Model name: model_name=MEAM_LAMMPS_PascuetFernandez_2015_AlU__MO_596300673917_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Al
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=4.049998879432679
cohesive_energy=3.360254209517775
mass=26.981538
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: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.5509113591400254
Energy: 0.7064304135688879
Energy: 0.5509113591398034
Energy: 0.7064304135691101
Energy: 0.5509113591398034
Energy: 0.7064304135688879
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.5509113591398034
Energy: 0.7064304135693599
Energy: 0.5509113591398034
Energy: 0.7064304135688879
Energy: 0.5509113591398034
Energy: 0.7064304135688879
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.01037439563585412
Energy: 0.5509113591398034
Energy: 0.5509113591398034
Energy: 0.7064304135693599
Energy: 0.5509113591398034
Energy: 0.7064304135691101
Energy: 0.5509113591395535
Energy: 0.7064304135688879

minimum gb energy = 0.01037439563585412 eV
minimum distance =  2.50074732730127 Angstroms
sigma value = 1


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

Energy: 0.7019627426710235
Energy: 0.6630522917348167
Energy: 0.7019627426710235
Energy: 0.6630522917348167
Energy: 0.7019627426710235
Energy: 0.6630522917348167
Energy: 0.7622149472743573
Energy: 0.595608185706902
Energy: 0.7622149472743573
Energy: 0.595608185706902
Energy: 0.7622149472743573
Energy: 0.595608185706902
Energy: 0.6333692303421731
Energy: 0.7469686504190981
Energy: 0.656351932784881
Energy: 0.7469686504190981
Energy: 0.6333692303421731
Energy: 0.7469686504190981
Energy: 0.7631196332105221
Energy: 0.6176354069119071
Energy: 0.7631196332111235
Energy: 0.6176354069119071
Energy: 0.7631196332105221
Energy: 0.6176354069119071
Energy: 0.6757691017670765
Energy: 0.7566250917496771
Energy: 0.6757691017670765
Energy: 0.7566250917496771
Energy: 0.6757691017670765
Energy: 0.7566250917496771
Energy: 0.7031691193741146
Energy: 0.6156541105596856
Energy: 0.7031691193741146
Energy: 0.6156541105596856
Energy: 0.7031691193741146
Energy: 0.6156541105596856
Energy: 0.6753074012570567
Energy: 0.7391953760307478
Energy: 0.6753074012570567
Energy: 0.7391953760307478
Energy: 0.6753074012570567
Energy: 0.7391953760307478
Energy: 0.6588813952560895
Energy: 0.750663572299669
Energy: 0.6588813952560895
Energy: 0.7506635723002704
Energy: 0.6588813952560895
Energy: 0.750663572299669
Energy: 0.7170732435404715
Energy: 0.6678113396008863
Energy: 0.7170732435404715
Energy: 0.6678113396008863
Energy: 0.717073243541073
Energy: 0.6678113396008863
Energy: 0.5946650555956121
Energy: 0.7554815955182627
Energy: 0.5946650555956121
Energy: 0.7554815955182627
Energy: 0.5946650555956121
Energy: 0.7554815955182627
Energy: 0.8252345140428387
Energy: 0.6057816081402135
Energy: 0.8252345140428387
Energy: 0.6057816081402135
Energy: 0.8252345140428387
Energy: 0.6057816081402135
Energy: 0.5635662447902776
Energy: 0.8226837370491209
Energy: 0.5635662447896762
Energy: 0.8226837370491209
Energy: 0.5635662447902776
Energy: 0.8226837370491209
Energy: 0.7512923360347973
Energy: 0.568850113518171
Energy: 0.7512923360353986
Energy: 0.568850113518171
Energy: 0.7512923360347973
Energy: 0.568850113518171
Energy: 0.6100167819519182
Energy: 0.704182488072508
Energy: 0.6100167819519182
Energy: 0.7041824880731095
Energy: 0.6100167819519182
Energy: 0.7041824880731095
Energy: 0.7767436658185388
Energy: 0.6160443516118658
Energy: 0.7767436658185388
Energy: 0.6160443516124673
Energy: 0.7767436658185388
Energy: 0.6160443516124673
Energy: 0.751615165056404
Energy: 0.6926103409883748
Energy: 0.7516151650558027
Energy: 0.6926103409883748
Energy: 0.751615165056404
Energy: 0.6926103409883748
Energy: 0.6858519381722883
Energy: 0.6711258588555742
Energy: 0.6858519381716869
Energy: 0.6711258588555742
Energy: 0.6858519381722883
Energy: 0.6711258588549727
Energy: 0.7212449054454124
Energy: 0.6294460031671223
Energy: 0.7212449054454124
Energy: 0.6294460031671223
Energy: 0.7212449054454124
Energy: 0.6294460031671223
Energy: 0.5910908768093258
Energy: 0.6307187284422668
Energy: 0.5910908768093258
Energy: 0.6307187284422668
Energy: 0.5910908768093258
Energy: 0.6307187284422668
Energy: 0.7136115785887741
Energy: 0.6158194395792016
Energy: 0.7136115785887741
Energy: 0.6158194395792016
Energy: 0.7136115785887741
Energy: 0.6158194395792016
Energy: 0.6069457599736738
Energy: 0.7596948613148771
Energy: 0.6069457599742752
Energy: 0.7596948613148771
Energy: 0.6069457599736738
Energy: 0.7596948613148771
Energy: 0.7534845739985536
Energy: 0.6730151407640307
Energy: 0.7534845739985536
Energy: 0.673015140764632
Energy: 0.7534845739985536
Energy: 0.6730151407640307
Energy: 0.5845138100602731
Energy: 0.7631880058028886
Energy: 0.5845138100608746
Energy: 0.7631880058028886
Energy: 0.5845138100608746
Energy: 0.76318800580349

minimum gb energy = 0.5635662447896762 eV
minimum distance =  2.56385536659046 Angstroms
sigma value = 33


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

Energy: 0.7580194463064358
Energy: 0.7143241757038264
Energy: 0.7299242374593883
Energy: 0.7143241757038264
Energy: 0.7580194463064358
Energy: 0.7143241757038264
Energy: 0.78417758174078
Energy: 0.622481816495455
Energy: 0.7841775817411221
Energy: 0.622481816495455
Energy: 0.78417758174078
Energy: 0.6224818164951129
Energy: 0.6036044336489788
Energy: 0.6510336181410844
Energy: 0.6036044336486367
Energy: 0.6510336181414265
Energy: 0.6036044336489788
Energy: 0.6510336181421107
Energy: 0.7544505535632282
Energy: 0.7202841347209445
Energy: 0.754450553562233
Energy: 0.7202841347209445
Energy: 0.7544505535629171
Energy: 0.7202841347223129
Energy: 0.683419332904139
Energy: 0.6650271037522343
Energy: 0.6834193329044811
Energy: 0.6650271037518921
Energy: 0.683419332903797
Energy: 0.6650271037522343
Energy: 0.6444105054679761
Energy: 0.5965173674960955
Energy: 0.6444105054666077
Energy: 0.5965173674964376
Energy: 0.6444105054679761
Energy: 0.5965173674960955
Energy: 0.7436200237256793
Energy: 0.6823159716616887
Energy: 0.7436200237263634
Energy: 0.6823159716613466
Energy: 0.7436200237256793
Energy: 0.6823159716603204
Energy: 0.5701922465470932
Energy: 0.7758729673624652
Energy: 0.5701922465467512
Energy: 0.7758729673624652
Energy: 0.5701922465474353
Energy: 0.7758729673624652
Energy: 0.6751312817356545
Energy: 0.594338158135539
Energy: 0.6751312817356545
Energy: 0.594338158135539
Energy: 0.6751312817356545
Energy: 0.5943381581348549
Energy: 0.6009706351133438
Energy: 0.7536569177219633
Energy: 0.6009750917908586
Energy: 0.7536569177223054
Energy: 0.6009706351133438
Energy: 0.7536569177223054
Energy: 0.7607303203521142
Energy: 0.599728424474721
Energy: 0.7607303203517721
Energy: 0.5997284244743788
Energy: 0.7607303203524564
Energy: 0.5997284244743788
Energy: 0.5924675444506741
Energy: 0.6502988346787834
Energy: 0.5924673243819685
Energy: 0.6502988346787834
Energy: 0.5924675444506741
Energy: 0.6502988346794676
Energy: 0.7823501300923511
Energy: 0.5809829833910035
Energy: 0.7823658093245323
Energy: 0.5809829833910035
Energy: 0.7823501300920089
Energy: 0.5809829833906613
Energy: 0.7358726257053047
Energy: 0.7256115171171533
Energy: 0.7358728666367654
Energy: 0.7256115171171533
Energy: 0.7358726257049626
Energy: 0.7256115171185219
Energy: 0.7141550451518729
Energy: 0.6595259354119821
Energy: 0.7141550451518729
Energy: 0.6595259354119821
Energy: 0.7141550451518729
Energy: 0.6595259354116401
Energy: 0.5966629839970194
Energy: 0.6536189820643525
Energy: 0.5966629839977036
Energy: 0.6536189820643525
Energy: 0.5966629839970194
Energy: 0.6536189820636683
Energy: 0.7199712131207301
Energy: 0.7274140618840207
Energy: 0.7199712131190195
Energy: 0.7274140618840207
Energy: 0.7199712131207301
Energy: 0.7274140618843629
Energy: 0.6837220540832454
Energy: 0.5943629637450343
Energy: 0.6837220540846138
Energy: 0.5943629637446922
Energy: 0.6837220540835874
Energy: 0.5943629637453763
Energy: 0.6390861503104511
Energy: 0.6393107818036919
Energy: 0.6390861503111354
Energy: 0.6393107818026655
Energy: 0.6390861503107932
Energy: 0.6393107818033498
Energy: 0.7381285182861408
Energy: 0.6812930462005256
Energy: 0.7381285182864828
Energy: 0.6812930462005256
Energy: 0.7381285182861408
Energy: 0.6812930461994992
Energy: 0.570647864657085
Energy: 0.7885076730299152
Energy: 0.5706478646557165
Energy: 0.7885076730299152
Energy: 0.570647864657085
Energy: 0.7885076730285469
Energy: 0.7065751025633923
Energy: 0.6004917492887604
Energy: 0.7065751025623659
Energy: 0.6004917492887604
Energy: 0.7065751025630502
Energy: 0.6004917492894447
Energy: 0.5989592293657318
Energy: 0.7731677812791611
Energy: 0.5989698679457796
Energy: 0.7731677812791611
Energy: 0.5989592293657318
Energy: 0.7731677812798452
Energy: 0.7667770454488269
Energy: 0.6664451318786203
Energy: 0.7667770454481427
Energy: 0.6664451318789624
Energy: 0.7667770454488269
Energy: 0.6664451318793044
Energy: 0.6038555686188
Energy: 0.6351553103848131
Energy: 0.6038368401736756
Energy: 0.6351553103844709
Energy: 0.6038555686188
Energy: 0.6351553103844709
Energy: 0.7894988154108374
Energy: 0.7002048457677661
Energy: 0.774629016411848
Energy: 0.7002048457677661
Energy: 0.7894988154108374
Energy: 0.7002048457684502
Energy: 0.7777249038748039
Energy: 0.7160750092844137
Energy: 0.7646698214084189
Energy: 0.7160750092844137
Energy: 0.7777249038748039
Energy: 0.7160750092857822
Energy: 0.5992743301113712
Energy: 0.6738216116372672
Energy: 0.5992743301117133
Energy: 0.673821611636925
Energy: 0.5992743301113712
Energy: 0.6738216116365829
Energy: 0.7548613606627321
Energy: 0.6321381761326471
Energy: 0.7548613606630742
Energy: 0.6321381761326471
Energy: 0.7548613606627321
Energy: 0.6321381761316208
Energy: 0.5976817601104527
Energy: 0.7959104436845049
Energy: 0.5976817601101105
Energy: 0.7959104436841629
Energy: 0.5976817601104527
Energy: 0.7959104436862156
Energy: 0.7776915736678293
Energy: 0.5943286615407155
Energy: 0.7776915736685134
Energy: 0.5943286615410577
Energy: 0.7776915736678293
Energy: 0.5943286615403734
Energy: 0.5869966814969342
Energy: 0.75432647759331
Energy: 0.5869966814972764
Energy: 0.75432647759331
Energy: 0.5869966814969342
Energy: 0.75432647759331
Energy: 0.7422925946444484
Energy: 0.6812966471730605
Energy: 0.7422925946458168
Energy: 0.6812966471730605
Energy: 0.7422925946441064
Energy: 0.6812966471723763
Energy: 0.6621427431792515
Energy: 0.7311312362624994
Energy: 0.6621427431795937
Energy: 0.7311312362621574
Energy: 0.6621427431792515
Energy: 0.7311312362618151
Energy: 0.656099867328745
Energy: 0.5924249309824068
Energy: 0.6560998673294293
Energy: 0.5924249309824068
Energy: 0.656099867328745
Energy: 0.5924249309824068
Energy: 0.7073393063868995
Energy: 0.733280765937543
Energy: 0.7073393063879257
Energy: 0.7332807659372009
Energy: 0.7073393063868995
Energy: 0.7332807659361747
Energy: 0.5964486698174449
Energy: 0.6831120042872935
Energy: 0.596450514647291
Energy: 0.6831120042872935
Energy: 0.5964486698174449
Energy: 0.6831120042855829
Energy: 0.6503730659697113
Energy: 0.639422734356972
Energy: 0.6503374303117057
Energy: 0.6394227343566299
Energy: 0.6503730659700534
Energy: 0.6394227343556036
Energy: 0.7357213243710744
Energy: 0.7279470934718625
Energy: 0.7357222723147693
Energy: 0.7279470934722045
Energy: 0.7357213243710744
Energy: 0.7279470934722045
Energy: 0.784679526138388
Energy: 0.580302416076897
Energy: 0.7846795261377038
Energy: 0.580302416076897
Energy: 0.7846795261380459
Energy: 0.580302416076897
Energy: 0.5924553853996253
Energy: 0.5853092016445064
Energy: 0.5924553853996253
Energy: 0.5853092016445064
Energy: 0.5924553853999673
Energy: 0.5853092016445064

minimum gb energy = 0.5701922465467512 eV
minimum distance =  2.66571787218395 Angstroms
sigma value = 51


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

Energy: 0.6625752512306364
Energy: 0.7428973096895735
Energy: 0.6625752512306364
Energy: 0.7428973096895735
Energy: 0.6625752512306364
Energy: 0.7428973096895735
Energy: 0.7244666027621349
Energy: 0.6328354834039568
Energy: 0.7244666027621349
Energy: 0.6328354834039568
Energy: 0.7244666027613423
Energy: 0.6328354834039568
Energy: 0.6500764527949638
Energy: 0.675919415173568
Energy: 0.6500764527949638
Energy: 0.6759194151727755
Energy: 0.6500764527949638
Energy: 0.6759194151727755
Energy: 0.6826962398778933
Energy: 0.5872796837809732
Energy: 0.6826962398778933
Energy: 0.5872796837809732
Energy: 0.6826962398778933
Energy: 0.5872796837809732
Energy: 0.6898187246858869
Energy: 0.7148641413820559
Energy: 0.6898187246858869
Energy: 0.7148641413820559
Energy: 0.6898187246858869
Energy: 0.7148641413820559
Energy: 0.6802725618334892
Energy: 0.6959997455371896
Energy: 0.6802725618326965
Energy: 0.6959997455371896
Energy: 0.6802725618326965
Energy: 0.6959997455371896
Energy: 0.698124229688647
Energy: 0.6482856565145434
Energy: 0.698124229688647
Energy: 0.6482856565145434
Energy: 0.698124229688647
Energy: 0.6482856565145434
Energy: 0.6146251003419841
Energy: 0.6591910261095763
Energy: 0.6146251003419841
Energy: 0.6591910261056131
Energy: 0.6146251003419841
Energy: 0.6591910261087837
Energy: 0.7740248983939069
Energy: 0.5884436788378524
Energy: 0.7740248983939069
Energy: 0.5884436788378524
Energy: 0.7740248983939069
Energy: 0.5884436788378524
Energy: 0.5839248819904114
Energy: 0.7456377765376846
Energy: 0.5839248819904114
Energy: 0.7456377765376846
Energy: 0.5839248819904114
Energy: 0.7456377765376846
Energy: 0.7656061324400342
Energy: 0.5761873835778827
Energy: 0.7656061324400342
Energy: 0.5761873835786754
Energy: 0.7656061324400342
Energy: 0.5761873835778827
Energy: 0.6644894858563976
Energy: 0.7236107606009081
Energy: 0.6644894858556051
Energy: 0.7236107606009081
Energy: 0.6644894858556051
Energy: 0.7236107606009081
Energy: 0.7491881032112697
Energy: 0.6462503109093765
Energy: 0.7491881032112697
Energy: 0.6462503109093765
Energy: 0.7491881032104771
Energy: 0.6462503109093765
Energy: 0.6751633685583246
Energy: 0.6153605029381369
Energy: 0.6751633685583246
Energy: 0.6153605029381369
Energy: 0.6751633685583246
Energy: 0.6153605029381369
Energy: 0.6859627519044222
Energy: 0.6856725379616897
Energy: 0.6859627519044222
Energy: 0.6856725379616897
Energy: 0.6859627519036297
Energy: 0.6856725379616897
Energy: 0.6951509997177107
Energy: 0.6742017869395648
Energy: 0.6951509997177107
Energy: 0.6742017869395648
Energy: 0.6951509997177107
Energy: 0.6742017869395648
Energy: 0.7026066268133425
Energy: 0.7509711607831162
Energy: 0.7026066268133425
Energy: 0.7509711607831162
Energy: 0.7026066268133425
Energy: 0.7509711607831162
Energy: 0.6829860745128749
Energy: 0.6481731624621535
Energy: 0.6829860745136676
Energy: 0.6481731624621535
Energy: 0.6829860745128749
Energy: 0.6481731624621535

minimum gb energy = 0.5761873835778827 eV
minimum distance =  2.46614369573029 Angstroms
sigma value = 19


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

Energy: 0.5825262130746902
Energy: 0.5932065047557757
Energy: 0.5577634794011828
Energy: 0.5932065047562459
Energy: 0.5825262130746902
Energy: 0.5932065047562459
Energy: 0.6897702418844869
Energy: 0.5634411721149276
Energy: 0.6897702418844869
Energy: 0.5634411721149276
Energy: 0.6897702418844869
Energy: 0.5634411721153978
Energy: 0.587261083528438
Energy: 0.5631140912597324
Energy: 0.587261083528438
Energy: 0.5631140912592622
Energy: 0.5872610835279678
Energy: 0.5631140912592622
Energy: 0.5870009580800121
Energy: 0.581815185685877
Energy: 0.5870009580800121
Energy: 0.581815185685428
Energy: 0.5870009580800121
Energy: 0.581815185685428
Energy: 0.5609061994478386
Energy: 0.5476326721435936
Energy: 0.5609061994483088
Energy: 0.5476326721440639
Energy: 0.5609061994478386
Energy: 0.5476326721440639
Energy: 0.5529311549195911
Energy: 0.5478682954439265
Energy: 0.5529311549200613
Energy: 0.5478682954434563
Energy: 0.5529311549200613
Energy: 0.5478682954434563
Energy: 0.617740568885457
Energy: 0.5818314867455505
Energy: 0.6177405688849869
Energy: 0.5818314867460207
Energy: 0.6177405688845167
Energy: 0.5818314867455505
Energy: 0.5833861179844954
Energy: 0.6417295749187437
Energy: 0.5833811113291251
Energy: 0.6417295749187437
Energy: 0.5833861179854357
Energy: 0.6417295749187437
Energy: 0.6899746370832777
Energy: 0.6523811923409042
Energy: 0.6899746370832777
Energy: 0.6523811923413744
Energy: 0.6899746370828075
Energy: 0.6523811923418444
Energy: 0.5577634794011828
Energy: 0.5932065047553057
Energy: 0.5577634794007127
Energy: 0.5932065047557757
Energy: 0.5577634794011828
Energy: 0.5932065047562459
Energy: 0.6897702418844869
Energy: 0.5634411721153978
Energy: 0.6897702418840166
Energy: 0.5634411721158681
Energy: 0.6897702418844869
Energy: 0.5634411721158681
Energy: 0.587261083528438
Energy: 0.5631140912597324
Energy: 0.5872610835279678
Energy: 0.5631140912597324
Energy: 0.5872610835274976
Energy: 0.5631140912597324
Energy: 0.5870009580800121
Energy: 0.5818398444653566
Energy: 0.5870009580795419
Energy: 0.5818398444653566
Energy: 0.5870009580800121
Energy: 0.5818398444648865
Energy: 0.5609061994483088
Energy: 0.5476326721431235
Energy: 0.560906199448779
Energy: 0.5476326721431235
Energy: 0.5609061994483088
Energy: 0.5476326721431235
Energy: 0.5529311549195911
Energy: 0.5478682954443966
Energy: 0.5529311549200613
Energy: 0.5478682954434563
Energy: 0.5529311549200613
Energy: 0.5478682954434563
Energy: 0.6177405688849869
Energy: 0.5818314867455505
Energy: 0.6177405688849869
Energy: 0.5818314867460207
Energy: 0.6177405688849869
Energy: 0.5818314867460207
Energy: 0.583428871036761
Energy: 0.6417295749192139
Energy: 0.5834923317035546
Energy: 0.6417295749182734
Energy: 0.583428871036761
Energy: 0.6417295749192139
Energy: 0.621708414141222
Energy: 0.6523811923409042
Energy: 0.6899746370837477
Energy: 0.6523811923409042
Energy: 0.621708414141222
Energy: 0.6523811923413744
Energy: 0.5825262130751603
Energy: 0.5932065047557757
Energy: 0.5577634794011828
Energy: 0.5932065047562459
Energy: 0.5825262130756306
Energy: 0.5932065047562459
Energy: 0.6897702418844869
Energy: 0.5634411721158681
Energy: 0.6897702418844869
Energy: 0.5634411721158681
Energy: 0.6897702418844869
Energy: 0.5634411721158681
Energy: 0.587261083528438
Energy: 0.5631140912592622
Energy: 0.587261083528438
Energy: 0.5631140912592622
Energy: 0.5872610835274976
Energy: 0.5631140912592622
Energy: 0.5870009580800121
Energy: 0.581815185685877
Energy: 0.5870009580804822
Energy: 0.581815185685877
Energy: 0.5870009580800121
Energy: 0.581815185685877
Energy: 0.5609061994478386
Energy: 0.5476326721431235
Energy: 0.5609061994483088
Energy: 0.5476326721431235
Energy: 0.5609061994483088
Energy: 0.5476326721435936
Energy: 0.5529311549195911
Energy: 0.5478682954443966
Energy: 0.5529311549200613
Energy: 0.5478682954434563
Energy: 0.5529311549200613
Energy: 0.5478682954434563
Energy: 0.617740568885457
Energy: 0.5818314867455505
Energy: 0.6177405688849869
Energy: 0.5818314867460207
Energy: 0.6177405688849869
Energy: 0.5818314867455505
Energy: 0.5833861179844954
Energy: 0.6417295749192139
Energy: 0.5833811113295954
Energy: 0.6417295749187437
Energy: 0.5833861179854357
Energy: 0.6417295749187437
Energy: 0.6899746370832777
Energy: 0.6523811923404339
Energy: 0.6899746370837477
Energy: 0.6523811923413744
Energy: 0.6899746370828075
Energy: 0.6523811923413744
Energy: 0.5577634794011828
Energy: 0.5932065047557757
Energy: 0.5577634794011828
Energy: 0.5932065047557757
Energy: 0.5577634794007127
Energy: 0.5932065047557757
Energy: 0.6897702418844869
Energy: 0.5634411721158681
Energy: 0.6897702418844869
Energy: 0.5634411721153978
Energy: 0.689770241884957
Energy: 0.5634411721153978
Energy: 0.587261083528908
Energy: 0.5631140912597324
Energy: 0.587261083528438
Energy: 0.5631140912592622
Energy: 0.5872610835270274
Energy: 0.5631140912592622

minimum gb energy = 0.5476326721431235 eV
minimum distance =  2.68344733676504 Angstroms
sigma value = 27


