Model name: model_name=MEAM_LAMMPS_JeongParkDo_2018_PdCu__MO_353393547686_001
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Cu
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.613315671682358
cohesive_energy=3.540278438572939
mass=63.546
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: 0.013701708896694025
Energy: 0.7280905836833865
Energy: 0.013701708896694025
Energy: 0.7280905836830727
Energy: 0.013701708896694025
Energy: 0.7280905836830727
Energy: 0.7280905836830727
Energy: 0.8633343973882066
Energy: 0.7280905836830727
Energy: 0.8633343973876139
Energy: 0.7280905836827936
Energy: 0.8633343973876139
Energy: 0.013701708896694025
Energy: 0.7280905836833865
Energy: 0.013701708896694025
Energy: 0.7280905836833865
Energy: 0.013701708896694025
Energy: 0.7280905836833865
Energy: 0.7280905836830727
Energy: 0.8633343973891483
Energy: 0.7280905836830727
Energy: 0.8633343973872998
Energy: 0.7280905836830727
Energy: 0.8633343973882066
Energy: 0.013701708896694025
Energy: 0.7280905836830727
Energy: 0.013701708896694025
Energy: 0.7280905836830727
Energy: 0.013701708896694025
Energy: 0.7280905836830727
Energy: 0.7280905836830727
Energy: 0.8633343973872998
Energy: 0.7280905836830727
Energy: 0.8633343973872998
Energy: 0.7280905836830727
Energy: 0.8633343973878927

minimum gb energy = 0.013701708896694025 eV
minimum distance =  2.38922785815322 Angstroms
sigma value = 1


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

Energy: 0.9687657738181861
Energy: 1.163891953121137
Energy: 0.9687657738181861
Energy: 1.163891953121137
Energy: 0.9687657738181861
Energy: 1.1638919531218928
Energy: 1.1801301853697272
Energy: 0.9081799474259185
Energy: 1.1801301853697272
Energy: 0.9081799474259185
Energy: 1.1801301853689719
Energy: 0.9081799474259185
Energy: 0.9285862023566215
Energy: 1.2860996024474798
Energy: 0.9285862023566215
Energy: 1.2860996024474798
Energy: 0.9285862023566215
Energy: 1.2860996024482352
Energy: 1.2047776294029608
Energy: 0.970572460822701
Energy: 1.2047776294029608
Energy: 0.9705724608234565
Energy: 1.2047776294029608
Energy: 0.9705724608234565
Energy: 1.0081517184787436
Energy: 1.0821230174525747
Energy: 1.0081517184787436
Energy: 1.0821230174525747
Energy: 1.0081517184787436
Energy: 1.0821230174525747
Energy: 1.0245068041965084
Energy: 0.9961736428206553
Energy: 1.0245068041965084
Energy: 0.9961736428206553
Energy: 1.0245068041965084
Energy: 0.9961736428206553
Energy: 0.9869905261642379
Energy: 1.1236348638811267
Energy: 0.9869905261649936
Energy: 1.1236348638811267
Energy: 0.9869905261649936
Energy: 1.1236348638818823
Energy: 0.984977584660476
Energy: 1.200627839306446
Energy: 0.9849775846612315
Energy: 1.200627839306446
Energy: 0.9849775846612315
Energy: 1.2006278393072014
Energy: 1.0905410142442749
Energy: 0.9572650707336615
Energy: 1.0905410142442749
Energy: 0.9572650707336615
Energy: 1.0905410142442749
Energy: 0.9572650707336615
Energy: 0.9215050016078037
Energy: 1.1970499102801084
Energy: 0.9215050016085592
Energy: 1.1970499102801084
Energy: 0.9215050016078037
Energy: 1.1970499102801084
Energy: 1.2309526653311613
Energy: 0.8978740794593468
Energy: 1.2309526653311613
Energy: 0.8978740794593468
Energy: 1.2309526653304055
Energy: 0.8978740794593468
Energy: 0.8617000206878038
Energy: 1.2787507657233634
Energy: 0.8617000206878038
Energy: 1.2787507657233634
Energy: 0.8617000206878038
Energy: 1.278750765722608
Energy: 1.1991576197201106
Energy: 0.8897286949157197
Energy: 1.1991576197201106
Energy: 0.8897286949157197
Energy: 1.1991576197201106
Energy: 0.8897286949157197
Energy: 0.9339908896389847
Energy: 1.0685318889716335
Energy: 0.9339908896389847
Energy: 1.0685318889701225
Energy: 0.9339908896389847
Energy: 1.068531888970878
Energy: 1.2219763237154742
Energy: 0.9315606812971362
Energy: 1.2219763237154742
Energy: 0.9315606812978917
Energy: 1.2219763237154742
Energy: 0.9315606812971362
Energy: 1.1612942084369033
Energy: 1.1562328650987
Energy: 1.1612942084369033
Energy: 1.1562328650987
Energy: 1.1612942084369033
Energy: 1.1562328650987
Energy: 1.0615182491347943
Energy: 1.0094185558954332
Energy: 1.0615182491347943
Energy: 1.0094185558954332
Energy: 1.0615182491355502
Energy: 1.0094185558954332
Energy: 1.096570460502316
Energy: 1.0110728894541654
Energy: 1.096570460502316
Energy: 1.0110728894541654
Energy: 1.0965704605030717
Energy: 1.0110728894534096
Energy: 0.8767025540952645
Energy: 1.0642440046817152
Energy: 0.8767025540929978
Energy: 1.0642440046817152
Energy: 0.8767025540914865
Energy: 1.0642440046824706
Energy: 1.0744512891860782
Energy: 0.9403442879331515
Energy: 1.0744512891853226
Energy: 0.9403442879331515
Energy: 1.0744512891860782
Energy: 0.9403442879331515
Energy: 0.9113226818545158
Energy: 1.2887478521498583
Energy: 0.9113226818545158
Energy: 1.2887478521461146
Energy: 0.9113226818545158
Energy: 1.2887478521475915
Energy: 1.120549381983707
Energy: 0.9529507244447298
Energy: 1.1205493819844623
Energy: 0.9529507244447298
Energy: 1.120549381983707
Energy: 0.9529507244454857
Energy: 0.8677564219272008
Energy: 1.1775906827117815
Energy: 0.8677564219264453
Energy: 1.1775906827117815
Energy: 0.8677564219272008
Energy: 1.1775906827110258

minimum gb energy = 0.8617000206878038 eV
minimum distance =  2.36254189189164 Angstroms
sigma value = 33


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

Energy: 1.1318229060102205
Energy: 1.181633916592906
Energy: 1.1318229060102205
Energy: 1.181633916592476
Energy: 1.1318229060102205
Energy: 1.1816339165933356
Energy: 1.201392825865389
Energy: 0.9750532498407111
Energy: 1.201392825864959
Energy: 0.9750532498407111
Energy: 1.201392825865389
Energy: 0.9750532498407111
Energy: 0.9238651444154753
Energy: 0.9634901932119535
Energy: 0.9238651444150454
Energy: 0.9634901932119535
Energy: 0.9238651444150454
Energy: 0.9634901932115236
Energy: 1.0874931990552645
Energy: 1.0353323755598205
Energy: 1.0874931990552645
Energy: 1.0353323755602502
Energy: 1.0874931990556944
Energy: 1.0353323755602502
Energy: 1.085214043972558
Energy: 1.1396362331811685
Energy: 1.085214043972558
Energy: 1.1396362331807386
Energy: 1.085214043972558
Energy: 1.1396362331815983
Energy: 0.9784671319056019
Energy: 0.9217211409990973
Energy: 0.9784671319060315
Energy: 0.9217211409978079
Energy: 0.9784671319056019
Energy: 0.9217211409956588
Energy: 1.1035596688367613
Energy: 1.116573630469735
Energy: 1.103559668837191
Energy: 1.1165736304693052
Energy: 1.103559668837191
Energy: 1.1165736304688754
Energy: 0.9030098298320638
Energy: 1.2294550075817572
Energy: 0.903009829831634
Energy: 1.2294550075821868
Energy: 0.9030098298320638
Energy: 1.2294550075817572
Energy: 1.1025999505861432
Energy: 1.0041153472133548
Energy: 1.102599950586573
Energy: 1.0041153472137847
Energy: 1.1025999505861432
Energy: 1.0041153472137847
Energy: 0.9006943279623304
Energy: 1.1702090481545355
Energy: 0.90069432796276
Energy: 1.1702090481545355
Energy: 0.9006943279623304
Energy: 1.1702090481549654
Energy: 1.1106142349041472
Energy: 0.9018402407104354
Energy: 1.1106142349045771
Energy: 0.9018402407104354
Energy: 1.1106142349041472
Energy: 0.9018402407104354
Energy: 0.9347923144887252
Energy: 1.0384110515103833
Energy: 0.9347923144882955
Energy: 1.0384110515103833
Energy: 0.9347923144887252
Energy: 1.0384110515090939
Energy: 1.2386628346430821
Energy: 0.8700106615716628
Energy: 1.2386628346426525
Energy: 0.8700106615720926
Energy: 1.2386628346439417
Energy: 0.8700106615725225
Energy: 1.0773534762265224
Energy: 1.071411046456027
Energy: 1.0773534762265224
Energy: 1.071411046456027
Energy: 1.0773534762252333
Energy: 1.071411046456027
Energy: 1.2662253963686487
Energy: 1.0665950904657988
Energy: 1.2662253963695083
Energy: 1.0665950904662287
Energy: 1.2662253963690784
Energy: 1.0665950904657988
Energy: 1.0300969686624886
Energy: 0.9628232700817797
Energy: 1.0300969686620587
Energy: 0.9628232700822096
Energy: 1.0300969686624886
Energy: 0.9628232700817797
Energy: 0.9858058284666361
Energy: 1.0013063908195332
Energy: 0.9858058284666361
Energy: 1.001306390819963
Energy: 0.985805828467066
Energy: 1.0013063908191036
Energy: 1.1733735907769336
Energy: 1.0228293650754947
Energy: 1.173373590776504
Energy: 1.0228293650759246
Energy: 1.173373590776504
Energy: 1.0228293650759246
Energy: 0.8853732929418074
Energy: 1.0959468613925258
Energy: 0.8853732929413776
Energy: 1.0959468613912366
Energy: 0.8853732929413776
Energy: 1.0959468613916663
Energy: 1.1564938613268803
Energy: 1.0781571092349425
Energy: 1.1564938613268803
Energy: 1.0781571092349425
Energy: 1.1564938613260207
Energy: 1.0781571092349425
Energy: 0.8810033993714596
Energy: 1.1811631064923729
Energy: 0.8810033993718892
Energy: 1.1811631064910835
Energy: 0.8810033993714596
Energy: 1.181163106490654
Energy: 1.245539359034646
Energy: 0.9229707997246024
Energy: 1.2455393590350758
Energy: 0.9229707997241726
Energy: 1.2455393590350758
Energy: 0.9229707997241726
Energy: 0.8994520515086323
Energy: 1.170796794117655
Energy: 0.8994520515082025
Energy: 1.1707967941167952
Energy: 0.8994520515086323
Energy: 1.170796794117655
Energy: 1.1127710613352189
Energy: 0.9854381006364362
Energy: 1.1127710613352189
Energy: 0.9854381006364362
Energy: 1.1127710613356487
Energy: 0.9854381006368661
Energy: 0.9236943006551153
Energy: 0.9140218528312615
Energy: 0.9236943006546855
Energy: 0.9140218528308317
Energy: 0.9236943006546855
Energy: 0.9140218528321211
Energy: 1.1688888277742127
Energy: 1.1283913681475632
Energy: 1.1688888277746423
Energy: 1.128391368147993
Energy: 1.1688888277742127
Energy: 1.1283913681484228
Energy: 1.2397784522533615
Energy: 1.0518249055498432
Energy: 1.2397784522529316
Energy: 1.051824905550273
Energy: 1.2397784522529316
Energy: 1.0518249055498432
Energy: 1.0205960604266482
Energy: 1.1434133025245394
Energy: 1.0205960604262183
Energy: 1.1434133025249693
Energy: 1.020596060427078
Energy: 1.1434133025249693
Energy: 1.1928463867184014
Energy: 0.9488457137921855
Energy: 1.192846386717972
Energy: 0.9488457137921855
Energy: 1.192846386717972
Energy: 0.9488457137921855
Energy: 0.8995208950179258
Energy: 1.1088027904085769
Energy: 0.8995208950183555
Energy: 1.1088027904085769
Energy: 0.8995208950187852
Energy: 1.1088027904085769
Energy: 1.196168546570652
Energy: 1.0042219421246004
Energy: 1.196168546570222
Energy: 1.0042219421246004
Energy: 1.196168546570652
Energy: 1.0042219421246004
Energy: 0.9658707241056456
Energy: 1.2352698477483561
Energy: 0.9658707241065051
Energy: 1.2352698477479267
Energy: 0.9658707241060754
Energy: 1.2352698477470667
Energy: 1.1570843877780845
Energy: 1.0781579413903606
Energy: 1.157084387777655
Energy: 1.078157941389501
Energy: 1.157084387777655
Energy: 1.0781579413899307
Energy: 0.9702468821127683
Energy: 1.2190688897850106
Energy: 0.9702468821127683
Energy: 1.2190688897850106
Energy: 0.9702468821123386
Energy: 1.2190688897850106
Energy: 0.9628697239804126
Energy: 1.0301871555180304
Energy: 0.9628697239799828
Energy: 1.0301871555180304
Energy: 0.9628697239804126
Energy: 1.0301871555180304
Energy: 0.9800453386167817
Energy: 1.0229271180453663
Energy: 0.9800453386172113
Energy: 1.0229271180453663
Energy: 0.9800453386176411
Energy: 1.0229271180453663
Energy: 1.021433420737107
Energy: 1.173636952663556
Energy: 1.0214334207375368
Energy: 1.173636952663556
Energy: 1.021433420737107
Energy: 1.173636952663556
Energy: 1.0866482915792497
Energy: 0.9079788043844131
Energy: 1.0866482915775308
Energy: 0.9079788043839834
Energy: 1.08664829157882
Energy: 0.9079788043844131
Energy: 1.0774727229560124
Energy: 1.1216530403404015
Energy: 1.0774727229560124
Energy: 1.1216530403404015
Energy: 1.0774727229555827
Energy: 1.1216530403399716
Energy: 1.2272085465867053
Energy: 0.8863348291294403
Energy: 1.2272085465871352
Energy: 0.8863348291294403
Energy: 1.2272085465871352
Energy: 0.8863348291294403
Energy: 0.9224837584628525
Energy: 1.131037719995404
Energy: 0.9224837584628525
Energy: 1.1310377199958335
Energy: 0.9224837584628525
Energy: 1.1310377199958335

minimum gb energy = 0.8700106615716628 eV
minimum distance =  2.39077596952036 Angstroms
sigma value = 51


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

Energy: 1.0624683885455717
Energy: 1.0975253350745933
Energy: 1.0624683885445758
Energy: 1.0975253350745933
Energy: 1.0624683885455717
Energy: 1.0975253350745933
Energy: 1.1307303785419063
Energy: 1.0066536379147129
Energy: 1.1307303785419063
Energy: 1.0066536379147129
Energy: 1.1307303785419063
Energy: 1.0066536379147129
Energy: 0.94432244558864
Energy: 1.2663114200250374
Energy: 0.94432244558864
Energy: 1.2663114200250374
Energy: 0.94432244558864
Energy: 1.2663114200250374
Energy: 0.9993386646061495
Energy: 0.9423390992762828
Energy: 0.9993386646061495
Energy: 0.9423390992762828
Energy: 0.9993386646061495
Energy: 0.9423390992772785
Energy: 1.0803343894727582
Energy: 1.0459098245530303
Energy: 1.0803343894727582
Energy: 1.0459098245530303
Energy: 1.0803343894727582
Energy: 1.0459098245530303
Energy: 1.1087263980904891
Energy: 1.0105394448964307
Energy: 1.1087263980904891
Energy: 1.0105394448974263
Energy: 1.1087263980904891
Energy: 1.0105394448964307
Energy: 0.9477714390919817
Energy: 1.011688182920277
Energy: 0.9477714390919817
Energy: 1.011688182920277
Energy: 0.9477714390909859
Energy: 1.0116881829192812
Energy: 0.9723463035586105
Energy: 1.050491043624534
Energy: 0.9723463035586105
Energy: 1.050491043624534
Energy: 0.9723463035596062
Energy: 1.050491043624534
Energy: 1.1866466130459363
Energy: 0.9105081256927428
Energy: 1.1866466130459363
Energy: 0.9105081256927428
Energy: 1.1866466130459363
Energy: 0.9105081256927428
Energy: 0.9562726317824333
Energy: 1.252378124212409
Energy: 0.9562726317814374
Energy: 1.252378124212409
Energy: 0.9562726317814374
Energy: 1.2523781242084258
Energy: 1.1326889376258387
Energy: 0.9256448637454688
Energy: 1.1326889376258387
Energy: 0.9256448637454688
Energy: 1.1326889376258387
Energy: 0.9256448637454688
Energy: 1.0355138644101656
Energy: 1.1100833068196723
Energy: 1.0355138644101656
Energy: 1.1100833068196723
Energy: 1.0355138644101656
Energy: 1.1100833068196723
Energy: 1.1849823591456723
Energy: 0.9883774146241513
Energy: 1.1849823591456723
Energy: 0.9883774146241513
Energy: 1.1849823591456723
Energy: 0.9883774146241513
Energy: 1.0301449014370805
Energy: 0.9934848629091635
Energy: 1.0301449014370805
Energy: 0.9934848629081678
Energy: 1.0301449014370805
Energy: 0.9934848629081678
Energy: 0.9608593942420969
Energy: 1.0069429712916644
Energy: 0.9608593942420969
Energy: 1.0069429712916644
Energy: 0.9608593942420969
Energy: 1.0069429712906688
Energy: 1.1311665872416115
Energy: 1.0104582204210732
Energy: 1.1311665872416115
Energy: 1.0104582204200774
Energy: 1.1311665872406156
Energy: 1.0104582204210732
Energy: 1.0517332200995573
Energy: 1.2317195316681029
Energy: 1.0517332201005531
Energy: 1.2317195316681029
Energy: 1.0517332200995573
Energy: 1.2317195316690985
Energy: 1.0038271614048018
Energy: 0.9866967468489706
Energy: 1.0038271614048018
Energy: 0.9866967468499663
Energy: 1.0038271614048018
Energy: 0.9866967468499663

minimum gb energy = 0.9105081256927428 eV
minimum distance =  2.30035301407852 Angstroms
sigma value = 19


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

Energy: 0.9196267729185899
Energy: 0.8939249603661198
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 1.096680011707185
Energy: 1.0381142612659437
Energy: 1.096680011707185
Energy: 1.0381142612659437
Energy: 1.0966800117065945
Energy: 1.0381142612665344
Energy: 0.7796920814243593
Energy: 1.0512842705267866
Energy: 0.7796920814243593
Energy: 1.051284270526196
Energy: 0.7796920814243593
Energy: 1.0512842705256051
Energy: 0.887855130890549
Energy: 0.7797748780202371
Energy: 0.8878551308899583
Energy: 0.7797748780202371
Energy: 0.887855130890549
Energy: 0.7797748780202371
Energy: 0.8419166930341386
Energy: 0.903887002597238
Energy: 0.841916693033548
Energy: 0.903887002597238
Energy: 0.8419166930329571
Energy: 0.903887002597238
Energy: 0.8415800197132366
Energy: 0.9038799204579239
Energy: 0.8415800197126461
Energy: 0.9038799204579239
Energy: 0.8415800197132366
Energy: 0.9038799204579239
Energy: 0.8878574782602743
Energy: 0.7797887717256596
Energy: 0.8878574782602743
Energy: 0.7797887717262502
Energy: 0.8878574782602743
Energy: 0.7797887717262502
Energy: 0.7797914161581445
Energy: 1.0512836502257934
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 0.9196267729191805
Energy: 0.893924960365529
Energy: 0.9196267729191805
Energy: 0.893924960365529
Energy: 1.096680011707185
Energy: 1.0381142612659437
Energy: 1.0966800117065945
Energy: 1.038114261265353
Energy: 1.096680011707185
Energy: 1.038114261265353
Energy: 0.7796920814243593
Energy: 1.0512842705273773
Energy: 0.7796920814243593
Energy: 1.0512842705267866
Energy: 0.7796920814243593
Energy: 1.0512842705267866
Energy: 0.887855130890549
Energy: 0.7797748780196465
Energy: 0.887855130890549
Energy: 0.7797748780196465
Energy: 0.887855130890549
Energy: 0.7797748780202371
Energy: 0.8419166930341386
Energy: 0.903887002597238
Energy: 0.8419166930329571
Energy: 0.903887002597238
Energy: 0.8419166930341386
Energy: 0.903887002597238
Energy: 0.8415800197132366
Energy: 0.9038799204579239
Energy: 0.8415800197126461
Energy: 0.9038799204579239
Energy: 0.8415800197126461
Energy: 0.9038799204585144
Energy: 0.8878574782608648
Energy: 0.7797887717256596
Energy: 0.8878574782602743
Energy: 0.7797887717268409
Energy: 0.8878574782602743
Energy: 0.7797887717256596
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 0.7797914161575539
Energy: 1.0512836502252025
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 1.096789551694895
Energy: 1.0382399496590076
Energy: 0.9196267729191805
Energy: 0.893924960365529
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 1.0966800117065945
Energy: 1.038114261265353
Energy: 1.0966800117065945
Energy: 1.038114261265353
Energy: 1.096680011707185
Energy: 1.0381142612647625
Energy: 0.7796920814237687
Energy: 1.0512842705250147
Energy: 0.7796920814243593
Energy: 1.0512842705256051
Energy: 0.7796920814243593
Energy: 1.0512842705256051
Energy: 0.887855130890549
Energy: 0.7797748780202371
Energy: 0.887855130890549
Energy: 0.7797748780202371
Energy: 0.8878551308899583
Energy: 0.7797748780202371
Energy: 0.841916693033548
Energy: 0.9038870025960568
Energy: 0.8419166930329571
Energy: 0.9038870025966474
Energy: 0.8419166930329571
Energy: 0.903887002597238
Energy: 0.8415800197126461
Energy: 0.9038799204579239
Energy: 0.8415800197132366
Energy: 0.9038799204579239
Energy: 0.8415800197132366
Energy: 0.9038799204579239
Energy: 0.8878574782608648
Energy: 0.7797887717268409
Energy: 0.8878574782608648
Energy: 0.7797887717262502
Energy: 0.8878574782608648
Energy: 0.7797887717262502
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 0.7797914161581445
Energy: 1.0512836502252025
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 1.096789551694304
Energy: 1.0382399496590076
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 0.9196267729185899
Energy: 0.893924960365529
Energy: 0.9196267729191805
Energy: 0.8939249603661198
Energy: 1.096680011707185
Energy: 1.0381142612641718
Energy: 1.096680011707185
Energy: 1.0381142612647625
Energy: 1.096680011707185
Energy: 1.038114261263581
Energy: 0.7796920814243593
Energy: 1.051284270526196
Energy: 0.7796920814243593
Energy: 1.051284270526196
Energy: 0.7796920814243593
Energy: 1.0512842705256051

minimum gb energy = 0.7796920814237687 eV
minimum distance =  2.31320358732578 Angstroms
sigma value = 27


