781
Energy: 0.7026273725550564
Energy: 0.8268648509770781
Energy: 0.702627372554499
Energy: 0.8268648509759631
Energy: 0.8703279730443706
Energy: 0.8007973643607641
Energy: 0.8703279730433066
Energy: 0.8007973643602068
Energy: 0.870327973042749
Energy: 0.8007973643607641
Energy: 0.8407117778929253
Energy: 0.8246873139252595
Energy: 0.8407117778940401
Energy: 0.8246873139252595
Energy: 0.8407117778934827
Energy: 0.8246873139252595
Energy: 0.7047740513963953
Energy: 0.8354283336017141
Energy: 0.7047740513969526
Energy: 0.8354283336017141
Energy: 0.7047740513975101
Energy: 0.8354283336017141
Energy: 0.800587023901655
Energy: 0.8600418358825593
Energy: 0.8005870239027699
Energy: 0.8600418358825593
Energy: 0.800587023901655
Energy: 0.8600418358831168

minimum gb energy = 0.6924059811950404 eV
minimum distance =  2.31719312888145 Angstroms
sigma value = 67


========================================
theta = 121.00758300686714
========================================

Energy: 0.9799840244817862
Energy: 0.9813412132765162
Energy: 0.979984024484169
Energy: 0.9813412132765162
Energy: 0.9799840244817862
Energy: 0.9813412132765162
Energy: 0.9410596483167726
Energy: 0.9488200286523059
Energy: 0.9410596483167726
Energy: 0.9488200286531001
Energy: 0.9410596483151841
Energy: 0.9488200286531001
Energy: 0.9858522050487201
Energy: 0.951285694720231
Energy: 0.9858522050495143
Energy: 0.951285694720231
Energy: 0.9858522050487201
Energy: 0.951285694720231
Energy: 0.9644610424818848
Energy: 0.8984974950821248
Energy: 0.9644610424842678
Energy: 0.8984974950821248
Energy: 0.9644610424842678
Energy: 0.8984974950821248
Energy: 0.9112502582787209
Energy: 0.9500675803402329
Energy: 0.9112502582795151
Energy: 0.9500675803402329
Energy: 0.9112502582779266
Energy: 0.9500675803402329
Energy: 0.9898423028919929
Energy: 0.9505936415429392
Energy: 0.9898423028943758
Energy: 0.9505936415429392
Energy: 0.9898423028943758
Energy: 0.9505936415429392
Energy: 0.9205403166057207
Energy: 0.8819867317091338
Energy: 0.920540316604132
Energy: 0.8819867317083395
Energy: 0.9205403166049263
Energy: 0.8819867317083395
Energy: 0.9546876475613497
Energy: 0.8977855903461427
Energy: 0.9546876475605552
Energy: 0.8977855903453483
Energy: 0.9546876475613497
Energy: 0.8977855903461427
Energy: 0.9825121537078635
Energy: 0.9614603803570414
Energy: 0.9825121537086577
Energy: 0.9614603803570414
Energy: 0.9825121537070691
Energy: 0.9614603803570414
Energy: 0.949149287443064
Energy: 0.9306574603099869
Energy: 0.9491492874422698
Energy: 0.9306574603091925
Energy: 0.9491492874414755
Energy: 0.9306574603099869
Energy: 0.9654092392373967
Energy: 0.945217505449388
Energy: 0.9654092392373967
Energy: 0.945217505449388
Energy: 0.9654092392373967
Energy: 0.9452175054485936
Energy: 0.9214359226750716
Energy: 0.9203202045098189
Energy: 0.9214359226774543
Energy: 0.9203202045090245
Energy: 0.9214359226766601
Energy: 0.9203202045098189
Energy: 0.9418317006808741
Energy: 0.893207239532474
Energy: 0.9418317006808741
Energy: 0.8932072395316797
Energy: 0.9418317006824626
Energy: 0.893207239532474
Energy: 0.9482857951455073
Energy: 0.9573568642386325
Energy: 0.9482857951455073
Energy: 0.9573568642386325
Energy: 0.9482857951463016
Energy: 0.9573568642386325
Energy: 0.9212831273070072
Energy: 0.9109792404254875
Energy: 0.921283127305491
Energy: 0.9109792404254875
Energy: 0.9212831273085959
Energy: 0.9109792404254875
Energy: 0.9924685411249172
Energy: 0.9675310010661148
Energy: 0.9924685411209458
Energy: 0.9675310010661148
Energy: 0.9924685411209458
Energy: 0.9675310010661148
Energy: 0.9496324755077893
Energy: 0.951881318659689
Energy: 0.9496324755093778
Energy: 0.951881318659689
Energy: 0.9496324755085835
Energy: 0.951881318659689
Energy: 0.9758427213668415
Energy: 0.8815918836293272
Energy: 0.9758427213668415
Energy: 0.8815918836285329
Energy: 0.9758427213676358
Energy: 0.8815918836293272
Energy: 0.9332933194307163
Energy: 0.996037504209466
Energy: 0.9332933194307163
Energy: 0.9960375042102604
Energy: 0.9332933194330992
Energy: 0.9960375042102604
Energy: 0.945283053726425
Energy: 0.9725262097708206
Energy: 0.9452830537280136
Energy: 0.9725262097700264
Energy: 0.945283053726425
Energy: 0.972526209769232
Energy: 1.0483798344771387
Energy: 0.8841459363530256
Energy: 1.0483798344755502
Energy: 0.8841459363530256
Energy: 1.0483798344779331
Energy: 0.8841459363530256
Energy: 1.0050157932547854
Energy: 0.9916029834030612
Energy: 1.0050157932555797
Energy: 0.9916029834030612
Energy: 1.0050157932547854
Energy: 0.9916029834030612
Energy: 0.8534740176004273
Energy: 0.9878525943860483
Energy: 0.8534740176012217
Energy: 0.9878525943860483
Energy: 0.8534740176012217
Energy: 0.9878525943860483

minimum gb energy = 0.8534740176004273 eV
minimum distance =  2.1911811235074 Angstroms
sigma value = 33


========================================
theta = 124.1232945407953
========================================