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

Energy: 0.5776251889677295
Energy: 0.5664349914899844
Energy: 0.5776251889677295
Energy: 0.5664349914899844
Energy: 0.5776251889677295
Energy: 0.5664349914888327
Energy: 0.7368073727581106
Energy: 0.5989199343344765
Energy: 0.7368073727581106
Energy: 0.5989199343344765
Energy: 0.7368073727592621
Energy: 0.5989199343344765
Energy: 0.5715697097910857
Energy: 0.6458340943282699
Energy: 0.5715697097922374
Energy: 0.6458340943282699
Energy: 0.5715697097910857
Energy: 0.6458340943282699
Energy: 0.6750633873795601
Energy: 0.5580393610859132
Energy: 0.6750633873795601
Energy: 0.5580393610859132
Energy: 0.6750633873795601
Energy: 0.5580393610859132
Energy: 0.6750193799413474
Energy: 0.5841749278893664
Energy: 0.6750193799413474
Energy: 0.5841749278893664
Energy: 0.6750193799413474
Energy: 0.5841749278893664
Energy: 0.6914993310946969
Energy: 0.6962086080190332
Energy: 0.6914993310946969
Energy: 0.6962086080190332
Energy: 0.6914993310946969
Energy: 0.6962086080190332
Energy: 0.701901327215329
Energy: 0.5974697546863964
Energy: 0.701901327215329
Energy: 0.5974697546863964
Energy: 0.701901327215329
Energy: 0.5974697546863964
Energy: 0.5808663155391813
Energy: 0.5676423989985164
Energy: 0.5808663155391813
Energy: 0.5676423989985164
Energy: 0.5808663155391813
Energy: 0.5676423989985164
Energy: 0.676137093588067
Energy: 0.5715019098405568
Energy: 0.676137093588067
Energy: 0.571501927619046
Energy: 0.676137093588067
Energy: 0.5715019130085397
Energy: 0.5883522312862207
Energy: 0.7297396303743816
Energy: 0.5883522312873724
Energy: 0.7297396303743816
Energy: 0.5883522312873724
Energy: 0.7297396303743816
Energy: 0.7102238832538986
Energy: 0.5552697608019901
Energy: 0.7102238832538986
Energy: 0.5552697608019901
Energy: 0.5666710133503884
Energy: 0.5552697608019901
Energy: 0.7487446865260843
Energy: 0.693038436216312
Energy: 0.7487446865260843
Energy: 0.693038436216312
Energy: 0.7487446865260843
Energy: 0.693038436216312

minimum gb energy = 0.5552697608019901 eV
minimum distance =  2.59425931436952 Angstroms
sigma value = 9


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

Energy: 0.6270015505909049
Energy: 0.5929266583360329
Energy: 0.6270015505909049
Energy: 0.5929266583363565
Energy: 0.6270015505912285
Energy: 0.5929266583360329
Energy: 0.6659009316677068
Energy: 0.5951613670819811
Energy: 0.6659009316677068
Energy: 0.5800970840633558
Energy: 0.6659009316677068
Energy: 0.5800970840633558
Energy: 0.5478277315650857
Energy: 0.7010048564495276
Energy: 0.5478277315660565
Energy: 0.7010048564498512
Energy: 0.5478277315650857
Energy: 0.7010048564498512
Energy: 0.5630559666862919
Energy: 0.5416564830676515
Energy: 0.5630559666859682
Energy: 0.5416564830673279
Energy: 0.5630559666866154
Energy: 0.5416564830676515
Energy: 0.5961739228983506
Energy: 0.5712573600667566
Energy: 0.5961739228986742
Energy: 0.5712573600667566
Energy: 0.5961739228983506
Energy: 0.5712573600667566
Energy: 0.5934741886751338
Energy: 0.6498288562821041
Energy: 0.5934741886715742
Energy: 0.6255628747319459
Energy: 0.5934741886731922
Energy: 0.6255628747316224
Energy: 0.6102268807445279
Energy: 0.6140739173057427
Energy: 0.6102268807454986
Energy: 0.6140739173060663
Energy: 0.6102268807448514
Energy: 0.6140739173060663
Energy: 0.5261810103676987
Energy: 0.6093758646181081
Energy: 0.5261810103676987
Energy: 0.6093758646181081
Energy: 0.5261810103676987
Energy: 0.6093758646181081
Energy: 0.7431803503012259
Energy: 0.5700697713217535
Energy: 0.7431803503012259
Energy: 0.5700697713217535
Energy: 0.7431803503015495
Energy: 0.5700697713217535
Energy: 0.5964834497411817
Energy: 0.7170186642855201
Energy: 0.5964834497411817
Energy: 0.7170186642855201
Energy: 0.5964834497415054
Energy: 0.7170186642855201
Energy: 0.5657298135137522
Energy: 0.5370723716794313
Energy: 0.5657298135137522
Energy: 0.5370723716794313
Energy: 0.5657298135140757
Energy: 0.5370723716794313
Energy: 0.5657836520330676
Energy: 0.6622616635906827
Energy: 0.5657836520333912
Energy: 0.6622616635903591
Energy: 0.5657836520327439
Energy: 0.6622616635906827
Energy: 0.6679520326839673
Energy: 0.6365967732617712
Energy: 0.6679520326839673
Energy: 0.6365967732614477
Energy: 0.6679520326846144
Energy: 0.6365967732617712
Energy: 0.6923151665633128
Energy: 0.6831421619298085
Energy: 0.6923151665636363
Energy: 0.6831421619298085
Energy: 0.6923151665636363
Energy: 0.6831421619298085
Energy: 0.5556794177494344
Energy: 0.5843313812615305
Energy: 0.5556794177491108
Energy: 0.5843313812618541
Energy: 0.5556794177497579
Energy: 0.5843313812615305
Energy: 0.6939988908365489
Energy: 0.6140012671304038
Energy: 0.6939988908365489
Energy: 0.6140012671304038
Energy: 0.6939988908368725
Energy: 0.6140012671300803
Energy: 0.6583767240141251
Energy: 0.6591862261557347
Energy: 0.6583767240141251
Energy: 0.6591862261557347
Energy: 0.6583767240141251
Energy: 0.6591862261560584
Energy: 0.5636988089929912
Energy: 0.5676736160292506
Energy: 0.5636988089929912
Energy: 0.5676736160292506
Energy: 0.5636988089929912
Energy: 0.5676736160292506
Energy: 0.5303859373691632
Energy: 0.6639413797163954
Energy: 0.5303859373688395
Energy: 0.6639413797163954
Energy: 0.5303859373694867
Energy: 0.6639413797160718
Energy: 0.6833644241116439
Energy: 0.615287792390102
Energy: 0.6833644241119674
Energy: 0.6152877923907493
Energy: 0.6833644241113203
Energy: 0.6152877923904256
Energy: 0.5306389124513535
Energy: 0.6640274826214845
Energy: 0.5306389124513535
Energy: 0.6640274826214845
Energy: 0.5306389124513535
Energy: 0.6640274826218081
Energy: 0.563505977275583
Energy: 0.5677980750748047
Energy: 0.5635059772759067
Energy: 0.5677980750744811
Energy: 0.5635059772759067
Energy: 0.5677980750744811
Energy: 0.6583823840026372
Energy: 0.6593022908938857
Energy: 0.6583823840023135
Energy: 0.6593022908935621
Energy: 0.6583823840023135
Energy: 0.6593022908935621
Energy: 0.6435139942535615
Energy: 0.6633730361190415
Energy: 0.6435139942535615
Energy: 0.6633730361193652
Energy: 0.6435139942538851
Energy: 0.6633730361193652
Energy: 0.5556215012302784
Energy: 0.5844497569850667
Energy: 0.5556215012306019
Energy: 0.5844497569850667
Energy: 0.5556215012306019
Energy: 0.5844497569847432
Energy: 0.6934094383070291
Energy: 0.605698025036467
Energy: 0.6934094383070291
Energy: 0.6056980250367906
Energy: 0.6934094383067054
Energy: 0.6056980250367906
Energy: 0.667958702485614
Energy: 0.6365131049899801
Energy: 0.6679587024859376
Energy: 0.6365131049899801
Energy: 0.6679587024859376
Energy: 0.6365131049899801
Energy: 0.5657280000693178
Energy: 0.6346987278500716
Energy: 0.5657280000699649
Energy: 0.6346987278497481
Energy: 0.5657280000699649
Energy: 0.6346987278500716
Energy: 0.5657499332247267
Energy: 0.5369285964653325
Energy: 0.5657499332250502
Energy: 0.5369285964656562
Energy: 0.565749933224403
Energy: 0.5369285964653325
Energy: 0.5962821665586313
Energy: 0.6949083739232055
Energy: 0.5962821665596021
Energy: 0.6949083739232055
Energy: 0.5962821665583077
Energy: 0.6949083739232055
Energy: 0.7427689498394181
Energy: 0.5700253717373778
Energy: 0.7427689498400653
Energy: 0.5700253717377014
Energy: 0.7427689498400653
Energy: 0.5700253717377014
Energy: 0.5261847696743066
Energy: 0.6094360539574295
Energy: 0.5261847696746301
Energy: 0.6094360539574295
Energy: 0.5261847696743066
Energy: 0.6094360539574295
Energy: 0.6186674107158866
Energy: 0.6143709761097359
Energy: 0.6186674107155631
Energy: 0.6143709761097359
Energy: 0.6186674107155631
Energy: 0.6143709761097359
Energy: 0.5933734186497205
Energy: 0.6299197624345132
Energy: 0.5933734186493969
Energy: 0.6299197624351603
Energy: 0.5933734186493969
Energy: 0.6299197624351603
Energy: 0.5962635129038343
Energy: 0.5711878786595017
Energy: 0.5962635129038343
Energy: 0.5711878786598253
Energy: 0.5962635129038343
Energy: 0.5711878786598253
Energy: 0.5629862588925095
Energy: 0.541437174774282
Energy: 0.5629862588925095
Energy: 0.541437174774282
Energy: 0.5629862588925095
Energy: 0.5414371747746056
Energy: 0.5477918415063527
Energy: 0.7011927253815787
Energy: 0.5477918415063527
Energy: 0.7011927253815787
Energy: 0.5477918415063527
Energy: 0.7011927253812551
Energy: 0.665743728014421
Energy: 0.5749004275822205
Energy: 0.665743728014421
Energy: 0.5749004275822205
Energy: 0.6657437280137739
Energy: 0.5749004275822205
Energy: 0.6270015505912285
Energy: 0.5929266583363565
Energy: 0.627001550591552
Energy: 0.5929266583366801
Energy: 0.627001550591552
Energy: 0.5929266583360329
Energy: 0.6659009316686776
Energy: 0.5800970840630323
Energy: 0.665900931668354
Energy: 0.5800970840630323
Energy: 0.6659009316686776
Energy: 0.5800970840630323
Energy: 0.5478277315654092
Energy: 0.7010048564498512
Energy: 0.5478277315660565
Energy: 0.7010048564498512
Energy: 0.5478277315657328
Energy: 0.7010048564501749
Energy: 0.5630559666859682
Energy: 0.5416564830676515
Energy: 0.5630559666856446
Energy: 0.5416564830679751
Energy: 0.5630559666856446
Energy: 0.5416564830676515
Energy: 0.596173922898027
Energy: 0.5712573600670802
Energy: 0.5961739228986742
Energy: 0.5712573600674037
Energy: 0.5961739228983506
Energy: 0.5712573600677273

minimum gb energy = 0.5261810103676987 eV
minimum distance =  2.60537375592175 Angstroms
sigma value = 57


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

Energy: 0.4430807420345156
Energy: 0.4175571766984041
Energy: 0.4430807420345156
Energy: 0.4175571766984041
Energy: 0.44308074203377895
Energy: 0.4175571766984041
Energy: 0.42670513629543133
Energy: 0.43512748263602197
Energy: 0.42670513629543133
Energy: 0.43512748263602197
Energy: 0.42670513629543133
Energy: 0.43512748263675854
Energy: 0.43787544034332204
Energy: 0.5705454538845032
Energy: 0.43787544034332204
Energy: 0.5705454538852397
Energy: 0.43787544034332204
Energy: 0.5705454538852397
Energy: 0.36679134529590113
Energy: 0.3537840425279348
Energy: 0.36679134529590113
Energy: 0.3537840425279348
Energy: 0.36679134529590113
Energy: 0.3537840425279348
Energy: 0.4160670551096581
Energy: 0.4277662711858865
Energy: 0.4160670551096581
Energy: 0.4277662711858865
Energy: 0.4160670551096581
Energy: 0.4277662711858865
Energy: 0.34715447209468375
Energy: 0.4405827622533349
Energy: 0.34715447209468375
Energy: 0.4405827622533349
Energy: 0.34715447209468375
Energy: 0.4405827622533349
Energy: 0.34707900890991006
Energy: 0.4997395588494137
Energy: 0.34707900890991006
Energy: 0.4997395588494137
Energy: 0.34707900890991006
Energy: 0.4997395588494137
Energy: 0.42789893805039314
Energy: 0.41628050176240017
Energy: 0.42789893805039314
Energy: 0.41628050176240017
Energy: 0.42789893805039314
Energy: 0.41628050176240017
Energy: 0.36565711027597625
Energy: 0.3538030476954518
Energy: 0.36565711027597625
Energy: 0.3538030476954518
Energy: 0.36565711027597625
Energy: 0.3538030476954518
Energy: 0.4993915191102778
Energy: 0.4991465390206108
Energy: 0.4993915191102778
Energy: 0.4991465390206108
Energy: 0.4993915191102778
Energy: 0.4991465390206108
Energy: 0.4185877818834592
Energy: 0.4354425320980116
Energy: 0.4185877818834592
Energy: 0.4354425320980116
Energy: 0.4185877818827226
Energy: 0.4354425320980116
Energy: 0.44308074203377895
Energy: 0.41755717669914066
Energy: 0.44308074203377895
Energy: 0.41755717669914066
Energy: 0.44308074203377895
Energy: 0.41755717669914066
Energy: 0.42670513629469475
Energy: 0.43512748263675854
Energy: 0.42670513629469475
Energy: 0.43512748263675854
Energy: 0.42670513629469475
Energy: 0.43512748263675854
Energy: 0.43787544034258546
Energy: 0.5705454538852397
Energy: 0.43787544034258546
Energy: 0.5705454538852397
Energy: 0.43787544034258546
Energy: 0.5705454538852397
Energy: 0.36679134529590113
Energy: 0.3537840425271981
Energy: 0.36679134529590113
Energy: 0.3537840425279348
Energy: 0.36679134529590113
Energy: 0.3537840425279348
Energy: 0.4160670551096581
Energy: 0.4277662711851499
Energy: 0.4160670551096581
Energy: 0.4277662711858865
Energy: 0.41606705511039466
Energy: 0.4277662711851499
Energy: 0.3471544720939471
Energy: 0.4405827622533349
Energy: 0.3471544720939471
Energy: 0.4405827622533349
Energy: 0.3471544720939471
Energy: 0.4405827622533349
Energy: 0.3470790089091734
Energy: 0.4997395588494137
Energy: 0.3470790089091734
Energy: 0.4997395588494137
Energy: 0.3470790089091734
Energy: 0.4997395588494137
Energy: 0.42789893804965656
Energy: 0.41628050176313675
Energy: 0.42789893805039314
Energy: 0.41628050176313675
Energy: 0.42789893805039314
Energy: 0.41628050176313675

minimum gb energy = 0.3470790089091734 eV
minimum distance =  2.68597752066857 Angstroms
sigma value = 11


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

Energy: 0.5833077778450343
Energy: 0.5531205468621988
Energy: 0.5833077778450343
Energy: 0.5531205468616591
Energy: 0.5833077778450343
Energy: 0.5531205468616591
Energy: 0.6600879631871146
Energy: 0.5570458373803174
Energy: 0.6600879631871146
Energy: 0.5570458373803174
Energy: 0.660087963186575
Energy: 0.5570458373803174
Energy: 0.6204200397212855
Energy: 0.7993507250470623
Energy: 0.6204200397212855
Energy: 0.7993507250465226
Energy: 0.6204200397212855
Energy: 0.7993507250470623
Energy: 0.6798782755767533
Energy: 0.5781925659270541
Energy: 0.6798782755767533
Energy: 0.5781925659270541
Energy: 0.6798782755767533
Energy: 0.5781925659270541
Energy: 0.5466465634837233
Energy: 0.5194001545596423
Energy: 0.5466465634837233
Energy: 0.5194001545596423
Energy: 0.5466465634837233
Energy: 0.5194001545596423
Energy: 0.582789420541694
Energy: 0.5569531084680687
Energy: 0.582789420541694
Energy: 0.5569531084680687
Energy: 0.582789420541694
Energy: 0.5569531084686082
Energy: 0.6237569389668457
Energy: 0.6907338356700833
Energy: 0.6237569389668457
Energy: 0.6907338356700833
Energy: 0.6237569389668457
Energy: 0.6907338356695436
Energy: 0.5519583650708977
Energy: 0.5036303787137593
Energy: 0.5519583650708977
Energy: 0.5036303787142498
Energy: 0.5519583650708977
Energy: 0.5036303787137593
Energy: 0.5506611228937021
Energy: 0.5098399647167291
Energy: 0.5506611228937021
Energy: 0.5098399647167291
Energy: 0.5506611228942416
Energy: 0.5098399647167291
Energy: 0.5302648676154899
Energy: 0.7142468321651865
Energy: 0.5302648676149504
Energy: 0.7142468321646469
Energy: 0.5302648676149504
Energy: 0.7142468321646469
Energy: 0.6664231956382601
Energy: 0.6353213537658737
Energy: 0.6664231956382601
Energy: 0.6353213537664132
Energy: 0.6664231956387996
Energy: 0.6353213537658737
Energy: 0.546766545462775
Energy: 0.5218463431122556
Energy: 0.546766545462775
Energy: 0.5218463431122556
Energy: 0.546766545462775
Energy: 0.5218463431122556
Energy: 0.5732254298800821
Energy: 0.575127536036232
Energy: 0.5732254298800821
Energy: 0.5751275360367717
Energy: 0.5732254298800821
Energy: 0.575127536036232
Energy: 0.5982221248353637
Energy: 0.7292584065691999
Energy: 0.5982221248353637
Energy: 0.7292584065691999
Energy: 0.5982221248353637
Energy: 0.7292584065691999
Energy: 0.6951416482440569
Energy: 0.5571034986918318
Energy: 0.6951416482435172
Energy: 0.5571034986918318
Energy: 0.6951416482440569
Energy: 0.5571034986918318
Energy: 0.5832127272061033
Energy: 0.5578224222077962
Energy: 0.5832127272055636
Energy: 0.5578224222072566
Energy: 0.5832127272061033
Energy: 0.5578224222077962
Energy: 0.561503957046759
Energy: 0.5530714132286323
Energy: 0.5615039570462194
Energy: 0.5530714132280927
Energy: 0.5615039570462194
Energy: 0.5530714132280927
Energy: 0.6629011942204196
Energy: 0.6993068343602458
Energy: 0.6629011942204196
Energy: 0.6993068343597061
Energy: 0.6629011942204196
Energy: 0.6993068343602458
Energy: 0.66173682619981
Energy: 0.5820213056882362
Energy: 0.6617368261992705
Energy: 0.5820213056882362
Energy: 0.6617368261992705
Energy: 0.5820213056887757
Energy: 0.5538232779712138
Energy: 0.5297793736298493
Energy: 0.5538232779712138
Energy: 0.5297793736298493
Energy: 0.5538232779717533
Energy: 0.5297793736298493
Energy: 0.5131497525057355
Energy: 0.552622917992374
Energy: 0.5131497525051958
Energy: 0.552622917992374
Energy: 0.5131497525057355
Energy: 0.552622917992374
Energy: 0.6286977981773224
Energy: 0.623953468234105
Energy: 0.6286977981773224
Energy: 0.6239534682335653
Energy: 0.6286977981773224
Energy: 0.6239534682335653
Energy: 0.5551425211672353
Energy: 0.5705914950800736
Energy: 0.5551425211666957
Energy: 0.5705914950800736
Energy: 0.5551425211672353
Energy: 0.5705914950800736
Energy: 0.5515100919293779
Energy: 0.5334858167884033
Energy: 0.5515100919293779
Energy: 0.5334858167884033
Energy: 0.5515100919293779
Energy: 0.5334858167884033
Energy: 0.513160326803022
Energy: 0.732562687414155
Energy: 0.5131603268024825
Energy: 0.7325626874152341
Energy: 0.5131603268024825
Energy: 0.7325626874136153
Energy: 0.8022484643755171
Energy: 0.65229201396848
Energy: 0.8022484643749774
Energy: 0.65229201396848
Energy: 0.8022484643749774
Energy: 0.65229201396848

minimum gb energy = 0.5036303787137593 eV
minimum distance =  2.55025017130702 Angstroms
sigma value = 41