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

Energy: 0.8361957258633164
Energy: 0.7991297843980851
Energy: 0.8361957258633164
Energy: 0.7991297843966382
Energy: 0.8361957258633164
Energy: 0.7991297843966382
Energy: 1.0608931092294926
Energy: 0.829180499156482
Energy: 1.0608931092309395
Energy: 0.829180499156482
Energy: 1.0608931092309395
Energy: 0.829180499156482
Energy: 0.7637914404609298
Energy: 1.075573795109973
Energy: 0.7637914404609298
Energy: 1.075573795109973
Energy: 0.7637914404609298
Energy: 1.075573795109973
Energy: 1.022485971872411
Energy: 0.7693537539204147
Energy: 1.0224859718738577
Energy: 0.7693537539204147
Energy: 1.0224859718738577
Energy: 0.7693537539204147
Energy: 1.1313588729284225
Energy: 0.7667104304522118
Energy: 1.1313588729284225
Energy: 0.7667104304522118
Energy: 1.1313588729284225
Energy: 0.7667104304522118
Energy: 0.8775067756909025
Energy: 1.000101761534427
Energy: 0.8775067756909025
Energy: 1.000101761534427
Energy: 0.8775067756909025
Energy: 1.000101761534427
Energy: 0.7677065451880977
Energy: 0.8307128561883962
Energy: 0.7677065451880977
Energy: 0.8307128561883962
Energy: 0.7677065451880977
Energy: 0.8307128561883962
Energy: 0.8335708787178829
Energy: 0.8018472983309048
Energy: 0.8335708787178829
Energy: 0.8018472983309048
Energy: 0.8335708787178829
Energy: 0.8018472983309048
Energy: 0.8626876779367714
Energy: 0.8498483866489095
Energy: 0.8626876779353246
Energy: 0.8498483865491091
Energy: 0.8626876779338777
Energy: 0.8498483865361203
Energy: 0.9254898273220654
Energy: 0.8915553481985303
Energy: 0.9254898273220654
Energy: 0.8915553481985303
Energy: 0.9254898273220654
Energy: 0.8915553481985303
Energy: 0.9162424266927697
Energy: 0.7959290815262419
Energy: 0.9162424266927697
Energy: 0.7959290815262419
Energy: 0.8455636401075575
Energy: 0.7959290815262419
Energy: 1.013974756082375
Energy: 0.860465331307504
Energy: 1.013974756082375
Energy: 0.860465331307504
Energy: 1.013974756082375
Energy: 0.860465331307504

minimum gb energy = 0.7637914404609298 eV
minimum distance =  2.29870353149452 Angstroms
sigma value = 9


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

Energy: 0.7522991117483305
Energy: 0.8948713499401636
Energy: 0.752299111747924
Energy: 0.8948713499409766
Energy: 0.752299111747924
Energy: 0.8948713499409766
Energy: 1.0170766446804467
Energy: 0.9147779842372437
Energy: 1.017076644701956
Energy: 0.7995671361664672
Energy: 1.0170766446877273
Energy: 0.8593794366226538
Energy: 0.7074603931910328
Energy: 1.182295962981317
Energy: 0.707460393191846
Energy: 1.182295962981317
Energy: 0.7074603931906264
Energy: 1.1822959629809104
Energy: 0.7010033469216707
Energy: 0.6910071076365912
Energy: 0.7010033469216707
Energy: 0.6910071076365912
Energy: 0.7010033469220771
Energy: 0.6910071076361847
Energy: 0.8178271551946827
Energy: 0.8357635904768728
Energy: 0.8178271551946827
Energy: 0.8357635904772793
Energy: 0.8178271551942762
Energy: 0.8357635904772793
Energy: 0.7348234508322072
Energy: 0.8019886884895152
Energy: 0.7348234508309877
Energy: 0.7967012857601131
Energy: 0.7348234508313942
Energy: 0.7967012858840685
Energy: 0.7101756701026216
Energy: 0.8499947569891102
Energy: 0.7101756701022152
Energy: 0.8499947569891102
Energy: 0.710175670101402
Energy: 0.8499947569891102
Energy: 0.6760274542107576
Energy: 0.8583839755267177
Energy: 0.6760274542107576
Energy: 0.8583839755263112
Energy: 0.6760274542111641
Energy: 0.8583839755267177
Energy: 1.1997183192553678
Energy: 0.8629303040122418
Energy: 1.1997183192553678
Energy: 0.8629303040122418
Energy: 1.1997183192561809
Energy: 0.8629303040122418
Energy: 0.8758415980787422
Energy: 1.0102451004793662
Energy: 0.8758415980783356
Energy: 1.0102451004789594
Energy: 0.875841598077929
Energy: 1.0102451004826185
Energy: 0.7006005063525985
Energy: 0.6945715575451643
Energy: 0.700600506353005
Energy: 0.6945715575447577
Energy: 0.7006005063525985
Energy: 0.6945715575451643
Energy: 0.7795534730344903
Energy: 0.8096401526288223
Energy: 0.7795534730340837
Energy: 0.8096401526292288
Energy: 0.7795534730340837
Energy: 0.8096401526292288
Energy: 0.7315694191698763
Energy: 0.7320034734046913
Energy: 0.7315694191678437
Energy: 0.7320034734046913
Energy: 0.7315694191694698
Energy: 0.7320034734046913
Energy: 0.749082437580695
Energy: 1.0833076486368614
Energy: 0.7490824375823212
Energy: 1.0833076486368614
Energy: 0.7490824375794755
Energy: 1.0833076486360482
Energy: 0.6804213549161879
Energy: 0.8538050224714586
Energy: 0.6804213549157814
Energy: 0.853805022471052
Energy: 0.6804213549161879
Energy: 0.8538050224714586
Energy: 1.0244146091709991
Energy: 0.7401471139139282
Energy: 1.024414609170186
Energy: 0.7401471140528882
Energy: 1.0244146091709991
Energy: 0.7401471139899127
Energy: 0.9214181364261882
Energy: 0.8934264329104835
Energy: 0.921418136425375
Energy: 0.8934264329702069
Energy: 0.9214181364261882
Energy: 0.893426432977931
Energy: 0.6869332027408167
Energy: 0.8911162322902135
Energy: 0.6869332027412233
Energy: 0.8911162322902135
Energy: 0.6869332027412233
Energy: 0.8911162322902135
Energy: 0.6636910280366546
Energy: 0.9841913462692636
Energy: 0.663691028036248
Energy: 0.9841913462684505
Energy: 0.6636910280366546
Energy: 0.9841913462692636
Energy: 0.9521684601439878
Energy: 0.8428926333743896
Energy: 0.9521684601423619
Energy: 0.8428926333747959
Energy: 0.9521684601427682
Energy: 0.8428926333747959
Energy: 0.6637872827496824
Energy: 0.9841778581032946
Energy: 0.6637872827492758
Energy: 0.9841778581024815
Energy: 0.6637872827496824
Energy: 0.984177858102888
Energy: 0.68697653702767
Energy: 0.8909119800397284
Energy: 0.6869765370280765
Energy: 0.8909119800393218
Energy: 0.6869765370280765
Energy: 0.8909119800393218
Energy: 1.0239794868196144
Energy: 0.893327127621392
Energy: 1.0239794868196144
Energy: 0.8933271276197658
Energy: 1.0239794868192078
Energy: 0.8933271276234246
Energy: 1.0244618947015043
Energy: 0.7346805838717599
Energy: 1.0244618947019108
Energy: 0.7346805838705404
Energy: 1.0244618947023174
Energy: 0.7346805838725731
Energy: 0.6802525562238526
Energy: 0.8536831028628136
Energy: 0.6802525562234462
Energy: 0.8536831028628136
Energy: 0.6802525562234462
Energy: 0.853683102862407
Energy: 0.7490998570294749
Energy: 0.8964885590456292
Energy: 0.749099857030288
Energy: 0.8964885590464422
Energy: 0.7490998570298814
Energy: 0.8964885590460357
Energy: 0.7308075788075385
Energy: 0.7318586355705106
Energy: 0.7308075788067255
Energy: 0.7318586355705106
Energy: 0.7308075788091647
Energy: 0.7318586355705106
Energy: 0.7797470699421652
Energy: 0.7204254583080706
Energy: 0.7797470699421652
Energy: 0.7204254583096967
Energy: 0.7797470699417588
Energy: 0.7204254583092902
Energy: 0.7006922544745411
Energy: 0.6946752409316039
Energy: 0.7006922544745411
Energy: 0.6946752409311975
Energy: 0.7006922544745411
Energy: 0.6946752409316039
Energy: 0.8757778191676565
Energy: 1.02882397219644
Energy: 0.8757778191676565
Energy: 1.0288239721948138
Energy: 0.8757778191684696
Energy: 1.0288239721952206
Energy: 1.2021827038087358
Energy: 0.8627046508233669
Energy: 1.2021827038079227
Energy: 0.8627046508229606
Energy: 1.2021827038083293
Energy: 0.8627046508229606
Energy: 0.6760705773304535
Energy: 0.8587440382799507
Energy: 0.6760705773304535
Energy: 0.8587440382799507
Energy: 0.6760705773304535
Energy: 0.8587440382803573
Energy: 0.7104057391958574
Energy: 0.843562239886469
Energy: 0.7104057391812222
Energy: 0.843562239886469
Energy: 0.7104057391751242
Energy: 0.843562239886469
Energy: 0.7347462080667753
Energy: 0.745486341312183
Energy: 0.7347462080887279
Energy: 0.745486341312183
Energy: 0.7347462080842561
Energy: 0.745486341312183
Energy: 0.8178806560580524
Energy: 0.8359811432136774
Energy: 0.8178806560580524
Energy: 0.8359811432136774
Energy: 0.8178806560580524
Energy: 0.8359811432128644
Energy: 0.701045549623484
Energy: 0.6907302550079969
Energy: 0.701045549623484
Energy: 0.6907302550075903
Energy: 0.701045549622671
Energy: 0.6907302550079969
Energy: 0.7074122365392184
Energy: 1.1851847215014208
Energy: 0.7074122365388118
Energy: 1.1851847215022338
Energy: 0.7074122365392184
Energy: 1.1851847215022338
Energy: 1.0168512426961627
Energy: 0.7228081741824536
Energy: 1.016851242693317
Energy: 0.7228081741828601
Energy: 1.0168512426929104
Energy: 0.7228081741828601
Energy: 0.7522991117475174
Energy: 0.8948713499401636
Energy: 0.7522991117475174
Energy: 0.8948713499405702
Energy: 0.7522991117475174
Energy: 0.894871349939757
Energy: 1.017076644701143
Energy: 0.7995671361672805
Energy: 1.0170766446942319
Energy: 0.7995671361676868
Energy: 1.0170766446987036
Energy: 0.7995671361672805
Energy: 0.7074603931906264
Energy: 1.1822959629764385
Energy: 0.7074603931914395
Energy: 1.1822959629764385
Energy: 0.7074603931910328
Energy: 1.1822959629764385
Energy: 0.7010033469216707
Energy: 0.6910071076365912
Energy: 0.7010033469216707
Energy: 0.6910071076357781
Energy: 0.7010033469216707
Energy: 0.6910071076369977
Energy: 0.8178271551942762
Energy: 0.8357635904768728
Energy: 0.8178271551938696
Energy: 0.8357635904772793
Energy: 0.8178271551938696
Energy: 0.8357635904772793

minimum gb energy = 0.663691028036248 eV
minimum distance =  2.3688377143405 Angstroms
sigma value = 57


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

Energy: 0.3020499383705975
Energy: 0.3099679429529455
Energy: 0.3020499383705975
Energy: 0.30996794295202007
Energy: 0.3020499383705975
Energy: 0.3099679429529455
Energy: 0.3900287393745669
Energy: 0.9917540363608012
Energy: 0.3900287393745669
Energy: 0.9917540363608012
Energy: 0.3900287393754923
Energy: 0.9917540363608012
Energy: 0.34455251505686546
Energy: 0.9427175011120538
Energy: 0.34455251505686546
Energy: 0.9427175011120538
Energy: 0.34455251505686546
Energy: 0.9427175011120538
Energy: 0.3116443452401277
Energy: 0.30193258677597457
Energy: 0.3116443452401277
Energy: 0.3019325867769
Energy: 0.3116443452401277
Energy: 0.3019325867769
Energy: 0.3911504949002426
Energy: 0.39590688813999053
Energy: 0.3911504949002426
Energy: 0.39590688813999053
Energy: 0.3911504949002426
Energy: 0.39590688813906505
Energy: 0.3020627429056273
Energy: 1.1555075466609093
Energy: 0.3020627429056273
Energy: 1.1555075466609093
Energy: 0.3020627429056273
Energy: 1.1555075466609093
Energy: 0.3020841592523264
Energy: 1.1553552181462559
Energy: 0.3020841592523264
Energy: 1.1553552181462559
Energy: 0.3020841592523264
Energy: 1.1553552181453306
Energy: 0.3897765389276061
Energy: 0.39581185440000805
Energy: 0.3897765389276061
Energy: 0.3958118544009334
Energy: 0.3897765389285315
Energy: 0.39581185440000805
Energy: 0.31162924511204637
Energy: 0.3019235468812085
Energy: 0.31162924511204637
Energy: 0.30192354688213396
Energy: 0.31162924511204637
Energy: 0.3019235468812085
Energy: 0.3445623328079541
Energy: 0.9427511058325923
Energy: 0.3445623328079541
Energy: 0.9427511058325923
Energy: 0.3445623328079541
Energy: 0.9427511058325923
Energy: 0.38990718721807544
Energy: 0.9915817560281169
Energy: 0.38990718721807544
Energy: 0.9915817560281169
Energy: 0.38990718721807544
Energy: 0.9915817560281169
Energy: 0.3020499383705975
Energy: 0.30996794295202007
Energy: 0.3020499383705975
Energy: 0.3099679429529455
Energy: 0.3020499383705975
Energy: 0.3099679429529455
Energy: 0.3900287393754923
Energy: 0.9917540363608012
Energy: 0.3900287393754923
Energy: 0.9917540363608012
Energy: 0.3900287393745669
Energy: 0.9917540363598757
Energy: 0.34455251505686546
Energy: 0.9427175011120538
Energy: 0.34455251505686546
Energy: 0.9427175011120538
Energy: 0.34455251505686546
Energy: 0.9427175011120538
Energy: 0.3116443452401277
Energy: 0.30193258677597457
Energy: 0.3116443452401277
Energy: 0.30193258677597457
Energy: 0.3116443452401277
Energy: 0.30193258677597457
Energy: 0.3911504949002426
Energy: 0.39590688813906505
Energy: 0.3911504949002426
Energy: 0.39590688813999053
Energy: 0.3911504948993172
Energy: 0.39590688813999053
Energy: 0.3020627429056273
Energy: 1.1555075466609093
Energy: 0.3020627429056273
Energy: 1.1555075466609093
Energy: 0.3020627429047018
Energy: 1.1555075466609093
Energy: 0.30208415925140103
Energy: 1.1553552181462559
Energy: 0.3020841592523264
Energy: 1.1553552181462559
Energy: 0.3020841592523264
Energy: 1.1553552181462559
Energy: 0.3897765389285315
Energy: 0.39581185440000805
Energy: 0.3897765389285315
Energy: 0.39581185440000805
Energy: 0.3897765389285315
Energy: 0.39581185440000805

minimum gb energy = 0.3019235468812085 eV
minimum distance =  2.45039553166039 Angstroms
sigma value = 11


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

Energy: 0.6507295372391335
Energy: 0.7535530642848542
Energy: 0.6507295372391335
Energy: 0.7535530642848542
Energy: 0.6507295372391335
Energy: 0.753553064285532
Energy: 0.7871935717158383
Energy: 0.7297399474396462
Energy: 0.7871935717158383
Energy: 0.7297399474403241
Energy: 0.7871935717151605
Energy: 0.7297399474403241
Energy: 0.9073561054292654
Energy: 1.06619824382552
Energy: 0.8748731254663418
Energy: 1.06619824382552
Energy: 0.8748731254656638
Energy: 1.0661982438282316
Energy: 0.9725402635112428
Energy: 0.6211904780201286
Energy: 0.9725402635105648
Energy: 0.6211904780201286
Energy: 0.9725402635105648
Energy: 0.6211904780201286
Energy: 0.7390530429382466
Energy: 0.5493409657982409
Energy: 0.7390530429396024
Energy: 0.5493409657982409
Energy: 0.7390530429389244
Energy: 0.5493409657982409
Energy: 0.6909669690714302
Energy: 0.8002999943913292
Energy: 0.6909669690707524
Energy: 0.8002999943906512
Energy: 0.6909669690727861
Energy: 0.8002999943913292
Energy: 0.5477577413084591
Energy: 0.8012321476546381
Energy: 0.5477577413084591
Energy: 0.8012321476539602
Energy: 0.5477577413091369
Energy: 0.8012321476539602
Energy: 0.753622480141605
Energy: 0.5245974814035149
Energy: 0.753622480142283
Energy: 0.5245974814041928
Energy: 0.753622480141605
Energy: 0.5245974814041928
Energy: 0.7489744266497749
Energy: 0.5412230333308636
Energy: 0.7489744266504528
Energy: 0.5412230333308636
Energy: 0.7489744266504528
Energy: 0.5412230333308636
Energy: 0.5385646428735273
Energy: 1.0444940595128884
Energy: 0.5385646428742051
Energy: 1.0444940595135663
Energy: 0.5385646428742051
Energy: 1.044494059512272
Energy: 0.6979956539027373
Energy: 1.027389585904923
Energy: 0.6979956539054489
Energy: 1.0273895859056006
Energy: 0.6979956539054489
Energy: 1.0273895859056006
Energy: 0.7439556324684223
Energy: 0.5515590100409751
Energy: 0.7439556324691002
Energy: 0.5515590100402971
Energy: 0.7439556324691002
Energy: 0.5515590100409751
Energy: 0.7590786114578354
Energy: 0.6206749863516986
Energy: 0.7590786114571575
Energy: 0.6206749863510207
Energy: 0.7590786114578354
Energy: 0.6206749863510207
Energy: 0.823693400099218
Energy: 0.9511836755255664
Energy: 0.8236934000998958
Energy: 0.9511836755255664
Energy: 0.8236934001005737
Energy: 0.9511836755229164
Energy: 0.7891343552197929
Energy: 0.7266789529212395
Energy: 0.789134355219115
Energy: 0.7266789529205615
Energy: 0.7891343552177593
Energy: 0.7266789529205615
Energy: 0.6514328238689938
Energy: 0.754108426189905
Energy: 0.6514328238689938
Energy: 0.754108426189905
Energy: 0.6514328238689938
Energy: 0.7541084261892271
Energy: 0.6518022239715737
Energy: 0.7460332924457899
Energy: 0.6518022239722516
Energy: 0.7460332924457899
Energy: 0.6518022239715737
Energy: 0.746033292445112
Energy: 0.9490200481097103
Energy: 0.8438124252012832
Energy: 0.9490200481090324
Energy: 0.8438124252019611
Energy: 0.9490200481090324
Energy: 0.8438124252012832
Energy: 0.9815787728488284
Energy: 0.5735434971197417
Energy: 0.9815787728488284
Energy: 0.5735434971170301
Energy: 0.9815787728488284
Energy: 0.5735434971197417
Energy: 0.7437606626743101
Energy: 0.6492367733085207
Energy: 0.7437606626743101
Energy: 0.6492367733091985
Energy: 0.7437606626743101
Energy: 0.6492367733085207
Energy: 0.5382306458054774
Energy: 0.7551655171344794
Energy: 0.5382306458054774
Energy: 0.7551655171344794
Energy: 0.5382306458061552
Energy: 0.7551655171344794
Energy: 0.7483666108782335
Energy: 0.8015325639935154
Energy: 0.7483666108768778
Energy: 0.8015325639935154
Energy: 0.7483666108741661
Energy: 0.8015325639941934
Energy: 0.754401114248984
Energy: 0.6639686842684994
Energy: 0.754401114248984
Energy: 0.6639686842684994
Energy: 0.754401114248984
Energy: 0.6639686842678216
Energy: 0.7501995449076523
Energy: 0.63996737063153
Energy: 0.7501995449069744
Energy: 0.6399673706328858
Energy: 0.7501995449076523
Energy: 0.63996737063153
Energy: 0.5385237409211271
Energy: 1.0253539179108977
Energy: 0.538523740921805
Energy: 1.0253539179122535
Energy: 0.538523740921805
Energy: 1.0253539179129314
Energy: 1.1982265060636679
Energy: 1.0169257040730357
Energy: 1.198226506064346
Energy: 1.0169257040730357
Energy: 1.198226506064346
Energy: 1.0169257040730357

minimum gb energy = 0.5245974814035149 eV
minimum distance =  2.36054704897172 Angstroms
sigma value = 41


