Model name: model_name=EAM_Dynamo_BonnyCastinTerentyev_2013_FeNiCr__MO_763197941039_000
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.56200759857893
cohesive_energy=4.399993240679222
mass=55.845
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: 0.01750984455751639
Energy: 0.8843674515138513
Energy: 0.01750984455751639
Energy: 0.884367451513564
Energy: 0.017509844557839403
Energy: 0.884367451511662
Energy: 0.8843674515044122
Energy: 0.48649872137732003
Energy: 0.884367451511662
Energy: 0.48649872137764305
Energy: 0.8843674515088267
Energy: 0.48649872137764305
Energy: 0.01750984455751639
Energy: 0.8843674515044122
Energy: 0.01750984455751639
Energy: 0.8843674515040891
Energy: 0.01750984455751639
Energy: 0.8843674515072476
Energy: 0.884367451511662
Energy: 0.486498721376997
Energy: 0.884367451511662
Energy: 0.4864987213763869
Energy: 0.8843674515069245
Energy: 0.486498721376997
Energy: 0.017509844557839403
Energy: 0.8843674515059555
Energy: 0.017509844557839403
Energy: 0.8843674515053455
Energy: 0.017509844557839403
Energy: 0.8843674515088267
Energy: 0.8843674515119849
Energy: 0.48649872137606387
Energy: 0.8843674515081806
Energy: 0.48649872137732003
Energy: 0.8843674515085036
Energy: 0.48649872137606387

minimum gb energy = 0.01750984455751639 eV
minimum distance =  2.49049248758021 Angstroms
sigma value = 1


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

Energy: 1.1812295477829682
Energy: 1.1721917926944352
Energy: 1.181229547784523
Energy: 1.1721917926944352
Energy: 1.1812295477837456
Energy: 1.1721917926936576
Energy: 1.2959085122800746
Energy: 0.999098465142918
Energy: 1.295908512279297
Energy: 0.999098465142918
Energy: 1.2959085122800746
Energy: 0.999098465142918
Energy: 1.1913212600337137
Energy: 1.2101786291117722
Energy: 1.191321260035269
Energy: 1.2101786291109946
Energy: 1.1913212600337137
Energy: 1.2101786291117722
Energy: 1.2722551135581097
Energy: 1.1060927313959188
Energy: 1.2722551135581097
Energy: 1.1060927313959188
Energy: 1.2722551135565547
Energy: 1.1060927313959188
Energy: 1.1394658735166245
Energy: 1.1735977042755577
Energy: 1.1394658735174021
Energy: 1.17359770427478
Energy: 1.1394658735166245
Energy: 1.17359770427478
Energy: 1.2040249564478869
Energy: 1.102336008523671
Energy: 1.2040249564478869
Energy: 1.1023360085244487
Energy: 1.2040249564478869
Energy: 1.102336008523671
Energy: 1.15963066768165
Energy: 1.2606207842857127
Energy: 1.15963066768165
Energy: 1.2606207842857127
Energy: 1.15963066768165
Energy: 1.2606207842857127
Energy: 1.120856397459156
Energy: 1.2025563360155664
Energy: 1.120856397459156
Energy: 1.202556336014789
Energy: 1.120856397459156
Energy: 1.202556336014789
Energy: 1.2356907635984633
Energy: 1.1750715150963902
Energy: 1.2356907635992407
Energy: 1.1750715150963902
Energy: 1.2356907635984633
Energy: 1.1750715150971678
Energy: 0.9905140825980315
Energy: 1.354282996578118
Energy: 0.9905140825980315
Energy: 1.354282996578118
Energy: 0.9905140825980315
Energy: 1.354282996578118
Energy: 1.4426049463023778
Energy: 1.0969103027521758
Energy: 1.4426049463023778
Energy: 1.0969103027521758
Energy: 1.4426049463023778
Energy: 1.0969103027521758
Energy: 0.953105613015986
Energy: 1.214463922708573
Energy: 0.9531056130167634
Energy: 1.214463922708573
Energy: 0.9531056130167634
Energy: 1.2144639227093506
Energy: 1.2828281942255868
Energy: 0.9700811176993763
Energy: 1.2828281942248092
Energy: 0.9700811176993763
Energy: 1.2828281942263644
Energy: 0.9700811176993763
Energy: 1.0907552428905516
Energy: 1.184735622152504
Energy: 1.0907552428905516
Energy: 1.1847356221517265
Energy: 1.090755242891329
Energy: 1.1847356221455063
Energy: 1.2568014013304782
Energy: 0.9953097185530145
Energy: 1.2568014013304782
Energy: 0.9953097185530145
Energy: 1.2568014013304782
Energy: 0.9953097185530145
Energy: 1.2574430085964663
Energy: 1.2016402707011662
Energy: 1.2574430085964663
Energy: 1.2016402707003886
Energy: 1.257443008594911
Energy: 1.2016402706996112
Energy: 1.230577408685117
Energy: 1.1470311127551258
Energy: 1.2305774086843393
Energy: 1.1470311127559034
Energy: 1.230577408685117
Energy: 1.1470311127559034
Energy: 1.2405802814034357
Energy: 1.138145746656705
Energy: 1.2405802814042133
Energy: 1.138145746656705
Energy: 1.2405802814042133
Energy: 1.138145746656705
Energy: 1.038230193132669
Energy: 1.1140274248933904
Energy: 1.038230193132669
Energy: 1.1140274248933904
Energy: 1.0382301931318914
Energy: 1.1140274248918354
Energy: 1.148461352521649
Energy: 1.073915730488813
Energy: 1.148461352521649
Energy: 1.073915730488813
Energy: 1.148461352521649
Energy: 1.0739157304880353
Energy: 1.0245914505208404
Energy: 1.3696497676936288
Energy: 1.0245914505200628
Energy: 1.3696497676936288
Energy: 1.0245914505216178
Energy: 1.3696497676936288
Energy: 1.2664510441487988
Energy: 1.1724755119400125
Energy: 1.2664510441480212
Energy: 1.1724755119400125
Energy: 1.2664510441487988
Energy: 1.172475511939235
Energy: 0.8871667600555729
Energy: 1.301090162418359
Energy: 0.8871667600555729
Energy: 1.301090162418359
Energy: 0.8871667600547954
Energy: 1.301090162418359

minimum gb energy = 0.8871667600547954 eV
minimum distance =  2.36235241457594 Angstroms
sigma value = 33