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

Energy: 0.6347935551149965
Energy: 0.5449530013602818
Energy: 0.6347935551145711
Energy: 0.5449530013602818
Energy: 0.6347935551149965
Energy: 0.5449530013594313
Energy: 0.6565256123632567
Energy: 0.6049066762147008
Energy: 0.6565256123632567
Energy: 0.6049066762147008
Energy: 0.6565256123632567
Energy: 0.6049066762147008
Energy: 0.6782153666237182
Energy: 0.8174994764971458
Energy: 0.6782153666241435
Energy: 0.8174994764967206
Energy: 0.6782153666237182
Energy: 0.8174994764967206
Energy: 0.6244343051560359
Energy: 0.5361369547608082
Energy: 0.6244343051560359
Energy: 0.5361369547608082
Energy: 0.6244343051560359
Energy: 0.5361369547608082
Energy: 0.5311062984650978
Energy: 0.555635577428695
Energy: 0.5311062984650978
Energy: 0.555635577428695
Energy: 0.5311062984650978
Energy: 0.555635577428695
Energy: 0.6033317421185967
Energy: 0.6057999348559414
Energy: 0.6033317421190221
Energy: 0.6057999348555161
Energy: 0.6033317421190221
Energy: 0.6057999348559414
Energy: 0.5776923183827426
Energy: 0.6861114263706883
Energy: 0.5776923183823174
Energy: 0.6861114263706883
Energy: 0.5776923183827426
Energy: 0.6861114263706883
Energy: 0.5506240477230572
Energy: 0.5361257887990404
Energy: 0.5506240477234825
Energy: 0.5361257887990404
Energy: 0.5506240477230572
Energy: 0.5361257887990404
Energy: 0.541362965824168
Energy: 0.5520050785008074
Energy: 0.541362965824168
Energy: 0.5520050785012327
Energy: 0.541362965824168
Energy: 0.5520050785012327
Energy: 0.5951540055436401
Energy: 0.6954057382014988
Energy: 0.5951540055432148
Energy: 0.6954057382014988
Energy: 0.5951540055436401
Energy: 0.6954057382014988
Energy: 0.6984961644500882
Energy: 0.6906411644576553
Energy: 0.698496164449663
Energy: 0.6906411644576553
Energy: 0.698496164449663
Energy: 0.6906411644576553
Energy: 0.535926270657586
Energy: 0.5626716231318417
Energy: 0.5359262706580112
Energy: 0.5626716231318417
Energy: 0.535926270657586
Energy: 0.5626716231318417
Energy: 0.5515050808159656
Energy: 0.5386231755953206
Energy: 0.5515050808159656
Energy: 0.5386231755948954
Energy: 0.5515050808159656
Energy: 0.5386231755948954
Energy: 0.5284132331994121
Energy: 0.7344329338687832
Energy: 0.5284132331994121
Energy: 0.7344329338687832
Energy: 0.5284132331994121
Energy: 0.7344329338687832
Energy: 0.7019285840498072
Energy: 0.6517137079648415
Energy: 0.7019285840498072
Energy: 0.6517137079648415
Energy: 0.7019285840498072
Energy: 0.6517137079648415
Energy: 0.5228606258549513
Energy: 0.57651118346676
Energy: 0.5228606258549513
Energy: 0.57651118346676
Energy: 0.5228606258549513
Energy: 0.57651118346676
Energy: 0.5508860745027245
Energy: 0.5387987820240228
Energy: 0.5508860745027245
Energy: 0.5387987820231722
Energy: 0.5508860745022991
Energy: 0.5387987820244482
Energy: 0.6147463337279063
Energy: 0.7440368801091168
Energy: 0.6147463337279063
Energy: 0.7440368801091168
Energy: 0.6147463337279063
Energy: 0.7440368801091168
Energy: 0.6838746073861547
Energy: 0.6004938631497572
Energy: 0.6838746073874304
Energy: 0.6004938631497572
Energy: 0.6838746073878558
Energy: 0.6004938631497572
Energy: 0.6367122277692838
Energy: 0.5872987316309001
Energy: 0.6367122277692838
Energy: 0.6270464837420519
Energy: 0.6367122277692838
Energy: 0.5626457446976535
Energy: 0.5422274328547529
Energy: 0.6045978092618486
Energy: 0.5422274328543277
Energy: 0.6045978092618486
Energy: 0.5422274328547529
Energy: 0.6045978092614234
Energy: 0.6645795790996808
Energy: 0.8387880980471799
Energy: 0.664579579100106
Energy: 0.8387880980471799
Energy: 0.664579579100106
Energy: 0.8387880980471799
Energy: 0.6045528926454643
Energy: 0.5346838643611831
Energy: 0.6045528926454643
Energy: 0.5346838643611831
Energy: 0.6045528926454643
Energy: 0.5346838643616084
Energy: 0.5299907682835687
Energy: 0.5877142794952546
Energy: 0.529990768283994
Energy: 0.5877142794952546
Energy: 0.529990768283994
Energy: 0.5877142794952546
Energy: 0.5218446335155185
Energy: 0.6019679678818342
Energy: 0.5218446335155185
Energy: 0.6019679678818342
Energy: 0.5218446335155185
Energy: 0.6019679678818342
Energy: 0.5774136616066783
Energy: 0.7805841241357097
Energy: 0.5774136616071036
Energy: 0.7805841241357097
Energy: 0.5774136616071036
Energy: 0.7805841241352842
Energy: 0.5382372871704453
Energy: 0.5346974909932748
Energy: 0.5382372871704453
Energy: 0.5346974909932748
Energy: 0.5382372871704453
Energy: 0.5346974909945506
Energy: 0.5397932108922733
Energy: 0.5766439128050311
Energy: 0.5397932108922733
Energy: 0.5766439128050311
Energy: 0.5397932108922733
Energy: 0.5766439128050311
Energy: 0.6357824373528629
Energy: 0.609026112372288
Energy: 0.6357824373532881
Energy: 0.609026112372288
Energy: 0.6357824373520122
Energy: 0.6090261123727134
Energy: 0.8153807568874216
Energy: 0.6658414315726096
Energy: 0.8153807568874216
Energy: 0.6658414315726096
Energy: 0.815380756887847
Energy: 0.6658414315726096
Energy: 0.5388746862602308
Energy: 0.5656313127359199
Energy: 0.5388746862602308
Energy: 0.5656313127363453
Energy: 0.5388746862602308
Energy: 0.5656313127359199
Energy: 0.5531334321801218
Energy: 0.5395065694972413
Energy: 0.553133432180547
Energy: 0.5395065694963908
Energy: 0.553133432180547
Energy: 0.5395065694972413
Energy: 0.522000863510082
Energy: 0.599717397806705
Energy: 0.5220008635105073
Energy: 0.599717397806705
Energy: 0.522000863510082
Energy: 0.5997173978062795

minimum gb energy = 0.5218446335155185 eV
minimum distance =  2.56796909296314 Angstroms
sigma value = 33


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

Energy: 0.5682786634229431
Energy: 0.5450755050053993
Energy: 0.5682786634238385
Energy: 0.54507550500719
Energy: 0.5682786634232415
Energy: 0.5450755050053993
Energy: 0.6868793850127003
Energy: 0.542770631854985
Energy: 0.6868793850121033
Energy: 0.5427706318552834
Energy: 0.6868793850124018
Energy: 0.5427706318552834
Energy: 0.7130053894479557
Energy: 0.7785951367751041
Energy: 0.7130053894479557
Energy: 0.7785951367751041
Energy: 0.7130053894479557
Energy: 0.7785951367751041
Energy: 0.6468803220795613
Energy: 0.5395384018198236
Energy: 0.6468803220795613
Energy: 0.5395384018198236
Energy: 0.6468803220795613
Energy: 0.5395384018198236
Energy: 0.5397036618083879
Energy: 0.6729673550774026
Energy: 0.5397036618072212
Energy: 0.6729673550774026
Energy: 0.5397036618083879
Energy: 0.672967355077701
Energy: 0.6600724582453041
Energy: 0.542758121645807
Energy: 0.6600724582453041
Energy: 0.5427581216467023
Energy: 0.6600724582453041
Energy: 0.5427581216455085
Energy: 0.6057649816884643
Energy: 0.8726512408172271
Energy: 0.6057649816884643
Energy: 0.8726512408175257
Energy: 0.6057649816878673
Energy: 0.8726512408169288
Energy: 0.6240769064793176
Energy: 0.6555255480270723
Energy: 0.6240769064799144
Energy: 0.6555255480270723
Energy: 0.624076906479616
Energy: 0.655525548027371
Energy: 0.6754431080247134
Energy: 0.5643924971068052
Energy: 0.6754431080247134
Energy: 0.5643924971068052
Energy: 0.6754431080247134
Energy: 0.5643924971068052
Energy: 0.6905494002677937
Energy: 0.5464558568845127
Energy: 0.6905494002674953
Energy: 0.5464558568845127
Energy: 0.6905494002674953
Energy: 0.5464558568848112
Energy: 0.6158359541568322
Energy: 0.6584328631493626
Energy: 0.6158359541574292
Energy: 0.658432863150258
Energy: 0.6158359541583247
Energy: 0.6584328631505565
Energy: 0.669018410494959
Energy: 0.5395326718320717
Energy: 0.669018410494959
Energy: 0.5395326718323701
Energy: 0.669018410494959
Energy: 0.5395326718323701
Energy: 0.5679845339858873
Energy: 0.6749087570973262
Energy: 0.5679845339852904
Energy: 0.6749087570973262
Energy: 0.5679845339855888
Energy: 0.6749087570973262
Energy: 0.6599392297674114
Energy: 0.6041818255703845
Energy: 0.659939229767113
Energy: 0.6041818255718768
Energy: 0.6599392297668145
Energy: 0.6041818255721751
Energy: 0.7674763920000222
Energy: 0.6059637485538971
Energy: 0.7674763920021114
Energy: 0.6059637485550908
Energy: 0.7674763920015145
Energy: 0.6059637485562848
Energy: 0.5418646012430696
Energy: 0.6572397745393241
Energy: 0.5418646012430696
Energy: 0.6572397745396227
Energy: 0.541864601243368
Energy: 0.6572397745393241
Energy: 0.6709396503042078
Energy: 0.5403723706068231
Energy: 0.6709396503039093
Energy: 0.5403723706065247
Energy: 0.6709396503042078
Energy: 0.5403723706071215
Energy: 0.5407764275550668
Energy: 0.6038796515858217
Energy: 0.5407764275568576
Energy: 0.6038796515855233
Energy: 0.5407764275574546
Energy: 0.6038796515852247
Energy: 0.7759018523601399
Energy: 0.6774538162816048
Energy: 0.7759018523598413
Energy: 0.6774538162822018
Energy: 0.7759018523601399
Energy: 0.6774538162819034
Energy: 0.661647338831461
Energy: 0.564765539543403
Energy: 0.661647338831461
Energy: 0.5647655395428062
Energy: 0.6616473388308641
Energy: 0.5647655395428062
Energy: 0.545813509705797
Energy: 0.5696841958961136
Energy: 0.545813509705797
Energy: 0.5696841958958151
Energy: 0.545813509705797
Energy: 0.5696841958964121
Energy: 0.5417866203164097
Energy: 0.7695689336242368
Energy: 0.5417866203164097
Energy: 0.7695689336242368
Energy: 0.5417866203161114
Energy: 0.7695689336239382
Energy: 0.6580914009245172
Energy: 0.6199445488603731
Energy: 0.6580914009245172
Energy: 0.6199445488594778
Energy: 0.6580914009254126
Energy: 0.6199445488606715
Energy: 0.53927241542743
Energy: 0.6621482654074139
Energy: 0.5392724154271317
Energy: 0.6621482654077122
Energy: 0.5392724154271317
Energy: 0.6621482654077122
Energy: 0.6794571846314896
Energy: 0.5438084562819854
Energy: 0.6794571846314896
Energy: 0.5438084562822839
Energy: 0.6794571846314896
Energy: 0.5438084562819854
Energy: 0.5429298743174719
Energy: 0.657095810994728
Energy: 0.5429298743159794
Energy: 0.6570958109944295
Energy: 0.5429298743165765
Energy: 0.6570958109944295
Energy: 0.7679852622043132
Energy: 0.5976808065877203
Energy: 0.7679852622046116
Energy: 0.5976808065877203
Energy: 0.7679852622043132
Energy: 0.5976808065877203
Energy: 0.5662050326771028
Energy: 0.5419439159197176
Energy: 0.5662050326726257
Energy: 0.5419439159197176
Energy: 0.5662050326723272
Energy: 0.541943915919419
Energy: 0.5641441517153734
Energy: 0.6613670497224707
Energy: 0.5641441517150748
Energy: 0.6613670497221722
Energy: 0.5641441517153734
Energy: 0.661367049722769
Energy: 0.5466937198479312
Energy: 0.7764495745108925
Energy: 0.5466937198482298
Energy: 0.7764495745111909
Energy: 0.5466937198482298
Energy: 0.7764495745111909
Energy: 0.6041478264985605
Energy: 0.5505690502494766
Energy: 0.6041478264985605
Energy: 0.5505690502488796
Energy: 0.6041478264991573
Energy: 0.550569050249178
Energy: 0.5392385497249421
Energy: 0.6660853962949965
Energy: 0.5392385497246437
Energy: 0.6660853962946981
Energy: 0.5392385497246437
Energy: 0.6660853962949965
Energy: 0.6564369924566492
Energy: 0.5449128933569106
Energy: 0.6564369924572462
Energy: 0.5449128933569106
Energy: 0.6564369924578431
Energy: 0.5449128933575077
Energy: 0.6084604767439556
Energy: 0.7247838564627418
Energy: 0.6084604767442543
Energy: 0.7247838564624433
Energy: 0.6084604767439556
Energy: 0.7247838564624433
Energy: 0.6085255762101031
Energy: 0.6572328984537639
Energy: 0.6085255762098044
Energy: 0.6572328984537639
Energy: 0.6085255762101031
Energy: 0.6572328984540624
Energy: 0.6652030411618229
Energy: 0.5450647532531446
Energy: 0.6652030411609275
Energy: 0.5450647532537416
Energy: 0.6652030411606291
Energy: 0.5450647532534431
Energy: 0.5392556555339183
Energy: 0.6661483579416531
Energy: 0.5392556555336198
Energy: 0.6661483579416531
Energy: 0.5392556555333213
Energy: 0.6661483579416531
Energy: 0.6036173045257861
Energy: 0.5505850362320199
Energy: 0.6036173045260846
Energy: 0.5505850362320199
Energy: 0.6036173045263832
Energy: 0.5505850362320199
Energy: 0.5465911729429062
Energy: 0.776309665692754
Energy: 0.5465911729426078
Energy: 0.776309665692754
Energy: 0.5465911729426078
Energy: 0.7763096656930526
Energy: 0.5641035990955298
Energy: 0.6713815913280898
Energy: 0.5641035990955298
Energy: 0.6713815913280898
Energy: 0.5641035990955298
Energy: 0.6713815913280898
Energy: 0.5663796142635461
Energy: 0.5419260119771051
Energy: 0.5663796142668294
Energy: 0.5419260119774035
Energy: 0.5663796142704108
Energy: 0.5419260119774035
Energy: 0.7678197147974885
Energy: 0.5975528356902016
Energy: 0.7678197147974885
Energy: 0.5975528356902016
Energy: 0.76781971479719
Energy: 0.5975528356905
Energy: 0.5432200035095843
Energy: 0.657189009379568
Energy: 0.5432200035122705
Energy: 0.6571890093798664
Energy: 0.5432200035074951
Energy: 0.657189009379568
Energy: 0.6794574827936826
Energy: 0.5438089315629535
Energy: 0.679457482793981
Energy: 0.5438089315632522
Energy: 0.679457482793981
Energy: 0.5438089315629535
Energy: 0.5392086754941369
Energy: 0.6631976013772507
Energy: 0.5392086754944354
Energy: 0.6631976013787432
Energy: 0.5392086754941369
Energy: 0.66319760137934
Energy: 0.660555968557462
Energy: 0.6198302782782683
Energy: 0.6605559685577606
Energy: 0.6198302782782683
Energy: 0.6605559685577606
Energy: 0.6198302782782683
Energy: 0.5417535586763695
Energy: 0.76972845736152
Energy: 0.5417535586763695
Energy: 0.76972845736152
Energy: 0.5417535586763695
Energy: 0.7697284573618184

minimum gb energy = 0.5392086754941369 eV
minimum distance =  2.57455991361548 Angstroms
sigma value = 67


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

Energy: 0.43744943247985446
Energy: 0.41924054647433906
Energy: 0.43744943248026247
Energy: 0.41924054647433906
Energy: 0.43744943247946916
Energy: 0.41924054647474707
Energy: 0.3929880840156798
Energy: 0.3779591207292298
Energy: 0.39298808401586116
Energy: 0.37795912072882176
Energy: 0.3929880840154758
Energy: 0.37795912072902577
Energy: 0.6730567469450491
Energy: 0.9506521142145443
Energy: 0.6758926611634535
Energy: 0.9506521142145443
Energy: 0.5643246954323349
Energy: 0.9506521142147483
Energy: 0.39297428613219876
Energy: 0.37801757427790833
Energy: 0.39297428613179075
Energy: 0.37801757427790833
Energy: 0.39297428613238
Energy: 0.37801757427770427
Energy: 0.43744943247985446
Energy: 0.419240546474135
Energy: 0.43744943247967316
Energy: 0.41924054647393105
Energy: 0.43744943248005846
Energy: 0.41924054647393105
Energy: 0.3929880840156798
Energy: 0.3779591207292298
Energy: 0.3929880840156798
Energy: 0.37795912072841376
Energy: 0.3929880840156798
Energy: 0.37795912072902577
Energy: 0.4202180087897774
Energy: 0.9506521142141362
Energy: 0.42021800878778265
Energy: 0.9506521142141362
Energy: 0.5018066101516957
Energy: 0.9506521142141362

minimum gb energy = 0.37795912072841376 eV
minimum distance =  2.64665132412394 Angstroms
sigma value = 3