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

Energy: 0.7412292718143849
Energy: 0.6390630404303325
Energy: 0.7412292718138505
Energy: 0.6390630404303325
Energy: 0.7412292718138505
Energy: 0.6390630404303325
Energy: 0.8129932425229675
Energy: 0.9158757549062887
Energy: 0.8129932425235015
Energy: 0.9158757549068232
Energy: 0.8129932425229675
Energy: 0.9158757549062887
Energy: 1.0687635869419665
Energy: 1.2070086865762424
Energy: 1.0687635869419665
Energy: 1.2070086865762424
Energy: 1.0687635869419665
Energy: 1.2070086865762424
Energy: 0.7899418902993253
Energy: 0.6360041320002051
Energy: 0.7899418902993253
Energy: 0.6360041320002051
Energy: 0.7899418902993253
Energy: 0.6360041320002051
Energy: 0.5926195983036024
Energy: 0.6423793090292634
Energy: 0.5926195983036024
Energy: 0.6423793090281946
Energy: 0.5926195983041367
Energy: 0.6423793090281946
Energy: 0.7946547312863006
Energy: 0.9222349330723943
Energy: 0.7946547312879035
Energy: 0.9222349330718601
Energy: 0.7946547312873693
Energy: 0.9222349330718601
Energy: 0.6110013717669163
Energy: 0.9796192544439456
Energy: 0.6110013717669163
Energy: 0.9796192544444798
Energy: 0.6110013717663821
Energy: 0.9796192544450141
Energy: 0.6038915157922943
Energy: 0.6361979875626739
Energy: 0.6038915157922943
Energy: 0.6361979875626739
Energy: 0.6038915157922943
Energy: 0.6361979875626739
Energy: 0.604240046559005
Energy: 0.635029690539671
Energy: 0.6042400465574022
Energy: 0.635029690539671
Energy: 0.6042400465584709
Energy: 0.635029690539671
Energy: 0.659788470569876
Energy: 1.0926490116599636
Energy: 0.659788470569876
Energy: 1.0926490116599636
Energy: 0.6597884705704102
Energy: 1.0926490116599636
Energy: 0.659365177003163
Energy: 1.067440866878874
Energy: 0.6593651770020944
Energy: 1.067440866878874
Energy: 0.6593651770020944
Energy: 1.0674408668794082
Energy: 0.6153714329171779
Energy: 0.7544395595931759
Energy: 0.6153714329177122
Energy: 0.7544395595931759
Energy: 0.6153714329171779
Energy: 0.75443955959371
Energy: 0.5958347447162651
Energy: 0.6265495375515633
Energy: 0.5958347447157307
Energy: 0.6265495375515633
Energy: 0.5958347447157307
Energy: 0.6265495375515633
Energy: 0.5682147748948552
Energy: 1.2992938696424647
Energy: 0.5682147748948552
Energy: 1.2992938696424647
Energy: 0.5682147748948552
Energy: 1.2992938696424647
Energy: 0.7911864606283175
Energy: 0.9965260818255385
Energy: 0.7911864606283175
Energy: 0.9965260818255385
Energy: 0.7911864606283175
Energy: 0.9965260818255385
Energy: 0.6017194162699313
Energy: 0.7706266685022529
Energy: 0.6017194162699313
Energy: 0.7706266685022529
Energy: 0.6017194162693971
Energy: 0.7706266685022529
Energy: 0.6178626648597241
Energy: 0.6262869314657571
Energy: 0.6178626648597241
Energy: 0.6262869314657571
Energy: 0.617862664860234
Energy: 0.6262869314652227
Energy: 0.8731489850528145
Energy: 1.240833999834755
Energy: 0.8731489850528145
Energy: 1.240833999834755
Energy: 0.8731489850528145
Energy: 1.240833999834755
Energy: 0.8136529597902514
Energy: 0.8620616205699547
Energy: 0.8136529597902514
Energy: 0.8620616205694204
Energy: 0.8136529597897171
Energy: 0.8620616205699547
Energy: 0.7338599121428215
Energy: 0.771757583567458
Energy: 0.7338599121433559
Energy: 0.7717575835658551
Energy: 0.7338599121428215
Energy: 0.7717575835679923
Energy: 0.601651899907964
Energy: 0.911309954821477
Energy: 0.601651899907964
Energy: 0.911309954821477
Energy: 0.601651899907964
Energy: 0.911309954821477
Energy: 1.0668985710122005
Energy: 1.1061486165413785
Energy: 1.0668985710122005
Energy: 1.10614861654405
Energy: 1.066898571011666
Energy: 1.1061486165435155
Energy: 0.8068358668055642
Energy: 0.6091331325587596
Energy: 0.8068358668055642
Energy: 0.6091331325587596
Energy: 0.8068358668055642
Energy: 0.6091331325582253
Energy: 0.6018410870353262
Energy: 0.7742212944351794
Energy: 0.6018410870358606
Energy: 0.7742212944351794
Energy: 0.6018410870358606
Energy: 0.7742212944351794
Energy: 0.5807639303549275
Energy: 0.9329018997429187
Energy: 0.5807639303549275
Energy: 0.9329018997429187
Energy: 0.5807639303549275
Energy: 0.9329018997429187
Energy: 0.609618158212604
Energy: 0.9543944567619246
Energy: 0.6096181582136725
Energy: 0.9543944567624586
Energy: 0.6096181582147411
Energy: 0.9543944567619246
Energy: 0.5915723855065576
Energy: 0.6089156716911234
Energy: 0.5915723855065576
Energy: 0.6089156716911234
Energy: 0.5915723855065576
Energy: 0.6089156716916577
Energy: 0.6042327611480386
Energy: 0.7674411735099439
Energy: 0.6042327611480386
Energy: 0.7674411735104782
Energy: 0.6042327611480386
Energy: 0.7674411735099439
Energy: 0.7347357070120456
Energy: 0.9161015477812645
Energy: 0.7347357070115113
Energy: 0.9161015477812645
Energy: 0.7347357070109771
Energy: 0.9161015477812645
Energy: 0.8978828341555376
Energy: 0.943725374871855
Energy: 0.8978828341555376
Energy: 0.943725374871855
Energy: 0.8978828341544688
Energy: 0.943725374871855
Energy: 0.5894534641834459
Energy: 0.7466284186172614
Energy: 0.5894534641834459
Energy: 0.7466284186167271
Energy: 0.5894534641834459
Energy: 0.7466284186167271
Energy: 0.6219013643699379
Energy: 0.7173440244651544
Energy: 0.6219013643704723
Energy: 0.7173440244651544
Energy: 0.6219013643699379
Energy: 0.7173440244651544
Energy: 0.5808868642160331
Energy: 0.7663965193639903
Energy: 0.5808868642160331
Energy: 0.7663965193639903
Energy: 0.5808868642160331
Energy: 0.7663965193639903

minimum gb energy = 0.5682147748948552 eV
minimum distance =  2.39585747573821 Angstroms
sigma value = 33


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

Energy: 0.7000310140197588
Energy: 0.6533383522930872
Energy: 0.7000310140186339
Energy: 0.6533383522927122
Energy: 0.7000310140205087
Energy: 0.653338352294587
Energy: 0.9890660893382867
Energy: 0.6226218710311685
Energy: 0.9890660893386616
Energy: 0.6226218710315435
Energy: 0.9890660893382867
Energy: 0.6226218710315435
Energy: 1.105494535993126
Energy: 0.9515647016397486
Energy: 1.1054945359961261
Energy: 0.9515647016393738
Energy: 1.1054945359942512
Energy: 0.9515647016393738
Energy: 0.9524662216621497
Energy: 0.6339508241725222
Energy: 0.9524662216621497
Energy: 0.6339508241725222
Energy: 0.9524662216625247
Energy: 0.6339508241725222
Energy: 0.6458658197583768
Energy: 1.1043450376656962
Energy: 0.6458658197580018
Energy: 1.1043450376656962
Energy: 0.6458658197583768
Energy: 1.1043450376656962
Energy: 0.9578256178475048
Energy: 0.651867754423804
Energy: 0.9578256178475048
Energy: 0.6518677544245539
Energy: 0.9578256178475048
Energy: 0.651867754423429
Energy: 0.6665043802801064
Energy: 0.7378652678584298
Energy: 0.6665043802797315
Energy: 0.7378652678573049
Energy: 0.6665043802804814
Energy: 0.7378652678584298
Energy: 0.7432614086405668
Energy: 0.8059244919340542
Energy: 0.7432614086401917
Energy: 0.8059244919340542
Energy: 0.7432614086394418
Energy: 0.8059244919336792
Energy: 1.1041538474755488
Energy: 0.6695778498402795
Energy: 1.1041538474755488
Energy: 0.6695778498402795
Energy: 1.1041538474759238
Energy: 0.6695778498402795
Energy: 1.0029293883278547
Energy: 0.6413386356079396
Energy: 1.0029293883274797
Energy: 0.6413386356075647
Energy: 1.0029293883274797
Energy: 0.6413386356075647
Energy: 0.6968089866857433
Energy: 0.6935632918467489
Energy: 0.6968089866879931
Energy: 0.693563291845999
Energy: 0.6968089866857433
Energy: 0.6935632918486239
Energy: 1.1271149178790938
Energy: 0.6332217281395236
Energy: 1.1271149178790938
Energy: 0.6332217281398986
Energy: 1.127114917878719
Energy: 0.6332217281395236
Energy: 0.6707662564350992
Energy: 1.1033241938858385
Energy: 0.6707662564350992
Energy: 1.1033241938858385
Energy: 0.6707662564350992
Energy: 1.1033241938858385
Energy: 0.8094509936826751
Energy: 0.7435604969614663
Energy: 0.8094509936819251
Energy: 0.7435604969610915
Energy: 0.8094509936815502
Energy: 0.7435604969614663
Energy: 0.7172055169941218
Energy: 0.6608604605496611
Energy: 0.7172055169967467
Energy: 0.6608604605477862
Energy: 0.7172055169956217
Energy: 0.6608604605485361
Energy: 0.6875057147737176
Energy: 0.9645999693883546
Energy: 0.6875057147740926
Energy: 0.9645999693898544
Energy: 0.6875057147737176
Energy: 0.9645999693891045
Energy: 1.1144153526300156
Energy: 0.6468745661713117
Energy: 1.1144153526303904
Energy: 0.6468745661724365
Energy: 1.1144153526303904
Energy: 0.6468745661728116
Energy: 0.6318466016193013
Energy: 0.9538584034418205
Energy: 0.6318466016189265
Energy: 0.9538584034418205
Energy: 0.6318466016189265
Energy: 0.9538584034421955
Energy: 1.0000375013807168
Energy: 1.1024972463143738
Energy: 1.0000375013799667
Energy: 1.1024972463139988
Energy: 1.0000375013807168
Energy: 1.1024972463139988
Energy: 1.1117720021674367
Energy: 0.6735400841190243
Energy: 1.1117720021678115
Energy: 0.6735400841190243
Energy: 1.1117720021678115
Energy: 0.6735400841190243
Energy: 0.6324291261695648
Energy: 0.7111148816307395
Energy: 0.6324291261684398
Energy: 0.7111148816296147
Energy: 0.6324291261688149
Energy: 0.7111148816296147
Energy: 0.621347027237554
Energy: 1.0111418698476773
Energy: 0.6213470272379289
Energy: 1.0111418698476773
Energy: 0.6213470272371789
Energy: 1.0111418698476773
Energy: 0.9128514586096801
Energy: 0.869343891579803
Energy: 0.9128514586093053
Energy: 0.869343891579428
Energy: 0.9128514586096801
Energy: 0.869343891579428
Energy: 0.6364623518934552
Energy: 0.9519778061768895
Energy: 0.6364623518930802
Energy: 0.9519778061768895
Energy: 0.6364623518930802
Energy: 0.9519778061772645
Energy: 1.101700361950998
Energy: 0.6468887462970501
Energy: 1.101700361951373
Energy: 0.6468887462963002
Energy: 1.101700361950998
Energy: 0.6468887462955503
Energy: 0.6505334331622376
Energy: 0.9599328523559976
Energy: 0.6505334331618625
Energy: 0.9599328523552478
Energy: 0.6505334331618625
Energy: 0.9599328523556228
Energy: 0.9622088260917874
Energy: 0.7122055909263925
Energy: 0.9622088260910716
Energy: 0.7122055909263925
Energy: 0.9622088260884468
Energy: 0.7122055909263925
Energy: 0.7588081381658683
Energy: 0.6371622979173294
Energy: 0.7588081381669933
Energy: 0.6371622979173294
Energy: 0.7588081381662434
Energy: 0.6371622979169543
Energy: 0.6707501951221375
Energy: 1.1031694500402587
Energy: 0.6707501951225125
Energy: 1.1031694500406335
Energy: 0.6707501951225125
Energy: 1.1031694500410085
Energy: 0.6402716700834011
Energy: 0.9978805782390496
Energy: 0.6402716700841511
Energy: 0.9978805782394247
Energy: 0.6402716700834011
Energy: 0.9978805782394247
Energy: 0.9792697222466159
Energy: 0.6325443281662897
Energy: 0.979269722246241
Energy: 0.6325443281666646
Energy: 0.9792697222447411
Energy: 0.6325443281662897
Energy: 0.6366030462374789
Energy: 1.127452591192386
Energy: 0.6366030462374789
Energy: 1.127452591192386
Energy: 0.6366030462374789
Energy: 1.127452591192386
Energy: 1.112113824202798
Energy: 0.6814078331442858
Energy: 1.112113824203548
Energy: 0.6814078331442858
Energy: 1.112113824203173
Energy: 0.6814078331442858
Energy: 0.7454255204760054
Energy: 0.7661764341369849
Energy: 0.7454255204763803
Energy: 0.76617643413511
Energy: 0.7454255204756304
Energy: 0.7661764341369849
Energy: 0.6954140916512727
Energy: 0.7654981445194311
Energy: 0.6954140916370238
Energy: 0.7654981445190562
Energy: 0.6954140916411485
Energy: 0.7654981445194311
Energy: 1.1121243853788836
Energy: 0.6814562239567179
Energy: 1.1121243853792586
Energy: 0.6814562239570929
Energy: 1.1121243853788836
Energy: 0.6814562239563429
Energy: 0.6366469728467727
Energy: 1.1272177806310368
Energy: 0.6366469728460227
Energy: 1.1272177806306618
Energy: 0.6366469728471477
Energy: 1.1272177806306618
Energy: 0.9790858086622882
Energy: 0.6323646838628614
Energy: 0.9790858086626634
Energy: 0.6323646838628614
Energy: 0.9790858086622882
Energy: 0.6323646838624863
Energy: 0.6402346269964022
Energy: 0.9980294720448004
Energy: 0.6402346269956524
Energy: 0.9980294720444253
Energy: 0.6402346269956524
Energy: 0.9980294720451753
Energy: 0.6706553359370822
Energy: 1.1031829621744427
Energy: 0.6706553359363322
Energy: 1.1031829621740676
Energy: 0.6706553359363322
Energy: 1.1031829621744427
Energy: 0.7588099142252098
Energy: 0.6370902813852323
Energy: 0.7588099142248349
Energy: 0.6370902813856072
Energy: 0.7588099142252098
Energy: 0.6370902813856072
Energy: 1.012525129468288
Energy: 0.7122659075374086
Energy: 1.0125251294675381
Energy: 0.7122659075374086
Energy: 1.012525129468663
Energy: 0.7122659075381585
Energy: 0.6504491926067147
Energy: 0.9602852124208003
Energy: 0.6504491926063397
Energy: 0.9602852124189254
Energy: 0.6504491926067147
Energy: 0.9602852124211751
Energy: 1.1016828049434724
Energy: 0.6468324373186478
Energy: 1.1016828049438472
Energy: 0.6468324373205226
Energy: 1.1016828049438472
Energy: 0.6468324373201478
Energy: 0.636429975426775
Energy: 0.9515377751005513
Energy: 0.6364299754260251
Energy: 0.9515377750998013
Energy: 0.636429975426775
Energy: 0.9515377751005513
Energy: 0.9132708188647246
Energy: 0.8693592306512231
Energy: 0.9132708188643497
Energy: 0.8693592306512231
Energy: 0.9132708188654747
Energy: 0.8693592306508481
Energy: 0.6213116738340947
Energy: 1.0112113598739199
Energy: 0.6213116738344697
Energy: 1.0112113598739199
Energy: 0.6213116738344697
Energy: 1.0112113598742947

minimum gb energy = 0.6213116738340947 eV
minimum distance =  2.34425263070776 Angstroms
sigma value = 67


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

Energy: 0.7469572123518045
Energy: 0.6769131270509662
Energy: 0.7469572123515766
Energy: 0.6769131270504821
Energy: 0.7469572123513203
Energy: 0.6769131270509662
Energy: 0.7331012602513485
Energy: 0.663172201919347
Energy: 0.7331012602513485
Energy: 0.663172201919347
Energy: 0.7331012602513485
Energy: 0.6631722019190908
Energy: 1.3626840918409153
Energy: 0.8670725754766833
Energy: 1.3626840918411718
Energy: 0.8670725754766833
Energy: 0.9084322630083302
Energy: 0.8670725754769395
Energy: 0.7330936850749203
Energy: 0.6631647829855433
Energy: 0.7330936850749203
Energy: 0.6631647829855433
Energy: 0.7330936850746641
Energy: 0.6631647829855433
Energy: 0.7469572123520607
Energy: 0.6769131270509662
Energy: 0.7469572123500673
Energy: 0.6769131270512225
Energy: 0.7469572123518045
Energy: 0.6769131270509662
Energy: 0.7331012602500955
Energy: 0.6631722019198312
Energy: 0.7331012602506081
Energy: 0.6631722019203437
Energy: 0.7331012602508643
Energy: 0.6631722019200874
Energy: 0.6853247982361373
Energy: 0.8670725754771959
Energy: 0.685324798236365
Energy: 0.8670725754771959
Energy: 0.9084322630083302
Energy: 0.8670725754764268

minimum gb energy = 0.6631647829855433 eV
minimum distance =  2.38933293830319 Angstroms
sigma value = 3