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

Energy: 1.2446752973565183
Energy: 1.2218907376781976
Energy: 1.2446752973565183
Energy: 1.2218907376781976
Energy: 1.2446752973565183
Energy: 1.2218907376781976
Energy: 1.2376462688199077
Energy: 1.1277095136757347
Energy: 1.23764626882035
Energy: 1.127709513676177
Energy: 1.2376462688207923
Energy: 1.127709513676177
Energy: 0.9933520868981355
Energy: 1.1911365258096969
Energy: 0.9933520868976932
Energy: 1.191136525810139
Energy: 0.9933520868972509
Energy: 1.1911365258096969
Energy: 1.1866630408861734
Energy: 1.2337377165165684
Energy: 1.186663040885731
Energy: 1.2337377165165684
Energy: 1.1866630408861734
Energy: 1.2337377165165684
Energy: 1.1539165500925208
Energy: 1.1180813696789338
Energy: 1.1539165500925208
Energy: 1.1180813696789338
Energy: 1.1539165500920785
Energy: 1.1180813696793763
Energy: 1.0096837862065513
Energy: 1.0493517382189905
Energy: 1.0096837862061092
Energy: 1.0493517382189905
Energy: 1.0096837862069934
Energy: 1.0493517382185484
Energy: 1.2374677437388932
Energy: 1.197718930594237
Energy: 1.2374677437388932
Energy: 1.197718930593795
Energy: 1.2374677437388932
Energy: 1.197718930593795
Energy: 0.9528412850771875
Energy: 1.2466762350648661
Energy: 0.952841285078072
Energy: 1.2466762350653084
Energy: 0.952841285076745
Energy: 1.2466762350653084
Energy: 1.0776221208607517
Energy: 0.9704955257224092
Energy: 1.0776221208607517
Energy: 0.9704955257224092
Energy: 1.0776221208616361
Energy: 0.9704955257232936
Energy: 0.9917733989317716
Energy: 1.2078450603674855
Energy: 0.9917733989313294
Energy: 1.2078450603670432
Energy: 0.991773398932214
Energy: 1.2078450603674855
Energy: 1.193327360363694
Energy: 1.0328048457252397
Energy: 1.1933273603645784
Energy: 1.0328048457252397
Energy: 1.193327360365463
Energy: 1.032804845725682
Energy: 1.0589698555401477
Energy: 1.0743508222333757
Energy: 1.0589698555397054
Energy: 1.0743508222329337
Energy: 1.0589698555401477
Energy: 1.0743508222329337
Energy: 1.2519589974470284
Energy: 0.9688358501802798
Energy: 1.2519589974470284
Energy: 0.9688358501793952
Energy: 1.2519589974465861
Energy: 0.9688358501798374
Energy: 1.183955511174776
Energy: 1.242837615573008
Energy: 1.1839555111743338
Energy: 1.2428376155725662
Energy: 1.1839555111734492
Energy: 1.242837615573008
Energy: 1.147979935111959
Energy: 1.119228540447928
Energy: 1.1479799351115165
Energy: 1.119228540447928
Energy: 1.147979935111959
Energy: 1.119228540447928
Energy: 1.0141462075143666
Energy: 1.1203419936966412
Energy: 1.0141462075152512
Energy: 1.1203419936966412
Energy: 1.0141462075152512
Energy: 1.1203419936966412
Energy: 1.2235058908002308
Energy: 1.2323881913295511
Energy: 1.223505890800673
Energy: 1.2323881913299932
Energy: 1.2235058908011154
Energy: 1.2323881913295511
Energy: 1.1462637287887825
Energy: 0.9849869658426044
Energy: 1.1462637287874557
Energy: 0.9849869658426044
Energy: 1.146263728787898
Energy: 0.9849869658421622
Energy: 1.093474162218742
Energy: 1.143633927959867
Energy: 1.0934741622191841
Energy: 1.1436339279603092
Energy: 1.093474162218742
Energy: 1.1436339279603092
Energy: 1.2647509595306616
Energy: 1.181327158153894
Energy: 1.264750959530219
Energy: 1.181327158153894
Energy: 1.2647509595310635
Energy: 1.181327158153894
Energy: 0.9524404636871279
Energy: 1.290088089277895
Energy: 0.9524404636875703
Energy: 1.290088089277895
Energy: 0.9524404636875703
Energy: 1.2900880892774529
Energy: 1.1439399687453171
Energy: 0.9905789166467692
Energy: 1.143939968744875
Energy: 0.9905789166472115
Energy: 1.1439399687457594
Energy: 0.9905789166472115
Energy: 0.9704707569887888
Energy: 1.2182306317493936
Energy: 0.970470756989231
Energy: 1.2182306317502785
Energy: 0.9704707569887888
Energy: 1.2182306317502785
Energy: 1.1853445061288057
Energy: 1.0564034244971485
Energy: 1.1853445061292482
Energy: 1.0564034244971485
Energy: 1.1853445061279213
Energy: 1.0564034244971485
Energy: 0.9936202094508975
Energy: 1.078201880999569
Energy: 0.9936202094508975
Energy: 1.0782018809991267
Energy: 0.9936202094508975
Energy: 1.0782018809991267
Energy: 1.224071541971177
Energy: 1.1628842490196831
Energy: 1.2240715419702926
Energy: 1.1628842490196831
Energy: 1.224071541971177
Energy: 1.1628842490187987
Energy: 1.240777614370275
Energy: 1.1746775309791562
Energy: 1.24077761436939
Energy: 1.1746775309795985
Energy: 1.24077761436939
Energy: 1.1746775309795985
Energy: 0.9725960360872387
Energy: 1.0681664301838838
Energy: 0.9725960360872387
Energy: 1.068166430180788
Energy: 0.9725960360872387
Energy: 1.068166430179019
Energy: 1.207046227231614
Energy: 1.013120738066849
Energy: 1.2070462272320563
Energy: 1.013120738066849
Energy: 1.2070462272320563
Energy: 1.0131207380664067
Energy: 0.958167174771358
Energy: 1.1867826203194625
Energy: 0.9581671747709157
Energy: 1.1867826203199048
Energy: 0.958167174771358
Energy: 1.1867826203199048
Energy: 1.1734890002783913
Energy: 0.9703064149201404
Energy: 1.173489000279276
Energy: 0.9703064149205826
Energy: 1.1734890002779492
Energy: 0.9703064149210249
Energy: 0.9675390283348679
Energy: 1.1927289468537212
Energy: 0.96753902833531
Energy: 1.192728946853279
Energy: 0.96753902833531
Energy: 1.1927289468537212
Energy: 1.2737320661294989
Energy: 1.1815492122556945
Energy: 1.2737320661299414
Energy: 1.1815492122556945
Energy: 1.2737320661299414
Energy: 1.1815492122556945
Energy: 1.1202271297243245
Energy: 1.1523464949734286
Energy: 1.1202271297238822
Energy: 1.1523464949734286
Energy: 1.1202271297238822
Energy: 1.1523464949729862
Energy: 1.126504005096676
Energy: 0.9980129816055509
Energy: 1.126504005095349
Energy: 0.9980129816046664
Energy: 1.1265040050957913
Energy: 0.9980129816051089
Energy: 1.2330096662684427
Energy: 1.2347706510220335
Energy: 1.2330096662693268
Energy: 1.2347706510224759
Energy: 1.2330096662688848
Energy: 1.2347706510220335
Energy: 0.9866173630725683
Energy: 1.14157042162084
Energy: 0.9866173630734527
Energy: 1.14157042162084
Energy: 0.9866173630721261
Energy: 1.14157042162084
Energy: 1.143584816925841
Energy: 1.0086597453649455
Energy: 1.1435848169253986
Energy: 1.0086597453645034
Energy: 1.143584816925841
Energy: 1.0086597453649455
Energy: 1.1838549894937453
Energy: 1.2370573697172005
Energy: 1.1838549894941877
Energy: 1.2370573697167582
Energy: 1.183854989493303
Energy: 1.2370573697172005
Energy: 1.2898690587765143
Energy: 0.9556677537936891
Energy: 1.2898690587765143
Energy: 0.9556677537932469
Energy: 1.2898690587769566
Energy: 0.9556677537941314
Energy: 1.0592487738213916
Energy: 1.08794947592365
Energy: 1.059248773821834
Energy: 1.0879494759240924
Energy: 1.0592487738209493
Energy: 1.0879494759240924

minimum gb energy = 0.9524404636871279 eV
minimum distance =  2.37838814137219 Angstroms
sigma value = 51


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

Energy: 1.0927540861017542
Energy: 1.0751488950395427
Energy: 1.0927540861007297
Energy: 1.0751488950395427
Energy: 1.0927540861007297
Energy: 1.0751488950395427
Energy: 1.1931426514885022
Energy: 1.0743049576483186
Energy: 1.1931426514885022
Energy: 1.074304957647294
Energy: 1.1931426514885022
Energy: 1.074304957647294
Energy: 1.088935853439743
Energy: 1.1751849430020207
Energy: 1.088935853439743
Energy: 1.1751849430009962
Energy: 1.088935853439743
Energy: 1.1751849430020207
Energy: 1.1068338822804946
Energy: 0.9982219630056578
Energy: 1.1068338822804946
Energy: 0.9982219630056578
Energy: 1.1068338822804946
Energy: 0.9982219630066825
Energy: 1.1461964645550522
Energy: 1.0609722749091282
Energy: 1.1461964645550522
Energy: 1.060972274907079
Energy: 1.1461964645550522
Energy: 1.0609722749091282
Energy: 1.1507680368508082
Energy: 1.06485445564192
Energy: 1.1507680368497835
Energy: 1.0648544556408952
Energy: 1.1507680368508082
Energy: 1.0648544556408952
Energy: 1.122535639514995
Energy: 1.1192382569564248
Energy: 1.1225356395170445
Energy: 1.1192382569564248
Energy: 1.1225356395108963
Energy: 1.1192382569574493
Energy: 1.023246723852473
Energy: 1.1288386614163344
Energy: 1.023246723852473
Energy: 1.1288386614163344
Energy: 1.023246723852473
Energy: 1.1288386614163344
Energy: 1.1085464495339692
Energy: 1.0678556715044576
Energy: 1.1085464495329445
Energy: 1.0678556715044576
Energy: 1.1085464495339692
Energy: 1.0678556715044576
Energy: 1.0517823196410983
Energy: 1.2197508009884017
Energy: 1.0517823196410983
Energy: 1.2197508009884017
Energy: 1.0517823196410983
Energy: 1.2197508009884017
Energy: 1.2501496910634546
Energy: 0.9611759548495676
Energy: 1.2501496910634546
Energy: 0.9611759548495676
Energy: 1.2501496910634546
Energy: 0.9611759548495676
Energy: 1.1020924761354594
Energy: 1.1451641709819333
Energy: 1.102092476136484
Energy: 1.1451641709819333
Energy: 1.1020924761354594
Energy: 1.1451641709819333
Energy: 1.183148485084136
Energy: 1.102400846022245
Energy: 1.183148485084136
Energy: 1.10240084602327
Energy: 1.1831484850851608
Energy: 1.102400846022245
Energy: 1.0906506149086583
Energy: 1.0354766199128451
Energy: 1.0906506149076336
Energy: 1.0354766199128451
Energy: 1.0906506149076336
Energy: 1.0354766199138699
Energy: 1.1604992006738604
Energy: 1.1158909598051392
Energy: 1.1604992006728356
Energy: 1.1158909598041145
Energy: 1.1604992006728356
Energy: 1.1158909598041145
Energy: 1.14494786049763
Energy: 1.0647951397708473
Energy: 1.1449478604986547
Energy: 1.0647951397708473
Energy: 1.1449478604996792
Energy: 1.0647951397708473
Energy: 1.144420706501956
Energy: 1.142050011194566
Energy: 1.144420706501956
Energy: 1.142050011194566
Energy: 1.144420706501956
Energy: 1.142050011194566
Energy: 1.140797211174615
Energy: 1.119530973058144
Energy: 1.140797211174615
Energy: 1.119530973058144
Energy: 1.140797211174615
Energy: 1.119530973058144