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

Energy: 0.6575112165183989
Energy: 0.5952309867667175
Energy: 0.6575112165175597
Energy: 0.5952309867669643
Energy: 0.6575112165181027
Energy: 0.5952309867667175
Energy: 0.6124944391714637
Energy: 0.5458689187180331
Energy: 0.6124944391717105
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Energy: 0.6124944391714637
Energy: 0.5458689187180331
Energy: 0.5449445590240999
Energy: 0.7522466845165309
Energy: 0.5449445590235571
Energy: 0.752246684515988
Energy: 0.5449445590238532
Energy: 0.752246684515988
Energy: 0.6558249221226324
Energy: 0.5934706251996608
Energy: 0.6558249221220895
Energy: 0.5934706251996608
Energy: 0.6558249221226324
Energy: 0.593470625199414
Energy: 0.5838249350336727
Energy: 0.6111185581328249
Energy: 0.5838249350344624
Energy: 0.611118558132282
Energy: 0.5838249350339194
Energy: 0.6111185581325781
Energy: 0.5454815492500628
Energy: 0.6220687761243835
Energy: 0.5454815492503096
Energy: 0.6220687761249264
Energy: 0.5454815492497666
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Energy: 0.5586925036569949
Energy: 0.6822004041024464
Energy: 0.5586925036569949
Energy: 0.6822004041019035
Energy: 0.5586925036575378
Energy: 0.6822004041021503
Energy: 0.6669987939363637
Energy: 0.5995673693045201
Energy: 0.6669987939369066
Energy: 0.5984825849689618
Energy: 0.6669987939361168
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Energy: 0.5191345407691319
Energy: 0.6146841556783542
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Energy: 0.6146841556783542
Energy: 0.5191345407688852
Energy: 0.6146841556786503
Energy: 0.5499946380011922
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Energy: 0.6194120064292727
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Energy: 0.6194120064289766
Energy: 0.5666640451781207
Energy: 0.6017761762489856
Energy: 0.5666640451778245
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Energy: 0.5666640451778245
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Energy: 0.59412382870149
Energy: 0.5629224120232597
Energy: 0.5941238287022796
Energy: 0.5588993133742376
Energy: 0.59412382870149
Energy: 0.5588993133742376
Energy: 0.58699361312882
Energy: 0.5999242866642068
Energy: 0.58699361312882
Energy: 0.5999242866644536
Energy: 0.5869936131285733
Energy: 0.5999242866644536
Energy: 0.616512062359502
Energy: 0.6664806369671579
Energy: 0.616512062359502
Energy: 0.6664806369671579
Energy: 0.616512062359502
Energy: 0.6664806369671579
Energy: 0.6601647585971048
Energy: 0.6197927452375777
Energy: 0.660164758597401
Energy: 0.6197927452373309
Energy: 0.6601647585965619
Energy: 0.6197927452373309
Energy: 0.6601794635437258
Energy: 0.5567844072520932
Energy: 0.6601794635437258
Energy: 0.5567844072520932
Energy: 0.6601794635434297
Energy: 0.5567844072518463
Energy: 0.6314151032504954
Energy: 0.5923315807078113
Energy: 0.6314151032497057
Energy: 0.5923315807081074
Energy: 0.6314151032504954
Energy: 0.5923315807078113
Energy: 0.5632414344488752
Energy: 0.7173403223384379
Energy: 0.5632414344488752
Energy: 0.7173403223381911
Energy: 0.5632414344486285
Energy: 0.7173403223381911
Energy: 0.6460715517819534
Energy: 0.6121934069906869
Energy: 0.6460715517824962
Energy: 0.6121934069906869
Energy: 0.6460715517822495
Energy: 0.6121934069906869
Energy: 0.5945867840087669
Energy: 0.6315508447132926
Energy: 0.5945867840087669
Energy: 0.6315508447130459
Energy: 0.5945867840090137
Energy: 0.6315508447130459
Energy: 0.5587062985991067
Energy: 0.6444443356890787
Energy: 0.55870629859886
Energy: 0.6444443356887826
Energy: 0.558706298598317
Energy: 0.6444443356887826
Energy: 0.5406863570519705
Energy: 0.7040821860313523
Energy: 0.5406863570514276
Energy: 0.7040821860311054
Energy: 0.5406863570514276
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Energy: 0.7193959637243746
Energy: 0.5615434816745775
Energy: 0.7193959637241278
Energy: 0.5615434816748242
Energy: 0.7193959637243746
Energy: 0.5615434816748242
Energy: 0.5607205397802045
Energy: 0.617538281384802
Energy: 0.5607205397804512
Energy: 0.6175382813850981
Energy: 0.5607205397804512
Energy: 0.617538281384802
Energy: 0.5811803454311102
Energy: 0.6438883932900287
Energy: 0.5811803454316532
Energy: 0.6438883932900287
Energy: 0.5811803454319493
Energy: 0.6438883932902755
Energy: 0.5277658327595296
Energy: 0.6343380100811989
Energy: 0.5277658327587398
Energy: 0.6343380100814952
Energy: 0.5277658327584437
Energy: 0.6343380100814952
Energy: 0.6506815423112426
Energy: 0.5606140936708536
Energy: 0.6506815423117854
Energy: 0.5606140936708536
Energy: 0.6506815423112426
Energy: 0.5606140936711004
Energy: 0.5970423730592699
Energy: 0.6114617415791572
Energy: 0.5970423730598128
Energy: 0.6114617415791572
Energy: 0.5970423730592699
Energy: 0.6114617415794533
Energy: 0.6295408029786004
Energy: 0.5936561022209199
Energy: 0.6295408029793901
Energy: 0.593656102221216
Energy: 0.6295408029788473
Energy: 0.593656102221216
Energy: 0.6552771247912559
Energy: 0.5398368242837893
Energy: 0.6552771247910092
Energy: 0.5398368242837893
Energy: 0.655277124790713
Energy: 0.5398368242840854
Energy: 0.6540668826987329
Energy: 0.5243457527043703
Energy: 0.6540668826987329
Energy: 0.5243457527049133
Energy: 0.6540668826984369
Energy: 0.5243457527046664
Energy: 0.6227331495441973
Energy: 0.5957526186350958
Energy: 0.6227331495436544
Energy: 0.5957526186353919
Energy: 0.6227331495441973
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Energy: 0.6218784021289538
Energy: 0.610696566813892
Energy: 0.6218784021294967
Energy: 0.610696566813892
Energy: 0.6218784021292499
Energy: 0.610696566813645
Energy: 0.6953054858012759
Energy: 0.5618812582404573
Energy: 0.6953054858012759
Energy: 0.5618812582404573
Energy: 0.6953054858012759
Energy: 0.5618812582407534
Energy: 0.5713374381461643
Energy: 0.620275594243914
Energy: 0.5713374381459176
Energy: 0.6202755942442102
Energy: 0.5713374381467073
Energy: 0.6202755942436672
Energy: 0.5588489937378065
Energy: 0.6503547114604514
Energy: 0.5588489937364245
Energy: 0.6503547114599085
Energy: 0.5588489937361777
Energy: 0.6503547114599085
Energy: 0.5801260514114884
Energy: 0.6250035946731546
Energy: 0.5801260514120313
Energy: 0.6250035946731546
Energy: 0.5801260514117353
Energy: 0.6250035946731546
Energy: 0.7625213328975111
Energy: 0.5625766821217507
Energy: 0.7625213328972643
Energy: 0.5625766821217507
Energy: 0.7625213328975111
Energy: 0.5625766821217507
Energy: 0.48386092934701797
Energy: 0.6862571645155106
Energy: 0.48386092934726466
Energy: 0.6862571645155106
Energy: 0.4838609293475608
Energy: 0.6862571645155106
Energy: 0.6355882981838488
Energy: 0.636062922939686
Energy: 0.6355882981830098
Energy: 0.6360629229407718
Energy: 0.6355882981835526
Energy: 0.6360629229386003
Energy: 0.6068278192324753
Energy: 0.6265249390603221
Energy: 0.6068278192327714
Energy: 0.6265249390600753
Energy: 0.6068278192327714
Energy: 0.6265249390597791
Energy: 0.7442355318275885
Energy: 0.5393666831414777
Energy: 0.7442355318262558
Energy: 0.5393666831414777
Energy: 0.7442355318270454
Energy: 0.5393666831414777
Energy: 0.507828153435536
Energy: 0.696672775937093
Energy: 0.507828153435536
Energy: 0.696672775937093
Energy: 0.507828153435832
Energy: 0.696672775937093
Energy: 0.6336608329469836
Energy: 0.6065490190408231
Energy: 0.6336608329469836
Energy: 0.6065490190405272
Energy: 0.6336608329469836
Energy: 0.6065490190408231
Energy: 0.6512329253002712
Energy: 0.5154843873058217
Energy: 0.6512329253008142
Energy: 0.5154843873061177
Energy: 0.6512329253008142
Energy: 0.5154843873061177
Energy: 0.6647689441324673
Energy: 0.523971006821028
Energy: 0.6647689441319243
Energy: 0.5239710068212748
Energy: 0.664768944132714
Energy: 0.523971006820732
Energy: 0.530316171754294
Energy: 0.6594959916909622
Energy: 0.5303161717539978
Energy: 0.6594959916909622
Energy: 0.530316171754294
Energy: 0.6594959916915052
Energy: 0.5206260402366046
Energy: 0.6152821024270739
Energy: 0.5206260402366046
Energy: 0.6152821024267777
Energy: 0.5206260402360617
Energy: 0.6152821024270739
Energy: 0.614370171086915
Energy: 0.6066724646483637
Energy: 0.6143701710863722
Energy: 0.6066724646483637
Energy: 0.6143701710858293
Energy: 0.6066724646480675
Energy: 0.6083145767114653
Energy: 0.5963325576729143
Energy: 0.6083145767114653
Energy: 0.5963325576726182
Energy: 0.6083145767112185
Energy: 0.5963325576726182
Energy: 0.5469908850794695
Energy: 0.6173763829160458
Energy: 0.5469908850797163
Energy: 0.6173763829165887
Energy: 0.5469908850794695
Energy: 0.6173763829165887

minimum gb energy = 0.48386092934701797 eV
minimum distance =  2.52561990430561 Angstroms
sigma value = 81


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

Energy: 0.6298408482174555
Energy: 0.5855069566072579
Energy: 0.6035860237328959
Energy: 0.5855069566083756
Energy: 0.6298408482170829
Energy: 0.5855069566083756
Energy: 0.6023183689545564
Energy: 0.5745488825815303
Energy: 0.6023183689538113
Energy: 0.5745488825815303
Energy: 0.6023183689538113
Energy: 0.5745488825815303
Energy: 0.6407238915608483
Energy: 0.5392077372176824
Energy: 0.6136250403471166
Energy: 0.5392077372158195
Energy: 0.6407238915604756
Energy: 0.539207737215447
Energy: 0.5239490862530639
Energy: 0.5886712819338646
Energy: 0.5239490862527252
Energy: 0.588671281933492
Energy: 0.5239490862523527
Energy: 0.588671281933492
Energy: 0.5331788614677087
Energy: 0.6342159689804375
Energy: 0.5331788614669636
Energy: 0.6342159689808101
Energy: 0.5331788614673361
Energy: 0.6342159689808101
Energy: 0.5508720094461177
Energy: 0.5918029699375331
Energy: 0.5508720094461177
Energy: 0.5918029699390234
Energy: 0.5508720094461177
Energy: 0.5918029699386508
Energy: 0.5430543579971905
Energy: 0.5373562747740765
Energy: 0.543031940727298
Energy: 0.5373562747744491
Energy: 0.5430543579960728
Energy: 0.5373562747744491
Energy: 0.6513527990228744
Energy: 0.6948740832821316
Energy: 0.6514304741122711
Energy: 0.6948740832825041
Energy: 0.6513527990225019
Energy: 0.6948740832825041
Energy: 0.5971549874152111
Energy: 0.6008623367792424
Energy: 0.5971549874155837
Energy: 0.6008623367807325
Energy: 0.5971549874152111
Energy: 0.6008623367807325
Energy: 0.5669164234904074
Energy: 0.7164347835900967
Energy: 0.5669164234904074
Energy: 0.7164347835904692
Energy: 0.5669164234900348
Energy: 0.7164347835900967
Energy: 0.5346727546743669
Energy: 0.6978988111499592
Energy: 0.5346727546747394
Energy: 0.6978988111499592
Energy: 0.5346727546747394
Energy: 0.6978988111499592
Energy: 0.560497047486177
Energy: 0.5913036810527055
Energy: 0.560497047486177
Energy: 0.591303681053078
Energy: 0.5604970474858043
Energy: 0.591303681053078
Energy: 0.616594769459742
Energy: 0.6493210217896538
Energy: 0.6165947694601146
Energy: 0.6493210217896538
Energy: 0.6165947694601146
Energy: 0.6493210217896538
Energy: 0.5922416195149861
Energy: 0.6579739995736853
Energy: 0.5922416195161038
Energy: 0.6579739995733127
Energy: 0.5922416195153586
Energy: 0.6579739995736853
Energy: 0.739190912971499
Energy: 0.5941496365863029
Energy: 0.7391909129707539
Energy: 0.5941496365870482
Energy: 0.7391909129700087
Energy: 0.5941496365866755
Energy: 0.6510059861457554
Energy: 0.5374378392076941
Energy: 0.6510059861450104
Energy: 0.5374378392073216
Energy: 0.6510059861453829
Energy: 0.537437839206949
Energy: 0.58212375161303
Energy: 0.5922180232723772
Energy: 0.58212375161303
Energy: 0.5922180232731222
Energy: 0.5821237516134024
Energy: 0.5922180232731222
Energy: 0.5360789915507131
Energy: 0.5995346416401335
Energy: 0.5361073428169897
Energy: 0.599534641639761
Energy: 0.5360789915503406
Energy: 0.599534641639761
Energy: 0.46823385296229236
Energy: 0.5938851809543763
Energy: 0.46823385296229236
Energy: 0.5938851809543763
Energy: 0.46823385296229236
Energy: 0.5938851809543763
Energy: 0.5991542411409236
Energy: 0.6082703586382805
Energy: 0.5991542411446493
Energy: 0.6082703586386531
Energy: 0.5991542411327611
Energy: 0.6082703586390256
Energy: 0.6564934315134119
Energy: 0.6523961353742668
Energy: 0.6564934315134119
Energy: 0.6523961353742668
Energy: 0.6564934315130393
Energy: 0.6523961353738941
Energy: 0.6264166122318763
Energy: 0.5801671334829724
Energy: 0.5632050113597378
Energy: 0.5801671334833451
Energy: 0.6264166122307587
Energy: 0.5801671334833451
Energy: 0.5958085226545243
Energy: 0.5758081889248825
Energy: 0.5685313268448269
Energy: 0.5758081889256276
Energy: 0.5958085226552694
Energy: 0.5758081889256276
Energy: 0.7075660385038135
Energy: 0.6024475932790524
Energy: 0.7075660385034409
Energy: 0.6024475932775621
Energy: 0.7075660385034409
Energy: 0.6024475932779346
Energy: 0.60515850115274
Energy: 0.6017963930630503
Energy: 0.6051585011531125
Energy: 0.6017963930634228
Energy: 0.6051585011534851
Energy: 0.6017963930637954
Energy: 0.47870624932570477
Energy: 0.6892355897147528
Energy: 0.47870624932570477
Energy: 0.6892355897151254
Energy: 0.47870624932533223
Energy: 0.6892355897151254
Energy: 0.5276675321761095
Energy: 0.5240097815928162
Energy: 0.5276675321761095
Energy: 0.5240097815916985
Energy: 0.5276675321761095
Energy: 0.5240097815916985
Energy: 0.6014543784822234
Energy: 0.5856160855362857
Energy: 0.6014542443761459
Energy: 0.585616085535913
Energy: 0.6014543784822234
Energy: 0.585616085535913
Energy: 0.5774283147185538
Energy: 0.5403317200672378
Energy: 0.5773305737700377
Energy: 0.5403317200668653
Energy: 0.5774283147174363
Energy: 0.5403317200668653
Energy: 0.6622553971410752
Energy: 0.526209832582377
Energy: 0.6622553971410752
Energy: 0.5262098325816319
Energy: 0.6622553971418202
Energy: 0.5262098325816319
Energy: 0.5902388275239691
Energy: 0.7153548283136132
Energy: 0.5902388275243416
Energy: 0.7153548283128681
Energy: 0.5902388275247141
Energy: 0.7153548283128681
Energy: 0.6252681031396399
Energy: 0.6166163237981135
Energy: 0.6252681031396399
Energy: 0.616616323798486
Energy: 0.6252681031400126
Energy: 0.616616323798486
Energy: 0.5603612311044359
Energy: 0.5810820018243579
Energy: 0.5603612311040632
Energy: 0.5810820018236128
Energy: 0.5603612311048084
Energy: 0.5810820018236128
Energy: 0.4751163843530467
Energy: 0.5108785952733204
Energy: 0.475116384351929
Energy: 0.5108785952725753
Energy: 0.4751163843526741
Energy: 0.5108785952725753
Energy: 0.5595379961679902
Energy: 0.7597413876353304
Energy: 0.559709373920335
Energy: 0.7597413876338401
Energy: 0.5595379961691077
Energy: 0.7597413876342126
Energy: 0.6062207889556975
Energy: 0.5970360203011978
Energy: 0.6062207889556975
Energy: 0.5970360203004528
Energy: 0.60622078895607
Energy: 0.597036020301943
Energy: 0.5774491144369898
Energy: 0.6740533122228183
Energy: 0.5774491144369898
Energy: 0.6740533122235634
Energy: 0.5774491144366173
Energy: 0.6740533122235634
Energy: 0.5813768197559617
Energy: 0.5276625900390319
Energy: 0.5813768197570794
Energy: 0.5276625900390319
Energy: 0.5813768197563344
Energy: 0.5276625900386595

minimum gb energy = 0.46823385296229236 eV
minimum distance =  2.59575940712467 Angstroms
sigma value = 43


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

Energy: 0.6166330381758998
Energy: 0.6155322175544696
Energy: 0.6166330381754421
Energy: 0.6155322175544696
Energy: 0.6166330381758998
Energy: 0.6155322175544696
Energy: 0.6542165178153386
Energy: 0.5782631142606715
Energy: 0.6542165178153386
Energy: 0.5782631142606715
Energy: 0.6542165178153386
Energy: 0.5782631142606715
Energy: 0.6064327977940517
Energy: 0.671783252044148
Energy: 0.6064327977940517
Energy: 0.6717832520446056
Energy: 0.5847799898347836
Energy: 0.6717832520446056
Energy: 0.6460163377603805
Energy: 0.5964553054052639
Energy: 0.6460163377603805
Energy: 0.5964553054052639
Energy: 0.6460163377603805
Energy: 0.5964553054052639
Energy: 0.5922629807167223
Energy: 0.6168700143025477
Energy: 0.5922629807167223
Energy: 0.6168700143025477
Energy: 0.5922629807171799
Energy: 0.6168700143020901
Energy: 0.5655130587765148
Energy: 0.6011928220334429
Energy: 0.5655130587765148
Energy: 0.6011928220334429
Energy: 0.5655130587760573
Energy: 0.6011928220334429
Energy: 0.6130306976669225
Energy: 0.6763410815633849
Energy: 0.6130306976669225
Energy: 0.6763410815633849
Energy: 0.6130306976669225
Energy: 0.6763410815633849
Energy: 0.5855132237701834
Energy: 0.6087186597749018
Energy: 0.5855132237706411
Energy: 0.6087186597749018
Energy: 0.5855132237706411
Energy: 0.6087186597749018
Energy: 0.6016283751205564
Energy: 0.6025880576097684
Energy: 0.6016283751205564
Energy: 0.6025880576097684
Energy: 0.6016283751205564
Energy: 0.6025880576097684
Energy: 0.5492062248170166
Energy: 0.6530093136527474
Energy: 0.5492062248170166
Energy: 0.6530093136527474
Energy: 0.5492062248170166
Energy: 0.653009313653205
Energy: 0.6888789134604736
Energy: 0.6195593137739107
Energy: 0.6888789134604736
Energy: 0.6195593137739107
Energy: 0.6888789134604736
Energy: 0.6195593137739107
Energy: 0.5854012892598425
Energy: 0.6021953863274081
Energy: 0.5854012892598425
Energy: 0.6021953863274081
Energy: 0.5854012892598425
Energy: 0.6021953863274081
Energy: 0.6045728411871917
Energy: 0.6205316617187097
Energy: 0.6045728411871917
Energy: 0.6205316617187097
Energy: 0.6045728411871917
Energy: 0.6205316617187097
Energy: 0.5191964474489185
Energy: 0.6785151023442281
Energy: 0.5191964474489185
Energy: 0.6785151023442281
Energy: 0.5191964474489185
Energy: 0.6785151023442281
Energy: 0.5874321368510377
Energy: 0.561181949520214
Energy: 0.5874321368510377
Energy: 0.561181949520214
Energy: 0.5874321368510377
Energy: 0.561181949520214
Energy: 0.6304772245495043
Energy: 0.6021675702244518
Energy: 0.6304772245495043
Energy: 0.6021675702244518
Energy: 0.6304772245495043
Energy: 0.6021675702244518
Energy: 0.6193982489801386
Energy: 0.5913744580462782
Energy: 0.6193982489801386
Energy: 0.5913744580462782
Energy: 0.6193982489801386
Energy: 0.5913744580462782
Energy: 0.7059892766933675
Energy: 0.550743865929064
Energy: 0.7059892766933675
Energy: 0.550743865929064
Energy: 0.7059892766933675
Energy: 0.550743865929064
Energy: 0.6126376664102581
Energy: 0.5543360687230514
Energy: 0.6126376664102581
Energy: 0.5543360687230514
Energy: 0.6126376664102581
Energy: 0.5543360687230514
Energy: 0.6300130575209727
Energy: 0.5774169979778006
Energy: 0.6300130575209727
Energy: 0.5774169979778006
Energy: 0.6300130575209727
Energy: 0.5774169979778006
Energy: 0.6150520868265156
Energy: 0.6354247918587418
Energy: 0.6150520868265156
Energy: 0.6354247918587418
Energy: 0.6150520868265156
Energy: 0.6354247918587418
Energy: 0.694918520502882
Energy: 0.5420442519905798
Energy: 0.694918520502882
Energy: 0.5420442519905798
Energy: 0.694918520502882
Energy: 0.5420442519905798
Energy: 0.5343392050504083
Energy: 0.6222377447301464
Energy: 0.5343392050504083
Energy: 0.6222377447301464
Energy: 0.5343392050504083
Energy: 0.6222377447301464
Energy: 0.6040605310791035
Energy: 0.6053938684659282
Energy: 0.6040605310791035
Energy: 0.6053938684659282
Energy: 0.6040605310791035
Energy: 0.6053938684659282
Energy: 0.582312808663045
Energy: 0.5822680748274291
Energy: 0.582312808663045
Energy: 0.5822680748274291
Energy: 0.582312808663045
Energy: 0.5822680748274291
Energy: 0.6668934420874729
Energy: 0.5730547269182148
Energy: 0.6668934420874729
Energy: 0.573054726917757
Energy: 0.6668934420874729
Energy: 0.5730547269182148
Energy: 0.597697742226628
Energy: 0.6353870224713426
Energy: 0.597697742226628
Energy: 0.6353870224713426
Energy: 0.597697742226628
Energy: 0.6353870224713426
Energy: 0.6213343643793898
Energy: 0.6044284100722087
Energy: 0.6213343643793898
Energy: 0.6044284100717511
Energy: 0.6213343643793898
Energy: 0.6044284100722087
Energy: 0.5821734199534295
Energy: 0.5852917904750577
Energy: 0.5821734199529718
Energy: 0.5852917904750577
Energy: 0.5821734199534295
Energy: 0.5852917904750577
Energy: 0.665094902018531
Energy: 0.7017624973598708
Energy: 0.6650949020180734
Energy: 0.7017624973598708
Energy: 0.6650949020180734
Energy: 0.7017624973598708
Energy: 0.5698608494634549
Energy: 0.6005041563508882
Energy: 0.5979440304312118
Energy: 0.6005041563508882
Energy: 0.5698608494634549
Energy: 0.6005041563508882

minimum gb energy = 0.5191964474489185 eV
minimum distance =  2.54713987249126 Angstroms
sigma value = 57