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

Energy: 1.0838562127447506
Energy: 0.8778877517429963
Energy: 1.052739716872237
Energy: 0.8778877517423762
Energy: 1.0838562127437585
Energy: 0.8778877517410122
Energy: 0.9752837590513318
Energy: 0.9184416527009891
Energy: 0.9752837590547421
Energy: 0.9184416527020431
Energy: 0.9752837590537501
Energy: 0.9184416527016711
Energy: 0.9133697721685026
Energy: 1.1049866304737228
Energy: 0.8949141521707948
Energy: 1.1049866304747147
Energy: 0.9133697721695565
Energy: 1.104986630476451
Energy: 1.0586709019978477
Energy: 0.9105832390603342
Energy: 1.0586709019968557
Energy: 0.9105832390596523
Energy: 1.0586709019978477
Energy: 0.9105832390603342
Energy: 0.9552052004066883
Energy: 1.006046337916132
Energy: 0.9552052004076806
Energy: 1.0060463379151399
Energy: 0.9552052004066883
Energy: 1.0060463379158218
Energy: 0.8856755225883769
Energy: 1.0504864615549747
Energy: 0.8856755225870127
Energy: 1.0504864615539204
Energy: 0.8856755225876949
Energy: 1.0504864615539204
Energy: 1.0730093572665778
Energy: 1.1328231391080394
Energy: 1.0731785681047215
Energy: 1.1328231391063033
Energy: 1.073009357267942
Energy: 1.1328231391066754
Energy: 1.0542439950472773
Energy: 0.9257494251826822
Energy: 1.0542439950455411
Energy: 0.9444429069625508
Energy: 1.054243995044549
Energy: 0.9444429069621789
Energy: 0.8900771054692314
Energy: 0.9792354302206353
Energy: 0.8900771054671852
Energy: 0.9792354302223714
Energy: 0.8900771054661932
Energy: 0.9792354302223714
Energy: 0.9354577171481452
Energy: 1.0763531912144693
Energy: 0.935457717146099
Energy: 1.0763531912127953
Energy: 0.9354577171470911
Energy: 1.0763531912131052
Energy: 1.124331318070095
Energy: 1.2047189192073235
Energy: 1.1243313180691028
Energy: 1.2047189192063315
Energy: 1.124331318070095
Energy: 1.2047189192063315
Energy: 0.9350282386410526
Energy: 0.9703113991489347
Energy: 0.9350334003725204
Energy: 0.970311399152283
Energy: 0.9350282386420447
Energy: 0.970311399152283
Energy: 0.9131402061757724
Energy: 0.9659262130069389
Energy: 0.9131402061730441
Energy: 0.965926213006629
Energy: 0.9131402061730441
Energy: 0.9659262130069389
Energy: 0.9828398132921055
Energy: 1.1454801014924487
Energy: 0.9828398132917954
Energy: 1.1454801014941849
Energy: 0.9828398132921055
Energy: 1.1454801014944949
Energy: 1.250348362756174
Energy: 1.0482089907831493
Energy: 1.250348362757166
Energy: 1.048208990779429
Energy: 1.2503483627582204
Energy: 1.0482089907797392
Energy: 1.0534889772508655
Energy: 0.9181814003533678
Energy: 1.0534889772474554
Energy: 0.9181814003540497
Energy: 1.0534889772454092
Energy: 0.9181814003547317
Energy: 1.0232571628494174
Energy: 0.9420309188674947
Energy: 1.0232571628497273
Energy: 0.9420309188661306
Energy: 1.0232571628497273
Energy: 0.9420309188657586
Energy: 0.9413487728551159
Energy: 1.1153400413723207
Energy: 0.9413487728534417
Energy: 1.1153400413726307
Energy: 0.9413487728527596
Energy: 1.1153400413733128
Energy: 1.0913998417819872
Energy: 1.0629744040036735
Energy: 1.0913998417823592
Energy: 1.0629744040064018
Energy: 1.0913998417819872
Energy: 1.0629744040050375
Energy: 0.9599878245771758
Energy: 0.9260973705492066
Energy: 0.9599878245792218
Energy: 0.9260973705457962
Energy: 0.9599878245789119
Energy: 0.9260973705457962
Energy: 0.9588270934330074
Energy: 1.0636853717537074
Energy: 0.9527297221856864
Energy: 1.0636853717568076
Energy: 0.958827093427923
Energy: 1.0636853717561254
Energy: 0.8817575462947994
Energy: 1.1272629561717926
Energy: 0.8818535371104855
Energy: 1.1272629561694365
Energy: 0.8817575462934354
Energy: 1.1272629561697467
Energy: 1.0302170759601543
Energy: 0.9582650147542074
Energy: 1.0302170759608364
Energy: 0.9582650147531534
Energy: 1.0302170759622005
Energy: 0.9582650147528433
Energy: 0.9243309771270347
Energy: 0.9373009619715361
Energy: 0.9243309771294529
Energy: 0.9373009619722181
Energy: 0.9243309771304451
Energy: 0.9373009619722181
Energy: 0.9471045679933219
Energy: 1.0637469060805589
Energy: 0.9471045679909037
Energy: 1.063746906079567
Energy: 0.9471045679940039
Energy: 1.063746906079567
Energy: 0.9094473331476954
Energy: 1.010843693433863
Energy: 0.9096418805826241
Energy: 1.0108436934352274
Energy: 0.9094473331500516
Energy: 1.0108436934352274
Energy: 1.0850228336837326
Energy: 0.9825704752286962
Energy: 1.0850228336837326
Energy: 0.9825704752297502
Energy: 1.0850228336844148
Energy: 0.982570475229068
Energy: 0.9790822359198105
Energy: 0.9198340817490368
Energy: 0.9790822359188184
Energy: 0.9198340817473005
Energy: 0.9790822359195004
Energy: 0.9198340817473005
Energy: 0.9781254941140192
Energy: 0.9421296382027224
Energy: 0.978125494114329
Energy: 0.9421296382024124
Energy: 0.9781254941156933
Energy: 0.9421296382024124
Energy: 0.9858218214570124
Energy: 0.8854938661200575
Energy: 0.9538367372153503
Energy: 0.8854938661186934
Energy: 0.9858218214545943
Energy: 0.8854938661190035
Energy: 1.2134567534264102
Energy: 1.004925507146313
Energy: 1.181229571553377
Energy: 1.004925507145631
Energy: 1.2134567534260379
Energy: 1.004925507146313
Energy: 1.0595658403979964
Energy: 0.9260198282532676
Energy: 1.0595658403973145
Energy: 0.9260198282550036
Energy: 1.0595658403976864
Energy: 0.9260198282550036
Energy: 0.9151831281163203
Energy: 0.9643476854321725
Energy: 0.9151831281187383
Energy: 0.9643476854365749
Energy: 0.9151831281173743
Energy: 0.9643476854362648
Energy: 1.0362301310650652
Energy: 0.9738274375920748
Energy: 1.0362301310671111
Energy: 0.9738274375913926
Energy: 1.0362301310654374
Energy: 0.9738274375907107
Energy: 0.9053151253542803
Energy: 0.9896843080445785
Energy: 0.9053151253539703
Energy: 0.9896843080418504
Energy: 0.9053151253532882
Energy: 0.9896843080456326
Energy: 0.944487681341864
Energy: 1.0377501860140708
Energy: 0.944538898760087
Energy: 1.0377501860151246
Energy: 0.944487681342546
Energy: 1.0377501860151246
Energy: 0.9498537950500509
Energy: 0.9929676982106965
Energy: 0.9498546108318379
Energy: 0.9929676982100145
Energy: 0.9498537950473227
Energy: 0.9929676982100145
Energy: 1.1250689712009334
Energy: 0.8954729590369639
Energy: 1.1250689712009334
Energy: 0.8954729590359718
Energy: 1.125068971199941
Energy: 0.8954729590362818
Energy: 0.7886573165193234
Energy: 1.0659093403877167
Energy: 0.7886573165182691
Energy: 1.0659093403846163
Energy: 0.788657316517277
Energy: 1.0659093403863524
Energy: 0.9552352859306424
Energy: 1.0380582259107314
Energy: 0.9552352859299603
Energy: 1.0380582259089952
Energy: 0.9552352859295884
Energy: 1.0380582259086852
Energy: 0.9935700244078194
Energy: 1.0278697894388678
Energy: 0.9935685916949223
Energy: 1.0278697894378757
Energy: 0.9935700244085015
Energy: 1.027869789439922
Energy: 1.1091008992346991
Energy: 0.8999366814975607
Energy: 1.109100899233707
Energy: 0.8999366814968787
Energy: 1.1091008992357532
Energy: 0.8999366814972506
Energy: 0.8447863754589728
Energy: 1.102027087713645
Energy: 0.8447863754569267
Energy: 1.1020270877146991
Energy: 0.8447863754586628
Energy: 1.1020270877150091
Energy: 0.9310585058543672
Energy: 0.9610320422221246
Energy: 0.9310585058564134
Energy: 0.9610320422214425
Energy: 0.9310585058577775
Energy: 0.9610320422217525
Energy: 1.0802896962186337
Energy: 0.8982645516780543
Energy: 1.080289696221052
Energy: 0.8982645516760079
Energy: 1.08028969622037
Energy: 0.8982645516760079
Energy: 1.119686884441129
Energy: 0.8331345278446327
Energy: 1.119686884441439
Energy: 0.8331345278425865
Energy: 1.1196868844418113
Energy: 0.8331345278415323
Energy: 0.9296911259350373
Energy: 1.0233815513354254
Energy: 0.9296906539159016
Energy: 1.0233815513351154
Energy: 0.9296911259367112
Energy: 1.0233815513351154
Energy: 0.8858891093318355
Energy: 0.9674193989359797
Energy: 0.8858891093315255
Energy: 0.9674193989363516
Energy: 0.8858891093301613
Energy: 0.9674193989359797
Energy: 0.9936990850169974
Energy: 1.0014968725076983
Energy: 0.9936990850190435
Energy: 1.0014968725067062
Energy: 0.9936990850180515
Energy: 1.0014968725070161
Energy: 0.9580283308272624
Energy: 0.9783742151378116
Energy: 0.9580283308282544
Energy: 0.9783742151398579
Energy: 0.9580283308316646
Energy: 0.9783742151394857
Energy: 0.9853373841340628
Energy: 0.9522928297741153
Energy: 0.9855782675495178
Energy: 0.9522928297754794
Energy: 0.9853373841340628
Energy: 0.9522928297757893

minimum gb energy = 0.788657316517277 eV
minimum distance =  2.29411982165981 Angstroms
sigma value = 81


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

Energy: 0.9609457316065004
Energy: 0.9307326713908256
Energy: 0.9134327407885983
Energy: 0.9307326713903573
Energy: 0.9609457316065004
Energy: 0.9307326713898892
Energy: 0.8467157805915705
Energy: 0.9614226050734546
Energy: 0.8467157805915705
Energy: 0.9614226050734546
Energy: 0.8467157805920386
Energy: 0.9614226050743907
Energy: 1.080934358359937
Energy: 1.0770859525389134
Energy: 1.0596729701037793
Energy: 1.0770859525389134
Energy: 1.080934358359937
Energy: 1.0770859525389134
Energy: 0.8488970075737691
Energy: 1.0493398400691338
Energy: 0.8488970075718968
Energy: 1.0493398400686658
Energy: 0.8488970075737691
Energy: 1.0493398400686658
Energy: 0.8631966745710715
Energy: 0.7954015718824298
Energy: 0.8631966745701355
Energy: 0.795401571883834
Energy: 0.8631966745706035
Energy: 0.795401571883834
Energy: 0.8746785941511238
Energy: 0.8711352802804565
Energy: 0.8746785941506559
Energy: 0.8711352802799885
Energy: 0.8746785941501877
Energy: 0.8711352802795206
Energy: 0.923925383693752
Energy: 1.0511274078031936
Energy: 0.923925383693752
Energy: 1.0511274078031936
Energy: 0.923925383693752
Energy: 1.0511274078027253
Energy: 0.9587185606752233
Energy: 1.082712331860542
Energy: 0.9587294168563649
Energy: 1.082712331860542
Energy: 0.9587185606752233
Energy: 1.0827123318624143
Energy: 1.0595592392237063
Energy: 1.0014155980889268
Energy: 1.0595592392237063
Energy: 1.0014155980893948
Energy: 1.0595592392246422
Energy: 1.0014155980879906
Energy: 0.8709676991417447
Energy: 1.3267123214490535
Energy: 0.8709676991422126
Energy: 1.3267123214490535
Energy: 0.8709676991417447
Energy: 1.3267123214485854
Energy: 1.086750896599125
Energy: 1.1029138717520153
Energy: 1.0867508965995931
Energy: 1.1029138717520153
Energy: 1.086750896599125
Energy: 1.1029138717520153
Energy: 0.9646170986940247
Energy: 0.8479866965707169
Energy: 0.9646170986944927
Energy: 0.8479866965716529
Energy: 0.9646170986935567
Energy: 0.8479866965711849
Energy: 0.8438575525279892
Energy: 0.8795424851546145
Energy: 0.8438575525279892
Energy: 0.8795424851546145
Energy: 0.8438575525275211
Energy: 0.8795424851536784
Energy: 0.9960190205616914
Energy: 1.0482104121014448
Energy: 0.9960190205621593
Energy: 1.0482104121000404
Energy: 0.9960190205621593
Energy: 1.0482104121014448
Energy: 1.1187018330370906
Energy: 0.8349302672469283
Energy: 1.1187018330361544
Energy: 0.8349302672492686
Energy: 1.1187018330375584
Energy: 0.8349302672492686
Energy: 1.0527997960683664
Energy: 0.8118481025472206
Energy: 1.0527997960674302
Energy: 0.8118481025476889
Energy: 1.0527997960683664
Energy: 0.8118481025472206
Energy: 0.8963228612818754
Energy: 0.908410737614739
Energy: 0.8963228612814074
Energy: 0.908410737614739
Energy: 0.8963228612818754
Energy: 0.908410737614739
Energy: 0.758272108567561
Energy: 1.0017318372446686
Energy: 0.7586046210625804
Energy: 1.0017318372451365
Energy: 0.7582721085670929
Energy: 1.0017318372432642
Energy: 0.9787108068183792
Energy: 1.0965542010988132
Energy: 0.9787108068183792
Energy: 1.0965542010988132
Energy: 0.9787108068188473
Energy: 1.0965542010997493
Energy: 1.0500091801006932
Energy: 1.012633019001522
Energy: 1.0500091801006932
Energy: 1.012633019001522
Energy: 1.0500091801006932
Energy: 1.012633019001522
Energy: 0.9498985115237217
Energy: 0.892776976060282
Energy: 0.9498985115237217
Energy: 0.89277697606075
Energy: 0.9498985115232538
Energy: 0.892776976061686
Energy: 0.8793234795354332
Energy: 0.8799814913002227
Energy: 0.8275958214636207
Energy: 0.8799814913006909
Energy: 0.8793234795354332
Energy: 0.8799814913006909
Energy: 0.881735938268792
Energy: 0.9331103638242377
Energy: 0.8279089782154575
Energy: 0.9331103638242377
Energy: 0.8817359382701963
Energy: 0.9331103638218975
Energy: 1.0821042165772663
Energy: 0.8656372943562278
Energy: 1.0821042165777344
Energy: 0.8656372943566958
Energy: 1.0821042165772663
Energy: 0.8656372943552916
Energy: 1.0016150784956797
Energy: 1.0577150326162832
Energy: 1.0016150784947435
Energy: 1.0577150326162832
Energy: 1.0016150784952116
Energy: 1.0577150326158151
Energy: 1.0009269636868112
Energy: 1.0605320829024147
Energy: 1.0009269636872795
Energy: 1.0605320829028828
Energy: 1.0009269636868112
Energy: 1.0605320829033509
Energy: 0.7582602489116577
Energy: 0.8391513388127396
Energy: 0.7582602489102535
Energy: 0.8391513388113355
Energy: 0.7582602489116577
Energy: 0.8391513388113355
Energy: 0.991187646073418
Energy: 0.9084372330485485
Energy: 0.9911876460738861
Energy: 0.9084372330485485
Energy: 0.991187646073418
Energy: 0.9084372330490166
Energy: 0.92793964714795
Energy: 0.8442731768558601
Energy: 0.9265810926931786
Energy: 0.8442731768558601
Energy: 0.9279396471535665
Energy: 0.8442731768558601
Energy: 1.0539153578445177
Energy: 0.845048669272086
Energy: 1.0539153578449858
Energy: 0.8450486692716179
Energy: 1.0539153578440494
Energy: 0.8450486692697458
Energy: 1.055587683282828
Energy: 1.1136307177553046
Energy: 1.0555876832823599
Energy: 1.1136307177539004
Energy: 1.0555876832823599
Energy: 1.1136307177548366
Energy: 0.8312333547687887
Energy: 0.8635636177678939
Energy: 0.8312333547697248
Energy: 0.8635636177678939
Energy: 0.8312333547687887
Energy: 0.8635636177683621
Energy: 0.9644245018443615
Energy: 0.871963882640133
Energy: 0.9644245018443615
Energy: 0.871963882640133
Energy: 0.9644245018443615
Energy: 0.8719638826406011
Energy: 1.0594929821591268
Energy: 1.0521820688985084
Energy: 1.0594929821595949
Energy: 1.0521820688985084
Energy: 1.0594929821586587
Energy: 1.0521820688994443
Energy: 0.9150617316920342
Energy: 1.328236197206638
Energy: 0.9150376100426959
Energy: 1.3282361972071062
Energy: 0.9150617316920342
Energy: 1.3282361972080423
Energy: 1.0113028503744377
Energy: 1.053546126907043
Energy: 1.011302850375374
Energy: 1.053546126907043
Energy: 1.011302850374906
Energy: 1.053546126907511
Energy: 0.8705056634300298
Energy: 0.9653922526598568
Energy: 0.87050566343237
Energy: 0.9653922526598568
Energy: 0.8705056634309658
Energy: 0.9653922526584526
Energy: 0.8856370404300437
Energy: 1.0652611650294186
Energy: 0.8856370404295755
Energy: 1.0652611650298867
Energy: 0.8856370404300437
Energy: 1.0652611650275463

minimum gb energy = 0.7582602489102535 eV
minimum distance =  2.29610720577517 Angstroms
sigma value = 43


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

Energy: 1.1017811583047366
Energy: 0.843414821192817
Energy: 1.1017811583047366
Energy: 0.843414821192817
Energy: 1.1017811583047366
Energy: 0.8434148211933918
Energy: 0.9923211051989363
Energy: 0.8624279111688854
Energy: 0.9923211051989363
Energy: 0.8624279111694605
Energy: 0.9923211051983615
Energy: 0.8624279111688854
Energy: 0.9479957671896685
Energy: 1.0819487638137608
Energy: 0.9479957671902434
Energy: 1.081948763814336
Energy: 0.9479957671896685
Energy: 1.081948763814336
Energy: 1.0194945215850226
Energy: 0.9135023117925546
Energy: 1.0194945215850226
Energy: 0.9135023117925546
Energy: 1.0194945215850226
Energy: 0.9135023117925546
Energy: 0.9091566025286502
Energy: 0.9355362625512228
Energy: 0.9091566025292253
Energy: 0.9355362625512228
Energy: 0.9091566025286502
Energy: 0.9355362625512228
Energy: 0.9212147072685631
Energy: 1.0269988765472893
Energy: 0.9212147072685631
Energy: 1.0269988765472893
Energy: 0.9212147072685631
Energy: 1.0269988765472893
Energy: 0.9630702279945941
Energy: 1.1018491281561387
Energy: 0.9630702279957439
Energy: 1.1018491281567135
Energy: 0.9630702279945941
Energy: 1.1018491281561387
Energy: 0.962633572444824
Energy: 0.9302472859203651
Energy: 0.962633572444824
Energy: 0.9302472859209402
Energy: 0.962633572444824
Energy: 0.9302472859197902
Energy: 0.9680505885164506
Energy: 0.9099445836255038
Energy: 0.9680505885170255
Energy: 0.9099445836255038
Energy: 0.9680505885164506
Energy: 0.9099445836255038
Energy: 0.9165435908585752
Energy: 1.0369781994721008
Energy: 0.9165435908585752
Energy: 1.0369781994721008
Energy: 0.9165435908585752
Energy: 1.0369781994721008
Energy: 1.1318998008719718
Energy: 0.9718052574188933
Energy: 1.1318998008719718
Energy: 0.9718052574188933
Energy: 1.1318998008725465
Energy: 0.9718052574194683
Energy: 0.9425621862670353
Energy: 0.951503365688185
Energy: 0.9425621862670353
Energy: 0.951503365688185
Energy: 0.9425621862676103
Energy: 0.9515033656876102
Energy: 0.9154427496334397
Energy: 1.0522556006955412
Energy: 0.9154427496328649
Energy: 1.0522556006955412
Energy: 0.9154427496334397
Energy: 1.052255600694966
Energy: 0.9173000302764343
Energy: 1.1381516700678436
Energy: 0.9173000302764343
Energy: 1.1381516700678436
Energy: 0.9173000302770093
Energy: 1.1381516700678436
Energy: 1.0872002661625175
Energy: 0.9644984554662123
Energy: 1.0872002661630922
Energy: 0.9644984554662123
Energy: 1.0872002661625175
Energy: 0.9644984554662123
Energy: 0.9493463607406636
Energy: 0.9291746831062251
Energy: 0.9493463607406636
Energy: 0.9291746831068
Energy: 0.9493463607412385
Energy: 0.9291746831062251
Energy: 1.0157785505539387
Energy: 0.8678662070758939
Energy: 1.0157785505533639
Energy: 0.8678662070764688
Energy: 1.0157785505533639
Energy: 0.8678662070764688
Energy: 1.1891642582410102
Energy: 0.9324565344210356
Energy: 1.1891642582410102
Energy: 0.9324565344216107
Energy: 1.189164258241585
Energy: 0.9324565344210356
Energy: 1.195285340781443
Energy: 0.9301046224293995
Energy: 1.195285340781443
Energy: 0.9301046224293995
Energy: 1.195285340781443
Energy: 0.9301046224288244
Energy: 1.0157332010809292
Energy: 0.946559150607304
Energy: 1.0157332010809292
Energy: 0.9465591506067291
Energy: 1.015733201081504
Energy: 0.946559150607304
Energy: 0.9523305635906381
Energy: 0.9372791845370995
Energy: 0.9523305635912129
Energy: 0.9372791845365246
Energy: 0.9523305635906381
Energy: 0.9372791845365246
Energy: 1.0564062367237324
Energy: 0.8932016224518255
Energy: 1.0564062367237324
Energy: 0.8932016224518255
Energy: 1.0564062367231575
Energy: 0.8932016224518255
Energy: 0.9411844999598384
Energy: 1.004665720267679
Energy: 0.9411844999598384
Energy: 1.004665720267679
Energy: 0.9411844999598384
Energy: 1.004665720267679
Energy: 0.9516680237906047
Energy: 1.0541480380535686
Energy: 0.9516680237906047
Energy: 1.0541480380541435
Energy: 0.9516680237911798
Energy: 1.0541480380535686
Energy: 0.9897498550231215
Energy: 0.9142136629091068
Energy: 0.9897498550231215
Energy: 0.9142136629091068
Energy: 0.9897498550231215
Energy: 0.9142136629085319
Energy: 1.0990732523223652
Energy: 0.9732739381152532
Energy: 1.0990732523223652
Energy: 0.9732739381152532
Energy: 1.0990732523223652
Energy: 0.9732739381152532
Energy: 0.918363086697053
Energy: 1.0115877322997422
Energy: 0.918363086697053
Energy: 1.0115877322997422
Energy: 0.918363086697053
Energy: 1.0115877322997422
Energy: 0.999545857327486
Energy: 0.9142144822491248
Energy: 0.999545857327486
Energy: 0.9142144822496997
Energy: 0.999545857327486
Energy: 0.9142144822491248
Energy: 0.989609213622891
Energy: 0.9094079113104222
Energy: 0.989609213622891
Energy: 0.9094079113104222
Energy: 0.989609213622891
Energy: 0.9094079113104222
Energy: 1.1014047895347674
Energy: 1.0999705796516381
Energy: 1.1014047895347674
Energy: 1.0999705796516381
Energy: 1.1014047895347674
Energy: 1.0999705796527879
Energy: 0.9221325273526186
Energy: 1.0164931260658556
Energy: 0.9221325273520438
Energy: 1.0164931260652805
Energy: 0.9221325273520438
Energy: 1.0164931260658556

minimum gb energy = 0.843414821192817 eV
minimum distance =  2.31082033836336 Angstroms
sigma value = 57