Energy: 1.0288395153285081
Energy: 1.035208710852822
Energy: 1.0288395153280043
Energy: 1.035208710852822
Energy: 1.028839515329012
Energy: 1.0352087108523185
Energy: 0.9969122243085337
Energy: 0.9933265839499703
Energy: 0.9969122243070221
Energy: 0.9933265839499703
Energy: 0.9969122243090375
Energy: 0.9933265839504742
Energy: 1.0896326546777757
Energy: 0.9987863676758982
Energy: 1.0896326546767678
Energy: 0.998786367676402
Energy: 1.0896326546767678
Energy: 0.9987863676769059
Energy: 1.0417082919663365
Energy: 0.9746564222706572
Energy: 1.0417082919673442
Energy: 0.9746564222706572
Energy: 1.0417082919653287
Energy: 0.9746564222706572
Energy: 1.0356188407549685
Energy: 1.0259621441697993
Energy: 1.0356188407564801
Energy: 1.0259621441703028
Energy: 1.0356188407539608
Energy: 1.0259621441703028
Energy: 1.1080697255816323
Energy: 1.05989539030499
Energy: 1.108069725583648
Energy: 1.0598953903044859
Energy: 1.1080697255816323
Energy: 1.05989539030499
Energy: 1.0561338062578427
Energy: 0.9517932859958086
Energy: 1.0561338062583467
Energy: 0.9517932859968165
Energy: 1.0561338062588503
Energy: 0.9517932859958086
Energy: 1.0484434976236696
Energy: 1.019884054509173
Energy: 1.0484434976231656
Energy: 1.019884054509173
Energy: 1.0484434976236696
Energy: 1.0198840545086694
Energy: 1.0088358910563335
Energy: 1.0538886380472519
Energy: 1.0088358910568374
Energy: 1.0538886380472519
Energy: 1.0088358910553255
Energy: 1.0538886380472519
Energy: 1.0813411697930615
Energy: 0.9846347126199689
Energy: 1.0813411697930615
Energy: 0.9846347126199689
Energy: 1.0813411697920996
Energy: 0.9846347126199689
Energy: 1.0334944508737907
Energy: 1.019293274734385
Energy: 1.0334944508742947
Energy: 1.019293274734385
Energy: 1.0334944508742947
Energy: 1.019293274734385
Energy: 0.9903164277217567
Energy: 1.0004092301390115
Energy: 0.990316427720749
Energy: 1.0004092301385075
Energy: 0.9903164277222606
Energy: 1.0004092301390115
Energy: 1.047201493462836
Energy: 0.9924934435598738
Energy: 1.047201493462836
Energy: 0.9924934435608814
Energy: 1.0472014934643477
Energy: 0.9924934435588659
Energy: 1.0219187528068083
Energy: 1.0001887575761739
Energy: 1.0219187528073121
Energy: 1.0001887575761739
Energy: 1.0219187528068083
Energy: 1.0001887575761739
Energy: 1.0540644574612241
Energy: 0.9709674208518291
Energy: 1.0540644574597124
Energy: 0.9709674208513254
Energy: 1.0540644574602163
Energy: 0.9709674208508214
Energy: 1.0416234631213608
Energy: 1.0390232879202181
Energy: 1.0416234631223684
Energy: 1.0390232879197143
Energy: 1.0416234631213608
Energy: 1.0390232879212258
Energy: 1.0200444706649856
Energy: 1.023799192818162
Energy: 1.0200444706649856
Energy: 1.023799192817658
Energy: 1.0200444706634741
Energy: 1.023799192817658
Energy: 1.1144122606004654
Energy: 1.039035168544021
Energy: 1.1144122606014732
Energy: 1.0390351685435169
Energy: 1.1144122606014732
Energy: 1.0390351685430133
Energy: 0.9891895074771869
Energy: 1.0408047636914026
Energy: 0.9891895074766832
Energy: 1.0408047636919064
Energy: 0.9891895074761793
Energy: 1.0408047636914026
Energy: 0.9719917985713427
Energy: 1.0246679983333995
Energy: 0.9719917985708388
Energy: 1.0246679983339035
Energy: 0.9719917985693273
Energy: 1.0246679983339035
Energy: 1.0600053762540036
Energy: 1.0533414250501103
Energy: 1.0600053762540036
Energy: 1.0533414250506141
Energy: 1.0600053762545074
Energy: 1.0533414250501103
Energy: 1.0507679413329643
Energy: 0.9443903753995123
Energy: 1.0507679413329643
Energy: 0.9443903754000162
Energy: 1.0507679413334683
Energy: 0.9443903753995123
Energy: 1.0113561612113782
Energy: 1.0194006384997851
Energy: 1.0113561612103705
Energy: 1.0194006384992813
Energy: 1.0113561612113782
Energy: 1.0194006384997851
Energy: 1.051652022502531
Energy: 1.0181726485039233
Energy: 1.0516520225020272
Energy: 1.0181726485039233
Energy: 1.051652022502531
Energy: 1.0181726485034195
Energy: 0.989426407203499
Energy: 1.0017875145791852
Energy: 0.9894264072045069
Energy: 1.001787514579689
Energy: 0.9894264072040029
Energy: 1.001787514579689
Energy: 1.0140828964093513
Energy: 1.0089445428676116
Energy: 1.014082896409855
Energy: 1.0089445428676116
Energy: 1.014082896409855
Energy: 1.0089445428676116
Energy: 1.0546448783277238
Energy: 0.9476815853881619
Energy: 1.0546448783272195
Energy: 0.947681585387658
Energy: 1.0546448783287314
Energy: 0.9476815853881619
Energy: 1.0601337989105033
Energy: 1.0370853251533483
Energy: 1.0601337989089914
Energy: 1.0370853251548602
Energy: 1.060133798911511
Energy: 1.0370853251523866
Energy: 0.9734646315917899
Energy: 1.0270022725040808
Energy: 0.9734646315933015
Energy: 1.0270022725040808
Energy: 0.9734646315907822
Energy: 1.0270022725040808
Energy: 0.9855110986140672
Energy: 0.9568660766267055
Energy: 0.9855110986140672
Energy: 0.9568660766267055
Energy: 0.9855110986130593
Energy: 0.9568660766267055
Energy: 1.104654913474466
Energy: 1.0559737644016807
Energy: 1.104654913474466
Energy: 1.0559737644011769
Energy: 1.104654913474466
Energy: 1.0559737644016807
Energy: 1.039285558119293
Energy: 1.0394272785403276
Energy: 1.0392855581177816
Energy: 1.0394272785403276
Energy: 1.0392855581203009
Energy: 1.0394272785408314
Energy: 1.0389045338528877
Energy: 1.0464301639065825
Energy: 1.0389045338528877
Energy: 1.046430163906079
Energy: 1.038904533852384
Energy: 1.0464301639055749
Energy: 1.05032922789874
Energy: 1.0054036090850558
Energy: 1.0503292278972285
Energy: 1.0054036090850558
Energy: 1.0503292278982361
Energy: 1.0054036090850558
Energy: 1.0199643870760686
Energy: 1.0227767132888748
Energy: 1.019964387075061
Energy: 1.0227767132888748
Energy: 1.019964387075061
Energy: 1.0227767132888748
Energy: 1.0570862666628031
Energy: 0.9979432532247674
Energy: 1.0570862666617955
Energy: 0.9979432532242637
Energy: 1.0570862666622995
Energy: 0.9979432532247674
Energy: 0.9954650948126131
Energy: 0.9969195553891802
Energy: 0.9954650948126131
Energy: 0.9969195553891802
Energy: 0.9954650948121092
Energy: 0.9969195553886763