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

Energy: 0.6465009252778086
Energy: 0.5634056504953056
Energy: 0.6465009252778086
Energy: 0.5634056504953056
Energy: 0.6465009252772161
Energy: 0.5634056504953056
Energy: 0.5646144848769084
Energy: 0.5838780340317025
Energy: 0.5646144848769084
Energy: 0.5838780340317025
Energy: 0.5646144848769084
Energy: 0.5838780340317025
Energy: 0.563302302825378
Energy: 0.6815192956490483
Energy: 0.563302302825378
Energy: 0.6815192956555661
Energy: 0.5633023028259706
Energy: 0.6815192956016459
Energy: 0.7282867781907916
Energy: 0.5880052062251697
Energy: 0.7282867781967167
Energy: 0.5880052062257622
Energy: 0.7282867781961243
Energy: 0.5880052062227997
Energy: 0.7295201188893173
Energy: 0.6047820861320606
Energy: 0.7295201188887248
Energy: 0.6047820861320606
Energy: 0.7295201188893173
Energy: 0.6047820861320606
Energy: 0.5741547828140013
Energy: 0.6300879497167265
Energy: 0.5741547828140013
Energy: 0.6300879497167265
Energy: 0.5741547828140013
Energy: 0.6300879497167265
Energy: 0.642319533716894
Energy: 0.6099605523209475
Energy: 0.6423195337163015
Energy: 0.6099605523209475
Energy: 0.642319533716894
Energy: 0.609960552322725
Energy: 0.5992385485236567
Energy: 0.5657024442210362
Energy: 0.5992385485248417
Energy: 0.5657024442210362
Energy: 0.5992385485242493
Energy: 0.5657024442210362
Energy: 0.6588374954152469
Energy: 0.5768983865997777
Energy: 0.6588374954158395
Energy: 0.5768983865997777
Energy: 0.6588374954170246
Energy: 0.5768983865997777
Energy: 0.5922146140652071
Energy: 0.6042627848856901
Energy: 0.5922146140652071
Energy: 0.6042627848856901
Energy: 0.5922146140657997
Energy: 0.6042627848856901
Energy: 0.5640165245663223
Energy: 0.6207907986462321
Energy: 0.5640165245663223
Energy: 0.6207907986468246
Energy: 0.5640165245663223
Energy: 0.6207907986468246
Energy: 0.6852236338212632
Energy: 0.5970441057110663
Energy: 0.6852236338206705
Energy: 0.5970441057110663
Energy: 0.6852236338212632
Energy: 0.5970441057110663
Energy: 0.5881467554955985
Energy: 0.5774701506162505
Energy: 0.5881467554955985
Energy: 0.5774701506162505
Energy: 0.5881467554955985
Energy: 0.5774701506162505
Energy: 0.6448689524333995
Energy: 0.5069256563314638
Energy: 0.644868952433992
Energy: 0.5069256563320563
Energy: 0.6448689524333995
Energy: 0.5069256563314638
Energy: 0.6841123887918457
Energy: 0.5352464230460857
Energy: 0.6841123887918457
Energy: 0.5352464230460857
Energy: 0.6841123887918457
Energy: 0.5352464230460857
Energy: 0.6997949637468234
Energy: 0.5701959421318551
Energy: 0.6997949637468234
Energy: 0.5701959421318551
Energy: 0.6997949637462308
Energy: 0.5701959421318551
Energy: 0.5848533090215384
Energy: 0.6044706966607774
Energy: 0.5848533090215384
Energy: 0.6044706966607774
Energy: 0.5848533090215384
Energy: 0.6044706966613699
Energy: 0.5631733943694301
Energy: 0.5912701782609935
Energy: 0.5631733943700228
Energy: 0.5912701782621785
Energy: 0.5631733943694301
Energy: 0.5912701782604011
Energy: 0.5846188006080687
Energy: 0.6044689682179247
Energy: 0.5846188006080687
Energy: 0.6044689682185174
Energy: 0.5846188006080687
Energy: 0.6044689682179247
Energy: 0.6935592400935888
Energy: 0.5702049041704084
Energy: 0.6935592400935888
Energy: 0.5702049041704084
Energy: 0.6935592400935888
Energy: 0.5702049041704084
Energy: 0.6841192031370376
Energy: 0.5350693989441637
Energy: 0.6841192031370376
Energy: 0.5350693989441637
Energy: 0.6841192031370376
Energy: 0.5350693989435711
Energy: 0.6536875010296453
Energy: 0.6419872271808562
Energy: 0.6536875010296453
Energy: 0.6419872271808562
Energy: 0.6536875010302379
Energy: 0.6419872271808562
Energy: 0.5881491826220023
Energy: 0.5775569929203218
Energy: 0.5881491826225947
Energy: 0.5775569929197292
Energy: 0.5881491826220023
Energy: 0.5775569929203218
Energy: 0.685068212375117
Energy: 0.5970330509242954
Energy: 0.6850682123745244
Energy: 0.5970330509242954
Energy: 0.685068212375117
Energy: 0.5970330509242954

minimum gb energy = 0.5069256563314638 eV
minimum distance =  2.59425316183884 Angstroms
sigma value = 17


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

Energy: 0.6438731498446202
Energy: 0.5807127861224014
Energy: 0.6438731498437821
Energy: 0.5807127861232394
Energy: 0.6438731498446202
Energy: 0.5807127861224014
Energy: 0.5974419135147846
Energy: 0.6293698952008799
Energy: 0.5974419135147846
Energy: 0.6293698952008799
Energy: 0.5974419135147846
Energy: 0.6293698952008799
Energy: 0.569421805607054
Energy: 0.6290152143463881
Energy: 0.569421805607054
Energy: 0.6290152143463881
Energy: 0.569421805607054
Energy: 0.6290152143463881
Energy: 0.6203085492395569
Energy: 0.6307449529943446
Energy: 0.6203085492395569
Energy: 0.6307449529943446
Energy: 0.6203085492395569
Energy: 0.6307449529943446
Energy: 0.6299356457763737
Energy: 0.6230830245079905
Energy: 0.6299356457772115
Energy: 0.6230830245079905
Energy: 0.6299356457772115
Energy: 0.6230830245079905
Energy: 0.6084741846524977
Energy: 0.662459118720773
Energy: 0.6084741846524977
Energy: 0.662459118720773
Energy: 0.6084741846524977
Energy: 0.662459118720773
Energy: 0.6711244838301195
Energy: 0.573176793231515
Energy: 0.6711244838301195
Energy: 0.573176793231515
Energy: 0.6711244838301195
Energy: 0.573176793231515
Energy: 0.601817412625307
Energy: 0.6274957364883085
Energy: 0.601817412625307
Energy: 0.6274957364883085
Energy: 0.601817412625307
Energy: 0.6274957364883085
Energy: 0.5520821126763827
Energy: 0.6001698970777054
Energy: 0.5520821126763827
Energy: 0.6001698970777054
Energy: 0.5520821126763827
Energy: 0.6001698970777054
Energy: 0.606218435552073
Energy: 0.5972083343274557
Energy: 0.606218435552073
Energy: 0.5972083343274557
Energy: 0.606218435552073
Energy: 0.5972083343274557
Energy: 0.658902097858117
Energy: 0.5713251562727428
Energy: 0.658902097858117
Energy: 0.5713251562727428
Energy: 0.658902097858117
Energy: 0.5713251562727428
Energy: 0.6130564924491428
Energy: 0.6145535344407959
Energy: 0.6130564924499808
Energy: 0.6145535344407959
Energy: 0.6130564924499808
Energy: 0.6145535344407959
Energy: 0.5721675012459314
Energy: 0.6324951726908055
Energy: 0.5721675012459314
Energy: 0.6324951726908055
Energy: 0.5721675012450934
Energy: 0.6324951726908055
Energy: 0.6059018703361445
Energy: 0.5659623663969834
Energy: 0.6059018703361445
Energy: 0.5659623663969834
Energy: 0.6059018703361445
Energy: 0.5659623663969834
Energy: 0.6222795965604413
Energy: 0.6091417059058949
Energy: 0.6222795965604413
Energy: 0.6091417059058949
Energy: 0.6222795965604413
Energy: 0.6091417059058949
Energy: 0.5981289851848257
Energy: 0.6644555371245534
Energy: 0.5981289851848257
Energy: 0.6644555371245534
Energy: 0.5981289851848257
Energy: 0.6644555371245534
Energy: 0.6032429939824018
Energy: 0.5677492476386419
Energy: 0.6032429939824018
Energy: 0.5677492476386419
Energy: 0.6032429939824018
Energy: 0.5677492476386419

minimum gb energy = 0.5520821126763827 eV
minimum distance =  2.61711160877541 Angstroms
sigma value = 17


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

Energy: 0.6116565705391207
Energy: 0.5584931510716924
Energy: 0.6116565705394442
Energy: 0.5584931510713689
Energy: 0.6116565705404151
Energy: 0.5584931510713689
Energy: 0.5664568568410235
Energy: 0.5918353219703555
Energy: 0.5664568568410235
Energy: 0.5918353219706791
Energy: 0.5664568568410235
Energy: 0.5918353219706791
Energy: 0.5207149138322767
Energy: 0.5820264414606592
Energy: 0.5207149138319531
Energy: 0.5820264414606592
Energy: 0.5207149138322767
Energy: 0.5820264414606592
Energy: 0.5844085006752462
Energy: 0.5366270173320027
Energy: 0.5844085006749226
Energy: 0.5366270173320027
Energy: 0.5844085006745989
Energy: 0.5366270173303848
Energy: 0.6361411653742371
Energy: 0.5691439895697882
Energy: 0.6361411653742371
Energy: 0.5691439895697882
Energy: 0.6361411653742371
Energy: 0.5691439895697882
Energy: 0.5215512281933264
Energy: 0.5451335637594924
Energy: 0.5215512281933264
Energy: 0.5451335637591689
Energy: 0.52155122819365
Energy: 0.5451335637591689
Energy: 0.6625765113460665
Energy: 0.5534783131117454
Energy: 0.6625765113447722
Energy: 0.5534783131117454
Energy: 0.662576511345743
Energy: 0.5534783131117454
Energy: 0.5988979128907648
Energy: 0.5839044368630844
Energy: 0.5988979128907648
Energy: 0.5839044368630844
Energy: 0.5988979128904411
Energy: 0.5839044368630844
Energy: 0.5601305675633563
Energy: 0.5972189512443513
Energy: 0.5601305675633563
Energy: 0.5972189512443513
Energy: 0.5601305675633563
Energy: 0.5972189512440277
Energy: 0.5566914054239216
Energy: 0.4772739101684684
Energy: 0.5566914054245687
Energy: 0.4772739101684684
Energy: 0.5566914054248924
Energy: 0.4772739101681448
Energy: 0.5938638199581975
Energy: 0.5903233640591474
Energy: 0.593863819957874
Energy: 0.590323364059471
Energy: 0.593863819957874
Energy: 0.5903233640597946
Energy: 0.5310880889356567
Energy: 0.5983173411848114
Energy: 0.5310880889356567
Energy: 0.5983173411851055
Energy: 0.5310880889356567
Energy: 0.5983173411851055
Energy: 0.60726693622029
Energy: 0.5634681259719074
Energy: 0.60726693622029
Energy: 0.5634681259719074
Energy: 0.60726693622029
Energy: 0.5634681259719074
Energy: 0.6328545440817331
Energy: 0.5321246592351371
Energy: 0.6328545440817331
Energy: 0.5321246592351371
Energy: 0.6328545440817331
Energy: 0.5321246592351371
Energy: 0.600761277472405
Energy: 0.5950853623874591
Energy: 0.6007612774717579
Energy: 0.5950853623874591
Energy: 0.6007612774720815
Energy: 0.5950853623877828
Energy: 0.555038005406354
Energy: 0.5803393260481394
Energy: 0.555038005406354
Energy: 0.5803393260484631
Energy: 0.555038005406354
Energy: 0.5803393260484631
Energy: 0.5557999831162083
Energy: 0.5127860258175186
Energy: 0.5557999831162083
Energy: 0.5127860258175186
Energy: 0.5557999831158846
Energy: 0.5127860258175186
Energy: 0.6122979383858863
Energy: 0.5709607815631778
Energy: 0.6122979383858863
Energy: 0.5709607815631778
Energy: 0.6122979383858863
Energy: 0.5709607815628541
Energy: 0.5629382743489119
Energy: 0.5963845572128507
Energy: 0.5629382743492354
Energy: 0.5963845572131742
Energy: 0.5629382743489119
Energy: 0.5963845572128507
Energy: 0.5550150852274686
Energy: 0.531944319502829
Energy: 0.5550150852274686
Energy: 0.5319443195031526
Energy: 0.5550150852277922
Energy: 0.5319443195031526
Energy: 0.5633645130239241
Energy: 0.5965583646483723
Energy: 0.5633645130242477
Energy: 0.5965583646483723
Energy: 0.5633645130245714
Energy: 0.5965583646483723
Energy: 0.6124708280272471
Energy: 0.5709591318446542
Energy: 0.6124708280269235
Energy: 0.5709591318443306
Energy: 0.6124708280272471
Energy: 0.5709591318446542
Energy: 0.5559039543453285
Energy: 0.5126452977538328
Energy: 0.5559039543453285
Energy: 0.5126452977538328
Energy: 0.5559039543446813
Energy: 0.5126452977535094
Energy: 0.5549604218629676
Energy: 0.6138678025120126
Energy: 0.5549604218626439
Energy: 0.6138678025120126
Energy: 0.5549604218629676
Energy: 0.613867802511689
Energy: 0.6007506472689662
Energy: 0.595121163652336
Energy: 0.6007506472686426
Energy: 0.595121163652336
Energy: 0.6007506472689662
Energy: 0.595121163652336
Energy: 0.6328811525460971
Energy: 0.5319830083314713
Energy: 0.6328811525460971
Energy: 0.5319830083311476
Energy: 0.6328811525460971
Energy: 0.5319830083311476
Energy: 0.6072586296752222
Energy: 0.5429321531374163
Energy: 0.6072586296752222
Energy: 0.5429321531374163
Energy: 0.6072586296752222
Energy: 0.5429321531374163
Energy: 0.5308599417016233
Energy: 0.5982585663317923
Energy: 0.5308599417016233
Energy: 0.5982585663317923
Energy: 0.5308599417016233
Energy: 0.5982585663317923
Energy: 0.5938807262513909
Energy: 0.5903581567904582
Energy: 0.5938807262517144
Energy: 0.5903581567904582
Energy: 0.5938807262520379
Energy: 0.5903581567904582
Energy: 0.556610684901274
Energy: 0.47723727816339473
Energy: 0.5566106849006267
Energy: 0.4772372781637183
Energy: 0.5566106849003031
Energy: 0.4772372781637183
Energy: 0.5601317189993457
Energy: 0.5972109883349982
Energy: 0.5601317189993457
Energy: 0.5972109883349982
Energy: 0.5601317189993457
Energy: 0.5972109883349982
Energy: 0.5989890599405552
Energy: 0.6120879380611424
Energy: 0.5989890599405552
Energy: 0.6120879380608187
Energy: 0.5989890599408787
Energy: 0.6120879380608187
Energy: 0.6627417796756929
Energy: 0.5535008125403845
Energy: 0.6627417796753694
Energy: 0.553500812540061
Energy: 0.6627417796753694
Energy: 0.5535008125403845
Energy: 0.5216470953343236
Energy: 0.5247911961874773
Energy: 0.5216470953346473
Energy: 0.5247911961874773
Energy: 0.5216470953346473
Energy: 0.5247911961874773
Energy: 0.6363248395236436
Energy: 0.56913266370243
Energy: 0.6363248395236436
Energy: 0.5691326637027536
Energy: 0.6363248395236436
Energy: 0.5691326637027536
Energy: 0.5844703700724889
Energy: 0.5813001861122195
Energy: 0.5844703700724889
Energy: 0.5813001861122195
Energy: 0.5844703700724889
Energy: 0.5813001861118959
Energy: 0.5208651112138378
Energy: 0.5820068139724408
Energy: 0.5208651112141613
Energy: 0.5820068139724408
Energy: 0.5208651112138378
Energy: 0.5820068139724408
Energy: 0.566543760084782
Energy: 0.5855032541768616
Energy: 0.5665437600851057
Energy: 0.585503254176538
Energy: 0.566543760084782
Energy: 0.585503254176538
Energy: 0.6116565705397679
Energy: 0.5584931510716924
Energy: 0.6116565705404151
Energy: 0.5584931510716924
Energy: 0.6116565705404151
Energy: 0.5584931510716924
Energy: 0.5664568568407001
Energy: 0.5509677288760371
Energy: 0.5664568568413472
Energy: 0.5509677288757134
Energy: 0.5664568568410235
Energy: 0.5509677288757134
Energy: 0.5207149138316295
Energy: 0.5820264414606592
Energy: 0.5207149138319531
Energy: 0.5820264414606592
Energy: 0.5207149138319531
Energy: 0.5820264414606592
Energy: 0.5844085006739518
Energy: 0.5283661688698201
Energy: 0.5844085006742754
Energy: 0.5283661688701438
Energy: 0.5844085006739518
Energy: 0.5283661688701438
Energy: 0.6361411653739135
Energy: 0.5691439895701117
Energy: 0.6361411653739135
Energy: 0.5691439895701117
Energy: 0.6361411653739135
Energy: 0.5691439895701117

minimum gb energy = 0.47723727816339473 eV
minimum distance =  2.54978230300362 Angstroms
sigma value = 57


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

Energy: 0.5837453788827724
Energy: 0.5423767056417326
Energy: 0.5837453788822454
Energy: 0.5423767056412058
Energy: 0.5837453788822454
Energy: 0.5423767056412058
Energy: 0.5237514657450126
Energy: 0.5277624959193807
Energy: 0.5237514657450126
Energy: 0.5277624959193807
Energy: 0.5237514657455394
Energy: 0.5277624959193807
Energy: 0.5056221880304432
Energy: 0.5243460658264226
Energy: 0.5056221880304432
Energy: 0.5243460658258958
Energy: 0.50562218803097
Energy: 0.5243460658264226
Energy: 0.5539909379720057
Energy: 0.49809213071909536
Energy: 0.5539909379725326
Energy: 0.4980921307185685
Energy: 0.5539909379725326
Energy: 0.4980921307185685
Energy: 0.5747374120020065
Energy: 0.5107158119292354
Energy: 0.5747374120020065
Energy: 0.5107158119287086
Energy: 0.5747374120025334
Energy: 0.5107158119287086
Energy: 0.4877484547407977
Energy: 0.4702527278055002
Energy: 0.4877484547407977
Energy: 0.4702527278055002
Energy: 0.48774845474132456
Energy: 0.4702527278055002
Energy: 0.5620618016344999
Energy: 0.5222915900613495
Energy: 0.5620618016350268
Energy: 0.5222915900618765
Energy: 0.5620618016350268
Energy: 0.5222915900618765
Energy: 0.5611578069704297
Energy: 0.5706785472333145
Energy: 0.5611578069709566
Energy: 0.5706785472333145
Energy: 0.5611578069709566
Energy: 0.5706785472333145
Energy: 0.5085251593967194
Energy: 0.5103285967103616
Energy: 0.5085251593967194
Energy: 0.5103285967103616
Energy: 0.5085251593967194
Energy: 0.5103285967103616
Energy: 0.5500064643611551
Energy: 0.46915927783157574
Energy: 0.5500064643611551
Energy: 0.4691592778321026
Energy: 0.5500064643606282
Energy: 0.46915927783157574
Energy: 0.5573449526348089
Energy: 0.5602411292823914
Energy: 0.5573449526348089
Energy: 0.5602411292818645
Energy: 0.5573449526348089
Energy: 0.5602411292823914
Energy: 0.4849855786171138
Energy: 0.5640160031720032
Energy: 0.4849855786171138
Energy: 0.5640160031725301
Energy: 0.4849855786171138
Energy: 0.564016003173057
Energy: 0.5458430102040294
Energy: 0.5072992219476289
Energy: 0.5458430102040294
Energy: 0.5072992219476289
Energy: 0.5458430102045563
Energy: 0.5072992219481558
Energy: 0.5690227034420139
Energy: 0.5187111316933619
Energy: 0.5690227034425408
Energy: 0.5187111316933619
Energy: 0.5690227034425408
Energy: 0.518711131692835
Energy: 0.5018124153771085
Energy: 0.5759397518719096
Energy: 0.5018124153765817
Energy: 0.5759397518719096
Energy: 0.5018124153771085
Energy: 0.5759397518713828
Energy: 0.560290311116144
Energy: 0.5247855654184277
Energy: 0.5602903111166709
Energy: 0.5247855654184277
Energy: 0.5602903111166709
Energy: 0.5247855654184277
Energy: 0.6104493961948467
Energy: 0.5098622286231342
Energy: 0.6104493961953735
Energy: 0.5098622286231342
Energy: 0.6104493961948467
Energy: 0.5098622286231342
Energy: 0.5723007774530537
Energy: 0.5722395976653419
Energy: 0.5723007774530537
Energy: 0.5722395976653419
Energy: 0.5723007774530537
Energy: 0.5722395976653419
Energy: 0.5235979770877326
Energy: 0.549974807072378
Energy: 0.5235979770877326
Energy: 0.549974807072378
Energy: 0.5235979770882594
Energy: 0.5499748070718511
Energy: 0.5341896732625432
Energy: 0.4921262656076426
Energy: 0.5341896732620163
Energy: 0.4921262656076426
Energy: 0.5341896732625432
Energy: 0.4921262656076426
Energy: 0.5715683426688498
Energy: 0.5420232651499852
Energy: 0.5715683426688498
Energy: 0.5420232651499852
Energy: 0.5715683426688498
Energy: 0.5420232651499852
Energy: 0.4997687343670182
Energy: 0.5566706195550807
Energy: 0.4997687343670182
Energy: 0.5566706195550807
Energy: 0.4997687343670182
Energy: 0.5566706195550807
Energy: 0.48443652122270786
Energy: 0.4799657284185153
Energy: 0.48443652122270786
Energy: 0.4799657284185153
Energy: 0.48443652122218095
Energy: 0.4799657284185153
Energy: 0.525502065838243
Energy: 0.612365253678892
Energy: 0.5255020658387699
Energy: 0.612365253678892
Energy: 0.5255020658387699
Energy: 0.612365253678892
Energy: 0.5671892009684555
Energy: 0.5438207721615667
Energy: 0.5671892009684555
Energy: 0.5438207721620936
Energy: 0.5671892009684555
Energy: 0.5438207721620936
Energy: 0.5407373121045786
Energy: 0.4797198236225078
Energy: 0.5407373121045786
Energy: 0.4797198236225078
Energy: 0.5407373121050576
Energy: 0.4797198236225078
Energy: 0.5017438631945815
Energy: 0.571014904613258
Energy: 0.5017438631945815
Energy: 0.571014904613258
Energy: 0.5017438631951084
Energy: 0.571014904613258

minimum gb energy = 0.46915927783157574 eV
minimum distance =  2.58138126054527 Angstroms
sigma value = 43