minimum gb energy = 0.9611759548495676 eV
minimum distance =  2.32791250575849 Angstroms
sigma value = 19


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

Energy: 0.9665685579312877
Energy: 0.9103671955399566
Energy: 0.9665685579318954
Energy: 0.9103671955399566
Energy: 0.9665685579318954
Energy: 0.9103671955399566
Energy: 1.0310980018804332
Energy: 1.0598106104470515
Energy: 1.0310980018786096
Energy: 1.0598106104464435
Energy: 1.0310980018798255
Energy: 1.059810610448875
Energy: 0.9855607913550676
Energy: 0.9936094135780961
Energy: 0.9855607913556755
Energy: 0.9936094135774881
Energy: 0.9855607913544598
Energy: 0.9936094135787038
Energy: 1.069719494567968
Energy: 0.9608949370244525
Energy: 1.0697194945661446
Energy: 0.9608949370244525
Energy: 1.06971949456736
Energy: 0.9608949370244525
Energy: 0.9191314296489378
Energy: 0.8536788525819305
Energy: 0.9191314296489378
Energy: 0.853678852583754
Energy: 0.9191314296489378
Energy: 0.8536788525813229
Energy: 0.9181725822851307
Energy: 0.8552287238965556
Energy: 0.9181725822857385
Energy: 0.8552287238971633
Energy: 0.9181725822857385
Energy: 0.8552287238965556
Energy: 1.0690211698734187
Energy: 0.960864933801825
Energy: 1.069021169875242
Energy: 0.960864933801825
Energy: 1.0690211698740264
Energy: 0.960864933801825
Energy: 0.9851182423520489
Energy: 1.0559103554692664
Energy: 0.9851182423526565
Energy: 1.0559103554692664
Energy: 0.9851182423526565
Energy: 1.055910355467443
Energy: 1.0312556167000024
Energy: 1.0599967160603496
Energy: 1.031255616701826
Energy: 1.0599967160609576
Energy: 1.0312556167012181
Energy: 1.0599967160603496
Energy: 0.9665685579312877
Energy: 0.910367195539349
Energy: 0.9665685579306799
Energy: 0.9103671955399566
Energy: 0.9665685579312877
Energy: 0.910367195539349
Energy: 1.0310980018786096
Energy: 1.0598106104494829
Energy: 1.0310980018804332
Energy: 1.059810610448267
Energy: 1.0310980018786096
Energy: 1.0598106104476592
Energy: 0.9855607913544598
Energy: 0.9936094135768804
Energy: 0.985560791353852
Energy: 0.9936094135768804
Energy: 0.985560791353852
Energy: 0.9936094135774881
Energy: 1.06971949456736
Energy: 0.9608949370250601
Energy: 1.06971949456736
Energy: 0.9608949370250601
Energy: 1.06971949456736
Energy: 0.9608949370238445
Energy: 0.9191314296483301
Energy: 0.8536788525801071
Energy: 0.9191314296477222
Energy: 0.8536788525819305
Energy: 0.9191314296483301
Energy: 0.8536788525813229
Energy: 0.9181725822851307
Energy: 0.8552287238965556
Energy: 0.9181725822857385
Energy: 0.8552287238965556
Energy: 0.9181725822851307
Energy: 0.8552287238965556
Energy: 1.069021169875242
Energy: 0.960864933801825
Energy: 1.069021169875242
Energy: 0.960864933801825
Energy: 1.0690211698758498
Energy: 0.9608649338012172
Energy: 0.9851182423532645
Energy: 1.055910355470482
Energy: 0.9851182423526565
Energy: 1.055910355469874
Energy: 0.9851182423526565
Energy: 1.055910355469874
Energy: 1.0312556167012181
Energy: 1.0599967160609576
Energy: 1.0312556167006102
Energy: 1.0599967160609576
Energy: 1.0312556167012181
Energy: 1.0599967160609576
Energy: 0.9665685579318954
Energy: 0.9103671955399566
Energy: 0.9665685579312877
Energy: 0.9103671955399566
Energy: 0.9665685579306799
Energy: 0.9103671955411723
Energy: 1.0310980018804332
Energy: 1.0598106104434044
Energy: 1.0310980018798255
Energy: 1.0598106104464435
Energy: 1.031098001878002
Energy: 1.0598106104446203
Energy: 0.9855607913550676
Energy: 0.9936094135787038
Energy: 0.9855607913550676
Energy: 0.9936094135768804
Energy: 0.9855607913544598
Energy: 0.9936094135768804
Energy: 1.069719494567968
Energy: 0.9608949370250601
Energy: 1.0697194945667523
Energy: 0.9608949370250601
Energy: 1.0697194945661446
Energy: 0.9608949370244525
Energy: 0.9191314296483301
Energy: 0.8536788525855775
Energy: 0.9191314296483301
Energy: 0.8536788525855775
Energy: 0.9191314296477222
Energy: 0.8536788525831464
Energy: 0.9181725822851307
Energy: 0.8552287238959477
Energy: 0.9181725822863462
Energy: 0.8552287238965556
Energy: 0.9181725822851307
Energy: 0.8552287238953399
Energy: 1.0690211698740264
Energy: 0.960864933801825
Energy: 1.0690211698740264
Energy: 0.960864933801825
Energy: 1.0690211698722032
Energy: 0.960864933801825
Energy: 0.9851182423532645
Energy: 1.0559103554680507
Energy: 0.9851182423526565
Energy: 1.0559103554692664
Energy: 0.9851182423526565
Energy: 1.0559103554686586
Energy: 1.031255616701826
Energy: 1.0599967160609576
Energy: 1.0312556167012181
Energy: 1.0599967160609576
Energy: 1.031255616701826
Energy: 1.0599967160609576
Energy: 0.9665685579306799
Energy: 0.9103671955399566
Energy: 0.9665685579306799
Energy: 0.910367195539349
Energy: 0.9665685579312877
Energy: 0.910367195539349
Energy: 1.0310980018816487
Energy: 1.0598106104464435
Energy: 1.031098001881041
Energy: 1.0598106104464435
Energy: 1.0310980018804332
Energy: 1.0598106104470515
Energy: 0.9855607913556755
Energy: 0.9936094135762725
Energy: 0.985560791353852
Energy: 0.9936094135762725
Energy: 0.9855607913544598
Energy: 0.9936094135756648

minimum gb energy = 0.8536788525801071 eV
minimum distance =  2.35216586095526 Angstroms
sigma value = 27