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

Energy: 1.0460960503771706
Energy: 0.7897003137842273
Energy: 1.0460960503771706
Energy: 0.7897003137834829
Energy: 1.0460960503771706
Energy: 0.7897003137842273
Energy: 0.8423869185190245
Energy: 0.8333101111222556
Energy: 0.8423869185197689
Energy: 0.8333101111222556
Energy: 0.8423869185190245
Energy: 0.8333101111222556
Energy: 0.9085129547890898
Energy: 0.9441082526939591
Energy: 0.9085129547883454
Energy: 0.9441082526939591
Energy: 0.9085129547883454
Energy: 0.9441082526932149
Energy: 1.1538626302917872
Energy: 0.9452478959094266
Energy: 1.1538626302917872
Energy: 0.9452478959094266
Energy: 1.1538626302917872
Energy: 0.9452478959094266
Energy: 1.0615800766287893
Energy: 0.9453348063965442
Energy: 1.0615800766287893
Energy: 0.9453348063965442
Energy: 1.0615800766287893
Energy: 0.9453348063957997
Energy: 0.9484978464667678
Energy: 0.9285260694950993
Energy: 0.9484978464667678
Energy: 0.9285260694936105
Energy: 0.9484978464675122
Energy: 0.9285260694928661
Energy: 1.0069472104636492
Energy: 1.0260246146270895
Energy: 1.0069472104636492
Energy: 1.0260246146270895
Energy: 1.0069472104636492
Energy: 1.0260246146270895
Energy: 0.9757948061661236
Energy: 0.7901519594483435
Energy: 0.9757948061661236
Energy: 0.7901519594475992
Energy: 0.9757948061653792
Energy: 0.7901519594475992
Energy: 0.9606187508059761
Energy: 0.8284818221065408
Energy: 0.9606187508067205
Energy: 0.8284818221065408
Energy: 0.9606187508059761
Energy: 0.8284818221065408
Energy: 0.7352592583018197
Energy: 0.9240341685093578
Energy: 0.7352592583010752
Energy: 0.9240341685093578
Energy: 0.7352592583010752
Energy: 0.9240341685108467
Energy: 0.8670744813061002
Energy: 0.8739245167383392
Energy: 0.8670744813061002
Energy: 0.8739245167383392
Energy: 0.8670744813068446
Energy: 0.8739245167390836
Energy: 0.9838658676120711
Energy: 0.9921490192992656
Energy: 0.9838658676105823
Energy: 0.9921490192992656
Energy: 0.9838658676113267
Energy: 0.9921490192992656
Energy: 0.8830195288611942
Energy: 0.8282529149410909
Energy: 0.8830195288619386
Energy: 0.8282529149410909
Energy: 0.8830195288611942
Energy: 0.8282529149418354
Energy: 0.9149408607114331
Energy: 0.8555860985965499
Energy: 0.9149408607114331
Energy: 0.8555860985958056
Energy: 0.9149408607114331
Energy: 0.8555860985958056
Energy: 1.0117020034522028
Energy: 0.828628637302335
Energy: 1.0117020034514586
Energy: 0.8286286373030795
Energy: 1.011702003450714
Energy: 0.828628637302335
Energy: 1.0492558850896312
Energy: 0.8173535794247913
Energy: 1.0492558850903755
Energy: 0.8173535794247913
Energy: 1.04925588509112
Energy: 0.8173535794247913
Energy: 0.7362414367172795
Energy: 0.8429528047718676
Energy: 0.7362414367172795
Energy: 0.8429528047718676
Energy: 0.7362414367172795
Energy: 0.8429528047718676
Energy: 0.8714031118878124
Energy: 0.871985351935096
Energy: 0.8714031118878124
Energy: 0.871985351935096
Energy: 0.871403111887068
Energy: 0.871985351935096
Energy: 0.7362842440380779
Energy: 0.8425672136589939
Energy: 0.7362842440380779
Energy: 0.8425672136589939
Energy: 0.7362842440380779
Energy: 0.8425672136604827
Energy: 1.0490813164709862
Energy: 0.8175556854078535
Energy: 1.0490813164717308
Energy: 0.8175556854078535
Energy: 1.0490813164717308
Energy: 0.8175556854071091
Energy: 1.0113903288915187
Energy: 0.8284917349511012
Energy: 1.0113903288907744
Energy: 0.8284917349511012
Energy: 1.011390328897474
Energy: 0.8284917349511012
Energy: 0.9150094256757775
Energy: 0.8961255031932966
Energy: 0.9150094256757775
Energy: 0.8961255031925522
Energy: 0.9150094256750332
Energy: 0.8961255031925522
Energy: 0.8829208477339364
Energy: 0.828075524437002
Energy: 0.8829208477339364
Energy: 0.8280755244377465
Energy: 0.8829208477346808
Energy: 0.8280755244362576
Energy: 0.9838176475295694
Energy: 0.9919627693722486
Energy: 0.9838176475310582
Energy: 0.9919627693722486
Energy: 0.9838176475303138
Energy: 0.9919627693722486

minimum gb energy = 0.7352592583010752 eV
minimum distance =  2.33595192839811 Angstroms
sigma value = 17


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

Energy: 1.0540267139490094
Energy: 0.7513364070173151
Energy: 1.0540267139490094
Energy: 0.7513364070173151
Energy: 1.0540267139479564
Energy: 0.7513364070173151
Energy: 0.8468810095105694
Energy: 0.9111002126363468
Energy: 0.8468810095095166
Energy: 0.9111002126363468
Energy: 0.8468810095095166
Energy: 0.9111002126363468
Energy: 0.8730503036874727
Energy: 0.8532440204697371
Energy: 0.8730503036874727
Energy: 0.8532440204697371
Energy: 0.8730503036874727
Energy: 0.8532440204697371
Energy: 0.9838298146491449
Energy: 1.0152699211431933
Energy: 0.9838298146491449
Energy: 1.0152699211431933
Energy: 0.9838298146480923
Energy: 1.0152699211431933
Energy: 0.9403888685159332
Energy: 0.9577557466161271
Energy: 0.9403888685159332
Energy: 0.9577557466161271
Energy: 0.9403888685159332
Energy: 0.9577557466161271
Energy: 0.9778267817782643
Energy: 0.8173281693651668
Energy: 0.9778267817782643
Energy: 0.8173281693651668
Energy: 0.9778267817782643
Energy: 0.817328169364114
Energy: 0.9137701230365618
Energy: 0.7370310147196663
Energy: 0.9137701230365618
Energy: 0.7370310147196663
Energy: 0.9137701230365618
Energy: 0.7370310147196663
Energy: 0.9548692842798424
Energy: 0.9376918059567029
Energy: 0.9548692842798424
Energy: 0.9376918059577558
Energy: 0.9548692842798424
Energy: 0.9376918059577558
Energy: 0.8070921517934878
Energy: 0.9838141169208497
Energy: 0.8070921517924351
Energy: 0.9838141169208497
Energy: 0.8070921517934878
Energy: 0.9838141169208497
Energy: 0.895570434103354
Energy: 0.9049798274380643
Energy: 0.895570434103354
Energy: 0.9049798274380643
Energy: 0.895570434103354
Energy: 0.9049798274380643
Energy: 0.9000592043804744
Energy: 0.8325775356351622
Energy: 0.9000592043804744
Energy: 0.8325775356351622
Energy: 0.9000592043804744
Energy: 0.8325775356351622
Energy: 0.9235344547825213
Energy: 0.9975101052952452
Energy: 0.9235344547825213
Energy: 0.9975101052952452
Energy: 0.9235344547825213
Energy: 0.9975101052952452
Energy: 0.6829364755131561
Energy: 0.9377047173228803
Energy: 0.6829364755131561
Energy: 0.9377047173228803
Energy: 0.6829364755131561
Energy: 0.9377047173228803
Energy: 0.772490268742177
Energy: 0.8274088873408111
Energy: 0.772490268742177
Energy: 0.8274088873397583
Energy: 0.772490268742177
Energy: 0.8274088873397583
Energy: 0.790513623541602
Energy: 0.9436052890185024
Energy: 0.7905136235426546
Energy: 0.9436052890185024
Energy: 0.790513623541602
Energy: 0.9436052890185024
Energy: 0.7883449861921062
Energy: 0.9538464755038328
Energy: 0.7883449861910534
Energy: 0.9538464755048857
Energy: 0.7883449861910534
Energy: 0.9538464755038328
Energy: 0.7710327719042268
Energy: 0.8271538084865041
Energy: 0.7710327719042268
Energy: 0.8271538084865041
Energy: 0.7710327719042268
Energy: 0.8271538084865041

minimum gb energy = 0.6829364755131561 eV
minimum distance =  2.37774163177621 Angstroms
sigma value = 17


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

Energy: 1.0353278849609644
Energy: 0.6742937996862619
Energy: 1.0353278849617775
Energy: 0.6742937996862619
Energy: 1.0353278849613712
Energy: 0.6742937996854489
Energy: 0.814082812732714
Energy: 0.8047413433755976
Energy: 0.8140828127335271
Energy: 0.804741343375191
Energy: 0.8140828127331206
Energy: 0.8047413433755976
Energy: 0.7627937101781873
Energy: 0.8023423816589699
Energy: 0.7627937101785938
Energy: 0.8023423816589699
Energy: 0.7627937101781873
Energy: 0.8023423816593762
Energy: 0.9277315901406011
Energy: 0.7628892538241777
Energy: 0.9277315901410077
Energy: 0.7628892538245843
Energy: 0.9277315901406011
Energy: 0.7628892538241777
Energy: 0.9816757589437576
Energy: 0.781146197596721
Energy: 0.9816757589433512
Energy: 0.781146197595908
Energy: 0.9816757589433512
Energy: 0.7811461975971276
Energy: 0.7346858106974418
Energy: 0.8162766037110041
Energy: 0.7346858106974418
Energy: 0.8162766037105974
Energy: 0.7346858106978483
Energy: 0.8162766037105974
Energy: 0.8351806127873023
Energy: 0.7539531494239137
Energy: 0.8351806127877086
Energy: 0.7539531494239137
Energy: 0.8351806127885217
Energy: 0.7539531494239137
Energy: 0.8740212767642183
Energy: 0.8570971122945072
Energy: 0.8740212767642183
Energy: 0.8570971122949136
Energy: 0.8740212767642183
Energy: 0.8570971122945072
Energy: 0.8460035623655112
Energy: 0.8269997186109512
Energy: 0.8460035623655112
Energy: 0.8269997186109512
Energy: 0.8460035623646981
Energy: 0.8269997186113576
Energy: 0.7977443283051403
Energy: 0.675115538117023
Energy: 0.7977443283047337
Energy: 0.6751155381174295
Energy: 0.7977443283051403
Energy: 0.6751155381166164
Energy: 0.898984132147851
Energy: 0.836898018164816
Energy: 0.8989841321474444
Energy: 0.836898018165629
Energy: 0.8989841321466314
Energy: 0.8368980181652225
Energy: 0.7678072069619518
Energy: 0.9578833252814103
Energy: 0.7678072069619518
Energy: 0.9578833252814103
Energy: 0.7678072069619518
Energy: 0.9578833252818169
Energy: 0.8341298415243455
Energy: 0.8023055104490217
Energy: 0.834129841523939
Energy: 0.8023055104494282
Energy: 0.8341298415247521
Energy: 0.8023055104490217
Energy: 0.919264247970974
Energy: 0.7785316410442841
Energy: 0.9192642479701607
Energy: 0.7785316410426579
Energy: 0.9192642479705673
Energy: 0.7785316410442841
Energy: 0.8368270774554313
Energy: 0.9509552308645253
Energy: 0.8368270774550248
Energy: 0.9509552308645253
Energy: 0.8368270774558378
Energy: 0.9509552308645253
Energy: 0.7002142829839428
Energy: 0.857516061943592
Energy: 0.7002142829867517
Energy: 0.8231421705007741
Energy: 0.7002142829847559
Energy: 0.8231421705011808
Energy: 0.7027123718751608
Energy: 0.7270919151745834
Energy: 0.7027123718743478
Energy: 0.7270919151745834
Energy: 0.7027123718747543
Energy: 0.7270919151745834
Energy: 0.8830717424791452
Energy: 0.9008890560248727
Energy: 0.8830717424779255
Energy: 0.9008890560248727
Energy: 0.8830717424795517
Energy: 0.9008890560248727
Energy: 0.768322440645531
Energy: 0.8197166033398273
Energy: 0.7683224406459376
Energy: 0.8197166033390142
Energy: 0.7683224406451246
Energy: 0.8197166033398273
Energy: 0.7016115698027333
Energy: 0.7894066384000907
Energy: 0.7016115698015137
Energy: 0.7894066384000907
Energy: 0.7016115698027333
Energy: 0.765256272324855
Energy: 0.7682285534882596
Energy: 0.8199490656478743
Energy: 0.7682285534874465
Energy: 0.8199490656478743
Energy: 0.7682285534874465
Energy: 0.8199490656478743
Energy: 0.8829723213189192
Energy: 0.9007535952461484
Energy: 0.8829723213185126
Energy: 0.9007535952461484
Energy: 0.8829723213181062
Energy: 0.9007535952457418
Energy: 0.7027438547120363
Energy: 0.7269340737902554
Energy: 0.7027438547128494
Energy: 0.726934073790662
Energy: 0.7027438547116298
Energy: 0.726934073790662
Energy: 0.7001540380213089
Energy: 0.905563484277226
Energy: 0.700154038022122
Energy: 0.905563484277226
Energy: 0.700154038022122
Energy: 0.9055634842768195
Energy: 0.8361321274131283
Energy: 0.9509662064019164
Energy: 0.8361321274131283
Energy: 0.9509662064019164
Energy: 0.8361321274115021
Energy: 0.950966206402323
Energy: 0.9193933215633716
Energy: 0.7783879378273192
Energy: 0.9193933215629649
Energy: 0.7783879378277258
Energy: 0.9193933215629649
Energy: 0.7783879378273192
Energy: 0.8339757916618302
Energy: 0.8025295008540635
Energy: 0.8339757916618302
Energy: 0.802529500853657
Energy: 0.8339757916618302
Energy: 0.80252950085447
Energy: 0.7679088342933409
Energy: 0.9582203510889591
Energy: 0.7679088342925278
Energy: 0.9582203510893655
Energy: 0.7679088342929342
Energy: 0.9582203510889591
Energy: 0.8992003967660603
Energy: 0.8368696593569421
Energy: 0.8992003967664668
Energy: 0.8368696593565357
Energy: 0.8992003967660603
Energy: 0.8368696593577553
Energy: 0.7976263309932444
Energy: 0.6750561558260745
Energy: 0.797626330993651
Energy: 0.6750561558260745
Energy: 0.797626330993651
Energy: 0.675056155826481
Energy: 0.8461281030657435
Energy: 0.8269416249530461
Energy: 0.8461281030657435
Energy: 0.8269416249526396
Energy: 0.8461281030661498
Energy: 0.8269416249530461
Energy: 0.8740171573564207
Energy: 0.8570472178678628
Energy: 0.8740171573560142
Energy: 0.8570472178670497
Energy: 0.8740171573560142
Energy: 0.8570472178674564
Energy: 0.8355914984750897
Energy: 0.7540186264982197
Energy: 0.8355914984754963
Energy: 0.7540186264986263
Energy: 0.8355914984750897
Energy: 0.7540186264986263
Energy: 0.7344626912255957
Energy: 0.7692601843061507
Energy: 0.7344626912255957
Energy: 0.7692601843065573
Energy: 0.7344626912255957
Energy: 0.7692601843061507
Energy: 0.9817594646281018
Energy: 0.7810874669610134
Energy: 0.9817594646281018
Energy: 0.7810874669610134
Energy: 0.9817594646281018
Energy: 0.78108746696142
Energy: 0.9277125895781612
Energy: 0.8768827436365587
Energy: 0.9277125895777547
Energy: 0.876882743636152
Energy: 0.9277125895781612
Energy: 0.8768827436365587
Energy: 0.7627232816852773
Energy: 0.8024846076798475
Energy: 0.7627232816852773
Energy: 0.8024846076798475
Energy: 0.7627232816856838
Energy: 0.8024846076806235
Energy: 0.8141372436875846
Energy: 0.784851872508811
Energy: 0.8141372436867714
Energy: 0.784851872508811
Energy: 0.814137243687178
Energy: 0.784851872508811
Energy: 1.0353278849609644
Energy: 0.6742937996866685
Energy: 1.0353278849613712
Energy: 0.6742937996874815
Energy: 1.0353278849609644
Energy: 0.6742937996874815
Energy: 0.8140828127331206
Energy: 0.8234574521900963
Energy: 0.8140828127339335
Energy: 0.8234574521896897
Energy: 0.8140828127343401
Energy: 0.8234574521896897
Energy: 0.7627937101790003
Energy: 0.8023423816589699
Energy: 0.7627937101790003
Energy: 0.8023423816589699
Energy: 0.7627937101790003
Energy: 0.8023423816585633
Energy: 0.9277315901406011
Energy: 0.7351529438337157
Energy: 0.9277315901406011
Energy: 0.7351529438341222
Energy: 0.9277315901406011
Energy: 0.7351529438341222
Energy: 0.9816757589417251
Energy: 0.7811461975955014
Energy: 0.9816757589425381
Energy: 0.781146197595908
Energy: 0.9816757589425381
Energy: 0.7811461975946883

minimum gb energy = 0.6742937996854489 eV
minimum distance =  2.29469726993701 Angstroms
sigma value = 57


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

Energy: 0.9854214280287722
Energy: 0.6236381550210653
Energy: 0.9854214280287722
Energy: 0.6236381550204033
Energy: 0.9854214280294341
Energy: 0.6236381550204033
Energy: 0.7333783899754213
Energy: 0.7280361865754115
Energy: 0.7333783899740973
Energy: 0.7280361865760733
Energy: 0.7333783899760832
Energy: 0.7280361865754115
Energy: 0.7077261387417532
Energy: 0.7396891941232666
Energy: 0.7077261387424151
Energy: 0.7396891941232666
Energy: 0.7077261387417532
Energy: 0.7396891941239285
Energy: 0.893626124425634
Energy: 0.6997446363060363
Energy: 0.893626124425634
Energy: 0.6997446363066985
Energy: 0.8936261244262959
Energy: 0.6997446363066985
Energy: 0.8930139615619255
Energy: 0.7064107969288714
Energy: 0.8930139615625875
Energy: 0.7064107969288714
Energy: 0.8930139615619255
Energy: 0.7064107969295335
Energy: 0.6888034067719797
Energy: 0.7110582326648606
Energy: 0.6888034067713177
Energy: 0.7110582326648606
Energy: 0.6888034067719797
Energy: 0.7110582326648606
Energy: 0.8746230786479168
Energy: 0.7807624717691068
Energy: 0.8746230786459309
Energy: 0.7807624717691068
Energy: 0.8746230786459309
Energy: 0.7807624717691068
Energy: 0.7957188852179414
Energy: 0.8053408015270351
Energy: 0.7957188852179414
Energy: 0.8053408015243874
Energy: 0.7957188852179414
Energy: 0.8053408015250493
Energy: 0.7491419779455614
Energy: 0.7100060541203627
Energy: 0.7491419779455614
Energy: 0.7100060541203627
Energy: 0.7491419779448993
Energy: 0.7100060541203627
Energy: 0.7248773602077625
Energy: 0.6898818278389381
Energy: 0.7248773602084243
Energy: 0.6898818278389381
Energy: 0.7248773602077625
Energy: 0.6898818278389381
Energy: 0.844105650994888
Energy: 0.804573116310432
Energy: 0.844105650994888
Energy: 0.804573116310432
Energy: 0.844105650994888
Energy: 0.804573116310432
Energy: 0.6632286503104454
Energy: 0.8226253925090218
Energy: 0.6632286503097834
Energy: 0.8226253925076978
Energy: 0.6632286503097834
Energy: 0.8226253925083598
Energy: 0.7250322714878215
Energy: 0.7314255218015365
Energy: 0.7250322714871597
Energy: 0.7314255218021984
Energy: 0.7250322714871597
Energy: 0.7314255218021984
Energy: 0.8507571227434694
Energy: 0.7569424566911086
Energy: 0.8507571227434694
Energy: 0.7569424566904467
Energy: 0.8507571227428072
Energy: 0.7569424566904467
Energy: 0.7107668863218524
Energy: 0.9176562107540234
Energy: 0.7107668863225143
Energy: 0.9176562107533613
Energy: 0.7107668863218524
Energy: 0.9176562107526994
Energy: 0.7557954405150794
Energy: 0.735424629560214
Energy: 0.7557954405150794
Energy: 0.7354246295615379
Energy: 0.7557954405157413
Energy: 0.735424629560876
Energy: 0.8447916243187361
Energy: 0.7229616313587163
Energy: 0.8447916243187361
Energy: 0.7229616313593782
Energy: 0.8447916243187361
Energy: 0.7229616313587163
Energy: 0.7432193155703261
Energy: 0.915415668668535
Energy: 0.7432193155703261
Energy: 0.915415668668535
Energy: 0.7432193155703261
Energy: 0.915415668668535
Energy: 0.7239101653811661
Energy: 0.7795632492538674
Energy: 0.7239101653805042
Energy: 0.7795632492525437
Energy: 0.7239101653818281
Energy: 0.7795632492525437
Energy: 0.8353304615520047
Energy: 0.690140393407726
Energy: 0.8353304615520047
Energy: 0.690140393407726
Energy: 0.8353304615513428
Energy: 0.690140393407726
Energy: 0.7793612125652253
Energy: 0.8435050962798277
Energy: 0.7793612125652253
Energy: 0.8435050962811518
Energy: 0.7793612125652253
Energy: 0.8435050962804896
Energy: 0.6453980249554054
Energy: 0.7790552585327342
Energy: 0.6453980249573912
Energy: 0.7790552585314103
Energy: 0.6453980249580531
Energy: 0.7790552585333961
Energy: 0.6479134827391632
Energy: 0.6602490027600102
Energy: 0.6479134827398251
Energy: 0.6602490027593483
Energy: 0.6479134827385012
Energy: 0.6602490027600102
Energy: 0.7116796691000208
Energy: 0.7822401673916051
Energy: 0.7116796691006827
Energy: 0.782240167392267
Energy: 0.711679669099359
Energy: 0.782240167392267
Energy: 0.7284842376235204
Energy: 0.8239219087834341
Energy: 0.7284842376215348
Energy: 0.8239219087827722
Energy: 0.7284842376228586
Energy: 0.8239219087827722
Energy: 0.7271896045557281
Energy: 0.6601835816231546
Energy: 0.72718960455639
Energy: 0.6601835816231546
Energy: 0.72718960455639
Energy: 0.6601835816231546
Energy: 0.642481617922284
Energy: 0.7828531162131935
Energy: 0.6424816179216221
Energy: 0.7828531162118696
Energy: 0.6424816179216221
Energy: 0.7828531162125316

minimum gb energy = 0.6236381550204033 eV
minimum distance =  2.33381461946757 Angstroms
sigma value = 43