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

Energy: 0.5425673172676729
Energy: 0.42811648473127933
Energy: 0.5425673172680568
Energy: 0.4281164847316632
Energy: 0.5425673172680568
Energy: 0.4281164847316632
Energy: 0.4609607428109516
Energy: 0.472954300785188
Energy: 0.4609607428105677
Energy: 0.472954300785188
Energy: 0.4609607428109516
Energy: 0.472954300785188
Energy: 0.44607216919145937
Energy: 0.47309105167930054
Energy: 0.44607216919145937
Energy: 0.47309105167930054
Energy: 0.44607216919145937
Energy: 0.47309105167968435
Energy: 0.5252014144123165
Energy: 0.4330570260030923
Energy: 0.5252014144119326
Energy: 0.4330570260030923
Energy: 0.5252014144123165
Energy: 0.4330570260030923
Energy: 0.4956630909330725
Energy: 0.46604920900764524
Energy: 0.4956630909330725
Energy: 0.46604920900764524
Energy: 0.4956630909330725
Energy: 0.4660492090072613
Energy: 0.4280068769222163
Energy: 0.45580984000226893
Energy: 0.4280068769222163
Energy: 0.45580984000226893
Energy: 0.4280068769222163
Energy: 0.45580984000226893
Energy: 0.5041676313141544
Energy: 0.45129374948354506
Energy: 0.5041676313141544
Energy: 0.45129374948354506
Energy: 0.5041676313141544
Energy: 0.45129374948354506
Energy: 0.5186663807221621
Energy: 0.5047716149174833
Energy: 0.518666380722546
Energy: 0.5047716149170993
Energy: 0.518666380722546
Energy: 0.5047716149174833
Energy: 0.4235829826181933
Energy: 0.4544448742814579
Energy: 0.42358298261857724
Energy: 0.4544448742814579
Energy: 0.42358298261857724
Energy: 0.4544448742814579
Energy: 0.4714790466836214
Energy: 0.44633669079061633
Energy: 0.4714790466836214
Energy: 0.44633669079061633
Energy: 0.4714790466836214
Energy: 0.44633669079061633
Energy: 0.500525384922855
Energy: 0.48625001349228336
Energy: 0.500525384923239
Energy: 0.4862500134926672
Energy: 0.500525384922855
Energy: 0.48625001349228336
Energy: 0.44087559491653655
Energy: 0.4734003878903104
Energy: 0.44087559491615264
Energy: 0.47340038789069433
Energy: 0.44087559491615264
Energy: 0.4734003878903104
Energy: 0.47167914059813854
Energy: 0.43810701909223587
Energy: 0.47167914059813854
Energy: 0.43810701909223587
Energy: 0.47167914059813854
Energy: 0.43810701909223587
Energy: 0.4946302749854148
Energy: 0.49535417040424606
Energy: 0.49463027498579876
Energy: 0.49535417040424606
Energy: 0.4946302749854148
Energy: 0.49535417040424606
Energy: 0.44575769382299346
Energy: 0.4720567309804346
Energy: 0.4457576938233773
Energy: 0.4720567309804346
Energy: 0.4457576938233773
Energy: 0.4720567309804346
Energy: 0.48392565506310564
Energy: 0.4328574416707537
Energy: 0.48392565506310564
Energy: 0.4328574416707537
Energy: 0.48392565506310564
Energy: 0.4328574416707537
Energy: 0.5072159392377884
Energy: 0.4943862561439185
Energy: 0.5072159392377884
Energy: 0.4943862561439185
Energy: 0.5072159392374044
Energy: 0.4943862561439185
Energy: 0.4280454948118396
Energy: 0.5230443705958144
Energy: 0.4280454948118396
Energy: 0.5230443705958144
Energy: 0.4280454948118396
Energy: 0.5230443705958144
Energy: 0.4570647596350531
Energy: 0.44796203690721087
Energy: 0.4570647596350531
Energy: 0.44796203690759473
Energy: 0.4570647596350531
Energy: 0.44796203690721087
Energy: 0.4803614589780024
Energy: 0.49670538714556756
Energy: 0.48036145897761856
Energy: 0.49670538714556756
Energy: 0.4803614589780024
Energy: 0.49670538714556756
Energy: 0.44016977526115003
Energy: 0.5430156072391572
Energy: 0.4401697752615339
Energy: 0.5430156072391572
Energy: 0.4401697752615339
Energy: 0.5430156072391572
Energy: 0.485869039916258
Energy: 0.46162428035616976
Energy: 0.485869039916258
Energy: 0.46162428035578595
Energy: 0.485869039916258
Energy: 0.46162428035578595
Energy: 0.474814874910421
Energy: 0.4484584571433599
Energy: 0.474814874910421
Energy: 0.4484584571433599
Energy: 0.474814874910421
Energy: 0.4484584571433599
Energy: 0.5110746117558841
Energy: 0.5332610912284013
Energy: 0.5110746117555002
Energy: 0.5332610912284013
Energy: 0.5110746117558841
Energy: 0.5332610912284013
Energy: 0.4612584563925321
Energy: 0.45140848645642895
Energy: 0.4612584563925321
Energy: 0.45140848645642895
Energy: 0.46125845639291596
Energy: 0.45140848645604503
Energy: 0.5006762337526521
Energy: 0.43478972584206754
Energy: 0.5006762337518844
Energy: 0.43478972584206754
Energy: 0.5006762337522682
Energy: 0.43478972584206754
Energy: 0.4570847364248169
Energy: 0.5090006316807878
Energy: 0.4570847364252007
Energy: 0.5090006316807878
Energy: 0.4570847364248169
Energy: 0.5090006316807878
Energy: 0.4529306129742813
Energy: 0.5041139292036256
Energy: 0.4529306129742813
Energy: 0.5041139292036256
Energy: 0.4529306129742813
Energy: 0.5041139292036256
Energy: 0.4922037157975342
Energy: 0.4180305226118985
Energy: 0.4922037157979181
Energy: 0.4180305226122824
Energy: 0.4922037157971503
Energy: 0.4180305226122824
Energy: 0.44085167128836233
Energy: 0.4892530247247114
Energy: 0.44085167128797853
Energy: 0.4892530247247114
Energy: 0.44085167128836233
Energy: 0.4892530247247114
Energy: 0.4551656103122952
Energy: 0.5148368560309398
Energy: 0.4551656103119114
Energy: 0.5148368560313237
Energy: 0.4551656103122952
Energy: 0.5148368560313237
Energy: 0.4928611689544641
Energy: 0.41397838133139614
Energy: 0.4928611689544641
Energy: 0.41397838133139614
Energy: 0.4928611689544641
Energy: 0.41397838133139614
Energy: 0.40709677940319716
Energy: 0.5387970856708792
Energy: 0.4070967794024294
Energy: 0.5387970856708792
Energy: 0.40709677940281336
Energy: 0.5387970856708792
Energy: 0.48612497656830483
Energy: 0.4961160231073741
Energy: 0.486124976567921
Energy: 0.49611602310699016
Energy: 0.48612497656830483
Energy: 0.49611602310699016
Energy: 0.4603321307820605
Energy: 0.434356763411856
Energy: 0.4603321307816766
Energy: 0.434356763411856
Energy: 0.4603321307820605
Energy: 0.434356763411856
Energy: 0.42717273803200706
Energy: 0.46312255030529736
Energy: 0.4271727380316232
Energy: 0.46312255030491356
Energy: 0.4271727380316232
Energy: 0.46312255030491356

minimum gb energy = 0.4070967794024294 eV
minimum distance =  2.57441300853308 Angstroms
sigma value = 81


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

Energy: 0.10429161344876647
Energy: 0.13049961826387527
Energy: 0.10429161344862221
Energy: 0.130499618263731
Energy: 0.10429161344847795
Energy: 0.130499618263731
Energy: 0.2689289406309745
Energy: 0.19487577493212416
Energy: 0.26892894063084627
Energy: 0.19487577493239666
Energy: 0.26892894063084627
Energy: 0.1948757749319799
Energy: 0.26884930525438505
Energy: 0.19450662124441845
Energy: 0.26884930525452927
Energy: 0.19450662124441845
Energy: 0.26884930525438505
Energy: 0.19450662124427423
Energy: 0.10429161344862221
Energy: 0.130499618263731
Energy: 0.10429161344862221
Energy: 0.130499618263731
Energy: 0.10429161344847795
Energy: 0.130499618263731
Energy: 0.268928940630702
Energy: 0.19487577493226846
Energy: 0.268928940630702
Energy: 0.19487577493212416
Energy: 0.268928940630702
Energy: 0.19487577493212416
Energy: 0.26884930525438505
Energy: 0.19450662124441845
Energy: 0.26884930525438505
Energy: 0.19450662124412998
Energy: 0.26884930525452927
Energy: 0.194506621244691
Energy: 0.10429161344876647
Energy: 0.130499618263731
Energy: 0.10429161344862221
Energy: 0.130499618263731
Energy: 0.10429161344847795
Energy: 0.130499618263731
Energy: 0.2689289406305577
Energy: 0.19487577493226846
Energy: 0.26892894063084627
Energy: 0.19487577493212416
Energy: 0.26892894063041345
Energy: 0.19487577493212416
Energy: 0.26884930525452927
Energy: 0.19450662124427423
Energy: 0.26884930525452927
Energy: 0.19450662124441845
Energy: 0.26884930525452927
Energy: 0.19450662124456272
Energy: 0.10429161344876647
Energy: 0.130499618263731
Energy: 0.10429161344847795
Energy: 0.130499618263731
Energy: 0.10429161344847795
Energy: 0.13049961826358675

minimum gb energy = 0.10429161344847795 eV
minimum distance =  2.83763899398038 Angstroms
sigma value = 3


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

Energy: 0.48222093378189
Energy: 0.48917285238299624
Energy: 0.48222093378189
Energy: 0.48917285238299624
Energy: 0.48222093378189
Energy: 0.48917285238299624
Energy: 0.46809056946543665
Energy: 0.4535159466178398
Energy: 0.46809056946543665
Energy: 0.4535159466178398
Energy: 0.4680905694650145
Energy: 0.4535159466178398
Energy: 0.4763136515375283
Energy: 0.45916586755448197
Energy: 0.4763136515375283
Energy: 0.45916586755448197
Energy: 0.4763136515375283
Energy: 0.45916586755448197
Energy: 0.47423731337104635
Energy: 0.44237452090222584
Energy: 0.47423731337104635
Energy: 0.44237452090222584
Energy: 0.47423731337104635
Energy: 0.44237452090222584
Energy: 0.3988396813502552
Energy: 0.48897945617788585
Energy: 0.3988396813498331
Energy: 0.48897945617788585
Energy: 0.3988396813498331
Energy: 0.48897945617788585
Energy: 0.49677990769438535
Energy: 0.4490661046891997
Energy: 0.49677990769438535
Energy: 0.4490661046891997
Energy: 0.49677990769438535
Energy: 0.4490661046891997
Energy: 0.4586934205859888
Energy: 0.4466429406994002
Energy: 0.4586934205859888
Energy: 0.4466429406994002
Energy: 0.4586934205859888
Energy: 0.44664294069982224
Energy: 0.437151090669695
Energy: 0.47116544406215144
Energy: 0.437151090669695
Energy: 0.4711654440625736
Energy: 0.4371510906692728
Energy: 0.47116544406215144
Energy: 0.465678526816564
Energy: 0.4625240061803587
Energy: 0.465678526816564
Energy: 0.4625240061803587
Energy: 0.465678526816564
Energy: 0.4625240061803587
Energy: 0.48858264842258337
Energy: 0.42719321381344216
Energy: 0.48858264842258337
Energy: 0.42719321381344216
Energy: 0.48858264842258337
Energy: 0.42719321381344216
Energy: 0.4059122703645734
Energy: 0.47029129398026137
Energy: 0.4059122703649955
Energy: 0.4702912939806834
Energy: 0.4059122703645734
Energy: 0.4702912939806834
Energy: 0.46135284192146736
Energy: 0.4787947128651815
Energy: 0.46135284192188947
Energy: 0.4787947128651815
Energy: 0.46135284192188947
Energy: 0.4787947128651815
Energy: 0.47794189804958814
Energy: 0.3961643212187101
Energy: 0.4779418980491661
Energy: 0.3961643212187101
Energy: 0.4779418980491661
Energy: 0.3961643212187101
Energy: 0.40946206787761397
Energy: 0.4573506972186555
Energy: 0.40946206787761397
Energy: 0.4573506972186555
Energy: 0.40946206787761397
Energy: 0.4573506972186555
Energy: 0.4464538006027311
Energy: 0.47726211836312454
Energy: 0.4464538006027311
Energy: 0.47726211836312454
Energy: 0.4464538006027311
Energy: 0.47726211836312454
Energy: 0.5004469087661166
Energy: 0.44622131216497435
Energy: 0.5004469087661166
Energy: 0.44622131216497435
Energy: 0.5004469087661166
Energy: 0.44622131216497435
Energy: 0.45866454592902384
Energy: 0.48074556578572214
Energy: 0.45866454592902384
Energy: 0.4807455657861442
Energy: 0.45866454592902384
Energy: 0.4807455657861442
Energy: 0.454676028018783
Energy: 0.4648920152929955
Energy: 0.45467602801836093
Energy: 0.4648920152929955
Energy: 0.45467602801836093
Energy: 0.4648920152929955
Energy: 0.44891603304727984
Energy: 0.4515626624447113
Energy: 0.4489160330468578
Energy: 0.4515626624447113
Energy: 0.4489160330468578
Energy: 0.4515626624447113
Energy: 0.4686637369318985
Energy: 0.4878477108434405
Energy: 0.4686637369318985
Energy: 0.4878477108434405
Energy: 0.46866373693232055
Energy: 0.4878477108434405
Energy: 0.47270962421607915
Energy: 0.4473075964187871
Energy: 0.47270962421607915
Energy: 0.4473075964187871
Energy: 0.47270962421607915
Energy: 0.4473075964187871
Energy: 0.4674606740523039
Energy: 0.4504159215297737
Energy: 0.467460674052726
Energy: 0.4504159215297737
Energy: 0.4674606740523039
Energy: 0.4504159215297737
Energy: 0.4455266361807279
Energy: 0.4848473053914601
Energy: 0.4455266361807279
Energy: 0.4848473053914601
Energy: 0.44552663618115007
Energy: 0.48484730539188226
Energy: 0.4527593695132177
Energy: 0.42839146314265625
Energy: 0.4527593695132177
Energy: 0.42839146314265625
Energy: 0.4527593695132177
Energy: 0.42839146314265625
Energy: 0.47313593669175547
Energy: 0.4805159794631286
Energy: 0.47313593669175547
Energy: 0.4805159794631286
Energy: 0.47313593669175547
Energy: 0.4805159794631286
Energy: 0.4213137208673715
Energy: 0.4649411637019606
Energy: 0.4213137208673715
Energy: 0.4649411637019606
Energy: 0.4213137208673715
Energy: 0.4649411637019606
Energy: 0.5060925806227264
Energy: 0.4262084769093028
Energy: 0.5060925806231484
Energy: 0.42620847690888075
Energy: 0.5060925806227264
Energy: 0.42620847690888075
Energy: 0.4590742600461714
Energy: 0.4626427931446889
Energy: 0.4590742600461714
Energy: 0.4626427931446889
Energy: 0.45907426004574936
Energy: 0.4626427931446889
Energy: 0.4046816413363812
Energy: 0.49993601380665276
Energy: 0.4046816413363812
Energy: 0.49993601380665276
Energy: 0.4046816413363812
Energy: 0.49993601380665276
Energy: 0.5104245570563993
Energy: 0.4355609442004571
Energy: 0.5104245570568213
Energy: 0.4355609442004571
Energy: 0.5104245570563993
Energy: 0.4355609442004571
Energy: 0.4814843848821449
Energy: 0.4633234697502391
Energy: 0.4814843848821449
Energy: 0.4633234697506611
Energy: 0.4814843848821449
Energy: 0.4633234697506611
Energy: 0.43790681851418894
Energy: 0.4494087636823068
Energy: 0.43790681851418894
Energy: 0.44940876368188465
Energy: 0.43790681851418894
Energy: 0.44940876368188465
Energy: 0.4507412870549197
Energy: 0.4406936368438875
Energy: 0.45074128705534183
Energy: 0.4406936368434655
Energy: 0.45074128705534183
Energy: 0.4406936368434655

minimum gb energy = 0.3961643212187101 eV
minimum distance =  2.60567849709618 Angstroms
sigma value = 67


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

Energy: 0.557458849486422
Energy: 0.5302326105829279
Energy: 0.557458849486422
Energy: 0.5302326105829279
Energy: 0.557458849486422
Energy: 0.5302326105829279
Energy: 0.5046378655642392
Energy: 0.5185194829719149
Energy: 0.5046378655642392
Energy: 0.5185194829719149
Energy: 0.5046378655642392
Energy: 0.5185194829719149
Energy: 0.575471697786843
Energy: 0.5105135549567877
Energy: 0.575471697786843
Energy: 0.5105135549561863
Energy: 0.5535355361865948
Energy: 0.5105135549561863
Energy: 0.5240030217001242
Energy: 0.48978383860464014
Energy: 0.524003021699523
Energy: 0.4897838386040387
Energy: 0.524003021699523
Energy: 0.48978383860464014
Energy: 0.5135462466965047
Energy: 0.5306568075943648
Energy: 0.5135462466965047
Energy: 0.5306568075943648
Energy: 0.5135462466965047
Energy: 0.5306568075943648
Energy: 0.5346356774018519
Energy: 0.5188280852338015
Energy: 0.5346356774018519
Energy: 0.5188280852338015
Energy: 0.5346356774018519
Energy: 0.5188280852344032
Energy: 0.5702660372798779
Energy: 0.4796562178078421
Energy: 0.5702660372792765
Energy: 0.4796562178084436
Energy: 0.5702660372798779
Energy: 0.4796562178084436
Energy: 0.5054044079355424
Energy: 0.5532510461786909
Energy: 0.5054044079355424
Energy: 0.5532510461786909
Energy: 0.5054044079355424
Energy: 0.5532510461786909
Energy: 0.5339902879302204
Energy: 0.5454190445204385
Energy: 0.5339902879302204
Energy: 0.5454190445204385
Energy: 0.5339902879302204
Energy: 0.5454190445204385
Energy: 0.5471615576813097
Energy: 0.521299716474159
Energy: 0.547161557681911
Energy: 0.5212997164735576
Energy: 0.5471615576813097
Energy: 0.5212997164735576
Energy: 0.5087000655977288
Energy: 0.5480618599663449
Energy: 0.508700065596526
Energy: 0.5480618599657435
Energy: 0.5087000655977288
Energy: 0.5480618599663449
Energy: 0.5030655788536896
Energy: 0.5719476588214044
Energy: 0.5030655788536896
Energy: 0.571947658820803
Energy: 0.5030655788536896
Energy: 0.571947658820803
Energy: 0.4985341406633462
Energy: 0.5172816470020533
Energy: 0.4985341406627448
Energy: 0.5172816470020533
Energy: 0.4985341406633462
Energy: 0.5172816470020533
Energy: 0.5298289647969939
Energy: 0.5503538899289312
Energy: 0.5298289647975954
Energy: 0.5503538899283297
Energy: 0.5298289647975954
Energy: 0.5503538899289312
Energy: 0.5128843707265146
Energy: 0.5237408166471668
Energy: 0.5128843707259131
Energy: 0.5237408166471668
Energy: 0.5128843707259131
Energy: 0.5237408166471668
Energy: 0.5216925026300528
Energy: 0.516314228100846
Energy: 0.5216925026294515
Energy: 0.516314228100846
Energy: 0.5216925026300528
Energy: 0.516314228100846
Energy: 0.498202359944364
Energy: 0.5282681779764206
Energy: 0.498202359944364
Energy: 0.5282681779764206
Energy: 0.498202359944364
Energy: 0.5282681779764206
Energy: 0.5556434391367499
Energy: 0.4855105337383626
Energy: 0.5556434391367499
Energy: 0.4855105337383626
Energy: 0.5556434391367499
Energy: 0.4855105337383626
Energy: 0.5496148885344182
Energy: 0.5354574665400281
Energy: 0.5496148885344182
Energy: 0.5354574665400281
Energy: 0.5496148885344182
Energy: 0.5354574665400281
Energy: 0.5247074852774946
Energy: 0.5646468420230626
Energy: 0.524707485278096
Energy: 0.5646468420230626
Energy: 0.5247074852774946
Energy: 0.5646468420230626
Energy: 0.5318694770379013
Energy: 0.5051226849525321
Energy: 0.5318694770385026
Energy: 0.5051226849525321
Energy: 0.5318694770379013
Energy: 0.5051226849525321
Energy: 0.5270708201065951
Energy: 0.5526346606511564
Energy: 0.5270708201065951
Energy: 0.5526346606511564
Energy: 0.5270708201065951
Energy: 0.552634660650555
Energy: 0.5335012856320452
Energy: 0.515977439166253
Energy: 0.5335012856320452
Energy: 0.515977439166253
Energy: 0.5335012856314439
Energy: 0.515977439166253

minimum gb energy = 0.4796562178078421 eV
minimum distance =  2.65750164118932 Angstroms
sigma value = 33