minimum gb energy = 0.9443903753995123 eV
minimum distance =  2.20910437622575 Angstroms
sigma value = 41


========================================
theta = 129.5211963586422
========================================

Energy: 1.0821012021098972
Energy: 1.0821088280866353
Energy: 1.0821012021098972
Energy: 1.0821088280852598
Energy: 1.0821012021085217
Energy: 1.0821088280866353
Energy: 1.0977405266358837
Energy: 1.057833744705642
Energy: 1.0977405266331322
Energy: 1.057833744705642
Energy: 1.0977405266358837
Energy: 1.0578337447070179
Energy: 1.3000938533106565
Energy: 1.0804182159351658
Energy: 1.3000938533120323
Energy: 1.0804182159351658
Energy: 1.3000938533106565
Energy: 1.0804182159365416
Energy: 1.122023121512263
Energy: 1.1139824992940526
Energy: 1.122023121512263
Energy: 1.1139824992926768
Energy: 1.122023121512263
Energy: 1.1139824992926768
Energy: 1.0667230045333123
Energy: 1.0615827770750974
Energy: 1.0667230045333123
Energy: 1.0615827770750974
Energy: 1.0667230045333123
Energy: 1.0615827770764734
Energy: 1.1686905600434456
Energy: 1.147522333828387
Energy: 1.1686905600434456
Energy: 1.1475223338297629
Energy: 1.1686905600434456
Energy: 1.147522333828387
Energy: 1.143333162872682
Energy: 1.0257119062528472
Energy: 1.1433331628740575
Energy: 1.0257119062528472
Energy: 1.1433331628740575
Energy: 1.0257119062528472
Energy: 1.1712983869242426
Energy: 1.0434398443504944
Energy: 1.1712983869242426
Energy: 1.0434398443504944
Energy: 1.1712983869242426
Energy: 1.0434398443504944
Energy: 1.0961373013680211
Energy: 1.0472350733095244
Energy: 1.0961373013680211
Energy: 1.0472350733081486
Energy: 1.0961373013680211
Energy: 1.0472350733095244
Energy: 1.084214815846336
Energy: 1.075658003038155
Energy: 1.084214815846336
Energy: 1.075658003038155
Energy: 1.084214815846336
Energy: 1.075658003038155
Energy: 1.193507579406286
Energy: 1.0901059202734058
Energy: 1.1935075794076617
Energy: 1.0901059202734058
Energy: 1.1935075794076617
Energy: 1.0901059202734058
Energy: 1.178945976960217
Energy: 1.0578594228055223
Energy: 1.178945976960217
Energy: 1.0578594228055223
Energy: 1.178945976960217
Energy: 1.0578594228055223
Energy: 1.182900657905185
Energy: 1.1306809739127939
Energy: 1.182900657905185
Energy: 1.1306809739127939
Energy: 1.182900657905185
Energy: 1.1306809739127939
Energy: 1.0694188489022618
Energy: 1.0940869090022407
Energy: 1.0694188489022618
Energy: 1.0940869090022407
Energy: 1.0694188489022618
Energy: 1.0940869090022407

minimum gb energy = 1.0257119062528472 eV
minimum distance =  2.19791738153683 Angstroms
sigma value = 11


========================================
theta = 135.99657265110037
========================================