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

Energy: 0.9215084364195821
Energy: 0.5606737131821379
Energy: 0.9215084364200644
Energy: 0.5606737131821379
Energy: 0.9215084364195821
Energy: 0.5606737131821379
Energy: 0.6428408301808236
Energy: 0.6612852829192978
Energy: 0.6428408301803413
Energy: 0.6612852829183332
Energy: 0.6428408301808236
Energy: 0.6612852829192978
Energy: 0.6367890798426428
Energy: 0.6631370935901778
Energy: 0.6367890798426428
Energy: 0.6631370935906601
Energy: 0.6367890798426428
Energy: 0.6631370935901778
Energy: 0.8457782384256075
Energy: 0.5960908781162093
Energy: 0.8457782384256075
Energy: 0.5960908781162093
Energy: 0.8457782384256075
Energy: 0.5960908781157269
Energy: 0.7489908608578025
Energy: 0.7004615451393206
Energy: 0.7489908608578025
Energy: 0.7004615451393206
Energy: 0.7489908608582848
Energy: 0.7004615451393206
Energy: 0.5953849103219333
Energy: 0.6237391456515178
Energy: 0.5953849103224156
Energy: 0.6237391456515178
Energy: 0.5953849103224156
Energy: 0.6237391456515178
Energy: 0.7855164521633858
Energy: 0.6548763635046395
Energy: 0.7855164521638681
Energy: 0.6548763635041572
Energy: 0.7855164521638681
Energy: 0.654876363503675
Energy: 0.7751500391935154
Energy: 0.6869287755087923
Energy: 0.7751500391935154
Energy: 0.6869287755092746
Energy: 0.7751500391935154
Energy: 0.6869287755092746
Energy: 0.566905365809369
Energy: 0.6156243834945397
Energy: 0.566905365809369
Energy: 0.6156243834940575
Energy: 0.566905365809369
Energy: 0.6156243834940575
Energy: 0.6269270328505141
Energy: 0.6329828989835988
Energy: 0.6269270328500318
Energy: 0.6329828989835988
Energy: 0.6269270328514788
Energy: 0.6329828989835988
Energy: 0.6952706336068928
Energy: 0.7116011970385004
Energy: 0.6952706336078573
Energy: 0.7116011970389827
Energy: 0.6952706336078573
Energy: 0.7116011970389827
Energy: 0.5354220644267771
Energy: 0.6146348271605546
Energy: 0.5354220644320823
Energy: 0.6146348271610369
Energy: 0.5354220644320823
Energy: 0.6146348271615192
Energy: 0.6266243499926346
Energy: 0.565988198432896
Energy: 0.6266243499931169
Energy: 0.565988198432896
Energy: 0.6266243499921523
Energy: 0.565988198432896
Energy: 0.7098597737964993
Energy: 0.7084754071045688
Energy: 0.7098597737964993
Energy: 0.7084754071050511
Energy: 0.7098597737964993
Energy: 0.7084754071050511
Energy: 0.6317426271152572
Energy: 0.6147905839948468
Energy: 0.631742627114775
Energy: 0.6147905839924352
Energy: 0.631742627114775
Energy: 0.6147905839929175
Energy: 0.6427838112227301
Energy: 0.5975937347339315
Energy: 0.6427838112232124
Energy: 0.5975937347339315
Energy: 0.6427838112227301
Energy: 0.5975937347344139
Energy: 0.7399384519821417
Energy: 0.7043799390683672
Energy: 0.7399384519821417
Energy: 0.7043799390683672
Energy: 0.7399384519821417
Energy: 0.7043799390683672
Energy: 0.5689710383678711
Energy: 0.7588629060185136
Energy: 0.5689710383683534
Energy: 0.7588629060185136
Energy: 0.5689710383678711
Energy: 0.7588629060180313
Energy: 0.6217933566706405
Energy: 0.6343505247307513
Energy: 0.6217933566711228
Energy: 0.6343505247302691
Energy: 0.6217933566711228
Energy: 0.6343505247302691
Energy: 0.7277731143317716
Energy: 0.7631433631814593
Energy: 0.7277731143317716
Energy: 0.7631433631814593
Energy: 0.7277731143317716
Energy: 0.7631433631814593
Energy: 0.6077554663544565
Energy: 0.8943991353226466
Energy: 0.60775546634674
Energy: 0.8943991353226466
Energy: 0.6077554663472223
Energy: 0.8943991353226466
Energy: 0.6686787591061208
Energy: 0.6447200449573058
Energy: 0.6686787591061208
Energy: 0.6447200449568236
Energy: 0.6686787591066031
Energy: 0.6447200449573058
Energy: 0.7329018931157154
Energy: 0.6243198910616186
Energy: 0.7329018931157154
Energy: 0.6243198910621008
Energy: 0.7329018931157154
Energy: 0.6243198910621008
Energy: 0.6391226371988895
Energy: 0.8930609406138879
Energy: 0.6391226371988895
Energy: 0.8930609406138879
Energy: 0.6391226371988895
Energy: 0.8930609406138879
Energy: 0.6330610867452858
Energy: 0.6494360486213302
Energy: 0.6330610867452858
Energy: 0.6494360486213302
Energy: 0.6330610867452858
Energy: 0.6494360486222948
Energy: 0.7001292690806636
Energy: 0.6019628568560047
Energy: 0.7001292690811459
Energy: 0.6019628568560047
Energy: 0.7001292690806636
Energy: 0.6019628568560047
Energy: 0.5881857602510181
Energy: 0.8285450089047688
Energy: 0.5881857602510181
Energy: 0.8285450089047688
Energy: 0.5858750926086687
Energy: 0.8285450089042866
Energy: 0.5929800572472974
Energy: 0.6313713251396843
Energy: 0.5929800572468151
Energy: 0.6313713251396843
Energy: 0.5929800572472974
Energy: 0.6313713251396843
Energy: 0.6110924111866793
Energy: 0.564976820664685
Energy: 0.6110924111871616
Energy: 0.5649768206642026
Energy: 0.6110924111866793
Energy: 0.564976820664685
Energy: 0.6286900582210695
Energy: 0.7689706454706727
Energy: 0.6286900582210695
Energy: 0.768970645471155
Energy: 0.6286900582215517
Energy: 0.7689706454706727
Energy: 0.6090765325195595
Energy: 0.8040497650934304
Energy: 0.6090765325190772
Energy: 0.8040497650934304
Energy: 0.6090765325190772
Energy: 0.8040497650934304
Energy: 0.6111785758689968
Energy: 0.5456391252677933
Energy: 0.6111785758689968
Energy: 0.5456391252673111
Energy: 0.6111785758685144
Energy: 0.5456391252673111
Energy: 0.5662725969373662
Energy: 0.6543371371693257
Energy: 0.5662725969354371
Energy: 0.6543371371693257
Energy: 0.5662725969368839
Energy: 0.6543371371702903
Energy: 0.6752208554165939
Energy: 0.7820572713979016
Energy: 0.6752208554165939
Energy: 0.7820572713979016
Energy: 0.6752208554165939
Energy: 0.7820572713983839
Energy: 0.6218548670610282
Energy: 0.6083822713644297
Energy: 0.6218548670615105
Energy: 0.6083822713644297
Energy: 0.621854867060546
Energy: 0.6083822713644297
Energy: 0.5543725069023501
Energy: 0.6075058929252961
Energy: 0.5543725069028324
Energy: 0.6075058929243315
Energy: 0.5543725069028324
Energy: 0.6075058929252961

minimum gb energy = 0.5354220644267771 eV
minimum distance =  2.34336547491522 Angstroms
sigma value = 81


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

Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.4350427110357013
Energy: 0.03605956407335581
Energy: 0.4350427110357013
Energy: 0.036059563749214776
Energy: 0.4350427110357013
Energy: 0.03605956376516307
Energy: 0.435069098507492
Energy: 0.03596227616134387
Energy: 0.435069098507492
Energy: 0.03596227615957184
Energy: 0.435069098507492
Energy: 0.0359622761808161
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.4350427110357013
Energy: 0.03605955044185315
Energy: 0.4350427110357013
Energy: 0.03605955089174809
Energy: 0.4350427110357013
Energy: 0.0360595508120469
Energy: 0.435069098507492
Energy: 0.035962274259026476
Energy: 0.435069098507492
Energy: 0.03596227424485022
Energy: 0.435069098507492
Energy: 0.03596227425548241
Energy: 0.03542782036683643
Energy: 0.06747990739047222
Energy: 0.03542782036683643
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.4350427110357013
Energy: 0.036059536884735593
Energy: 0.4350427110357013
Energy: 0.03605953753476955
Energy: 0.4350427110357013
Energy: 0.03605953702289374
Energy: 0.435069098507492
Energy: 0.035962272096320955
Energy: 0.435069098507492
Energy: 0.03596227212998957
Energy: 0.435069098507492
Energy: 0.03596227211758535
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222
Energy: 0.035427820368608455
Energy: 0.06747990739047222

minimum gb energy = 0.03542782036683643 eV
minimum distance =  2.53124530797319 Angstroms
sigma value = 3


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

Energy: 0.8709595134681648
Energy: 0.5448515312620948
Energy: 0.8709595134697556
Energy: 0.5448515312615646
Energy: 0.870959513468695
Energy: 0.5448515312615646
Energy: 0.5736320086067389
Energy: 0.6384604358806729
Energy: 0.5736320086067389
Energy: 0.6384604358812032
Energy: 0.5736320086067389
Energy: 0.6384604358806729
Energy: 0.638895995557778
Energy: 0.6431798990537637
Energy: 0.6388959955572475
Energy: 0.6431798990542941
Energy: 0.638895995557778
Energy: 0.6431798990542941
Energy: 0.7862386215481887
Energy: 0.5773911301488363
Energy: 0.7862386215481887
Energy: 0.5773911301488363
Energy: 0.7862386215481887
Energy: 0.5773911301488363
Energy: 0.6180390286118538
Energy: 0.6999443536858025
Energy: 0.6180390286118538
Energy: 0.6999443536858025
Energy: 0.6180390286118538
Energy: 0.6999443536852722
Energy: 0.5586557685223511
Energy: 0.6204465230210191
Energy: 0.5586557685223511
Energy: 0.6204465230210191
Energy: 0.5586557685223511
Energy: 0.6204465230210191
Energy: 0.7213538903473037
Energy: 0.6316215761362
Energy: 0.7213538903473037
Energy: 0.6316215761362
Energy: 0.721353890347834
Energy: 0.6316215761356697
Energy: 0.6225695385586515
Energy: 0.6897911543508821
Energy: 0.6225695385581212
Energy: 0.6897911543492913
Energy: 0.6225695385586515
Energy: 0.6897911543492913
Energy: 0.6030991560468939
Energy: 0.6200333980801322
Energy: 0.6030991560468939
Energy: 0.6200333980796021
Energy: 0.6030991560468939
Energy: 0.6200333980801322
Energy: 0.7331375222839458
Energy: 0.6101152355791425
Energy: 0.7331375222839458
Energy: 0.6101152355791425
Energy: 0.7331375222839458
Energy: 0.6101152355786121
Energy: 0.5980940211227537
Energy: 0.6779744363260084
Energy: 0.5980940211227537
Energy: 0.6779744363275992
Energy: 0.5980940211227537
Energy: 0.6779744363260084
Energy: 0.6327232671990691
Energy: 0.6452407313438373
Energy: 0.6327232671990691
Energy: 0.6452407313438373
Energy: 0.6327232671985388
Energy: 0.6452407313438373
Energy: 0.6462454863294955
Energy: 0.6017543747201048
Energy: 0.6462454863289653
Energy: 0.6017543747201048
Energy: 0.6462454863294955
Energy: 0.6017543747201048
Energy: 0.6071163182897962
Energy: 0.6794250714197444
Energy: 0.6071163182897962
Energy: 0.6794250714202749
Energy: 0.6071163182897962
Energy: 0.6794250714197444
Energy: 0.6230750794275335
Energy: 0.6222114884339554
Energy: 0.6230750794280638
Energy: 0.6222114884339554
Energy: 0.6230750794275335
Energy: 0.6222114884339554
Energy: 0.7056393005890128
Energy: 0.6136215099788793
Energy: 0.7056393005884825
Energy: 0.6136215099783491
Energy: 0.7056393005890128
Energy: 0.6136215099788793
Energy: 0.6104237659410237
Energy: 0.7353418959688891
Energy: 0.6104237659410237
Energy: 0.7353418959683586
Energy: 0.6104237659415541
Energy: 0.7353418959683586
Energy: 0.6416837899900569
Energy: 0.6053333310884706
Energy: 0.6416837899900569
Energy: 0.6053333310884706
Energy: 0.6416837899900569
Energy: 0.6053333310884706
Energy: 0.6418465464672266
Energy: 0.602318815678281
Energy: 0.6418465464672266
Energy: 0.602318815678281
Energy: 0.6418465464672266
Energy: 0.602318815678281
Energy: 0.6184434617612891
Energy: 0.812763599728095
Energy: 0.6184434617618192
Energy: 0.8127635997286253
Energy: 0.6184434617618192
Energy: 0.8127635997286253
Energy: 0.6137701280273244
Energy: 0.5994680499475326
Energy: 0.6137701280267943
Energy: 0.5994680499480628
Energy: 0.6137701280273244
Energy: 0.5994680499480628
Energy: 0.6802635199394328
Energy: 0.6273486613955298
Energy: 0.6802635199389025
Energy: 0.6273486613955298
Energy: 0.6802635199389025
Energy: 0.6273486613955298
Energy: 0.5940570322415761
Energy: 0.8142506441971958
Energy: 0.5940570322410458
Energy: 0.8142506441971958
Energy: 0.5940570322415761
Energy: 0.8142506441971958
Energy: 0.6539266518138737
Energy: 0.5865899168811282
Energy: 0.653926651810692
Energy: 0.5865899168816585
Energy: 0.653926651810692
Energy: 0.5865899168816585
Energy: 0.6318586275713166
Energy: 0.5787411254970498
Energy: 0.6318586275713166
Energy: 0.5787411254970498
Energy: 0.6318586275713166
Energy: 0.5787411254970498
Energy: 0.5686044126968742
Energy: 0.6671225409622118
Energy: 0.5686044126974046
Energy: 0.6671225409627423
Energy: 0.5686044126974046
Energy: 0.6671225409616816
Energy: 0.651928570367055
Energy: 0.5601293635566448
Energy: 0.651928570367055
Energy: 0.5601293635566448
Energy: 0.651928570367055
Energy: 0.5601293635566448
Energy: 0.6495477863834466
Energy: 0.6022025636674346
Energy: 0.6495477863839768
Energy: 0.6022025636674346
Energy: 0.6495477863839768
Energy: 0.6022025636674346
Energy: 0.5406082768999996
Energy: 0.7642440329559533
Energy: 0.5406082768999996
Energy: 0.764244032955423
Energy: 0.5406082768999996
Energy: 0.764244032955423
Energy: 0.7411158426005614
Energy: 0.6110906211798107
Energy: 0.7411158426000312
Energy: 0.6110906211798107
Energy: 0.7411158426000312
Energy: 0.6110906211798107
Energy: 0.6763883547463919
Energy: 0.6092169086604097
Energy: 0.6763883547463919
Energy: 0.6092169086604097
Energy: 0.6763883547458616
Energy: 0.6092169086604097
Energy: 0.6576322232958641
Energy: 0.626982967962473
Energy: 0.6576322232958641
Energy: 0.6269829679630032
Energy: 0.6576322232958641
Energy: 0.6269829679630032
Energy: 0.6745445328114337
Energy: 0.610872795382115
Energy: 0.6745445328119639
Energy: 0.610872795382115
Energy: 0.6745445328114337
Energy: 0.6108727953815847

minimum gb energy = 0.5406082768999996 eV
minimum distance =  2.37140755848221 Angstroms
sigma value = 67


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

Energy: 0.8951009500190457
Energy: 0.704816171759975
Energy: 0.8951009500198012
Energy: 0.704816171759975
Energy: 0.8951009500198012
Energy: 0.704816171759975
Energy: 0.7012439445290073
Energy: 0.7617031121571793
Energy: 0.7012439445290073
Energy: 0.7617031121571793
Energy: 0.7012439445282517
Energy: 0.7617031121571793
Energy: 0.7548753683248471
Energy: 0.7620368103802543
Energy: 0.7548753683248471
Energy: 0.7620368103802543
Energy: 0.7548753683256028
Energy: 0.7620368103802543
Energy: 0.8068062714281222
Energy: 0.6911887581106899
Energy: 0.8068062714288778
Energy: 0.6911887581106899
Energy: 0.8068062714288778
Energy: 0.6911887581106899
Energy: 0.7551850653597557
Energy: 0.7613141280949784
Energy: 0.7551850653605113
Energy: 0.7613141280957341
Energy: 0.7551850653605113
Energy: 0.7613141280949784
Energy: 0.73455878883081
Energy: 0.7482598163298873
Energy: 0.7345587888315657
Energy: 0.7482598163291317
Energy: 0.7345587888315657
Energy: 0.7482598163291317
Energy: 0.7546370375821377
Energy: 0.7674578808481838
Energy: 0.7546370375828934
Energy: 0.7674578808481838
Energy: 0.7546370375828934
Energy: 0.7674578808481838
Energy: 0.7364592803347036
Energy: 0.8645552461176218
Energy: 0.7364592803347036
Energy: 0.8645552461176218
Energy: 0.7364592803354593
Energy: 0.8645552461176218
Energy: 0.7977789144273367
Energy: 0.811490277954864
Energy: 0.7977789144273367
Energy: 0.8114902779556195
Energy: 0.7977789144273367
Energy: 0.8114902779556195
Energy: 0.7406603263254072
Energy: 0.7623856571763066
Energy: 0.7406603263254072
Energy: 0.7623856571763066
Energy: 0.7406603263254072
Energy: 0.7623856571763066
Energy: 0.745336208607813
Energy: 0.7893561761087025
Energy: 0.745336208607813
Energy: 0.789356176107947
Energy: 0.745336208607813
Energy: 0.7893561761087025
Energy: 0.7390482414665083
Energy: 0.7678731619054273
Energy: 0.7390482414665083
Energy: 0.7678731619054273
Energy: 0.7390482414665083
Energy: 0.767873161906183
Energy: 0.7402308300777192
Energy: 0.7085690409450877
Energy: 0.7402308300777192
Energy: 0.7085690409450877
Energy: 0.7402308300777192
Energy: 0.7085690409450877
Energy: 0.7464748377762768
Energy: 0.8654792186325826
Energy: 0.7464748377762768
Energy: 0.8654792186325826
Energy: 0.7464748377762768
Energy: 0.8654792186325826
Energy: 0.7299463275701672
Energy: 0.7287582135485009
Energy: 0.7299463275701672
Energy: 0.7287582135477454
Energy: 0.7299463275701672
Energy: 0.7287582135485009
Energy: 0.7186259004438812
Energy: 0.7237268247721499
Energy: 0.7186259004438812
Energy: 0.7237268247721499
Energy: 0.7186259004438812
Energy: 0.7237268247721499
Energy: 0.712224824911223
Energy: 0.8693908249440164
Energy: 0.712224824911223
Energy: 0.8693908249440164
Energy: 0.712224824911223
Energy: 0.8693908249432609
Energy: 0.7620483371231171
Energy: 0.6747911549117838
Energy: 0.7620483371238728
Energy: 0.6747911549110281
Energy: 0.7620483371238728
Energy: 0.6747911549117838
Energy: 0.8551851436386332
Energy: 0.766186582952476
Energy: 0.8551851436386332
Energy: 0.766186582952476
Energy: 0.8551851436378777
Energy: 0.766186582952476
Energy: 0.7893942059641385
Energy: 0.7671835194800325
Energy: 0.7893942059641385
Energy: 0.7671835194807881
Energy: 0.7893942059633829
Energy: 0.7671835194807881
Energy: 0.7422488810961445
Energy: 0.6907071726226222
Energy: 0.7422488810953889
Energy: 0.6907071726226222
Energy: 0.7422488810953889
Energy: 0.6907071726226222
Energy: 0.7658333807943831
Energy: 0.7992231167808961
Energy: 0.7658333807943831
Energy: 0.7992231167808961
Energy: 0.7658333807943831
Energy: 0.7992231167816516
Energy: 0.7248402265925188
Energy: 0.7762465391346727
Energy: 0.7248402265925188
Energy: 0.7762465391346727
Energy: 0.7248402265925188
Energy: 0.7762465391346727

minimum gb energy = 0.6747911549110281 eV
minimum distance =  2.34082056285941 Angstroms
sigma value = 33