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

Energy: 0.8351633935361689
Energy: 0.8064039980463662
Energy: 0.8351633935361689
Energy: 0.8064039980463662
Energy: 0.8351633935376576
Energy: 0.8064039980463662
Energy: 0.9513238587342043
Energy: 0.9074774234847839
Energy: 0.9513238587981906
Energy: 0.9074774234847839
Energy: 0.9513238587461151
Energy: 0.9074774234847839
Energy: 0.8560528953216835
Energy: 0.8449003563631182
Energy: 0.8560528953216835
Energy: 0.8449003563735062
Energy: 0.8560528953216835
Energy: 0.8449003563898835
Energy: 1.1215481373590026
Energy: 0.8353255232190638
Energy: 1.1215481373575138
Energy: 0.8353255232190638
Energy: 1.1215481373575138
Energy: 0.8353255232190638
Energy: 1.120604524245981
Energy: 0.8054199055943853
Energy: 1.120604524245981
Energy: 0.8054199055943853
Energy: 1.1206045242444922
Energy: 0.8054199055943853
Energy: 1.1206306247584765
Energy: 0.9379669949082615
Energy: 1.1206306247584765
Energy: 0.9379669949082615
Energy: 1.1206306247599653
Energy: 0.9379669949082615
Energy: 0.8578027619472449
Energy: 0.8759172426328
Energy: 0.8578027619472449
Energy: 0.8759172426328
Energy: 0.8578027619472449
Energy: 0.8759172426328
Energy: 0.8316522662351263
Energy: 0.8100311851572725
Energy: 0.8316522662351263
Energy: 0.8100311851572725
Energy: 0.8316522662336374
Energy: 0.8100311851572725
Energy: 1.0548566265118269
Energy: 0.9047294313680238
Energy: 1.054856626510338
Energy: 0.9047294313680238
Energy: 1.0548566265118269
Energy: 0.9047294313680238
Energy: 1.2236046923450603
Energy: 0.9068319944522779
Energy: 1.2236046923435715
Energy: 0.9068319944537667
Energy: 1.2236046923435715
Energy: 0.9068319944537667
Energy: 0.8634014478376911
Energy: 0.8587889004816033
Energy: 0.8634014478376911
Energy: 0.8587889004830921
Energy: 0.8634014478376911
Energy: 0.8587889004816033
Energy: 1.19889800262014
Energy: 0.9543672901487822
Energy: 1.19889800262014
Energy: 0.9543672901547375
Energy: 1.19889800262014
Energy: 0.9543672901487822

minimum gb energy = 0.8054199055943853 eV
minimum distance =  2.35009887960512 Angstroms
sigma value = 9


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

Energy: 0.7961985345381597
Energy: 1.0564418014667596
Energy: 0.7961985345377414
Energy: 1.0564418014663413
Energy: 0.796198534537323
Energy: 1.0564418014671781
Energy: 1.1728195905562375
Energy: 0.7270640864184985
Energy: 1.1728195905574923
Energy: 0.7270640864193351
Energy: 1.1728195905562375
Energy: 0.7270640864193351
Energy: 0.8257750367180271
Energy: 1.0850688215973001
Energy: 0.8257750367171904
Energy: 1.0850688215985551
Energy: 0.8257750367184455
Energy: 1.0850688215956268
Energy: 0.7017052995101495
Energy: 0.6896065126663745
Energy: 0.7017052995093129
Energy: 0.6896065126663745
Energy: 0.7017052995101495
Energy: 0.6896065126659562
Energy: 0.892163715343481
Energy: 0.9997001340732868
Energy: 0.8921637153438995
Energy: 0.9997001340611554
Energy: 0.8921637153430628
Energy: 0.9997001340515339
Energy: 0.9595805659332529
Energy: 0.8611996078908961
Energy: 0.9595805659324163
Energy: 0.8611996078904779
Energy: 0.9595805659324163
Energy: 0.861199607887968
Energy: 0.7332278538781508
Energy: 0.7978063942307957
Energy: 0.7332278538794058
Energy: 0.797806394229959
Energy: 0.7332278538777325
Energy: 0.7978063942316322
Energy: 0.699392609698257
Energy: 0.9130307077352735
Energy: 0.6993926096978387
Energy: 0.9130307077352735
Energy: 0.6993926096970021
Energy: 0.9130307077352735
Energy: 0.927936824011009
Energy: 1.000320156898947
Energy: 0.9279368240114274
Energy: 1.0003201568993654
Energy: 0.9279368240101725
Energy: 1.0003201568993654
Energy: 1.0465629216304961
Energy: 0.9858831862794092
Energy: 1.0465629216304961
Energy: 0.9858831862768993
Energy: 1.0465629216292411
Energy: 0.9858831862848475
Energy: 0.6934377720205782
Energy: 0.6854630542370171
Energy: 0.6934377720209965
Energy: 0.6854630542370171
Energy: 0.6934377720209965
Energy: 0.6854630542370171
Energy: 1.0117419625721236
Energy: 0.7544386911950036
Energy: 1.0117419625717052
Energy: 0.7544386911954218
Energy: 1.0117419625729602
Energy: 0.7544386911954218
Energy: 0.8426777530934819
Energy: 0.8740554593047817
Energy: 0.8426777530863704
Energy: 0.8740554593022717
Energy: 0.8426777530876253
Energy: 0.8740554593022717
Energy: 0.7777228857625584
Energy: 0.8373242086429311
Energy: 0.7777228857604668
Energy: 0.8373242086420943
Energy: 0.7777228857613034
Energy: 0.8373242086370746
Energy: 0.6953955789607189
Energy: 0.9191222706531968
Energy: 0.6953955789611372
Energy: 0.91912227065487
Energy: 0.6953955789598824
Energy: 0.9191222706565435
Energy: 0.7320983881966266
Energy: 0.799536651863855
Energy: 0.7320983881966266
Energy: 0.7995366518642735
Energy: 0.7320983881957899
Energy: 0.7995366518646917
Energy: 1.2028320291823917
Energy: 0.8593216073286305
Energy: 1.20283202918281
Energy: 0.8593216073294672
Energy: 1.2028320291823917
Energy: 0.8593216073298855
Energy: 0.7052242244754916
Energy: 0.7482603382166015
Energy: 0.7052242244767466
Energy: 0.7482603382086532
Energy: 0.7052242244738183
Energy: 0.7482603382103267
Energy: 0.7021142112345456
Energy: 1.2149607090527896
Energy: 0.7021142112328724
Energy: 1.2149607090523715
Energy: 0.7021142112341273
Energy: 1.2149607090527896
Energy: 0.9675395577996615
Energy: 0.9737797471146015
Energy: 0.9675395578000797
Energy: 0.9737797471150198
Energy: 0.9675395578000797
Energy: 0.9737797471146015
Energy: 0.7021814384906159
Energy: 1.2147286408110316
Energy: 0.7021814384914146
Energy: 1.2147286408114502
Energy: 0.7021814384909962
Energy: 1.2147286408114502
Energy: 0.7050034750540275
Energy: 0.9515239157499901
Energy: 0.7050034750536092
Energy: 0.9515239157094122
Energy: 0.7050034750548642
Energy: 0.9515239157181972
Energy: 1.2032141107430325
Energy: 0.8599395907015518
Energy: 1.203214110745124
Energy: 0.8599395907011335
Energy: 1.2032141107413592
Energy: 0.8599395907011335
Energy: 0.7321839871138279
Energy: 0.7551507124782958
Energy: 0.7321839871171746
Energy: 0.7551507124711843
Energy: 0.7321839871142463
Energy: 0.7551507124770408
Energy: 0.6953817017964102
Energy: 0.9194698151363384
Energy: 0.6953817017959919
Energy: 0.9194698151380118
Energy: 0.6953817017959919
Energy: 0.9194698151371751
Energy: 0.776734653513251
Energy: 0.837083018070725
Energy: 0.7767346535140877
Energy: 0.8370830180749084
Energy: 0.7767346535124143
Energy: 0.8370830180728167
Energy: 0.8446552659595292
Energy: 0.8739875055426327
Energy: 0.8446552659574376
Energy: 0.873987505546816
Energy: 0.8446552659578558
Energy: 0.8739875055430512
Energy: 1.0124483030858724
Energy: 0.6960299206972378
Energy: 1.012448303085036
Energy: 0.6960299206984927
Energy: 1.012448303085036
Energy: 0.6960299206997478
Energy: 0.6934634648579043
Energy: 0.6855716902746997
Energy: 0.693463464857486
Energy: 0.6855716902746997
Energy: 0.6934634648579043
Energy: 0.685571690275118
Energy: 1.0474051930251707
Energy: 1.0541769562343974
Energy: 1.0474051930239157
Energy: 1.0541769562339793
Energy: 1.047405193024334
Energy: 1.0541769562343974
Energy: 0.9279855134913492
Energy: 1.0000856838817704
Energy: 0.9279855134909308
Energy: 1.000085683881352
Energy: 0.927985513501389
Energy: 1.0000856838817704
Energy: 0.6992734985500723
Energy: 0.9131308490336847
Energy: 0.6992734985496539
Energy: 0.9131308490341031
Energy: 0.6992734985500723
Energy: 0.9131308490315931
Energy: 0.7330014612039502
Energy: 0.7978957651992616
Energy: 0.7330014612031134
Energy: 0.7978957652230685
Energy: 0.733001461202695
Energy: 0.7978957652213949
Energy: 0.9708860894924627
Energy: 0.7017845502355943
Energy: 0.9708860894928809
Energy: 0.7017845502389408
Energy: 0.9708860894924627
Energy: 0.7017845502460524
Energy: 0.8912756856040294
Energy: 0.9992995569822378
Energy: 0.8912756856048659
Energy: 0.9992995569876761
Energy: 0.891275685609886
Energy: 0.9992995569889312
Energy: 0.7030767413190266
Energy: 0.6892637467843677
Energy: 0.7030767413186083
Energy: 0.6892637467843677
Energy: 0.7030767413181901
Energy: 0.6892637467852043
Energy: 0.8256881799628492
Energy: 1.0850487786778944
Energy: 0.8256881799632676
Energy: 1.0850487786774758
Energy: 0.8256881799628492
Energy: 1.0850487786778944
Energy: 1.172794663562589
Energy: 0.860171376356007
Energy: 1.1727946635621707
Energy: 0.8601713763551706
Energy: 1.1727946635617523
Energy: 0.860171376356007
Energy: 0.7961985345364864
Energy: 1.0564418014663413
Energy: 0.7961985345369047
Energy: 1.0564418014659231
Energy: 0.796198534537323
Energy: 1.0564418014663413
Energy: 1.1728195905558192
Energy: 0.7270640864210084
Energy: 1.1728195905558192
Energy: 0.7270640864235185
Energy: 1.1728195905554006
Energy: 0.7270640864231002
Energy: 0.8257750367180271
Energy: 1.0850688215973001
Energy: 0.8257750367167722
Energy: 1.0850688215964635
Energy: 0.8257750367176088
Energy: 1.0850688215973001
Energy: 0.7017052995101495
Energy: 0.6896065126688845
Energy: 0.7017052995130779
Energy: 0.6896065126688845
Energy: 0.7017052995109863
Energy: 0.6896065126688845
Energy: 0.8921637153422262
Energy: 0.9997001340645021
Energy: 0.8921637153430628
Energy: 0.9997001340527888
Energy: 0.8921637153426446
Energy: 0.9997001340686853