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

Energy: 0.6134456489700215
Energy: 0.5581417904337475
Energy: 0.5973639640266152
Energy: 0.5581417904341289
Energy: 0.613445648970403
Energy: 0.5581417904341289
Energy: 0.5460295273243365
Energy: 0.5801366659594732
Energy: 0.5460295273243365
Energy: 0.5801366659583287
Energy: 0.5460295273243365
Energy: 0.5801366659583287
Energy: 0.5918281245790115
Energy: 0.5714608623412253
Energy: 0.591828124579393
Energy: 0.5714608623416066
Energy: 0.5918281245801561
Energy: 0.5714608623416066
Energy: 0.5623174638511829
Energy: 0.5348569564517518
Energy: 0.5623174638511829
Energy: 0.5348569564509889
Energy: 0.5623174638511829
Energy: 0.5348569564509889
Energy: 0.5370541736972022
Energy: 0.5501213400658618
Energy: 0.5370541736972022
Energy: 0.5501213400670064
Energy: 0.5370541736968206
Energy: 0.5501213400666248
Energy: 0.5887628457010751
Energy: 0.5824332132596519
Energy: 0.5887628457006935
Energy: 0.5741700771017937
Energy: 0.5887628456999304
Energy: 0.5741700771021753
Energy: 0.5779713719794901
Energy: 0.5857891169791212
Energy: 0.5779713719794901
Energy: 0.5857891169798841
Energy: 0.5779713719791086
Energy: 0.5857891169798841
Energy: 0.5584155032323509
Energy: 0.5679049918406409
Energy: 0.5584155032319693
Energy: 0.5679049918410224
Energy: 0.5584155032319693
Energy: 0.5679049918410224
Energy: 0.5546494130435797
Energy: 0.6373764626703986
Energy: 0.5546486409236778
Energy: 0.6373764626696355
Energy: 0.5546494130435797
Energy: 0.6373764626696355
Energy: 0.6005180718012318
Energy: 0.5825695288891711
Energy: 0.6005180718012318
Energy: 0.577837589371605
Energy: 0.6005180718012318
Energy: 0.577837589371605
Energy: 0.5938353476346109
Energy: 0.5848317356629472
Energy: 0.5938304545426668
Energy: 0.5848317356629472
Energy: 0.5938353476353742
Energy: 0.5848317356629472
Energy: 0.5313508754316433
Energy: 0.553379912488648
Energy: 0.5313508754312617
Energy: 0.553379912488648
Energy: 0.5313508754316433
Energy: 0.5533799124882666
Energy: 0.6106107908648407
Energy: 0.5520001410048655
Energy: 0.6106107908652222
Energy: 0.552000141004484
Energy: 0.6106107908656038
Energy: 0.552000141004484
Energy: 0.5580640449541302
Energy: 0.5897828326460195
Energy: 0.5580640449545116
Energy: 0.5897828326452563
Energy: 0.5580640449545116
Energy: 0.5897828326452563
Energy: 0.5728279770651175
Energy: 0.5632894153759874
Energy: 0.5728279770647359
Energy: 0.5632894153767506
Energy: 0.5728279770651175
Energy: 0.563289415376369
Energy: 0.5626789996305182
Energy: 0.5616485371399942
Energy: 0.5626789996305182
Energy: 0.5616485371403758
Energy: 0.5626789996308996
Energy: 0.5616485371407574
Energy: 0.5854913554903064
Energy: 0.5724098750435994
Energy: 0.5854913554895435
Energy: 0.5724098750432179
Energy: 0.5854913554895435
Energy: 0.5724098750432179
Energy: 0.6288736748118605
Energy: 0.5891031829067007
Energy: 0.6288736748122421
Energy: 0.5891031829063191
Energy: 0.6288736748118605
Energy: 0.5891031829063191
Energy: 0.575667485323615
Energy: 0.5523844731141929
Energy: 0.5756674853243782
Energy: 0.5523844731153376
Energy: 0.5756674853239966
Energy: 0.552384473114956
Energy: 0.6063456247634872
Energy: 0.6062080522634011
Energy: 0.6063456247646317
Energy: 0.6062080522641643
Energy: 0.6063456247642501
Energy: 0.6062080522641643
Energy: 0.5922944233165761
Energy: 0.5873102259748659
Energy: 0.5922838476576163
Energy: 0.5873102259744843
Energy: 0.5922944233173393
Energy: 0.5873102259748659
Energy: 0.5875938275491314
Energy: 0.5669771855659503
Energy: 0.5875938275491314
Energy: 0.5669771855663319
Energy: 0.5875938275498943
Energy: 0.5669771855663319
Energy: 0.5675025977059978
Energy: 0.5854816509153894
Energy: 0.5710325389622111
Energy: 0.5854816509146262
Energy: 0.5675025977056163
Energy: 0.5854816509146262
Energy: 0.5854600233834272
Energy: 0.5577784322067522
Energy: 0.573051811572147
Energy: 0.5577784322071337
Energy: 0.5854600233830457
Energy: 0.5577784322071337
Energy: 0.5536015861113854
Energy: 0.5695487058436158
Energy: 0.533538332329639
Energy: 0.5695487058432342
Energy: 0.5536015861113854
Energy: 0.5695487058432342
Energy: 0.5627196114998633
Energy: 0.5713460681748322
Energy: 0.5627196114998633
Energy: 0.5713460681752138
Energy: 0.5627196114998633
Energy: 0.5713460681752138
Energy: 0.5972524369419994
Energy: 0.5539097476456437
Energy: 0.5972524369419994
Energy: 0.5539097476456437
Energy: 0.5972524369427625
Energy: 0.5539097476456437
Energy: 0.5800192443336085
Energy: 0.5951002262860521
Energy: 0.5800192443339901
Energy: 0.5951002262852889
Energy: 0.5800192443336085
Energy: 0.5951002262852889
Energy: 0.5684558094012253
Energy: 0.6086271666953709
Energy: 0.5684558094016068
Energy: 0.6086271666961339
Energy: 0.5684558094016068
Energy: 0.6086271666965155
Energy: 0.5397023181710344
Energy: 0.5366534784035242
Energy: 0.5397023181717975
Energy: 0.5366534784031426
Energy: 0.539702318171416
Energy: 0.5366534784031426
Energy: 0.6229287099754705
Energy: 0.578565495638096
Energy: 0.622928709975852
Energy: 0.5785654956384775
Energy: 0.622928709975852
Energy: 0.5785654956384775
Energy: 0.5787282861618652
Energy: 0.6029706354731512
Energy: 0.5787271997180624
Energy: 0.602970635471625
Energy: 0.5787282861626285
Energy: 0.602970635471625
Energy: 0.589993828610558
Energy: 0.5692520336861838
Energy: 0.5899950217125061
Energy: 0.5692520336861838
Energy: 0.589993828610558
Energy: 0.5692520336861838
Energy: 0.5885008773563396
Energy: 0.5572637759646848
Energy: 0.5885008773559582
Energy: 0.5572637759650663
Energy: 0.5885008773567212
Energy: 0.5572637759650663
Energy: 0.5818961136099549
Energy: 0.5642980413152552
Energy: 0.5818961136095734
Energy: 0.5642980413152552
Energy: 0.5818961136099549
Energy: 0.5642980413152552
Energy: 0.590307437941986
Energy: 0.5482937031561945
Energy: 0.590307437942749
Energy: 0.5482937031573393
Energy: 0.5903074379423675
Energy: 0.5482937031573393
Energy: 0.5519074801765688
Energy: 0.5694010049818509
Energy: 0.5519074801765688
Energy: 0.5694010049807062
Energy: 0.5519074801758056
Energy: 0.5694010049807062

minimum gb energy = 0.5313508754312617 eV
minimum distance =  2.57261416232395 Angstroms
sigma value = 41


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

Energy: 0.6189349485068563
Energy: 0.5863133132632208
Energy: 0.6189349485068563
Energy: 0.5863133132632208
Energy: 0.6189349485068563
Energy: 0.5863133132632208
Energy: 0.5751936354039012
Energy: 0.5997127479243373
Energy: 0.5751936354039012
Energy: 0.5997127479243373
Energy: 0.5751936354049431
Energy: 0.5997127479243373
Energy: 0.6632461310393717
Energy: 0.5941117757775649
Energy: 0.6254876119247044
Energy: 0.5941117757775649
Energy: 0.6254876119247044
Energy: 0.5941117757775649
Energy: 0.6474410116695264
Energy: 0.6652163050628036
Energy: 0.647441011670568
Energy: 0.6652163050628036
Energy: 0.647441011670568
Energy: 0.6652163050628036
Energy: 0.576010013878591
Energy: 0.6534453952547885
Energy: 0.576010013878591
Energy: 0.6534453952547885
Energy: 0.576010013878591
Energy: 0.6534453952547885
Energy: 0.640230766990875
Energy: 0.6440831821257066
Energy: 0.640230766990875
Energy: 0.6440831821257066
Energy: 0.640230766990875
Energy: 0.6440831821257066
Energy: 0.6869911201594638
Energy: 0.6149513881384591
Energy: 0.6869911201594638
Energy: 0.6149513881384591
Energy: 0.6869911201594638
Energy: 0.6149513881384591
Energy: 0.5982976565963078
Energy: 0.6045184973983104
Energy: 0.598297656595266
Energy: 0.6045184973983104
Energy: 0.598297656595266
Energy: 0.6045184973983104
Energy: 0.5924882949783519
Energy: 0.585151464985338
Energy: 0.5924882949783519
Energy: 0.585151464985338
Energy: 0.5924882949783519
Energy: 0.585151464985338
Energy: 0.6065529080695234
Energy: 0.5785943801073693
Energy: 0.6065529080695234
Energy: 0.5785943801073693
Energy: 0.6065529080695234
Energy: 0.5785943801073693
Energy: 0.6471967010350075
Energy: 0.6066163463887461
Energy: 0.6471967010350075
Energy: 0.6066163463887461
Energy: 0.6471967010350075
Energy: 0.6066163463877043
Energy: 0.6107142524945426
Energy: 0.5765480116760924
Energy: 0.6107142524945426
Energy: 0.5765480116760924
Energy: 0.6107142524945426
Energy: 0.5765480116760924
Energy: 0.6318132996173882
Energy: 0.5876410886457536
Energy: 0.6318132996173882
Energy: 0.5876410886457536
Energy: 0.6318132996173882
Energy: 0.5876410886457536
Energy: 0.6436252477257092
Energy: 0.6451792263760132
Energy: 0.6436252477257092
Energy: 0.6451792263760132
Energy: 0.6436252477257092
Energy: 0.6451792263760132

minimum gb energy = 0.5751936354039012 eV
minimum distance =  2.53426481969679 Angstroms
sigma value = 11


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

Energy: 0.6119582878351008
Energy: 0.6599849696692288
Energy: 0.6119582878351008
Energy: 0.6599849696692288
Energy: 0.6119582878355584
Energy: 0.6599849696692288
Energy: 0.576303699557395
Energy: 0.6156802828873486
Energy: 0.576303699557395
Energy: 0.6156802828873486
Energy: 0.5763036995569373
Energy: 0.6156802828873486
Energy: 0.6229634155944586
Energy: 0.5868526277356103
Energy: 0.6229634155944586
Energy: 0.5868526277356103
Energy: 0.6229634155944586
Energy: 0.5868526277356103
Energy: 0.6182255986179644
Energy: 0.6038705494237744
Energy: 0.6182255986179644
Energy: 0.6038705494237744
Energy: 0.6182255986179644
Energy: 0.6038705494237744
Energy: 0.6248112179506988
Energy: 0.5990311678599741
Energy: 0.6248112179511565
Energy: 0.5990311678599741
Energy: 0.6248112179511565
Energy: 0.5990311678599741
Energy: 0.6157136043242443
Energy: 0.6335506254331837
Energy: 0.6157136043242443
Energy: 0.6335506254331837
Energy: 0.6157136043242443
Energy: 0.6335506254331837
Energy: 0.6008523744960756
Energy: 0.5870570060089463
Energy: 0.6008523744960756
Energy: 0.5870570060089463
Energy: 0.6008523744965333
Energy: 0.5870570060089463
Energy: 0.6016314515924757
Energy: 0.5905114457749513
Energy: 0.6016314515924757
Energy: 0.5905114457749513
Energy: 0.6016314515924757
Energy: 0.5905114457749513
Energy: 0.5978166017090055
Energy: 0.5935358311212131
Energy: 0.5978166017090055
Energy: 0.5935358311212131
Energy: 0.5978166017090055
Energy: 0.5935358311212131
Energy: 0.5931041401929155
Energy: 0.6166313179406215
Energy: 0.5931041401929155
Energy: 0.6166313179406215
Energy: 0.5931041401929155
Energy: 0.6166313179406215
Energy: 0.6324509861385552
Energy: 0.6314704994948004
Energy: 0.6324509861385552
Energy: 0.6314704994948004
Energy: 0.6324509861380977
Energy: 0.6314704994948004
Energy: 0.6012923320698936
Energy: 0.6479490954709443
Energy: 0.6012923320698936
Energy: 0.6479490954704866
Energy: 0.6012923320698936
Energy: 0.6479490954709443
Energy: 0.5998280540304076
Energy: 0.6535036644782496
Energy: 0.5998280540304076
Energy: 0.6535036644787072
Energy: 0.5998280540304076
Energy: 0.6535036644787072
Energy: 0.6045063831063255
Energy: 0.6038949851564942
Energy: 0.6045063831063255
Energy: 0.6038949851560366
Energy: 0.6045063831058679
Energy: 0.6038949851560366
Energy: 0.5918660382630223
Energy: 0.5913200764915898
Energy: 0.5918660382625647
Energy: 0.5913200764915898
Energy: 0.5918660382630223
Energy: 0.5913200764915898
Energy: 0.5893394142409132
Energy: 0.5997083213703833
Energy: 0.5893394142409132
Energy: 0.5997083213703833
Energy: 0.5893394142409132
Energy: 0.5997083213703833
Energy: 0.6338939169815864
Energy: 0.6075170089757761
Energy: 0.6338939169815864
Energy: 0.6075170089757761
Energy: 0.6338939169815864
Energy: 0.6075170089757761
Energy: 0.6032483500990661
Energy: 0.6290728298654722
Energy: 0.6032483500986083
Energy: 0.6290728298654722
Energy: 0.6032483500986083
Energy: 0.6290728298654722
Energy: 0.5891623998494837
Energy: 0.6215154581354505
Energy: 0.5891623998499412
Energy: 0.6215154581354505
Energy: 0.5891623998499412
Energy: 0.6215154581354505
Energy: 0.5991614432471628
Energy: 0.5900294364468334
Energy: 0.5991614432471628
Energy: 0.590029436447291
Energy: 0.5991614432471628
Energy: 0.590029436447291
Energy: 0.5922500803990393
Energy: 0.5902269582526951
Energy: 0.5922500803990393
Energy: 0.5902269582526951
Energy: 0.5922500803990393
Energy: 0.5902269582526951
Energy: 0.6321239376804938
Energy: 0.60732062633599
Energy: 0.6321239376804938
Energy: 0.60732062633599
Energy: 0.6321239376804938
Energy: 0.60732062633599
Energy: 0.6178898451299025
Energy: 0.5948876283683822
Energy: 0.6178898451299025
Energy: 0.5948876283683822
Energy: 0.6178898451299025
Energy: 0.5948876283683822
Energy: 0.640350827382347
Energy: 0.5909764126718546
Energy: 0.640350827382347
Energy: 0.5909764126718546
Energy: 0.640350827382347
Energy: 0.5909764126718546
Energy: 0.6059965128094102
Energy: 0.6374046142993346
Energy: 0.6059965128089527
Energy: 0.6374046142988768
Energy: 0.6059965128094102
Energy: 0.6374046142988768
Energy: 0.5956672029514761
Energy: 0.6218348749061384
Energy: 0.5956672029514761
Energy: 0.6218348749061384
Energy: 0.5956672029514761
Energy: 0.6218348749061384
Energy: 0.585206548126442
Energy: 0.6152885847396103
Energy: 0.585206548126442
Energy: 0.6152885847396103
Energy: 0.585206548126442
Energy: 0.6152885847396103
Energy: 0.6000593814244117
Energy: 0.5945928777427916
Energy: 0.6000593814239542
Energy: 0.5945928777427916
Energy: 0.6000593814239542
Energy: 0.5945928777427916
Energy: 0.584957971904004
Energy: 0.616177299613942
Energy: 0.584957971904004
Energy: 0.616177299613942
Energy: 0.584957971904004
Energy: 0.616177299613942
Energy: 0.6005729580827368
Energy: 0.5955726344757659
Energy: 0.6005729580827368
Energy: 0.5955726344757659
Energy: 0.6005729580827368
Energy: 0.5955726344757659
Energy: 0.599173117248183
Energy: 0.6178146038489273
Energy: 0.5991731172477254
Energy: 0.6178146038489273
Energy: 0.5991731172477254
Energy: 0.6178146038489273

minimum gb energy = 0.5763036995569373 eV
minimum distance =  2.52857969847703 Angstroms
sigma value = 57


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

Energy: 0.49583561318307934
Energy: 0.5209757406589948
Energy: 0.49583561318307934
Energy: 0.5209757406589948
Energy: 0.49583561318307934
Energy: 0.5209757406589948
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5176211205495576
Energy: 0.5953167433931059
Energy: 0.517621119654157
Energy: 0.6254993958059438
Energy: 0.5176211201873182
Energy: 0.6254993958059438
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.5383979398680123
Energy: 0.5056984733260673
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.5777307023669627
Energy: 0.5080858700753996
Energy: 0.5777307023661483
Energy: 0.5080858700753996
Energy: 0.5777307023661483
Energy: 0.5080858700753996
Energy: 0.495835613182265
Energy: 0.5209757406589948
Energy: 0.495835613182265
Energy: 0.5209757406598091
Energy: 0.49583561318307934
Energy: 0.5209757406581804
Energy: 0.5775738069326771
Energy: 0.5068067238345051
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5176211203485047
Energy: 0.5770443531059455
Energy: 0.5176211203428043
Energy: 0.5059137972447104
Energy: 0.5176211194970609
Energy: 0.5059137972447104
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.5777307023661483
Energy: 0.5080858700745853
Energy: 0.5777307023661483
Energy: 0.5080858700745853
Energy: 0.577730702365334
Energy: 0.5080858700745853
Energy: 0.495835613182265
Energy: 0.5209757406589948
Energy: 0.495835613182265
Energy: 0.5209757406581804
Energy: 0.495835613182265
Energy: 0.5209757406581804
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5775738069343058
Energy: 0.5068067238336907
Energy: 0.5775738069334915
Energy: 0.5068067238345051
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5383844536204989
Energy: 0.5056677510904003
Energy: 0.5383844536213133
Energy: 0.5056677510904003
Energy: 0.5176211201637204
Energy: 0.5770443531059455
Energy: 0.5176211195556758
Energy: 0.5059137972447104
Energy: 0.51762112173472
Energy: 0.5059137972447104
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.538397939867198
Energy: 0.5056984733260673
Energy: 0.538397939867198
Energy: 0.5056984733260673

minimum gb energy = 0.495835613182265 eV
minimum distance =  2.57224116647928 Angstroms
sigma value = 9