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

Energy: 0.9368287396659803
Energy: 0.7535516809972026
Energy: 0.936828739665501
Energy: 0.7535516809972026
Energy: 0.9368287396659803
Energy: 0.7535516809972026
Energy: 0.7778992274633608
Energy: 0.8458528750044043
Energy: 0.7778992274628815
Energy: 0.8458528750039248
Energy: 0.7778992274628815
Energy: 0.8458528750039248
Energy: 0.8471068760698198
Energy: 0.8348912100734103
Energy: 0.8471068760707784
Energy: 0.8348912100729309
Energy: 0.8471068760702991
Energy: 0.8348912100724516
Energy: 0.8429443162655254
Energy: 0.7598552528719204
Energy: 0.8429443162650461
Energy: 0.759855252871441
Energy: 0.8429443162655254
Energy: 0.759855252871441
Energy: 0.8693726197879476
Energy: 0.8662998089945166
Energy: 0.8693726197884267
Energy: 0.8662998089945166
Energy: 0.8693726197879476
Energy: 0.866299808993558
Energy: 0.9346763552801808
Energy: 0.8623477276556373
Energy: 0.9346763552801808
Energy: 0.8478907033117415
Energy: 0.9346763552801808
Energy: 0.860923247778152
Energy: 0.7798861874743587
Energy: 0.8666131292841492
Energy: 0.7798861874734001
Energy: 0.8666131292841492
Energy: 0.7798861874738795
Energy: 0.8666131292841492
Energy: 0.8347551051771149
Energy: 0.8352253260326198
Energy: 0.8347551051771149
Energy: 0.8352253260326198
Energy: 0.8347551051775944
Energy: 0.8352253260326198
Energy: 0.8307417178115446
Energy: 0.8478701945118572
Energy: 0.8307417178115446
Energy: 0.8478701945123366
Energy: 0.8307417178115446
Energy: 0.8478701945118572
Energy: 0.8928466665808015
Energy: 0.7946563355511477
Energy: 0.8928466665803222
Energy: 0.7946563355506683
Energy: 0.8928466665812809
Energy: 0.7946563355506683
Energy: 0.8218040516801147
Energy: 0.9060348743555597
Energy: 0.8218040516801147
Energy: 0.9060348743555597
Energy: 0.8218040516796353
Energy: 0.9060348743555597
Energy: 0.7778635779698598
Energy: 0.7871365172464857
Energy: 0.7778635779698598
Energy: 0.7871365172464857
Energy: 0.7778635779698598
Energy: 0.787136517246965
Energy: 0.9345341682781623
Energy: 0.7912328175688012
Energy: 0.9345341682757657
Energy: 0.7912328175688012
Energy: 0.9345341682757657
Energy: 0.7912328175688012
Energy: 0.8028559068083079
Energy: 0.831945991911204
Energy: 0.8028559068083079
Energy: 0.8319459919116833
Energy: 0.8028559068083079
Energy: 0.8319459919116833
Energy: 0.8190835935174631
Energy: 0.8071791558509908
Energy: 0.8190835935174631
Energy: 0.8071791558509908
Energy: 0.8190835935174631
Energy: 0.8071791558509908
Energy: 0.8429055016412071
Energy: 0.8569738584060332
Energy: 0.8429055016416865
Energy: 0.8569738584060332
Energy: 0.8429055016416865
Energy: 0.8569738584060332
Energy: 0.855811634441998
Energy: 0.8369903928127048
Energy: 0.8558116344415188
Energy: 0.8369903928127048
Energy: 0.855811634441998
Energy: 0.8369903928127048
Energy: 0.8771624061770563
Energy: 0.8903077641081135
Energy: 0.8771624061760978
Energy: 0.8903077641081135
Energy: 0.8771624061770563
Energy: 0.8903077641081135
Energy: 0.8299071641441856
Energy: 0.8910936206313073
Energy: 0.8299071641441856
Energy: 0.8910936206313073
Energy: 0.8299071641441856
Energy: 0.8910936206313073
Energy: 0.8794317273965933
Energy: 0.8668665837350041
Energy: 0.8794317273961139
Energy: 0.8668665837359629
Energy: 0.8794317273961139
Energy: 0.8668665837359629
Energy: 0.87542874379529
Energy: 0.844165940842964
Energy: 0.87542874379529
Energy: 0.8441659408424848
Energy: 0.87542874379529
Energy: 0.844165940842964
Energy: 0.8194237961512999
Energy: 0.7641849193639173
Energy: 0.8194237961517792
Energy: 0.7641849193639173
Energy: 0.8194237961512999
Energy: 0.7641849193639173
Energy: 0.7827314387601682
Energy: 0.9060662232373949
Energy: 0.7827314387611267
Energy: 0.9060662232369155
Energy: 0.7827314387606473
Energy: 0.9060662232369155
Energy: 0.8824720238835424
Energy: 0.8049399282984275
Energy: 0.8824720238835424
Energy: 0.8049399282979481
Energy: 0.8824720238835424
Energy: 0.8049399282979481
Energy: 0.7776215413526917
Energy: 0.7851240165780446
Energy: 0.7776215413507743
Energy: 0.7851240165780446
Energy: 0.7776215413522123
Energy: 0.7851240165780446
Energy: 0.7828862423669963
Energy: 0.9090446534733765
Energy: 0.7828862423669963
Energy: 0.9090446534738559
Energy: 0.782886242366517
Energy: 0.9090446534743352
Energy: 0.7796034597413941
Energy: 0.7617210930145578
Energy: 0.7796034597409148
Energy: 0.7617210930140785
Energy: 0.7796034597409148
Energy: 0.7617210930145578
Energy: 0.8872278674373422
Energy: 0.8851144180628606
Energy: 0.8872278674373422
Energy: 0.8851144180628606
Energy: 0.8872278674373422
Energy: 0.8851144180628606
Energy: 0.8811629581370345
Energy: 0.9893565544430921
Energy: 0.8811629581370345
Energy: 0.9893565544426127
Energy: 0.8811629581370345
Energy: 0.9893565544430921
Energy: 0.7808032981646268
Energy: 0.8103254772530573
Energy: 0.7808032981646268
Energy: 0.8103254772530573
Energy: 0.7808032981641475
Energy: 0.810325477252578
Energy: 0.9178447114302066
Energy: 0.909343756859064
Energy: 0.9178447114302066
Energy: 0.909343756859064
Energy: 0.9178447114302066
Energy: 0.9093437568595433
Energy: 0.8681145883203495
Energy: 0.8677300316182966
Energy: 0.8681145883203495
Energy: 0.8677300316182966
Energy: 0.8681145883208287
Energy: 0.8677300316182966
Energy: 0.8404183893872529
Energy: 0.8431906110837617
Energy: 0.8404183893872529
Energy: 0.8431906110837617
Energy: 0.8404183893877323
Energy: 0.8431906110837617
Energy: 0.8198859696288276
Energy: 0.845757328903738
Energy: 0.8198859696288276
Energy: 0.8457573289042173
Energy: 0.8198859696288276
Energy: 0.845757328903738
Energy: 0.8050142340486328
Energy: 0.8336244460752817
Energy: 0.8050142340491121
Energy: 0.8336244460748023
Energy: 0.8050142340486328
Energy: 0.8336244460752817
Energy: 0.9378375433131692
Energy: 0.7905901489198675
Energy: 0.9378375433136485
Energy: 0.7905901489193881
Energy: 0.9378375433136485
Energy: 0.7905901489193881
Energy: 0.779972442054422
Energy: 0.8269781365395503
Energy: 0.7799724420558601
Energy: 0.826978136540509
Energy: 0.7799724420563394
Energy: 0.8269781365385918

minimum gb energy = 0.7535516809972026 eV
minimum distance =  2.35092399503217 Angstroms
sigma value = 41


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

Energy: 0.9812492934343432
Energy: 0.8615213108611859
Energy: 0.9812492934356518
Energy: 0.8615213108611859
Energy: 0.9812492934343432
Energy: 0.8615213108611859
Energy: 0.8640256071910736
Energy: 0.9398242186387462
Energy: 0.8640256071910736
Energy: 0.9398242186387462
Energy: 0.8640256071910736
Energy: 0.9398242186387462
Energy: 1.1626082333236103
Energy: 0.9591280061295838
Energy: 1.028783889067956
Energy: 0.9591280061295838
Energy: 1.0287838890587946
Energy: 0.9591280061295838
Energy: 0.9708188245868231
Energy: 0.9488386828182644
Energy: 0.9708188245868231
Energy: 0.9488386828182644
Energy: 0.9708188245868231
Energy: 0.9488386828182644
Energy: 0.941384736434018
Energy: 0.948558008676494
Energy: 0.941384736434018
Energy: 0.948558008676494
Energy: 0.941384736434018
Energy: 0.948558008676494
Energy: 1.078061506079042
Energy: 0.9887162062610644
Energy: 1.078061506079042
Energy: 0.9887162062610644
Energy: 1.078061506079042
Energy: 0.9887162062610644
Energy: 0.9687369426194169
Energy: 0.8797397671354137
Energy: 0.9687369426194169
Energy: 0.8797397671341048
Energy: 0.9687369426194169
Energy: 0.8797397671341048
Energy: 0.932223589587316
Energy: 0.9596139841557403
Energy: 0.9322235895886246
Energy: 0.9596139841557403
Energy: 0.9322235895886246
Energy: 0.9596139841544314
Energy: 0.8659085356946793
Energy: 0.8881359022374379
Energy: 0.8659085356946793
Energy: 0.8881359022387465
Energy: 0.8659085356946793
Energy: 0.8881359022387465
Energy: 1.025984739816212
Energy: 0.8870984083327637
Energy: 1.025984739816212
Energy: 0.8870984083327637
Energy: 1.025984739816212
Energy: 0.8870984083327637
Energy: 0.9357962578081543
Energy: 0.9594724685773951
Energy: 0.9357962578081543
Energy: 0.9594724685773951
Energy: 0.9357962578068457
Energy: 0.9594724685773951
Energy: 0.9621854640715406
Energy: 0.9288257519559702
Energy: 0.9621854640715406
Energy: 0.9288257519546615
Energy: 0.9621854640715406
Energy: 0.9288257519559702
Energy: 0.934016709506674
Energy: 0.9500507086001558
Energy: 0.934016709506674
Energy: 0.9500507086001558
Energy: 0.934016709506674
Energy: 0.9500507086001558
Energy: 0.9386642482037048
Energy: 0.9397122507637978
Energy: 0.9386642482037048
Energy: 0.9397122507637978
Energy: 0.9386642482037048
Energy: 0.9397122507637978

minimum gb energy = 0.8615213108611859 eV
minimum distance =  2.31890797726732 Angstroms
sigma value = 11


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

Energy: 1.1338072783563928
Energy: 1.044701148209488
Energy: 1.1338072783563928
Energy: 1.044701148209488
Energy: 1.1338072783563928
Energy: 1.0447011482100366
Energy: 1.0688238054204329
Energy: 1.0631452378434378
Energy: 1.068823805419858
Energy: 1.0631452378434378
Energy: 1.068823805419858
Energy: 1.0631452378434378
Energy: 1.0810769809048373
Energy: 1.071230707687231
Energy: 1.0810769809048373
Energy: 1.0712307076878058
Energy: 1.1103206385898725
Energy: 1.0712307076860812
Energy: 1.0584853048823786
Energy: 0.9379002122026043
Energy: 1.0584853048829534
Energy: 0.9379002122026043
Energy: 1.0584853048829534
Energy: 0.9379002122026043
Energy: 1.0515462912879117
Energy: 1.009116383178052
Energy: 1.0515462912879117
Energy: 1.009116383178052
Energy: 1.0515462912884865
Energy: 1.009116383178052
Energy: 0.9863334191576331
Energy: 1.0246868908573592
Energy: 0.9863334191576331
Energy: 1.0246868908573592
Energy: 0.9863334191576331
Energy: 1.0246868908573592
Energy: 1.1087398353153979
Energy: 1.0084163794297467
Energy: 1.1087398353153979
Energy: 1.0084163794297467
Energy: 1.1087398353153979
Energy: 1.0084163794297467
Energy: 1.05337890395
Energy: 1.046031172206475
Energy: 1.05337890395
Energy: 1.046031172206475
Energy: 1.05337890395
Energy: 1.046031172206475
Energy: 1.0181107435556191
Energy: 1.0519579832807462
Energy: 1.0181107435556191
Energy: 1.0519579832807462
Energy: 1.0181107435556191
Energy: 1.0519579832813208
Energy: 1.0086726399893837
Energy: 1.0036577564338272
Energy: 1.0086726399893837
Energy: 1.0036577564338272
Energy: 1.0086726399888086
Energy: 1.0036577564338272
Energy: 0.9467635021332985
Energy: 1.0898079814060266
Energy: 0.9467635021332985
Energy: 1.0898079814060266
Energy: 0.9467635021327236
Energy: 1.0898079814060266
Energy: 1.0480880831845567
Energy: 1.042252873805024
Energy: 1.0480880831851316
Energy: 1.042252873805024
Energy: 1.0480880831845567
Energy: 1.042252873805024
Energy: 1.1065665136754441
Energy: 1.014873425201639
Energy: 1.1065665136748692
Energy: 1.014873425201639
Energy: 1.1065665136737195
Energy: 1.014873425201639
Energy: 1.0149577610444431
Energy: 1.0786961021293533
Energy: 1.0149577610444431
Energy: 1.0786961021293533
Energy: 1.0149577610444431
Energy: 1.0786961021287786
Energy: 1.0166789896165482
Energy: 1.008875242079237
Energy: 1.0166789896159731
Energy: 1.008875242079237
Energy: 1.0166789896165482
Energy: 1.008875242079237
Energy: 1.0429264313439124
Energy: 1.038943062619224
Energy: 1.0429264313439124
Energy: 1.038943062619224
Energy: 1.0429264313439124
Energy: 1.038943062619224
Energy: 0.944429211746702
Energy: 1.175845131499063
Energy: 0.944429211746127
Energy: 1.175845131499063
Energy: 0.944429211746702
Energy: 1.175845131499063
Energy: 1.1124618626482108
Energy: 1.1013436205926055
Energy: 1.1124618626482108
Energy: 1.1013436205926055
Energy: 1.1124618626482108
Energy: 1.1013436205926055
Energy: 1.071411254955582
Energy: 0.9432478269998319
Energy: 1.071411254955582
Energy: 0.9432478269998319
Energy: 1.071411254955582
Energy: 0.9432478269998319
Energy: 1.0434174718844118
Energy: 1.028314111629823
Energy: 1.043417471884987
Energy: 1.028314111630398
Energy: 1.0434174718844118
Energy: 1.028314111629823
Energy: 0.9951733788750677
Energy: 0.9698435059305753
Energy: 0.9951733788750677
Energy: 0.9698435059305753
Energy: 0.9951733788756426
Energy: 0.9698435059305753
Energy: 1.090015782608454
Energy: 1.0700498022680287
Energy: 1.090015782608454
Energy: 1.0700498022674536
Energy: 1.090015782608454
Energy: 1.0700498022674536
Energy: 1.0377049576071007
Energy: 1.033189477937183
Energy: 1.0377049576071007
Energy: 1.0331894779366082
Energy: 1.0377049576071007
Energy: 1.033189477937183
Energy: 1.063445188560874
Energy: 1.0462361690749205
Energy: 1.063445188560299
Energy: 1.0462361690749205
Energy: 1.063445188560299
Energy: 1.0462361690749205
Energy: 0.9970886637896199
Energy: 0.9912633718494321
Energy: 0.9970886637896199
Energy: 0.9912633718494321
Energy: 0.9970886637896199
Energy: 0.9912633718494321
Energy: 0.9590239670887681
Energy: 1.0839173936704785
Energy: 0.9590239670881933
Energy: 1.0839173936704785
Energy: 0.9590239670887681
Energy: 1.0839173936704785
Energy: 1.0401497214688347
Energy: 1.0729712980309234
Energy: 1.0401497214688347
Energy: 1.0729712980303487
Energy: 1.0401497214682596
Energy: 1.0729712980303487
Energy: 1.0789348562190642
Energy: 1.0396120198895484
Energy: 1.0789348562190642
Energy: 1.0396120198895484
Energy: 1.0789348562190642
Energy: 1.0396120198895484
Energy: 1.0023710319254804
Energy: 1.0933321264369504
Energy: 1.0023710319254804
Energy: 1.0933321264375253
Energy: 1.0023710319260555
Energy: 1.0933321264369504
Energy: 0.9828079350493087
Energy: 0.9281016037295372
Energy: 0.9828079350493087
Energy: 0.9281016037295372
Energy: 0.9828079350493087
Energy: 0.9281016037295372
Energy: 1.0577163164049037
Energy: 1.0776045977293256
Energy: 1.0577163164049037
Energy: 1.077604597728751
Energy: 1.0577163164049037
Energy: 1.0776045977293256

minimum gb energy = 0.9281016037295372 eV
minimum distance =  2.33468384010485 Angstroms
sigma value = 57


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

Energy: 1.0255872976348477
Energy: 0.9137300543625901
Energy: 1.0255872976348477
Energy: 0.9137300543625901
Energy: 1.0255872976348477
Energy: 0.9137300543625901
Energy: 1.0239080536927248
Energy: 1.201568596549465
Energy: 1.0239080536927248
Energy: 1.201568596549465
Energy: 1.0239080536917018
Energy: 1.201568596549465
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0866051669182675
Energy: 0.9539799177616549
Energy: 1.062565348669271
Energy: 0.9815290220175759
Energy: 1.062565348669271
Energy: 0.9815290220175759
Energy: 1.0625653486702942
Energy: 0.9815290220185992
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0238760524289168
Energy: 0.9192952435963496
Energy: 1.0238760524299397
Energy: 0.9192952435963496
Energy: 1.0238760524299397
Energy: 0.9192952435963496
Energy: 1.0255872976348477
Energy: 0.9137300543636133
Energy: 1.0255872976348477
Energy: 0.9137300543636133
Energy: 1.0255872976348477
Energy: 0.9137300543636133
Energy: 1.0239080536917018
Energy: 1.201568596549465
Energy: 1.0239080536906784
Energy: 1.201568596549465
Energy: 1.0239080536927248
Energy: 1.201568596549465
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0625653486702942
Energy: 1.3425142515909263
Energy: 1.0625653486702942
Energy: 1.3425142515909263
Energy: 1.0625653486702942
Energy: 1.3425142515909263
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0238760524289168
Energy: 0.9192952435963496
Energy: 1.0238760524289168
Energy: 0.9192952435973727
Energy: 1.0238760524289168
Energy: 0.9192952435963496
Energy: 1.0255872976348477
Energy: 0.9137300543625901
Energy: 1.0255872976348477
Energy: 0.9137300543625901
Energy: 1.0255872976348477
Energy: 0.9137300543625901
Energy: 1.0239080536937477
Energy: 1.201568596549465
Energy: 1.0239080536927248
Energy: 1.201568596549465
Energy: 1.0239080536927248
Energy: 1.201568596549465
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.0866051669182675
Energy: 0.9539799177626781
Energy: 1.062565348669271
Energy: 1.3425142515909263
Energy: 1.0625653486702942
Energy: 1.3425142515909263
Energy: 1.062565348669271
Energy: 1.3425142515909263
Energy: 1.0866102675878915
Energy: 0.9539992074011712
Energy: 1.0866102675889149
Energy: 0.9539992074011712
Energy: 1.0866102675889149
Energy: 0.9539992074011712

minimum gb energy = 0.9137300543625901 eV
minimum distance =  2.34381639012052 Angstroms
sigma value = 9