Energy: 1.1827297711883489
Energy: 1.241711483145948
Energy: 1.1827297711883489
Energy: 1.2417114831453435
Energy: 1.1827297711877445
Energy: 1.2417114831453435
Energy: 1.2191764176838684
Energy: 1.1669130276577695
Energy: 1.2191764176838684
Energy: 1.1669130276571653
Energy: 1.219176417685077
Energy: 1.1669130276571653
Energy: 1.2301155815855285
Energy: 1.1629837126935
Energy: 1.2301155815861324
Energy: 1.1629837126935
Energy: 1.2301155815855285
Energy: 1.1629837126935
Energy: 1.205915458499181
Energy: 1.1290434091051065
Energy: 1.2059154584997853
Energy: 1.1290434091051065
Energy: 1.2059154584979723
Energy: 1.1290434091051065
Energy: 1.2190375863586371
Energy: 1.1388747529373284
Energy: 1.2190375863562197
Energy: 1.1388747529373284
Energy: 1.2190375863574285
Energy: 1.138874752937933
Energy: 1.1627451296462301
Energy: 1.2730949935801625
Energy: 1.1627451296462301
Energy: 1.2730949935801625
Energy: 1.1627451296468345
Energy: 1.2730949935801625
Energy: 1.139905765863499
Energy: 1.20127773515523
Energy: 1.1399057658622902
Energy: 1.2012777351546255
Energy: 1.1399057658622902
Energy: 1.2012777351546255
Energy: 1.1304469231094716
Energy: 1.166746483459015
Energy: 1.1304469231076586
Energy: 1.166746483459015
Energy: 1.1304469231088672
Energy: 1.166746483459015
Energy: 1.241410883431682
Energy: 1.171989209747007
Energy: 1.241410883429869
Energy: 1.171989209747007
Energy: 1.241410883431682
Energy: 1.1719892097464026
Energy: 1.1403307708416224
Energy: 1.2027713054669098
Energy: 1.1403307708428312
Energy: 1.2027713054669098
Energy: 1.1403307708422266
Energy: 1.2027713054669098
Energy: 1.1730976674123241
Energy: 1.1845218764159795
Energy: 1.1730976674129288
Energy: 1.184521876416584
Energy: 1.1730976674111155
Energy: 1.1845218764159795
Energy: 1.1761611790694493
Energy: 1.2672733586360887
Energy: 1.176161179070658
Energy: 1.2672733586360887
Energy: 1.1761611790700537
Energy: 1.2672733586360887
Energy: 1.2063817427245158
Energy: 1.210149188544063
Energy: 1.2063817427245158
Energy: 1.210149188544063
Energy: 1.2063817427251202
Energy: 1.210149188544063
Energy: 1.2156282052634158
Energy: 1.1814486180670267
Energy: 1.2156282052634158
Energy: 1.1814486180670267
Energy: 1.2156282052634158
Energy: 1.1814486180664223
Energy: 1.1635154634863256
Energy: 1.185725179745689
Energy: 1.16351546348693
Energy: 1.185725179745689
Energy: 1.1635154634863256
Energy: 1.185725179745689
Energy: 1.1420502976101332
Energy: 1.2291015106206291
Energy: 1.1420502976095288
Energy: 1.2291015106206291
Energy: 1.1420502976101332
Energy: 1.2291015106200247
Energy: 1.145515735864581
Energy: 1.184122665463963
Energy: 1.1455157358639765
Energy: 1.184122665463963
Energy: 1.1455157358621635
Energy: 1.184122665463963
Energy: 1.2024138126648212
Energy: 1.1814619071851942
Energy: 1.20241381266603
Energy: 1.1814619071857981
Energy: 1.2024138126648212
Energy: 1.1814619071851942
Energy: 1.1749757533966454
Energy: 1.1211002380280075
Energy: 1.1749757533954364
Energy: 1.121100238027403
Energy: 1.1749757533966454
Energy: 1.1211002380280075
Energy: 1.247599105661251
Energy: 1.1217454300324359
Energy: 1.2475991056606464
Energy: 1.12174543003304
Energy: 1.247599105661251
Energy: 1.1217454300324359
Energy: 1.238457138848711
Energy: 1.1776976682423044
Energy: 1.238457138848711
Energy: 1.1776976682429086
Energy: 1.238457138848711
Energy: 1.1776976682429086
Energy: 1.1820386040338278
Energy: 1.258623319693475
Energy: 1.1820386040338278
Energy: 1.258623319693475
Energy: 1.1820386040326192
Energy: 1.258623319692898
Energy: 1.2314391961539868
Energy: 1.1631954519127299
Energy: 1.2314391961533824
Energy: 1.1631954519121255
Energy: 1.231439196154591
Energy: 1.1631954519127299
Energy: 1.2590270558448171
Energy: 1.1676500997760135
Energy: 1.2590270558448171
Energy: 1.1676500997760135
Energy: 1.259027055844213
Energy: 1.1676500997760135
Energy: 1.1498946021082412
Energy: 1.2016437830021156
Energy: 1.1498946021088456
Energy: 1.20164378300272
Energy: 1.1498946021070324
Energy: 1.2016437830021156
Energy: 1.1433413940242623
Energy: 1.1596266984463426
Energy: 1.1433413940236579
Energy: 1.1596266984469465
Energy: 1.1433413940242623
Energy: 1.1596266984469465
Energy: 1.153767175759638
Energy: 1.21949897713069
Energy: 1.1537671757590335
Energy: 1.2194989771300857
Energy: 1.153767175759638
Energy: 1.2194989771300857
Energy: 1.1728075942102636
Energy: 1.2128695300806824
Energy: 1.1728075942090548
Energy: 1.2128695300806824
Energy: 1.1728075942084504
Energy: 1.2128695300806824
Energy: 1.2038127928802864
Energy: 1.1421787076438301
Energy: 1.2038127928790776
Energy: 1.1421787076438301
Energy: 1.203812792879682
Energy: 1.1421787076438301
Energy: 1.1788039784895235
Energy: 1.2163292651301643
Energy: 1.1788039784901279
Energy: 1.2163292651301643
Energy: 1.1788039784895235
Energy: 1.2163292651301643
Energy: 1.1389647227883022
Energy: 1.2198154590181818
Energy: 1.1389647227883022
Energy: 1.2198154590187862
Energy: 1.1389647227876976
Energy: 1.2198154590187862

minimum gb energy = 1.121100238027403 eV
minimum distance =  2.18881129079591 Angstroms
sigma value = 57


========================================
theta = 141.05755873101862
========================================

Energy: 1.006959588512771
Energy: 1.082275267451976
Energy: 1.006959588512771
Energy: 1.082275267451976
Energy: 1.0069595885116953
Energy: 1.082275267451976
Energy: 1.07522351217229
Energy: 1.1309880357723956
Energy: 1.0752235121690634
Energy: 1.1309880357723956
Energy: 1.075223512176592
Energy: 1.1309880357723956
Energy: 1.1768994440831264
Energy: 1.1283422849181073
Energy: 1.1768994440831264
Energy: 1.1283422849181073
Energy: 1.1768994440831264
Energy: 1.1283422849181073
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.1768434442960576
Energy: 1.1283977570190147
Energy: 1.1768434442960576
Energy: 1.1283977570190147
Energy: 1.1768434442960576
Energy: 1.1283977570190147
Energy: 1.0764943892806742
Energy: 1.130922781617815
Energy: 1.0764943892817496
Energy: 1.130922781617815
Energy: 1.0764943892817496
Energy: 1.130922781617815
Energy: 1.0069595885116953
Energy: 1.082275267456278
Energy: 1.0069595885116953
Energy: 1.082275267456278
Energy: 1.00695958851062
Energy: 1.082275267456278
Energy: 1.07522351217229
Energy: 1.1309880357766973
Energy: 1.075223512170139
Energy: 1.1309880357766973
Energy: 1.0752235121712146
Energy: 1.1309880357766973
Energy: 1.176899444082051
Energy: 1.1283422849181073
Energy: 1.1768994440809755
Energy: 1.1283422849181073
Energy: 1.1768994440809755
Energy: 1.128342284917032
Energy: 1.1618113129495466
Energy: 1.2751778678889045
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.1768434442971332
Energy: 1.128397757017939
Energy: 1.1768434442982088
Energy: 1.1283977570190147
Energy: 1.1768434442982088
Energy: 1.1283977570190147
Energy: 1.076494389284976
Energy: 1.1309227816188903
Energy: 1.0764943892828251
Energy: 1.1309227816188903
Energy: 1.0764943892839005
Energy: 1.130922781617815
Energy: 1.006959588512771
Energy: 1.082275267451976
Energy: 1.006959588512771
Energy: 1.082275267451976
Energy: 1.0069595885116953
Energy: 1.082275267451976
Energy: 1.0752235121712146
Energy: 1.1309880357734712
Energy: 1.0752235121712146
Energy: 1.1309880357723956
Energy: 1.0752235121712146
Energy: 1.1309880357723956
Energy: 1.1768994440831264
Energy: 1.1283422849181073
Energy: 1.176899444082051
Energy: 1.1283422849181073
Energy: 1.1768994440831264
Energy: 1.1283422849181073
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.161811312948471
Energy: 1.2751778678889045
Energy: 1.1618113129495466
Energy: 1.2751778678889045
Energy: 1.1768434442960576
Energy: 1.1283977570190147
Energy: 1.1768434442960576
Energy: 1.1283977570190147
Energy: 1.1768434442949822
Energy: 1.1283977570190147