minimum gb energy = 0.6854630542370171 eV
minimum distance =  2.35706664070761 Angstroms
sigma value = 57


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

Energy: 0.3618495044796077
Energy: 0.3695460319144005
Energy: 0.36184950448055997
Energy: 0.3695460319134482
Energy: 0.36184950447865544
Energy: 0.3695460319144005
Energy: 0.29362496622035206
Energy: 0.3618183163693553
Energy: 0.2936249662193998
Energy: 0.36181831638363926
Energy: 0.2936249662193998
Energy: 0.3618183163845916
Energy: 0.32973077427695485
Energy: 0.36013195229742073
Energy: 0.3297307742788594
Energy: 0.36013195229742073
Energy: 0.3297307742807639
Energy: 0.3601319522945639
Energy: 0.37272109863346264
Energy: 0.3667243869115331
Energy: 0.37272109863155817
Energy: 0.3667243869124854
Energy: 0.37272109863155817
Energy: 0.3667243869124854
Energy: 0.2942235100348388
Energy: 0.29135166453688766
Energy: 0.2942235100300774
Energy: 0.29135166453688766
Energy: 0.2942235100376956
Energy: 0.29135166453688766
Energy: 0.3613010653105919
Energy: 0.3322651852991995
Energy: 0.36130106530678285
Energy: 0.332265185297295
Energy: 0.3613010653105919
Energy: 0.3322651852991995
Energy: 0.35979835500458446
Energy: 0.3322128609026995
Energy: 0.35979835500458446
Energy: 0.3322128609026995
Energy: 0.35979835501601165
Energy: 0.33221286090174723
Energy: 0.29450967857959076
Energy: 0.29554550106508126
Energy: 0.29450967857863847
Energy: 0.29554550106508126
Energy: 0.294509678580543
Energy: 0.29554550106412897
Energy: 0.3728790987719324
Energy: 0.3662640907414184
Energy: 0.3728790987709802
Energy: 0.3662640907404662
Energy: 0.3728790987728847
Energy: 0.3662640907414184
Energy: 0.33001275371523436
Energy: 0.3599921818462499
Energy: 0.3300127537180912
Energy: 0.3599921818491067
Energy: 0.33001275371618666
Energy: 0.3599921818433931
Energy: 0.2946557993670333
Energy: 0.36279943022990513
Energy: 0.2946557993670333
Energy: 0.3627994302356187
Energy: 0.2946557993670333
Energy: 0.3627994302337142
Energy: 0.36184950447865544
Energy: 0.3695460319134482
Energy: 0.36184950447294184
Energy: 0.3695460319153528
Energy: 0.3618495044738941
Energy: 0.3695460319134482
Energy: 0.29362496622035206
Energy: 0.36181831634650097
Energy: 0.29362496622035206
Energy: 0.36181831634650097
Energy: 0.2936249662193998
Energy: 0.36181831633888284
Energy: 0.32973077427695485
Energy: 0.36013195229742073
Energy: 0.329730774285482
Energy: 0.3601319523012298
Energy: 0.32973077428738645
Energy: 0.3601319523002775
Energy: 0.3727210986325104
Energy: 0.3667243869124854
Energy: 0.37272109863155817
Energy: 0.36672438691343767
Energy: 0.3727210986325104
Energy: 0.3667243869124854
Energy: 0.29422351003579106
Energy: 0.2913516645378399
Energy: 0.2942235100348388
Energy: 0.2913516645378399
Energy: 0.29422351003388647
Energy: 0.29135166453688766
Energy: 0.36130106531344874
Energy: 0.3322651852982472
Energy: 0.3613010653086874
Energy: 0.33226518530015176
Energy: 0.3613010653124965
Energy: 0.3322651852944382
Energy: 0.3597983550017277
Energy: 0.33221286090174723
Energy: 0.35979835501601165
Energy: 0.33221286089984275
Energy: 0.3597983550036322
Energy: 0.33221286089889046
Energy: 0.29450967857959076
Energy: 0.29554550106508126
Energy: 0.29450967857959076
Energy: 0.2955455010660335
Energy: 0.29450967857863847
Energy: 0.2955455010660335

minimum gb energy = 0.29135166453688766 eV
minimum distance =  2.41870087041427 Angstroms
sigma value = 11