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

Energy: 0.6047825212536915
Energy: 0.6050056589640666
Energy: 0.6047825212543564
Energy: 0.6050056589640666
Energy: 0.6047825212536915
Energy: 0.6050056589640666
Energy: 0.6259909892937008
Energy: 0.6401303390676667
Energy: 0.6259909892937008
Energy: 0.6401303390676667
Energy: 0.6259909892937008
Energy: 0.6401303390676667
Energy: 0.6222392848432071
Energy: 0.564391682640206
Energy: 0.64988325560053
Energy: 0.564391682640206
Energy: 0.64988325560053
Energy: 0.564391682640206
Energy: 0.5673906658002977
Energy: 0.6377845038679278
Energy: 0.5673906658002977
Energy: 0.6377845038679278
Energy: 0.5673906658009626
Energy: 0.6377845038679278
Energy: 0.5773231522265286
Energy: 0.5996813487287093
Energy: 0.5773231522258637
Energy: 0.5996813487293742
Energy: 0.5773231522258637
Energy: 0.5996813487293742
Energy: 0.5709070845872551
Energy: 0.584486177310032
Energy: 0.5709070845872551
Energy: 0.584486177310032
Energy: 0.5709070845872551
Energy: 0.584486177310032
Energy: 0.6257054526913592
Energy: 0.6112211840884573
Energy: 0.6257054526913592
Energy: 0.6112211840884573
Energy: 0.6257054526913592
Energy: 0.6112211840884573
Energy: 0.563612179862879
Energy: 0.599823394918048
Energy: 0.563612179862879
Energy: 0.599823394918048
Energy: 0.563612179862879
Energy: 0.599823394918048
Energy: 0.6189742183096596
Energy: 0.5973002393235953
Energy: 0.6189742183096596
Energy: 0.5973002393242602
Energy: 0.6189742183096596
Energy: 0.5973002393235953
Energy: 0.5862712163098799
Energy: 0.5897199261921031
Energy: 0.5862712163098799
Energy: 0.5897199261921031
Energy: 0.5862712163098799
Energy: 0.589719926192768
Energy: 0.618860691387112
Energy: 0.56606371433708
Energy: 0.618860691387112
Energy: 0.56606371433708
Energy: 0.618860691387112
Energy: 0.56606371433708
Energy: 0.6197004553358423
Energy: 0.62897724023918
Energy: 0.6197004553358423
Energy: 0.6289772402385151
Energy: 0.6197004553358423
Energy: 0.6289772402385151
Energy: 0.5617743692762895
Energy: 0.6166297377179056
Energy: 0.5617743692756247
Energy: 0.6166297377179056
Energy: 0.5617743692756247
Energy: 0.6166297377179056
Energy: 0.5794897008050716
Energy: 0.6325697251860387
Energy: 0.5794897008050716
Energy: 0.6325697251853738
Energy: 0.5794897008050716
Energy: 0.6325697251853738
Energy: 0.6084593279981564
Energy: 0.6549306824113852
Energy: 0.6084593279981564
Energy: 0.6549306824113852
Energy: 0.6084593279981564
Energy: 0.6549306824113852
Energy: 0.6158929853113198
Energy: 0.6005633775021008
Energy: 0.6158929853113198
Energy: 0.6005633775014358
Energy: 0.6158929853113198
Energy: 0.6005633775014358
Energy: 0.5975273554815451
Energy: 0.5924431402453775
Energy: 0.5975273554815451
Energy: 0.5924431402453775
Energy: 0.5975273554815451
Energy: 0.5924431402453775
Energy: 0.6343527637345513
Energy: 0.6141352208642358
Energy: 0.6343527637345513
Energy: 0.6141352208642358
Energy: 0.6343527637345513
Energy: 0.6141352208642358
Energy: 0.5654964907418921
Energy: 0.5785490616497072
Energy: 0.5654964907418921
Energy: 0.5785490616497072
Energy: 0.5654964907418921
Energy: 0.5785490616497072
Energy: 0.584438840151109
Energy: 0.5904964265999564
Energy: 0.584438840151109
Energy: 0.5904964265999564
Energy: 0.5844388401517739
Energy: 0.5904964265999564
Energy: 0.6185545279384776
Energy: 0.5829905264883622
Energy: 0.6185545279384776
Energy: 0.5829905264883622
Energy: 0.6185545279384776
Energy: 0.5829905264883622

minimum gb energy = 0.5617743692756247 eV
minimum distance =  2.52094365626099 Angstroms
sigma value = 27


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

Energy: 0.622532962143487
Energy: 0.5588285394571884
Energy: 0.6225329621440475
Energy: 0.5588285394571884
Energy: 0.622532962143487
Energy: 0.5588285394577489
Energy: 0.5545454953524579
Energy: 0.5795484664895081
Energy: 0.5545454953530184
Energy: 0.5795484664895081
Energy: 0.5545454953530184
Energy: 0.5795484664895081
Energy: 0.5860780369777456
Energy: 0.587563050398915
Energy: 0.5860780369783061
Energy: 0.587563050398915
Energy: 0.5860780369783061
Energy: 0.587563050398915
Energy: 0.5783354828397158
Energy: 0.5618794621098545
Energy: 0.5783354828397158
Energy: 0.561879462110415
Energy: 0.5783354828397158
Energy: 0.5618794621098545
Energy: 0.5708729813011449
Energy: 0.5658524926720307
Energy: 0.5708729813011449
Energy: 0.5658524926720307
Energy: 0.5708729813011449
Energy: 0.5658524926720307
Energy: 0.5814684256762246
Energy: 0.5787497152812672
Energy: 0.5814684256762246
Energy: 0.5787497152807067
Energy: 0.581468425675664
Energy: 0.5787497152818276
Energy: 0.6239403668259313
Energy: 0.5465859842303866
Energy: 0.623940366825371
Energy: 0.5465859842303866
Energy: 0.6239403668259313
Energy: 0.5465859842303866
Energy: 0.6087387221992208
Energy: 0.610324413671627
Energy: 0.6087387221997813
Energy: 0.6103244136710666
Energy: 0.6087387221992208
Energy: 0.6103244136710666
Energy: 0.5600344861367113
Energy: 0.5786767326961203
Energy: 0.5600344861367113
Energy: 0.5786767326961203
Energy: 0.5600344861367113
Energy: 0.5786767326961203
Energy: 0.5784529353477131
Energy: 0.5586061614358885
Energy: 0.5784529353471526
Energy: 0.5586061614364489
Energy: 0.5784529353471526
Energy: 0.5586061614358885
Energy: 0.5713774669165955
Energy: 0.5586927615616226
Energy: 0.5713774669160351
Energy: 0.5586927615616226
Energy: 0.5713774669160351
Energy: 0.5586927615616226
Energy: 0.5601051782201535
Energy: 0.5786960402957783
Energy: 0.5601051782201535
Energy: 0.5786960402957783
Energy: 0.5601051782201535
Energy: 0.5786960402957783
Energy: 0.608519954935724
Energy: 0.6098800044881885
Energy: 0.608519954935724
Energy: 0.6098800044881885
Energy: 0.608519954935724
Energy: 0.6098800044876281
Energy: 0.6239017437273843
Energy: 0.5467082095509587
Energy: 0.6239017437279448
Energy: 0.5467082095509587
Energy: 0.6239017437273843
Energy: 0.5467082095509587
Energy: 0.5815362153501824
Energy: 0.5786955050070237
Energy: 0.581536215349622
Energy: 0.5786955050070237
Energy: 0.581536215349622
Energy: 0.5786955050070237
Energy: 0.5706762320107589
Energy: 0.56584378811751
Energy: 0.5706762320113193
Energy: 0.56584378811751
Energy: 0.5706762320107589
Energy: 0.56584378811751
Energy: 0.578038418825818
Energy: 0.5865677196787962
Energy: 0.578038418825818
Energy: 0.586567719679917
Energy: 0.578038418825818
Energy: 0.5865677196815985
Energy: 0.5780078548891716
Energy: 0.5875527299746913
Energy: 0.5780078548902926
Energy: 0.5875527299746913
Energy: 0.5780078548897322
Energy: 0.5875527299746913
Energy: 0.5545110126986567
Energy: 0.5796245649046247
Energy: 0.5545110126992172
Energy: 0.5796245649046247
Energy: 0.5545110126992172
Energy: 0.5796245649046247
Energy: 0.622532962143487
Energy: 0.5588285394571884
Energy: 0.622532962143487
Energy: 0.5588285394571884
Energy: 0.622532962143487
Energy: 0.5588285394571884
Energy: 0.5545454953530184
Energy: 0.5795484664895081
Energy: 0.5545454953530184
Energy: 0.5795484664895081
Energy: 0.554545495353579
Energy: 0.5795484664895081
Energy: 0.5860780369771851
Energy: 0.587563050398915
Energy: 0.5860780369777456
Energy: 0.587563050398915
Energy: 0.5860780369777456
Energy: 0.587563050398915
Energy: 0.5783354828391554
Energy: 0.5618794621098545
Energy: 0.5783354828397158
Energy: 0.561879462110415
Energy: 0.5783354828397158
Energy: 0.561879462110415
Energy: 0.5708729813011449
Energy: 0.5658524926714702
Energy: 0.5708729813011449
Energy: 0.5658524926720307
Energy: 0.5708729813011449
Energy: 0.5658524926720307
Energy: 0.581468425675664
Energy: 0.5787497152818276
Energy: 0.5814684256762246
Energy: 0.5787497152818276
Energy: 0.5814684256762246
Energy: 0.5787497152818276

minimum gb energy = 0.5465859842303866 eV
minimum distance =  2.54416097991758 Angstroms
sigma value = 19


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

Energy: 0.5969852073784448
Energy: 0.6397416355978411
Energy: 0.5969852073784448
Energy: 0.6397416355973574
Energy: 0.5969852073789287
Energy: 0.6397416355978411
Energy: 0.6736332027725843
Energy: 0.60094112735773
Energy: 0.6736332027725843
Energy: 0.60094112735773
Energy: 0.6736332027725843
Energy: 0.6009411273582138
Energy: 0.6830762806504692
Energy: 0.5962460151749972
Energy: 0.6550920800887807
Energy: 0.5962460151749972
Energy: 0.6550920800887807
Energy: 0.5962460151749972
Energy: 0.5786784339581528
Energy: 0.6391310818807279
Energy: 0.5786784339581528
Energy: 0.6391310818807279
Energy: 0.5786784339581528
Energy: 0.6391310818812117
Energy: 0.5926813791252291
Energy: 0.6628668803945114
Energy: 0.5926813791252291
Energy: 0.6628668803945114
Energy: 0.5926813791252291
Energy: 0.6628668803945114
Energy: 0.617098098269527
Energy: 0.5807100250666059
Energy: 0.617098098269527
Energy: 0.5807100250666059
Energy: 0.6170980982700108
Energy: 0.5807100250666059
Energy: 0.5958908641242474
Energy: 0.65279765929675
Energy: 0.5958908641242474
Energy: 0.65279765929675
Energy: 0.5958908641242474
Energy: 0.65279765929675
Energy: 0.5888244155329642
Energy: 0.6755177894705133
Energy: 0.5888244155329642
Energy: 0.6755177894705133
Energy: 0.5888244155329642
Energy: 0.6755177894705133
Energy: 0.6340954328883767
Energy: 0.5648048205025076
Energy: 0.6340954328883767
Energy: 0.5648048205025076
Energy: 0.6340954328883767
Energy: 0.5648048205025076
Energy: 0.622355726303587
Energy: 0.5983767069829972
Energy: 0.622355726303587
Energy: 0.5983767069829972
Energy: 0.622355726303587
Energy: 0.5983767069829972
Energy: 0.5661784891401923
Energy: 0.6526451715666738
Energy: 0.5661784891401923
Energy: 0.6526451715666738
Energy: 0.5661784891401923
Energy: 0.6526451715666738
Energy: 0.6678883089698289
Energy: 0.5920132672442976
Energy: 0.6678883089693451
Energy: 0.5920132672442976
Energy: 0.6678883089698289
Energy: 0.5920132672442976
Energy: 0.6261293034198333
Energy: 0.6101311583616293
Energy: 0.6261293034193496
Energy: 0.6101311583620911
Energy: 0.6261293034193496
Energy: 0.6101311583616293
Energy: 0.5769273520628972
Energy: 0.6158028572852755
Energy: 0.5769273520633811
Energy: 0.6158028572852755
Energy: 0.5769273520628972
Energy: 0.6158028572852755
Energy: 0.6204341106096798
Energy: 0.5981570781596949
Energy: 0.6204341106096798
Energy: 0.5981570781596949
Energy: 0.6204341106096798
Energy: 0.5981570781596949
Energy: 0.6664097509326958
Energy: 0.5905763336660093
Energy: 0.6664097509326958
Energy: 0.5905763336660093
Energy: 0.6664097509326958
Energy: 0.5905763336660093
Energy: 0.5720978623385542
Energy: 0.6415371558641244
Energy: 0.5720978623385542
Energy: 0.6415371558636406
Energy: 0.5720978623385542
Energy: 0.6415371558636406
Energy: 0.6367075270424238
Energy: 0.6587948806694927
Energy: 0.6367075270424238
Energy: 0.6587948806699764
Energy: 0.6367075270424238
Energy: 0.6587948806694927
Energy: 0.6354044321503288
Energy: 0.5771214143697794
Energy: 0.6354044321503288
Energy: 0.5771214143697794
Energy: 0.6354044321503288
Energy: 0.5771214143697794
Energy: 0.6029852299629633
Energy: 0.6049618372222914
Energy: 0.6029852299629633
Energy: 0.6049618372222914
Energy: 0.6029852299629633
Energy: 0.6049618372222914
Energy: 0.5615805501181614
Energy: 0.6842850897332976
Energy: 0.5615805501186453
Energy: 0.6842850897332976
Energy: 0.5615805501181614
Energy: 0.6842850897332976
Energy: 0.6741706235071623
Energy: 0.5921103203696004
Energy: 0.6741706235071623
Energy: 0.5921103203696004
Energy: 0.6741706235071623
Energy: 0.5921103203696004
Energy: 0.6512945560105878
Energy: 0.5825254011133171
Energy: 0.6512945560105878
Energy: 0.5825254011128332
Energy: 0.6512945560105878
Energy: 0.5825254011128332
Energy: 0.5959681923048993
Energy: 0.6331010847346625
Energy: 0.5959681923048993
Energy: 0.6331010847346625
Energy: 0.5959681923048993
Energy: 0.6331010847346625
Energy: 0.5984340652696881
Energy: 0.5885673472489719
Energy: 0.5984340652696881
Energy: 0.5885673472489719
Energy: 0.5984340652696881
Energy: 0.5885673472489719
Energy: 0.652854399491704
Energy: 0.608601711602968
Energy: 0.652854399491704
Energy: 0.608601711602968
Energy: 0.652854399491704
Energy: 0.608601711602968
Energy: 0.5615366734324391
Energy: 0.6110782527380535
Energy: 0.5615366734324391
Energy: 0.6110782527380535
Energy: 0.5615366734324391
Energy: 0.611078252739021
Energy: 0.6099897400929112
Energy: 0.6254441733643238
Energy: 0.6099897400929112
Energy: 0.62544417336384
Energy: 0.6099897400933949
Energy: 0.62544417336384
Energy: 0.6024419124422632
Energy: 0.5745414725732063
Energy: 0.6024419124422632
Energy: 0.5745414725732063
Energy: 0.6024419124422632
Energy: 0.5745414725732063

minimum gb energy = 0.5615366734324391 eV
minimum distance =  2.53346614306538 Angstroms
sigma value = 101


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

Energy: 0.5639645285780479
Energy: 0.6536831546204724
Energy: 0.5639645285780479
Energy: 0.6536831546204724
Energy: 0.5639645285780479
Energy: 0.6536831546204724
Energy: 0.6724942665762303
Energy: 0.5822942258166057
Energy: 0.6724942665762303
Energy: 0.5822942258166057
Energy: 0.6724942665762303
Energy: 0.5822942258166057
Energy: 0.6718914589757037
Energy: 0.5898652812145471
Energy: 0.6718914589757037
Energy: 0.5898652812149724
Energy: 0.6718914589752785
Energy: 0.5898652812149724
Energy: 0.5345810448614117
Energy: 0.6486069676986184
Energy: 0.5345810448614117
Energy: 0.6486069676986184
Energy: 0.5345810448614117
Energy: 0.6486069676986184
Energy: 0.580947596527254
Energy: 0.6382599229038185
Energy: 0.580947596527254
Energy: 0.6382599229038185
Energy: 0.5809475965268288
Energy: 0.6382599229038185
Energy: 0.6442375975270819
Energy: 0.551798309114771
Energy: 0.6442375975270819
Energy: 0.5517983091151962
Energy: 0.6442375975270819
Energy: 0.551798309114771
Energy: 0.5820097280673842
Energy: 0.6767749215854106
Energy: 0.5820097280669589
Energy: 0.6767749215854106
Energy: 0.5820097280673842
Energy: 0.6767749215854106
Energy: 0.5387419082189687
Energy: 0.6896945487635352
Energy: 0.5387419082185435
Energy: 0.7040405538678095
Energy: 0.5387419082189687
Energy: 0.7040405538673842
Energy: 0.6351018091820915
Energy: 0.5408307693928961
Energy: 0.6351018091820915
Energy: 0.5408307693933214
Energy: 0.6351018091820915
Energy: 0.5408307693924709
Energy: 0.5803724403559593
Energy: 0.6343728128822588
Energy: 0.5803724403559593
Energy: 0.634372812882684
Energy: 0.580372440355534
Energy: 0.634372812882684
Energy: 0.5349680539461473
Energy: 0.6608450350293099
Energy: 0.5349680539461473
Energy: 0.6608450350293099
Energy: 0.5349680539461473
Energy: 0.6608450350293099
Energy: 0.652759271584899
Energy: 0.5990158280602899
Energy: 0.6527592715844737
Energy: 0.5990158280602899
Energy: 0.652759271584899
Energy: 0.5990158280602899
Energy: 0.6360819118522295
Energy: 0.5927126429111782
Energy: 0.6360819118526547
Energy: 0.5927126429111782
Energy: 0.6360819118526547
Energy: 0.5927126429107529
Energy: 0.5659272990031868
Energy: 0.6607937846790229
Energy: 0.565927299003612
Energy: 0.6607937846790229
Energy: 0.565927299003612
Energy: 0.6607937846790229
Energy: 0.679985893239715
Energy: 0.5584653751970914
Energy: 0.679985893239715
Energy: 0.5584653751975168
Energy: 0.679985893239715
Energy: 0.5584653751970914
Energy: 0.6723190313716334
Energy: 0.5448498704419729
Energy: 0.6723190313712082
Energy: 0.5448498704419729
Energy: 0.6723190313712082
Energy: 0.5448498704419729
Energy: 0.5381711169459074
Energy: 0.6413329456597503
Energy: 0.5381711169459074
Energy: 0.6413329456597503
Energy: 0.5381711169459074
Energy: 0.6413329456597503
Energy: 0.5432714415820888
Energy: 0.6004477416490035
Energy: 0.5432714415820888
Energy: 0.6004477416502795
Energy: 0.5432714415820888
Energy: 0.600447741648153
Energy: 0.6560141249164959
Energy: 0.5409113159925665
Energy: 0.6560141249164959
Energy: 0.5409113159925665
Energy: 0.6560141249164959
Energy: 0.5409113159921413
Energy: 0.5802164638213283
Energy: 0.6128656300143864
Energy: 0.5802164638213283
Energy: 0.6128656300143864
Energy: 0.580216463820903
Energy: 0.6128656300143864
Energy: 0.536277303310181
Energy: 0.6603180353177497
Energy: 0.536277303310181
Energy: 0.6603180353177497
Energy: 0.536277303310181
Energy: 0.6603180353177497
Energy: 0.7216084270600882
Energy: 0.5428890973381109
Energy: 0.7216084270605135
Energy: 0.5428890973381109
Energy: 0.7216084270600882
Energy: 0.5428890973381109
Energy: 0.6429951056627414
Energy: 0.5408386674163667
Energy: 0.6429951056623162
Energy: 0.5408386674151101
Energy: 0.6429951056623162
Energy: 0.5408386674163667
Energy: 0.5315688120598004
Energy: 0.6482470076802163
Energy: 0.5315688120598004
Energy: 0.6482470076806415
Energy: 0.5315688120593751
Energy: 0.6482470076806415
Energy: 0.6791122318203034
Energy: 0.6362478813003379
Energy: 0.6791122318203034
Energy: 0.6362478813003379
Energy: 0.6791122318203034
Energy: 0.6362478812999126
Energy: 0.6526192895203425
Energy: 0.544315718400966
Energy: 0.6526192895203425
Energy: 0.544315718400966
Energy: 0.6526192895199172
Energy: 0.544315718400966
Energy: 0.5641420177330202
Energy: 0.6484641623359625
Energy: 0.564142017732595
Energy: 0.6484641623355373
Energy: 0.5641420177330202
Energy: 0.6484641623359625
Energy: 0.5735090524888448
Energy: 0.6065453829033128
Energy: 0.57350905248927
Energy: 0.6065453829033128
Energy: 0.57350905248927
Energy: 0.6065453829033128
Energy: 0.6445060466638567
Energy: 0.5400426272939461
Energy: 0.6445060466634314
Energy: 0.5400426272926703
Energy: 0.6445060466634314
Energy: 0.5400426272926703
Energy: 0.539706440937129
Energy: 0.6695556111114545
Energy: 0.5397064409367038
Energy: 0.6695556111114545
Energy: 0.5397064409367038
Energy: 0.6695556111114545
Energy: 0.5383464290946621
Energy: 0.6106531599608327
Energy: 0.5383464290946621
Energy: 0.6106531599608327
Energy: 0.5383464290946621
Energy: 0.6106531599608327
Energy: 0.6499844416729738
Energy: 0.5427964025941127
Energy: 0.6499844416725484
Energy: 0.5427964025941127
Energy: 0.6499844416725484
Energy: 0.5427964025941127
Energy: 0.694390524291235
Energy: 0.5407257425083679
Energy: 0.6943905242908097
Energy: 0.5407257425079426
Energy: 0.694390524291235
Energy: 0.5407257425087931

minimum gb energy = 0.5315688120593751 eV
minimum distance =  2.5555757614274 Angstroms
sigma value = 33


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

Energy: 0.011721851261494703
Energy: 0.6392221417929017
Energy: 0.01172185126114135
Energy: 0.6392221417929017
Energy: 0.011721851261494703
Energy: 0.6392221417932353
Energy: 0.01254696619931202
Energy: 0.19393726644345888
Energy: 0.01254696619931202
Energy: 0.19393726644345888
Energy: 0.01254696619931202
Energy: 0.19393726644345888
Energy: 0.6397663875881558
Energy: 0.19383465273020065
Energy: 0.6397579686254252
Energy: 0.1939688356154032
Energy: 0.6397689695180532
Energy: 0.19382207971041077
Energy: 0.01254696619931202
Energy: 0.19393726644345888
Energy: 0.01254696619931202
Energy: 0.19393726644345888
Energy: 0.01254696619931202
Energy: 0.1939372664438123

minimum gb energy = 0.01172185126114135 eV
minimum distance =  2.85511366051426 Angstroms
sigma value = 1