minimum gb energy = 1.00695958851062 eV
minimum distance =  2.27371905925612 Angstroms
sigma value = 9


========================================
theta = 148.41366190347208
========================================

Energy: 1.2073854639586283
Energy: 1.173999197309947
Energy: 1.2073854639577504
Energy: 1.173999197309947
Energy: 1.2073854639603847
Energy: 1.173999197309947
Energy: 1.1978061955223793
Energy: 1.2578039272560824
Energy: 1.1978061955241353
Energy: 1.2578039272560824
Energy: 1.1978061955223793
Energy: 1.2578039272569606
Energy: 1.1535884936293515
Energy: 1.2071418348354124
Energy: 1.1535884936293515
Energy: 1.2071418348362504
Energy: 1.1535884936302294
Energy: 1.2071418348362504
Energy: 1.186143051576699
Energy: 1.181482068397482
Energy: 1.186143051576699
Energy: 1.181482068397482
Energy: 1.186143051576699
Energy: 1.1814820683983602
Energy: 1.2003924066139429
Energy: 1.2235190537668241
Energy: 1.2003924066156992
Energy: 1.2235190537668241
Energy: 1.2003924066139429
Energy: 1.2235190537668241
Energy: 1.1155380826788417
Energy: 1.2564462073293523
Energy: 1.1155380826814758
Energy: 1.2564462073293523
Energy: 1.1155380826805978
Energy: 1.2564462073284743
Energy: 1.158409327442448
Energy: 1.1739941068548543
Energy: 1.1584093274433263
Energy: 1.1739941068548543
Energy: 1.1584093274433263
Energy: 1.1739941068548543
Energy: 1.1262479368547815
Energy: 1.2382619269767752
Energy: 1.1262479368530252
Energy: 1.2382619269767752
Energy: 1.1262479368539031
Energy: 1.2382619269767752
Energy: 1.244377605182308
Energy: 1.2596370136292958
Energy: 1.244377605182308
Energy: 1.2596370136301742
Energy: 1.24437760518143
Energy: 1.2596370136310522
Energy: 1.15890035518383
Energy: 1.1599132660996336
Energy: 1.15890035518383
Energy: 1.1599132660996336
Energy: 1.15890035518383
Energy: 1.1599132660987554
Energy: 1.1619288013854363
Energy: 1.1955267849403497
Energy: 1.1619288013845583
Energy: 1.1955267849412279
Energy: 1.1619288013854363
Energy: 1.1955267849394715
Energy: 1.167463999925417
Energy: 1.1835051992549308
Energy: 1.167463999926295
Energy: 1.1835051992540528
Energy: 1.167463999926295
Energy: 1.1835051992540528
Energy: 1.183937630678051
Energy: 1.2453114897404387
Energy: 1.1839376306771727
Energy: 1.245311489741317
Energy: 1.1839376306762948
Energy: 1.245311489741317
Energy: 1.249772437607369
Energy: 1.2507809738250404
Energy: 1.2497724376056125
Energy: 1.2507809738250404
Energy: 1.2497724376064907
Energy: 1.2507809738250404
Energy: 1.164205558122823
Energy: 1.278284780762593
Energy: 1.1642055581254573
Energy: 1.278284780762593
Energy: 1.1642055581219448
Energy: 1.278284780762593
Energy: 1.2584401926178874
Energy: 1.1686644922905047
Energy: 1.2584401926178874
Energy: 1.1686644922905047
Energy: 1.2584401926178874
Energy: 1.1686644922905047
Energy: 1.246451813297647
Energy: 1.2139633955225757
Energy: 1.2464518133002818
Energy: 1.2139633955216977
Energy: 1.246451813296769
Energy: 1.2139633955216977
Energy: 1.1933784800963578
Energy: 1.2112266055622016
Energy: 1.1933784800946015
Energy: 1.2112266055630796
Energy: 1.1933784800946015
Energy: 1.2112266055622016
Energy: 1.1799568981882604
Energy: 1.2332411866464414
Energy: 1.179956898191773
Energy: 1.2332411866464414
Energy: 1.1799568981891386
Energy: 1.2332411866464414
Energy: 1.2385998253292447
Energy: 1.1929551204138413
Energy: 1.2385998253292447
Energy: 1.1929551204138413
Energy: 1.2385998253292447
Energy: 1.1929551204147195
Energy: 1.1645092128306487
Energy: 1.1821461451215007
Energy: 1.1645092128288923
Energy: 1.1821461451215007
Energy: 1.1645092128306487
Energy: 1.1821461451215007

minimum gb energy = 1.1155380826788417 eV
minimum distance =  2.21446098956869 Angstroms
sigma value = 27


========================================
theta = 153.4746479833903
========================================