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

Energy: 0.6304712564616659
Energy: 0.7531835058031572
Energy: 0.6304712564595732
Energy: 0.7531835058087376
Energy: 0.6304712564637586
Energy: 0.7531835057453237
Energy: 0.8221211684690117
Energy: 0.8955797601628698
Energy: 0.8221211684683775
Energy: 0.8955797601628698
Energy: 0.8221211684697092
Energy: 0.8955797601628698
Energy: 0.9549816180248752
Energy: 1.109044256287262
Energy: 0.9549816180241778
Energy: 1.1090442562879597
Energy: 0.9549816180241778
Energy: 1.109044256287262
Energy: 0.943018842659261
Energy: 0.6471654661152444
Energy: 0.943018842659261
Energy: 0.647165466114547
Energy: 0.9430188426585635
Energy: 0.647165466114547
Energy: 0.9221958114021623
Energy: 0.6541599366130018
Energy: 0.92219581140286
Energy: 0.6541599366130018
Energy: 0.9221958114014649
Energy: 0.6541599366123042
Energy: 0.837728895761601
Energy: 0.9498076828010992
Energy: 0.8377288957622986
Energy: 0.9498076828010992
Energy: 0.8377288957629961
Energy: 0.9498076828010992
Energy: 0.5794673636287897
Energy: 1.0223349952979466
Energy: 0.5794673636315799
Energy: 1.022334995297249
Energy: 0.5794673636315799
Energy: 1.0223349952979466
Energy: 1.004621273616431
Energy: 0.6071947722984943
Energy: 1.0046212736171285
Energy: 0.6071947722984943
Energy: 1.004621273616431
Energy: 0.6071947722991919
Energy: 1.0026047145211072
Energy: 0.6484161040372788
Energy: 1.0026047145211072
Energy: 0.6484161040365812
Energy: 1.0026047145218047
Energy: 0.6484161040358837
Energy: 0.6031900480285652
Energy: 1.094024407536946
Energy: 0.6031900480278678
Energy: 1.094024407536946
Energy: 0.6031900480264725
Energy: 1.0940244075362484
Energy: 1.1222815674422484
Energy: 1.147112176506415
Energy: 1.1222815674429458
Energy: 1.1471121765050196
Energy: 1.1222815674429458
Energy: 1.1471121765043222
Energy: 0.91909884016816
Energy: 0.6108203613576404
Energy: 0.9190988401667649
Energy: 0.6108203613576404
Energy: 0.9190988401667649
Energy: 0.6108203613576404
Energy: 1.0045456318286716
Energy: 0.6425208762436683
Energy: 1.0045456318279742
Energy: 0.6425208762499462
Energy: 1.0045456318279742
Energy: 0.6425208762464586
Energy: 0.9033344467147542
Energy: 0.868562870703124
Energy: 0.9033344467140566
Energy: 0.8685628707519528
Energy: 0.9033344467154517
Energy: 0.8685628707010313
Energy: 0.8036986380708171
Energy: 0.9271350580505284
Energy: 0.8036986380888902
Energy: 0.9271350580512261
Energy: 0.8036986380749391
Energy: 0.9271350580505284
Energy: 0.632579703644796
Energy: 0.9770870468864156
Energy: 0.6325797036434009
Energy: 0.9770870468878107
Energy: 0.6325797036468886
Energy: 0.9770870468864156
Energy: 0.7957179741276466
Energy: 0.8261013351508747
Energy: 0.7957179741262513
Energy: 0.8261013351585478
Energy: 0.795717974128344
Energy: 0.8261013351466893
Energy: 1.1390321744325758
Energy: 1.1483740386183954
Energy: 1.1390321744304832
Energy: 1.1483740386183954
Energy: 1.1390321744304832
Energy: 1.1483740386183954
Energy: 1.0045313250047048
Energy: 0.626067740361462
Energy: 1.0045313250040073
Energy: 0.6260677403607644
Energy: 1.0045313250040073
Energy: 0.6260677403586717
Energy: 0.9183812407225347
Energy: 0.8350287048706123
Energy: 0.9183812407225347
Energy: 0.8350287048713099
Energy: 0.9183812407225347
Energy: 0.8350287048706123
Energy: 0.6001026175936577
Energy: 0.8926004578330141
Energy: 0.6001026175936577
Energy: 0.8926004579013109
Energy: 0.6001026175915651
Energy: 0.8926004578560335
Energy: 0.8267026805901464
Energy: 0.9840941556916671
Energy: 0.8267026805929365
Energy: 0.9840941556916671
Energy: 0.8267026805922392
Energy: 0.9840941556909695
Energy: 1.007286466961417
Energy: 0.8543600114392621
Energy: 1.0072864669621147
Energy: 0.8543600114378669
Energy: 1.007286466961417
Energy: 0.8543600114392621
Energy: 1.0034594171337592
Energy: 0.781205220396762
Energy: 1.0034594171330617
Energy: 0.7812052203960644
Energy: 1.0034594171330617
Energy: 0.7812052203960644
Energy: 0.5988694881711212
Energy: 1.0983914471890102
Energy: 0.5988694881732138
Energy: 1.0983914471883125
Energy: 0.5988694881711212
Energy: 1.0983914471897078
Energy: 1.1181296182414853
Energy: 1.1477171509586992
Energy: 1.1181296182414853
Energy: 1.1477171509586992
Energy: 1.1181296182407878
Energy: 1.1477171509586992

minimum gb energy = 0.5794673636287897 eV
minimum distance =  2.34297492977241 Angstroms
sigma value = 41


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

Energy: 0.7433147436362192
Energy: 0.7049410178500211
Energy: 0.7433147436356694
Energy: 0.7049410178500211
Energy: 0.7433147436351196
Energy: 0.7049410178505708
Energy: 0.8488899054408077
Energy: 1.0734814249436078
Energy: 0.848889905439708
Energy: 1.0734814249436078
Energy: 0.848889905439708
Energy: 1.0734814249436078
Energy: 0.9673410054784358
Energy: 1.4201906853632167
Energy: 0.9673410054817345
Energy: 1.4201906853632167
Energy: 0.9673410054729378
Energy: 1.4201906853637662
Energy: 0.800644438250794
Energy: 0.6955347572745901
Energy: 0.800644438250794
Energy: 0.6955347572745901
Energy: 0.8006444382502442
Energy: 0.6955347572745901
Energy: 0.7334276855832296
Energy: 0.711324051505254
Energy: 0.7334276855837794
Energy: 0.7113240515047041
Energy: 0.7334276855837794
Energy: 0.711324051505254
Energy: 1.04262179935773
Energy: 1.1023377997122923
Energy: 1.0426217993571802
Energy: 1.1023377997122923
Energy: 1.04262179935773
Energy: 1.1023377997122923
Energy: 0.6455998413259653
Energy: 1.0368672121274565
Energy: 0.6455998413259653
Energy: 1.0368672121274565
Energy: 0.6455998413254155
Energy: 1.0368672121274565
Energy: 0.7464147773886377
Energy: 0.696119532334231
Energy: 0.7464147773880879
Energy: 0.696119532334231
Energy: 0.7464147773886377
Energy: 0.696119532334231
Energy: 0.7385103367263578
Energy: 0.7081244774558614
Energy: 0.7385103367269075
Energy: 0.7081244774558614
Energy: 0.7385103367263578
Energy: 0.7081244774558614
Energy: 0.7085227250416427
Energy: 1.0760157484239112
Energy: 0.7085227250416427
Energy: 1.076015748424461
Energy: 0.7085227250421924
Energy: 1.0760157484239112
Energy: 0.7055674602103534
Energy: 1.0735703367150997
Energy: 0.7055674602081542
Energy: 1.0735703367150997
Energy: 0.7055674602059551
Energy: 1.0735703367156495
Energy: 0.7422687763356147
Energy: 1.1124873925238505
Energy: 0.7422687763367144
Energy: 1.1124873925238505
Energy: 0.7422687763356147
Energy: 1.1124873925238505
Energy: 0.7426807608607235
Energy: 0.7034895602743204
Energy: 0.7426807608607235
Energy: 0.7034895602743204
Energy: 0.7426807608612733
Energy: 0.7034895602748703
Energy: 0.5979842673784084
Energy: 1.0311190110093296
Energy: 0.5979842673784084
Energy: 1.0311190110104294
Energy: 0.5979842673806075
Energy: 1.0311190110126283
Energy: 1.0254595228299288
Energy: 0.929395422807256
Energy: 1.0254595228282795
Energy: 0.9293954228067063
Energy: 1.0254595228304784
Energy: 0.9293954228067063
Energy: 0.7355890052652574
Energy: 1.0236033860729012
Energy: 0.7355890052652574
Energy: 1.0236033860718015
Energy: 0.7355890052658072
Energy: 1.023603386070702
Energy: 0.7475505770160157
Energy: 0.7035664006644261
Energy: 0.7475505770154659
Energy: 0.7035664006644261
Energy: 0.7475505770160157
Energy: 0.7035664006639263
Energy: 1.1497690065450141
Energy: 1.268242440920369
Energy: 1.1497690065455641
Energy: 1.268242440920369
Energy: 1.1497690065444643
Energy: 1.268242440920369
Energy: 0.8305333884859317
Energy: 1.0964128271829627
Energy: 0.8305333884886807
Energy: 1.0964128271835127
Energy: 0.8305333884699877
Energy: 1.0964128271829627
Energy: 0.7115419266514721
Energy: 1.1538971661305248
Energy: 0.7115419266525717
Energy: 1.153897166129975
Energy: 0.7115419266514721
Energy: 1.1538971661354727
Energy: 0.6740656827666043
Energy: 1.0075265120073753
Energy: 0.6740656827633056
Energy: 1.0075265120068257
Energy: 0.6740656827644051
Energy: 1.0075265120073753
Energy: 1.0042648762663313
Energy: 1.0960851908613745
Energy: 1.0042648762668813
Energy: 1.0960851908608247
Energy: 1.0042648762663313
Energy: 1.0960851908608247
Energy: 0.8015389466093257
Energy: 0.6425737208916766
Energy: 0.8015389466098756
Energy: 0.6425737208922263
Energy: 0.8015389466120747
Energy: 0.6425737208922263
Energy: 0.7354846767224766
Energy: 1.3114870363179867
Energy: 0.7354846767230264
Energy: 1.3114870363179867
Energy: 0.7354846767230264
Energy: 1.3114870363179867
Energy: 0.6694718481328382
Energy: 1.0999474924443398
Energy: 0.6694718481388858
Energy: 1.0999474924443398
Energy: 0.669471848135587
Energy: 1.0999474924426904
Energy: 0.6339720850017354
Energy: 0.709715043555091
Energy: 0.6339720850226276
Energy: 0.7097150435814809
Energy: 0.6339720850094325
Energy: 0.709715043562788
Energy: 0.5975091165294375
Energy: 0.6432042427168777
Energy: 0.5975091165310871
Energy: 0.6432042427207262
Energy: 0.5975091165310871
Energy: 0.6432042427179772
Energy: 0.7402973858692133
Energy: 1.0738874896014154
Energy: 0.7402973858703128
Energy: 1.0738874896030648
Energy: 0.7402973858697631
Energy: 1.073887489605264
Energy: 0.7157676037900851
Energy: 1.1533308448586768
Energy: 0.7157676037889854
Energy: 1.1533308448586768
Energy: 0.7157676037906349
Energy: 1.1533308448592268
Energy: 1.0408879996332123
Energy: 0.670023990841947
Energy: 1.0408879996343121
Energy: 0.6700239908249036
Energy: 1.0408879996332123
Energy: 0.6700239908298516
Energy: 0.6696789113342947
Energy: 0.9795980769696656
Energy: 0.6696789113342947
Energy: 0.9795980769674664
Energy: 0.6696789113342947
Energy: 0.9795980769691157
Energy: 0.743926683284915
Energy: 0.7037133332735634
Energy: 0.7439266832854647
Energy: 0.7037133332735634
Energy: 0.743926683284915
Energy: 0.7037133332735634
Energy: 0.6701440286627505
Energy: 0.7884814417741185
Energy: 0.6701440286633003
Energy: 0.7884814417873134
Energy: 0.6701440286627505
Energy: 0.7884814417768674