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

Energy: 1.0429641937295524
Energy: 1.0798118953530027
Energy: 1.0429641937278815
Energy: 1.0798118953530027
Energy: 1.0429641937278815
Energy: 1.0798118953530027
Energy: 1.0690222856296867
Energy: 1.0535359929973127
Energy: 1.0690222856296867
Energy: 1.0535359929973127
Energy: 1.0690222856296867
Energy: 1.0535359929964774
Energy: 1.0989973295787696
Energy: 1.049492292459293
Energy: 1.1238813144359583
Energy: 1.049492292458458
Energy: 1.1238813144351232
Energy: 1.049492292458458
Energy: 1.0499051749183446
Energy: 1.1009627874742076
Energy: 1.0499051749191797
Energy: 1.1009627874742076
Energy: 1.0499051749183446
Energy: 1.1009627874742076
Energy: 1.0787450471065083
Energy: 1.0690508410170094
Energy: 1.0787450471065083
Energy: 1.0690508410178448
Energy: 1.0787450471073436
Energy: 1.0690508410170094
Energy: 1.0225794834487052
Energy: 1.0025090804172538
Energy: 1.0225794834478696
Energy: 1.0025090804180892
Energy: 1.0225794834478696
Energy: 1.0025090804172538
Energy: 0.9897387204960534
Energy: 1.0412715513854083
Energy: 0.9897387204960534
Energy: 1.0412715513854083
Energy: 0.9897387204960534
Energy: 1.0412715513854083
Energy: 1.0226175980531291
Energy: 1.0399424121475422
Energy: 1.0226175980522938
Energy: 1.0399424121475422
Energy: 1.0226175980522938
Energy: 1.0399424121475422
Energy: 1.1853542208329633
Energy: 1.067978458314575
Energy: 1.1853542208329633
Energy: 1.0679784583154104
Energy: 1.185354220832166
Energy: 1.067978458314575
Energy: 1.0263809172360268
Energy: 1.0270090932165719
Energy: 1.0263809172360268
Energy: 1.0270090932165719
Energy: 1.0263809172360268
Energy: 1.0270090932165719
Energy: 1.0037010902019896
Energy: 1.066463763883457
Energy: 1.0037010902036603
Energy: 1.0664637638826215
Energy: 1.003701090202825
Energy: 1.066463763883457
Energy: 1.0772400283210626
Energy: 1.0369362361357364
Energy: 1.077240028321898
Energy: 1.0369362361357364
Energy: 1.0772400283210626
Energy: 1.0369362361357364
Energy: 1.013755461206449
Energy: 1.2054940072772737
Energy: 1.013755461206449
Energy: 1.2054940072772737
Energy: 1.013755461206449
Energy: 1.2054940072772737
Energy: 1.0167113962793253
Energy: 1.0840780758454054
Energy: 1.0167113962801606
Energy: 1.0840780758462407
Energy: 1.0167113962793253
Energy: 1.0840780758462407
Energy: 1.182691681770874
Energy: 1.064676640150664
Energy: 1.182691681771709
Energy: 1.0646766401514993
Energy: 1.182691681771709
Energy: 1.064676640150664
Energy: 1.0283143875520318
Energy: 1.0537982965214678
Energy: 1.0283143875511964
Energy: 1.0537982965214678
Energy: 1.0283143875511964
Energy: 1.0537982965214678
Energy: 1.0840596443334483
Energy: 1.0758761899845402
Energy: 1.0840596443342836
Energy: 1.0758761899837048
Energy: 1.0840596443342836
Energy: 1.0758761899837048
Energy: 1.1511179755794863
Energy: 1.0628529211514768
Energy: 1.1511179755794863
Energy: 1.0628529211514768
Energy: 1.1511179755794863
Energy: 1.0628529211514768
Energy: 0.9904518865002727
Energy: 1.0837618925307926
Energy: 0.9904518865002727
Energy: 1.0837618925307926
Energy: 0.9904518865002727
Energy: 1.0837618925307926
Energy: 1.1328500192843396
Energy: 1.1010039231766184
Energy: 1.1328500192843396
Energy: 1.1010039231766184
Energy: 1.1328500192843396
Energy: 1.1010039231766184
Energy: 1.0740002511288402
Energy: 1.0356479791694464
Energy: 1.0740002511288402
Energy: 1.0356479791694464
Energy: 1.0740002511288402
Energy: 1.0356479791694464

minimum gb energy = 0.9897387204960534 eV
minimum distance =  2.33822801164325 Angstroms
sigma value = 27


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

Energy: 1.0008645337449735
Energy: 1.0348185493239674
Energy: 1.0008645337449735
Energy: 1.0348185493246715
Energy: 1.0008645337442692
Energy: 1.0348185493239674
Energy: 0.9791838370061615
Energy: 1.0190587118909902
Energy: 0.9791838370061615
Energy: 1.0190587118909902
Energy: 0.9791838370061615
Energy: 1.0190587118909902
Energy: 1.049773326038887
Energy: 0.9796064256788065
Energy: 1.0497733260409994
Energy: 0.9796064256781023
Energy: 1.0497733260395912
Energy: 0.9796064256781023
Energy: 0.9455504584115586
Energy: 0.9820477920460606
Energy: 0.9455504584122626
Energy: 0.982047792046765
Energy: 0.9455504584122626
Energy: 0.982047792046765
Energy: 0.9661638315606824
Energy: 0.9950879178813568
Energy: 0.9661638315599781
Energy: 0.9950879178806527
Energy: 0.9661638315606824
Energy: 0.9950879178806527
Energy: 0.9180685689788284
Energy: 0.9493249871116722
Energy: 0.9180685689795326
Energy: 0.9493249871116722
Energy: 0.9180685689788284
Energy: 0.9493249871116722
Energy: 0.9781756746365944
Energy: 1.001012413288565
Energy: 0.9781756746358902
Energy: 1.0010124132871565
Energy: 0.9781756746358902
Energy: 1.0010124132878608
Energy: 1.025714978172468
Energy: 1.0489435460518834
Energy: 1.025714978172468
Energy: 1.0489435460518834
Energy: 1.025714978172468
Energy: 1.0489435460525875
Energy: 0.9969427312377209
Energy: 0.9495324626055321
Energy: 0.9969427312377209
Energy: 0.9495324626055321
Energy: 0.9969427312377209
Energy: 0.9495324626055321
Energy: 0.9455597898623751
Energy: 0.983028047903817
Energy: 0.9455597898630792
Energy: 0.983028047903817
Energy: 0.9455597898630792
Energy: 0.983028047903817
Energy: 0.945452893158459
Energy: 1.026504108556971
Energy: 0.945452893158459
Energy: 1.026504108556971
Energy: 0.945452893158459
Energy: 1.026504108556971
Energy: 0.9990571004722787
Energy: 0.9782350593322034
Energy: 0.9990571004722787
Energy: 0.9782350593322034
Energy: 0.9990571004722787
Energy: 0.9782350593322034
Energy: 0.9965655842262348
Energy: 0.9930581721847682
Energy: 0.9965655842255307
Energy: 0.9930581721854724
Energy: 0.9965655842262348
Energy: 0.9930581721854724
Energy: 0.9457264976195696
Energy: 0.9976575437231969
Energy: 0.9457264976188655
Energy: 0.9976575437231969
Energy: 0.9457264976188655
Energy: 0.9976575437231969
Energy: 0.9181460303361713
Energy: 0.9489221839992371
Energy: 0.9181460303361713
Energy: 0.9489221839992371
Energy: 0.9181460303361713
Energy: 0.9489221839992371
Energy: 1.017956890623362
Energy: 0.973014658319394
Energy: 1.017956890623362
Energy: 0.97301465831869
Energy: 1.017956890623362
Energy: 0.973014658319394
Energy: 0.9766854525103156
Energy: 1.0287793908068688
Energy: 0.9766854525096116
Energy: 1.0287793908047564
Energy: 0.9766854525103156
Energy: 1.0287793908068688
Energy: 0.9907729109576408
Energy: 0.9796492746707182
Energy: 0.9907729109583447
Energy: 0.9796492746700141
Energy: 0.9907729109576408
Energy: 0.9796492746700141
Energy: 1.0225795379024654
Energy: 1.002975153874828
Energy: 1.0225795379017613
Energy: 1.002975153874828
Energy: 1.0225795379024654
Energy: 1.002975153874828
Energy: 1.0008645337435649
Energy: 1.0348185493246715
Energy: 1.0008645337435649
Energy: 1.0348185493246715
Energy: 1.0008645337435649
Energy: 1.0348185493246715
Energy: 0.9791838370075697
Energy: 1.0190587118895817
Energy: 0.9791838370075697
Energy: 1.0190587118895817
Energy: 0.9791838370075697
Energy: 1.0190587118902863
Energy: 1.0497733260417035
Energy: 0.9796064256773983
Energy: 1.049773326043112
Energy: 0.9796064256781023
Energy: 1.0497733260424076
Energy: 0.9796064256781023
Energy: 0.9455504584171917
Energy: 0.9820477920474688
Energy: 0.9455504584157833
Energy: 0.9820477920474688
Energy: 0.9455504584164874
Energy: 0.9820477920474688
Energy: 0.9661638315606824
Energy: 0.9950879178806527
Energy: 0.9661638315613864
Energy: 0.9950879178806527
Energy: 0.9661638315613864
Energy: 0.9950879178806527
Energy: 0.9180685689795326
Energy: 0.9493249871116722
Energy: 0.9180685689781244
Energy: 0.9493249871116722
Energy: 0.9180685689795326
Energy: 0.9493249871116722

minimum gb energy = 0.9180685689781244 eV
minimum distance =  2.36308498984113 Angstroms
sigma value = 19


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

Energy: 0.9522846222986318
Energy: 1.10834584441747
Energy: 0.9522846222986318
Energy: 1.108345844418078
Energy: 0.9522846222986318
Energy: 1.10834584441747
Energy: 1.029631210905471
Energy: 0.9688416517768964
Energy: 1.029631210905471
Energy: 0.9688416517768964
Energy: 1.029631210905471
Energy: 0.9688416517768964
Energy: 1.1764121127812275
Energy: 0.9271021579995581
Energy: 1.1186753833328715
Energy: 0.9271021579995581
Energy: 1.1186753833322636
Energy: 0.9271021579995581
Energy: 0.918598950903185
Energy: 1.011898301485867
Energy: 0.918598950903185
Energy: 1.011898301485867
Energy: 0.918598950903185
Energy: 1.011898301485867
Energy: 0.9784101763316293
Energy: 1.030419525131445
Energy: 0.9784101763316293
Energy: 1.030419525131445
Energy: 0.9784101763316293
Energy: 1.030419525131445
Energy: 1.0320761407053742
Energy: 0.9242798360500226
Energy: 1.0320761407053742
Energy: 0.9242798360494149
Energy: 1.0320761407053742
Energy: 0.9242798360500226
Energy: 0.9374414267395237
Energy: 1.1104910020660619
Energy: 0.9374414267395237
Energy: 1.1104910020660619
Energy: 0.9374414267401314
Energy: 1.1104910020660619
Energy: 0.9440930180847598
Energy: 1.1377209754252857
Energy: 0.9440930180847598
Energy: 1.1377209754258935
Energy: 0.9440930180847598
Energy: 1.1377209754252857
Energy: 1.0226153958952244
Energy: 0.9050749697405558
Energy: 1.0226153958952244
Energy: 0.9050749697405558
Energy: 1.0226153958952244
Energy: 0.9050749697405558
Energy: 1.003128550155489
Energy: 1.0133513651331145
Energy: 1.0031285501560967
Energy: 1.0133513651331145
Energy: 1.0031285501560967
Energy: 1.0133513651331145
Energy: 0.9062853595580218
Energy: 1.1402147392961983
Energy: 0.9062853595580218
Energy: 1.1402147392961983
Energy: 0.9062853595580218
Energy: 1.1402147392961983
Energy: 1.04775593332495
Energy: 0.9232716907206043
Energy: 1.0477559333243422
Energy: 0.9232716907212121
Energy: 1.0477559333243422
Energy: 0.9232716907206043
Energy: 1.001452361924651
Energy: 0.9750013373119091
Energy: 1.001452361924651
Energy: 0.9750013373119091
Energy: 1.0014523619240432
Energy: 0.9750013373119091
Energy: 0.9227088058379774
Energy: 1.0105917566482119
Energy: 0.9227088058379774
Energy: 1.0105917566482119
Energy: 0.9227088058379774
Energy: 1.0105917566482119
Energy: 1.0833902390480665
Energy: 0.9538610893131466
Energy: 1.0833902390480665
Energy: 0.9538610893131466
Energy: 1.0833902390480665
Energy: 0.9538610893131466
Energy: 1.1314858661785194
Energy: 0.9051595190986578
Energy: 1.1314858661785194
Energy: 0.9051595190986578
Energy: 1.1314858661785194
Energy: 0.9051595190986578
Energy: 0.929402056491924
Energy: 1.014260280119567
Energy: 0.9294020564913161
Energy: 1.014260280119567
Energy: 0.929402056491924
Energy: 1.014260280119567
Energy: 1.0146013626278536
Energy: 1.1149175791237027
Energy: 1.0146013626278536
Energy: 1.1149175791237027
Energy: 1.0146013626284613
Energy: 1.1149175791237027
Energy: 1.1460027832613031
Energy: 0.9228357229001427
Energy: 1.1460027832625186
Energy: 0.9228357229001427
Energy: 1.0649100661249253
Energy: 0.9228357229007503
Energy: 0.9313234441644709
Energy: 1.0291411701716875
Energy: 0.931323444163863
Energy: 1.0291411701716875
Energy: 0.931323444163863
Energy: 1.0291411701716875
Energy: 0.9016740422567725
Energy: 1.1557411846643317
Energy: 0.9016740422567725
Energy: 1.1557411846637515
Energy: 0.9016740422567725
Energy: 1.1557411846637515
Energy: 1.042464039035635
Energy: 0.9270079253666674
Energy: 1.042464039035027
Energy: 0.9270079253666674
Energy: 1.042464039035635
Energy: 0.9270079253666674
Energy: 1.044178984052978
Energy: 1.0783959605679807
Energy: 1.044178984052978
Energy: 1.0783959605679807
Energy: 1.044178984053586
Energy: 1.0783959605679807
Energy: 0.9444503667525643
Energy: 1.1253850082957602
Energy: 0.9444503667531722
Energy: 1.1253850082957602
Energy: 0.9444503667525643
Energy: 1.1253850082957602
Energy: 0.9661184923552094
Energy: 0.9270853379965501
Energy: 0.9661184923552094
Energy: 0.9270853379965501
Energy: 0.9661184923558175
Energy: 0.9270853379965501
Energy: 1.0634590108877198
Energy: 0.9194321812994241
Energy: 1.0634590108883275
Energy: 0.9194321812994241
Energy: 1.0634590108877198
Energy: 0.9194321813000319
Energy: 0.9029214075084779
Energy: 0.9796671853347072
Energy: 0.9029214075078702
Energy: 0.979667185335315
Energy: 0.9029214075078702
Energy: 0.9796671853347072
Energy: 1.0486236648723424
Energy: 0.9223453514780025
Energy: 1.0486236648729501
Energy: 0.9223453514780025
Energy: 1.0486236648729501
Energy: 0.9223453514780025
Energy: 1.006367087826883
Energy: 0.9224064614861468
Energy: 1.0063670878274904
Energy: 0.922406461485539
Energy: 1.0063670878274904
Energy: 0.9224064614861468

minimum gb energy = 0.9016740422567725 eV
minimum distance =  2.33357557535692 Angstroms
sigma value = 101


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

Energy: 0.8941014467640075
Energy: 1.03350100071648
Energy: 0.8941014467640075
Energy: 1.0335010007170142
Energy: 0.8941014467634734
Energy: 1.0335010007170142
Energy: 0.9554639148637187
Energy: 0.9073399710663698
Energy: 0.9554639148642531
Energy: 0.8786819563598306
Energy: 0.9554639148631844
Energy: 0.8786819563598306
Energy: 1.0146185634061262
Energy: 0.8812681191318164
Energy: 1.0146185634061262
Energy: 0.8812681191312821
Energy: 1.0146185634061262
Energy: 0.8812681191318164
Energy: 0.8568259476525585
Energy: 1.2626947672680362
Energy: 0.8568259476520244
Energy: 1.1168228709460748
Energy: 0.8568259476525585
Energy: 1.1168228709460748
Energy: 0.9314093355196305
Energy: 0.9798202996225595
Energy: 0.9314093355190963
Energy: 0.9798202996230938
Energy: 0.9314093355196305
Energy: 0.9798202996230938
Energy: 0.9892073536637986
Energy: 0.8683121761538544
Energy: 0.9892073536637986
Energy: 0.8683121761543887
Energy: 0.9892073536637986
Energy: 0.8683121761538544
Energy: 0.8785456581097336
Energy: 1.1476427644826446
Energy: 0.8785456581091993
Energy: 1.1476427644826446
Energy: 0.8785456581091993
Energy: 1.1476427644826446
Energy: 0.8681518283524002
Energy: 1.1410619635700574
Energy: 0.8681518283529344
Energy: 1.0634461800723856
Energy: 0.8681518283529344
Energy: 1.0634461800718513
Energy: 1.002088339400815
Energy: 0.869658233726445
Energy: 1.002088339400815
Energy: 0.8696582337259106
Energy: 1.0020883394002809
Energy: 0.869658233726445
Energy: 0.9320076871019646
Energy: 0.9964552541271648
Energy: 0.9320076871019646
Energy: 0.9964552541276992
Energy: 0.9320076871008961
Energy: 0.9964552541271648
Energy: 0.8555842991964411
Energy: 1.0524676493322942
Energy: 0.8555842991964411
Energy: 1.0524676493328282
Energy: 0.8555842991964411
Energy: 1.0524676493328282
Energy: 1.0405003498569152
Energy: 0.8784364424050801
Energy: 1.040500349856381
Energy: 0.8784364424050801
Energy: 1.040500349856381
Energy: 0.8784364424045457
Energy: 0.9870906952813352
Energy: 0.8815867432457026
Energy: 0.9870906952818694
Energy: 0.8815867432462369
Energy: 0.9870906952824037
Energy: 0.8815867432457026
Energy: 0.8941685315168131
Energy: 1.1344336882266413
Energy: 0.8941685315162786
Energy: 1.1344336882266413
Energy: 0.8941685315162786
Energy: 1.1449551276388863
Energy: 0.9961256418729393
Energy: 0.9690834540259152
Energy: 0.9961256418734736
Energy: 0.9690834540264495
Energy: 0.9961256418740079
Energy: 0.9690834540259152
Energy: 1.0134183616653394
Energy: 0.883603850009794
Energy: 1.0134183616653394
Energy: 0.883603850009794
Energy: 1.0134183616653394
Energy: 0.883603850009794
Energy: 0.8556435626391907
Energy: 1.2249514081354294
Energy: 0.855643562639725
Energy: 1.2249514081348951
Energy: 0.855643562639725
Energy: 1.224951408136498
Energy: 0.8558437677970742
Energy: 0.9796554315619026
Energy: 0.8558437677965642
Energy: 0.979655431562437
Energy: 0.8558437677965642
Energy: 0.979655431562437
Energy: 0.9890293027759361
Energy: 0.8696238516412024
Energy: 0.9890293027759361
Energy: 0.8696238516412024
Energy: 0.9890293027754018
Energy: 0.8696238516412024
Energy: 0.8793475963279975
Energy: 0.9801302256571875
Energy: 0.8793475963285318
Energy: 0.9801302256571875
Energy: 0.8793475963279975
Energy: 0.9801302256577218
Energy: 0.8702711960180533
Energy: 1.0930480324622895
Energy: 0.8702711960180533
Energy: 1.0930480324628238
Energy: 0.8702711960180533
Energy: 1.0930480324606868
Energy: 1.2089656793448478
Energy: 0.8685505586324378
Energy: 1.2089656793443377
Energy: 0.8685505586324378
Energy: 1.2089656793448478
Energy: 0.8685505586319034
Energy: 1.014069796406518
Energy: 0.8689001827762219
Energy: 1.014069796406518
Energy: 0.8689001827762219
Energy: 1.0140697964070522
Energy: 0.8689001827762219
Energy: 0.8568177977148937
Energy: 0.9828439255731447
Energy: 0.8568177977143596
Energy: 0.9828439255736791
Energy: 0.8568177977148937
Energy: 0.9828439255736791
Energy: 1.0399337845746015
Energy: 0.891229101657571
Energy: 1.0399337845751357
Energy: 0.8912291016570366
Energy: 1.0399337845746015
Energy: 0.891229101657571
Energy: 1.082194387027048
Energy: 0.8834232562333796
Energy: 1.0821943870275823
Energy: 0.8834232562328453
Energy: 1.0821943870275823
Energy: 0.8834232562333796
Energy: 0.8941533239323011
Energy: 1.180891584815739
Energy: 0.8941533239323011
Energy: 1.180891584815739
Energy: 0.8941533239323011
Energy: 1.180891584815739
Energy: 0.8944655845787867
Energy: 1.0241542286817316
Energy: 0.8944655845787867
Energy: 1.0241542286817316
Energy: 0.8944655845787867
Energy: 1.0241542286827758
Energy: 0.9829168391519025
Energy: 0.8812836258168042
Energy: 0.9829168391519025
Energy: 0.8812836258168042
Energy: 0.9829168391519025
Energy: 0.8812836258168042
Energy: 0.8562356859175658
Energy: 1.0823762504247476
Energy: 0.8562356859180998
Energy: 1.0823762504242134
Energy: 0.8562356859180998
Energy: 1.082376250423145
Energy: 0.8556509483961405
Energy: 0.9518490533167927
Energy: 0.8556509483961405
Energy: 0.9518490533167927
Energy: 0.8556509483966747
Energy: 0.951849053317327
Energy: 1.0925713629942826
Energy: 0.8684242595369757
Energy: 1.0925713629948168
Energy: 0.8684242595369757
Energy: 1.0925713629942826
Energy: 0.8684242595369757
Energy: 1.1439359813253283
Energy: 0.868882492175565
Energy: 1.1439359813258625
Energy: 0.8688824921750306
Energy: 1.1439359813253283
Energy: 0.868882492175565

minimum gb energy = 0.8555842991964411 eV
minimum distance =  2.34935851186577 Angstroms
sigma value = 33


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

Energy: 0.015501494382151655
Energy: 0.8064079075277717
Energy: 0.015501494382151655
Energy: 0.8064079075282155
Energy: 0.015501494382151655
Energy: 0.8064079075282155
Energy: 0.016168262519584
Energy: 0.25588739902251967
Energy: 0.016168262519584
Energy: 0.25588739902251967
Energy: 0.016168262519584
Energy: 0.25588739902251967
Energy: 0.8071478954826836
Energy: 0.25544639436001265
Energy: 0.8071443043027642
Energy: 0.2554463943595687
Energy: 0.8070192819536929
Energy: 0.2554463943595687
Energy: 0.016168262520471845
Energy: 0.25588739902210045
Energy: 0.016168262520471845
Energy: 0.25588739902251967
Energy: 0.016168262520471845
Energy: 0.25588739902251967

minimum gb energy = 0.015501494382151655 eV
minimum distance =  2.54253939048665 Angstroms
sigma value = 1