Energy: 1.3521599654722156
Energy: 1.4013747577272
Energy: 1.3099535781809917
Energy: 1.40137475772646
Energy: 1.3521599654722156
Energy: 1.4013747577227589
Energy: 1.1633900730630529
Energy: 1.165255703995685
Energy: 1.1633900730630529
Energy: 1.1652557039964253
Energy: 1.1633900730623126
Energy: 1.1652557039942046
Energy: 1.1517544118327412
Energy: 1.2190459775285662
Energy: 1.1517544118320346
Energy: 1.2190459775278262
Energy: 1.1517544118320346
Energy: 1.2190459775285662
Energy: 1.1797053268175894
Energy: 1.2914603013592947
Energy: 1.1797053268220306
Energy: 1.2914603013592947
Energy: 1.1797053268175894
Energy: 1.2914603013511525
Energy: 1.1976465169061774
Energy: 1.1379102298275412
Energy: 1.1976465169083979
Energy: 1.1379102298275412
Energy: 1.1976465169061774
Energy: 1.1379102298290216
Energy: 1.2626836010182498
Energy: 1.2976464619087933
Energy: 1.2626836010182498
Energy: 1.2976464619095334
Energy: 1.2626836010182498
Energy: 1.297646461905092
Energy: 1.1957557302405875
Energy: 1.1622226434465865
Energy: 1.195755730242808
Energy: 1.1622226434465865
Energy: 1.1957557302405875
Energy: 1.1622226434465865
Energy: 1.2447545925471886
Energy: 1.1510592762536143
Energy: 1.2447545925501158
Energy: 1.1510592762536143
Energy: 1.2447545925471886
Energy: 1.1510592762499134
Energy: 1.2219430425312916
Energy: 1.194460727322113
Energy: 1.2219413442027822
Energy: 1.1944607273213728
Energy: 1.2219430425305513
Energy: 1.1944607273280345
Energy: 1.2796264973788916
Energy: 1.15945338517819
Energy: 1.2796775350783114
Energy: 1.15945338517819
Energy: 1.2796264973788916
Energy: 1.1594533851796704
Energy: 1.294317289545768
Energy: 1.1660997725877558
Energy: 1.2943290782012753
Energy: 1.1660997725870155
Energy: 1.294317289546508
Energy: 1.1660997725899764
Energy: 1.1634479205035395
Energy: 1.1946595454163307
Energy: 1.1634479205027992
Energy: 1.1946595454163307
Energy: 1.1634479205035395
Energy: 1.19465954541337
Energy: 1.1515081776514893
Energy: 1.245776430802241
Energy: 1.1515081776507492
Energy: 1.2457764308015007
Energy: 1.1515081776514893
Energy: 1.2457764308089028
Energy: 1.1874320851942368
Energy: 1.0864326761940293
Energy: 1.187432085194977
Energy: 1.0864326761940293
Energy: 1.1874320851942368
Energy: 1.086432676193289
Energy: 1.340520973016677
Energy: 1.303840476726705
Energy: 1.343258132717452
Energy: 1.303840476726705
Energy: 1.340520973016677
Energy: 1.3038404767237444
Energy: 1.1700968474167828
Energy: 1.1377622537957652
Energy: 1.1700968474130815
Energy: 1.1377622537950252
Energy: 1.1700968474160425
Energy: 1.1377622537972456
Energy: 1.2074944048335607
Energy: 1.1526660886684434
Energy: 1.2074944048372618
Energy: 1.1526660886691835
Energy: 1.2074944048350413
Energy: 1.152666088663262
Energy: 1.293479638518756
Energy: 1.1208209493947436
Energy: 1.2934796385172755
Energy: 1.1208209493954837
Energy: 1.293479638518756
Energy: 1.120820949388082
Energy: 1.105560665995428
Energy: 1.1995648808355064
Energy: 1.0202169877699947
Energy: 1.199564880834766
Energy: 1.105560665995428
Energy: 1.1995648808266242
Energy: 1.3521599654714755
Energy: 1.4013747577227589
Energy: 1.309953578182472
Energy: 1.4013747577227589
Energy: 1.3521599654714755
Energy: 1.4013747577227589
Energy: 1.163390073060092
Energy: 1.1652557040001261
Energy: 1.1633900730608322
Energy: 1.1652557040001261
Energy: 1.163390073059352
Energy: 1.1652557039993858
Energy: 1.1517544118320346
Energy: 1.2190459775270859
Energy: 1.1517544118290741
Energy: 1.2190459775270859
Energy: 1.1517544118320346
Energy: 1.2190459775270859
Energy: 1.1797053268175894
Energy: 1.2914603013622554
Energy: 1.1797053268220306
Energy: 1.2914603013615154
Energy: 1.1797053268175894
Energy: 1.2914603013541135
Energy: 1.1976465169083979
Energy: 1.1379102298275412
Energy: 1.1976465169091381
Energy: 1.1379102298275412
Energy: 1.1976465169083979
Energy: 1.1379102298282813
Energy: 1.2626836010197304
Energy: 1.2976464619117538
Energy: 1.2626836010204705
Energy: 1.2976464619117538
Energy: 1.2626836010197304
Energy: 1.297646461908053

minimum gb energy = 1.0202169877699947 eV
minimum distance =  2.21980836509929 Angstroms
sigma value = 19


========================================
theta = 157.15649268207542
========================================