minimum gb energy = 0.5975091165294375 eV
minimum distance =  2.3361975616201 Angstroms
sigma value = 33


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

Energy: 0.8086856010720482
Energy: 0.8167064607962775
Energy: 0.8086856010743634
Energy: 0.8167064607970492
Energy: 0.8086856010732408
Energy: 0.8167064607970492
Energy: 0.9217472999183206
Energy: 0.7240967547892765
Energy: 0.9217472999163563
Energy: 0.7240967547892765
Energy: 0.9217472999190924
Energy: 0.7240967547892765
Energy: 1.2757583257842373
Energy: 0.9930597191093764
Energy: 1.2757583257865521
Energy: 0.9930597191074821
Energy: 1.275758325785009
Energy: 0.9930597191093764
Energy: 0.8691731284044409
Energy: 0.7587698230299144
Energy: 0.8691731284024765
Energy: 0.7587698230302651
Energy: 0.8691731284059842
Energy: 0.7587698230294934
Energy: 0.8159576836662494
Energy: 1.2217737087087486
Energy: 0.815957683665127
Energy: 1.2217737098874113
Energy: 0.8159576836662494
Energy: 1.2217737087334428
Energy: 1.0015840472510946
Energy: 0.7473560596634803
Energy: 1.0015840472472362
Energy: 0.7473560596650236
Energy: 1.0015840472514452
Energy: 0.7473560596650236
Energy: 0.8911062269788423
Energy: 0.678557284248151
Energy: 0.8911062269784213
Energy: 0.6785572842439417
Energy: 0.8911062269772988
Energy: 0.6785572842516587
Energy: 0.8215092949302544
Energy: 0.8330973520049239
Energy: 0.8215092949221166
Energy: 0.8330973520056953
Energy: 0.8215092949271676
Energy: 0.8330973520064671
Energy: 0.9097372510390361
Energy: 0.8221857634298101
Energy: 0.9097372511361999
Energy: 0.8221857634301608
Energy: 0.9097372512638808
Energy: 0.8221857634298101
Energy: 0.9861366950440505
Energy: 0.7145132612216001
Energy: 0.9861366950440505
Energy: 0.7145132612211792
Energy: 0.9861366950448222
Energy: 0.7145132612211792
Energy: 1.0241589686271497
Energy: 1.0052448751673475
Energy: 1.0241589686271497
Energy: 1.0052448751654537
Energy: 1.0241589686275707
Energy: 1.0052448751658043
Energy: 1.324084566712274
Energy: 0.8225010410924027
Energy: 1.324084566712274
Energy: 0.8225010410919819
Energy: 1.3240845667079946
Energy: 0.8225010410908595
Energy: 0.821955160758327
Energy: 0.9104266689256585
Energy: 0.8219551607586777
Energy: 0.9104266689128904
Energy: 0.8219551607579061
Energy: 0.9104266688751473
Energy: 0.838884202862378
Energy: 0.9427438289184723
Energy: 0.8388842028627989
Energy: 0.9427438289188932
Energy: 0.8388842028639215
Energy: 0.9427438289181217
Energy: 1.035735312903357
Energy: 0.7894141789778677
Energy: 1.0357353129072155
Energy: 0.7894141789789904
Energy: 1.035735312905672
Energy: 0.7894141789933017
Energy: 0.8267786929661409
Energy: 1.0281515727580355
Energy: 0.82677869296572
Energy: 1.0281515727580355
Energy: 0.826778692963826
Energy: 1.0281515727583863
Energy: 1.3389295921791646
Energy: 0.8164829662366379
Energy: 1.338929592181129
Energy: 0.8164829662366379
Energy: 1.33892959218611
Energy: 0.8164829662362872
Energy: 0.759961781592294
Energy: 1.0247074763762076
Energy: 0.7599617815946091
Energy: 1.0247074763981658
Energy: 0.7599617815919434
Energy: 1.024707476397394
Energy: 0.9903261714265625
Energy: 1.2380822273556038
Energy: 0.9903261714253699
Energy: 1.2380822273544811
Energy: 0.9903261714250192
Energy: 1.2380822273544811
Energy: 0.9687359802534184
Energy: 0.8282750091294855
Energy: 0.9687359802426148
Energy: 0.8282750091290646
Energy: 0.9687359802148336
Energy: 0.8282750091290646
Energy: 0.8186980905563372
Energy: 0.810014201601881
Energy: 0.8186980905567581
Energy: 0.8100142016030736
Energy: 0.8186980905571088
Energy: 0.810014201601881
Energy: 0.7046937897064245
Energy: 0.8656553429376578
Energy: 0.7046937897122474
Energy: 0.8656553429495839
Energy: 0.7046937897048812
Energy: 0.865655342934571
Energy: 1.0076522890035506
Energy: 0.805376924999942
Energy: 1.007652289002779
Energy: 0.8053769249802286
Energy: 1.007652289002779
Energy: 0.8053769249960836
Energy: 0.8197983143631725
Energy: 0.9298067311309793
Energy: 0.8197983143628217
Energy: 0.9298067311294359
Energy: 0.8197983143635934
Energy: 0.9298067311266998
Energy: 0.959149539339926
Energy: 0.8166027753675736
Energy: 0.9591495364685096
Energy: 0.8166027753675736
Energy: 0.9591495424893637
Energy: 0.8166027753675736
Energy: 0.7513619785154388
Energy: 1.005565585495134
Energy: 0.7513619785150882
Energy: 1.0055655854943624
Energy: 0.7513619785154388
Energy: 1.0055655854940115
Energy: 0.8672657390880775
Energy: 0.7816704581709167
Energy: 0.8672657390800098
Energy: 0.7816704581697241
Energy: 0.8672657390900419
Energy: 0.781670458170145
Energy: 0.8144937176121653
Energy: 0.8203658305295203
Energy: 0.8144937176113936
Energy: 0.8203658305291697
Energy: 0.8144937176121653
Energy: 0.8203658305287488
Energy: 0.825408952168717
Energy: 0.9099362286807087
Energy: 0.8254089521679454
Energy: 0.9099362286807087
Energy: 0.8254089521679454
Energy: 0.9099362286819014
Energy: 0.7143912401488389
Energy: 0.9903361738381578
Energy: 0.7143912401503822
Energy: 0.9903361738381578
Energy: 0.7143912401507332
Energy: 0.9903361738373861
Energy: 1.0452114612435075
Energy: 0.797931795386788
Energy: 1.0452114612419643
Energy: 0.7979317953860164
Energy: 1.0452114612419643
Energy: 0.7979317953864373
Energy: 0.81900599062345
Energy: 1.329882812731613
Energy: 0.8190059906238006
Energy: 1.329882812726211
Energy: 0.8190059906242217
Energy: 1.3298828127424165
Energy: 1.0576220362062343
Energy: 0.8238940410900425
Energy: 1.057622036201604
Energy: 0.8238940410900425
Energy: 1.0576220362124078
Energy: 0.8238940410900425
Energy: 0.9136791512737859
Energy: 1.0324016920325645
Energy: 0.91367915127105
Energy: 1.0324016920313719
Energy: 0.91367915127105
Energy: 1.0324016920294776
Energy: 0.9132063195621952
Energy: 1.0319175769392595
Energy: 0.9132063195621952
Energy: 1.0319175769388385
Energy: 0.9132063195606518
Energy: 1.0319175769388385
Energy: 1.0579040882741726
Energy: 0.8236721394372016
Energy: 1.0579040882838537
Energy: 0.8236721394372016
Energy: 1.0579040882826611
Energy: 0.8236721394372016
Energy: 0.8189743215492862
Energy: 1.3309012371548232
Energy: 0.8189743215497071
Energy: 1.3309012371494215
Energy: 0.8189743215504787
Energy: 1.3309012371532798
Energy: 1.0139247702597711
Energy: 0.7977934655753652
Energy: 1.0139247702582277
Energy: 0.797793465575716
Energy: 1.0139247702589993
Energy: 0.7977934655749441
Energy: 0.7143001849410493
Energy: 0.989173954951821
Energy: 0.7143001849414
Energy: 0.9891739549514702
Energy: 0.714300184944136
Energy: 0.9891739549533645
Energy: 0.8244617895549419
Energy: 0.9091507365942402
Energy: 0.8244617895557137
Energy: 0.9091507366019572
Energy: 0.8244617895557137
Energy: 0.909150736587365
Energy: 0.8133905208991393
Energy: 0.8204923264610411
Energy: 0.8133905208994902
Energy: 0.8204923264594977
Energy: 0.8133905208991393
Energy: 0.8204923264602694
Energy: 0.8669179695841597
Energy: 0.7812675034958596
Energy: 0.8669179695922273
Energy: 0.7812675034950879
Energy: 0.8669179695833878
Energy: 0.7812675034981748
Energy: 0.7512141252405014
Energy: 1.005511626862783
Energy: 0.7512141252401506
Energy: 1.0055116268631337
Energy: 0.7512141252397296
Energy: 1.0055116268631337
Energy: 0.9598559532146461
Energy: 0.8166496030860342
Energy: 0.9598559532281157
Energy: 0.8166496030856834
Energy: 0.9598559532253796
Energy: 0.8166496030864551
Energy: 0.819781769717221
Energy: 0.9291342560343664
Energy: 0.8197817697175719
Energy: 0.9291342560340157
Energy: 0.8197817697187646
Energy: 0.9291342560335948
Energy: 1.0073863343804863
Energy: 0.8103382640729767
Energy: 1.0073863343800655
Energy: 0.810338264077607
Energy: 1.00738633438203
Energy: 0.8103382640791504
Energy: 0.70501915399175
Energy: 0.8643854917270052
Energy: 0.7050191539906274
Energy: 0.8643854917300922
Energy: 0.7050191539913991
Energy: 0.8643854917243393