Energy: 1.2161725460371353
Energy: 1.3170424165358532
Energy: 1.2161725460371353
Energy: 1.3170424165364922
Energy: 1.2161725460371353
Energy: 1.3170424165364922
Energy: 1.164975582188879
Energy: 1.196065926782378
Energy: 1.164975582188879
Energy: 1.196065926782378
Energy: 1.164975582188879
Energy: 1.196065926782378
Energy: 1.1604832204533158
Energy: 1.1676475902210672
Energy: 1.1604832204539548
Energy: 1.1676475902210672
Energy: 1.1604832204539548
Energy: 1.1676475902210672
Energy: 1.171370274596515
Energy: 1.144564803174508
Energy: 1.171370274596515
Energy: 1.144564803174508
Energy: 1.1713702745952372
Energy: 1.144564803175147
Energy: 1.1921231561815802
Energy: 1.2260813905867471
Energy: 1.1921231561815802
Energy: 1.2260813905867471
Energy: 1.1921231561815802
Energy: 1.2260813905867471
Energy: 1.136681690793592
Energy: 1.1803929008782166
Energy: 1.1366816907929531
Energy: 1.1803929008782166
Energy: 1.1366816907929531
Energy: 1.1803929008775775
Energy: 1.1513302507097587
Energy: 1.179074381258065
Energy: 1.1513302507116754
Energy: 1.179074381258065
Energy: 1.1513302507097587
Energy: 1.1790743812574263
Energy: 1.2069485077941329
Energy: 1.1865121493060453
Energy: 1.2069485077928552
Energy: 1.1865121493060453
Energy: 1.2069485077947717
Energy: 1.1865121493060453
Energy: 1.1151936915335943
Energy: 1.1407801754125544
Energy: 1.1151936915335943
Energy: 1.1407801754112765
Energy: 1.115193691534233
Energy: 1.1407801754119153
Energy: 1.1682688726987496
Energy: 1.1468920056840022
Energy: 1.1682688726987496
Energy: 1.1468920056846412
Energy: 1.1682688726981105
Energy: 1.1468920056840022
Energy: 1.1531723056526841
Energy: 1.178548167060782
Energy: 1.1531723056526841
Energy: 1.178548167060782
Energy: 1.153172305652045
Energy: 1.1785481670601432
Energy: 1.1829745871821729
Energy: 1.175545672928202
Energy: 1.1829745871828117
Energy: 1.175545672928202
Energy: 1.1829745871821729
Energy: 1.175545672928202
Energy: 1.1625822633224148
Energy: 1.1850103399793608
Energy: 1.1625822633224148
Energy: 1.1850103399799998
Energy: 1.162582263321137
Energy: 1.1850103399799998
Energy: 1.1816856523108326
Energy: 1.1203103193504766
Energy: 1.1816856523114714
Energy: 1.1203103193504766
Energy: 1.1816856523114714
Energy: 1.1203103193504766
Energy: 1.1933264997648658
Energy: 1.1932389126363936
Energy: 1.1933264997655046
Energy: 1.1932389126363936
Energy: 1.1933264997661437
Energy: 1.1932389126357548
Energy: 1.165111075024354
Energy: 1.1641320632586332
Energy: 1.165111075024354
Energy: 1.1641320632586332
Energy: 1.165111075023715
Energy: 1.1641320632586332
Energy: 1.1571088709422264
Energy: 1.1211597052100362
Energy: 1.1571088709422264
Energy: 1.1211597052106752
Energy: 1.1571088709415873
Energy: 1.1211597052106752
Energy: 1.1888812816704775
Energy: 1.1799197823008465
Energy: 1.1888812816704775
Energy: 1.1799197823008465
Energy: 1.1888812816698386
Energy: 1.1799197823008465
Energy: 1.069504409160411
Energy: 1.2142768823280945
Energy: 1.069504409160411
Energy: 1.2142768823274557
Energy: 1.06950440916105
Energy: 1.2142768823280945
Energy: 1.1910549019313144
Energy: 1.1505875530067342
Energy: 1.1910549019313144
Energy: 1.1505875530054563
Energy: 1.1910549019306753
Energy: 1.1505875530086511
Energy: 1.1449968746584152
Energy: 1.1937718620281645
Energy: 1.144996874659693
Energy: 1.1937718620281645
Energy: 1.144996874659054
Energy: 1.1937718620288036
Energy: 1.1770969893029901
Energy: 1.163840155368747
Energy: 1.1770969893029901
Energy: 1.163840155368747
Energy: 1.1770969893023513
Energy: 1.163840155368747
Energy: 1.2026350420920213
Energy: 1.2395866377436724
Energy: 1.2026350420907435
Energy: 1.2395866377436724
Energy: 1.2026350420920213
Energy: 1.2395866377436724
Energy: 1.2505961206902991
Energy: 1.0845664595318776
Energy: 1.250596120690938
Energy: 1.0845664595325166
Energy: 1.250596120691577
Energy: 1.0845664595318776
Energy: 1.139218674566372
Energy: 1.1648115879008463
Energy: 1.1392186745657331
Energy: 1.1648115879014853
Energy: 1.1392186745657331
Energy: 1.1648115879014853
Energy: 1.1900843824606444
Energy: 1.1660391523281421
Energy: 1.1900843824606444
Energy: 1.1660391523281421
Energy: 1.1900843824606444
Energy: 1.166039152328781
Energy: 1.1503747929376809
Energy: 1.0995840659575833
Energy: 1.150374792936403
Energy: 1.0995840659575833
Energy: 1.1503747929370418
Energy: 1.0995840659575833
Energy: 1.1410031757468209
Energy: 1.2134765862555756
Energy: 1.141003175744904
Energy: 1.2134765862562145
Energy: 1.1410031757468209
Energy: 1.2134765862562145
Energy: 1.156686465444678
Energy: 1.2155980894818343
Energy: 1.156686465444039
Energy: 1.2155980894818343
Energy: 1.156686465444039
Energy: 1.2155980894818343

minimum gb energy = 1.069504409160411 eV
minimum distance =  2.19960483694037 Angstroms
sigma value = 101


========================================
theta = 159.95002427584853
========================================

Energy: 1.1879548229805468
Energy: 1.1306584588675102
Energy: 1.187954822978862
Energy: 1.1306584588675102
Energy: 1.1879548229799854
Energy: 1.1306584588675102
Energy: 1.1506381196527942
Energy: 1.1928935040558057
Energy: 1.1506381196511093
Energy: 1.1928935040558057
Energy: 1.1506381196527942
Energy: 1.1928935040563677
Energy: 1.2048984124438158
Energy: 1.1271112585809524
Energy: 1.2048984124460624
Energy: 1.1271112585809524
Energy: 1.2048984124443776
Energy: 1.1271112585815142
Energy: 1.10127524388635
Energy: 1.1590811456706558
Energy: 1.1012752438869116
Energy: 1.1590811456712176
Energy: 1.101275243887473
Energy: 1.1590811456706558
Energy: 1.0740596560789475
Energy: 1.1711896303010474
Energy: 1.0740596560772626
Energy: 1.1711896303010474
Energy: 1.0740596560778242
Energy: 1.1711896303010474
Energy: 1.119388508433307
Energy: 1.1044807548097084
Energy: 1.119388508433307
Energy: 1.1044807548102702
Energy: 1.1193885084316224
Energy: 1.1044807548097084
Energy: 1.1477379887587618
Energy: 1.1419283291090705
Energy: 1.1477379887582
Energy: 1.1419283291090705
Energy: 1.1477379887587618
Energy: 1.1419283291090705
Energy: 1.1128617142606287
Energy: 1.1409666187932366
Energy: 1.1128617142589436
Energy: 1.1409666187937986
Energy: 1.1128617142606287
Energy: 1.1409666187932366
Energy: 1.1201842666459296
Energy: 1.1154539184479695
Energy: 1.120184266646491
Energy: 1.1154539184479695
Energy: 1.1201842666459296
Energy: 1.115453918447408
Energy: 1.0924915215240678
Energy: 1.1416934034791257
Energy: 1.0924915215229445
Energy: 1.1416934034791257
Energy: 1.092491521522383
Energy: 1.1416934034785642
Energy: 1.1099276148651906
Energy: 1.121128678578967
Energy: 1.1099276148651906
Energy: 1.121128678578967
Energy: 1.1099276148651906
Energy: 1.1211286785795285
Energy: 1.1738492475854583
Energy: 1.1456009692305067
Energy: 1.173849247587143
Energy: 1.1456009692321916
Energy: 1.173849247587143
Energy: 1.1456009692305067
Energy: 1.0752561498032598
Energy: 1.1604840738596374
Energy: 1.0752561498032598
Energy: 1.1604840738590758
Energy: 1.075256149804383
Energy: 1.1604840738590758
Energy: 1.199104907121011
Energy: 1.0277259734242066
Energy: 1.1991049071221342
Energy: 1.0277259734242066
Energy: 1.199104907121011
Energy: 1.0277259734230832
Energy: 1.1512511675510735
Energy: 1.0905299251452027
Energy: 1.1512511675493886
Energy: 1.0905299251452027
Energy: 1.1512511675521966
Energy: 1.0905299251452027
Energy: 1.1493399335741588
Energy: 1.1094797030407642
Energy: 1.149339933575282
Energy: 1.1094797030402024
Energy: 1.149339933575282
Energy: 1.1094797030402024
Energy: 1.1043601698894023
Energy: 1.1603928184327097
Energy: 1.1043601698899639
Energy: 1.1603928184332712
Energy: 1.1043601698894023
Energy: 1.1603928184332712
Energy: 1.1030695272885112
Energy: 1.1512218978052735
Energy: 1.103069527287388
Energy: 1.1512218978052735
Energy: 1.1030695272885112
Energy: 1.1512218978052735
Energy: 1.119584723769917
Energy: 1.1150446548980626
Energy: 1.1195847237710403
Energy: 1.1150446548980626
Energy: 1.1195847237687937
Energy: 1.1150446548975006
Energy: 1.1817608507975477
Energy: 1.1417654265983417
Energy: 1.1817608507975477
Energy: 1.1417654265977797
Energy: 1.1817608507981092
Energy: 1.1417654265977797
Energy: 1.112446938572836
Energy: 1.1187211681835538
Energy: 1.1124469385733977
Energy: 1.1187211681835538
Energy: 1.112446938572836
Energy: 1.1187211681835538
Energy: 1.1697771028351758
Energy: 1.1078585250122852
Energy: 1.1697771028368609
Energy: 1.1078585250122852
Energy: 1.169777102836299
Energy: 1.1078585250128468
Energy: 1.0512771156715948
Energy: 1.1467320368812985
Energy: 1.051277115669961
Energy: 1.1467320368812985
Energy: 1.0512771156704717
Energy: 1.1467320368818603
Energy: 1.1013113235268515
Energy: 1.142322081568633
Energy: 1.1013113235285366
Energy: 1.1423220815697563
Energy: 1.1013113235268515
Energy: 1.142322081568633
Energy: 1.1747933802218558
Energy: 1.1900196031873616
Energy: 1.174793380222979
Energy: 1.1900196031873616
Energy: 1.174793380222979
Energy: 1.1900196031873616
Energy: 1.0740251485128258
Energy: 1.1468093052996864
Energy: 1.0740251485128258
Energy: 1.1468093052996864
Energy: 1.0740251485117027
Energy: 1.146809305300248
Energy: 1.1999891874070003
Energy: 1.0322127245141801
Energy: 1.199989187407562
Energy: 1.0322127245130568
Energy: 1.1999891874070003
Energy: 1.0322127245130568
Energy: 1.151235796782817
Energy: 1.090985314560976
Energy: 1.151235796782817
Energy: 1.0909853145615378
Energy: 1.1512357967839404
Energy: 1.0909853145615378
Energy: 1.084648375188439
Energy: 1.1094207336095656
Energy: 1.0846483751890006
Energy: 1.1094207336095656
Energy: 1.0846483751878773
Energy: 1.1094207336095656
Energy: 1.1408264156734635
Energy: 1.1592508827190304
Energy: 1.1408264156729018
Energy: 1.1592508827195922
Energy: 1.1408264156729018
Energy: 1.1592508827195922
Energy: 1.1006353456103268
Energy: 1.0285112931218194
Energy: 1.100635345612012
Energy: 1.0285112931218194
Energy: 1.1006353456103268
Energy: 1.0285112931212577
Energy: 1.0531783920136408
Energy: 1.143649150579094
Energy: 1.0531783920102713
Energy: 1.143649150579656
Energy: 1.0531783920147644
Energy: 1.143649150579094
Energy: 1.1703238371592932
Energy: 1.1451447124897205
Energy: 1.1703238371592932
Energy: 1.1451447124897205
Energy: 1.1703238371587317
Energy: 1.1451447124891585

minimum gb energy = 1.0277259734230832 eV
minimum distance =  2.21887586300484 Angstroms
sigma value = 33


========================================
theta = 180.0
========================================

Energy: 0.020530629378405184
Energy: 0.5917349083166468
Energy: 0.020530629377938533
Energy: 0.5917349083171135
Energy: 0.020530629378405184
Energy: 0.5917349083175801
Energy: 0.021297529487842942
Energy: 0.4770818946744103
Energy: 0.021297529487842942
Energy: 0.47708189467487694
Energy: 0.021297529487842942
Energy: 0.4770818946744103
Energy: 1.2550269298640304
Energy: 0.47688844272921477
Energy: 1.2550269298644972
Energy: 0.47688844240401035
Energy: 1.2550269298644972
Energy: 0.47688844231280597
Energy: 0.021297529490591004
Energy: 0.4770818946744103
Energy: 0.021297529490591004
Energy: 0.4770818946744103
Energy: 0.021297529490591004
Energy: 0.47708189467399553

minimum gb energy = 0.020530629377938533 eV
minimum distance =  2.4893776671828 Angstroms
sigma value = 1