minimum gb energy = 0.6785572842439417 eV
minimum distance =  2.35165938291683 Angstroms
sigma value = 67


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

Energy: 0.9213408930067568
Energy: 0.9620049188423181
Energy: 0.9213408930067568
Energy: 0.9620049188423181
Energy: 0.9213408930067568
Energy: 0.9620049188423181
Energy: 0.9228521342591448
Energy: 0.8021285805896017
Energy: 0.9228521342591448
Energy: 0.8021285805896017
Energy: 0.9228521342591448
Energy: 0.8021285805896017
Energy: 0.8917645166054646
Energy: 1.0441531466303207
Energy: 0.8917645166054646
Energy: 1.0441531466303207
Energy: 0.8917645166054646
Energy: 1.0441531466303207
Energy: 0.923193745652269
Energy: 0.8022047380514045
Energy: 0.923193745652269
Energy: 0.8022047380514045
Energy: 0.923193745652269
Energy: 0.8022047380514045
Energy: 0.9213408930093356
Energy: 0.9620049188423181
Energy: 0.9213408930093356
Energy: 0.9620049188423181
Energy: 0.9213408930067568
Energy: 0.9620049188423181
Energy: 0.9228521342591448
Energy: 0.8021285805896017
Energy: 0.9228521342591448
Energy: 0.8021285805921805
Energy: 0.9228521342591448
Energy: 0.8021285805896017
Energy: 0.8917645166054646
Energy: 1.0441531466303207
Energy: 0.8917645166080433
Energy: 1.0441531466277418
Energy: 0.8917645166080433
Energy: 1.0441531466277418

minimum gb energy = 0.8021285805896017 eV
minimum distance =  2.32025833186315 Angstroms
sigma value = 3


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

Energy: 1.1450925667877143
Energy: 1.108319452582545
Energy: 1.0914617024442677
Energy: 1.1083194525755267
Energy: 1.1450925667877143
Energy: 1.1083194525755267
Energy: 1.134297497656086
Energy: 1.0700389779943777
Energy: 1.134297497656086
Energy: 1.0700389779943777
Energy: 1.134297497656086
Energy: 1.0700389779908683
Energy: 1.0312385945059874
Energy: 1.5082685357658459
Energy: 1.0328583889331178
Energy: 1.5082685357623369
Energy: 1.0312385945059874
Energy: 1.5082685357658459
Energy: 1.1260310925105526
Energy: 1.1177660797453288
Energy: 1.1260310925105526
Energy: 1.117766079748838
Energy: 1.1260310925070434
Energy: 1.117766079748838
Energy: 1.0930945249256911
Energy: 1.1399267654705365
Energy: 1.0930945249221822
Energy: 1.1399267654670275
Energy: 1.0930945249221822
Energy: 1.1399267654670275
Energy: 1.0387549453047518
Energy: 1.2692694676064287
Energy: 1.0387549453047518
Energy: 1.2692694676064287
Energy: 1.038754945308261
Energy: 1.2692694676064287
Energy: 1.1948402635023427
Energy: 1.3734450571655221
Energy: 1.1943476328883913
Energy: 1.3734450571690315
Energy: 1.1948402634988335
Energy: 1.3734450571655221
Energy: 1.1100054656629743
Energy: 1.0752672000325307
Energy: 1.1100054656629743
Energy: 1.0752672000360401
Energy: 1.1100054656664835
Energy: 1.0752672000360401
Energy: 1.1430869841692792
Energy: 1.1176856843146417
Energy: 1.1430869841622606
Energy: 1.1176856843181509
Energy: 1.1430869841622606
Energy: 1.1176856843181509
Energy: 1.0603930846638003
Energy: 1.2974545025806055
Energy: 1.0603930846638003
Energy: 1.2974545025770965
Energy: 1.0603930846673095
Energy: 1.2974545025770965
Energy: 1.192775857389754
Energy: 1.2622313622750119
Energy: 1.192775857393263
Energy: 1.262231362278521
Energy: 1.192775857389754
Energy: 1.262231362278521
Energy: 1.1043208969138762
Energy: 1.1535298976744262
Energy: 1.1043208202501908
Energy: 1.1535298976779356
Energy: 1.1043208969138762
Energy: 1.1535298976779356
Energy: 1.205325503833277
Energy: 1.075673118894044
Energy: 1.2053255038367863
Energy: 1.075673118894044
Energy: 1.2053255038402957
Energy: 1.075673118894044
Energy: 1.1116758911473748
Energy: 1.291247348090498
Energy: 1.1116758911403561
Energy: 1.291247348090498
Energy: 1.1116758911438656
Energy: 1.291247348090498
Energy: 1.329498056180122
Energy: 1.1645637370654969
Energy: 1.3294980561766128
Energy: 1.1645637370619877
Energy: 1.3294980561766128
Energy: 1.1645637370619877
Energy: 1.1271725320549315
Energy: 1.1437677123110495
Energy: 1.1271725320584407
Energy: 1.143768016356136
Energy: 1.1271725320619501
Energy: 1.1437677123075403
Energy: 1.215343646762727
Energy: 1.086618512567184
Energy: 1.215343646762727
Energy: 1.086618512570693
Energy: 1.215343646762727
Energy: 1.086618512570693
Energy: 1.0439376861642045
Energy: 1.4002268968203424
Energy: 1.0439376861571859
Energy: 1.4002268968203424
Energy: 1.0439376861571859
Energy: 1.4002268968203424
Energy: 1.3434830540759413
Energy: 1.167426406777778
Energy: 1.3434830540759413
Energy: 1.1674264067742686
Energy: 1.3434830540759413
Energy: 1.1674264067742686
Energy: 1.1127565050186325
Energy: 1.1591072316413946
Energy: 1.1127565050151231
Energy: 1.159107231644904
Energy: 1.112756505011614
Energy: 1.159107231644904
Energy: 1.226139205573943
Energy: 1.1383176134034052
Energy: 1.2261335544984886
Energy: 1.1383176134034052
Energy: 1.226139205573943
Energy: 1.1383176134034052
Energy: 1.0363664814860463
Energy: 1.3674585335659568
Energy: 1.0363732917001853
Energy: 1.3674585335659568
Energy: 1.0363664814860463
Energy: 1.3674585335659568
Energy: 1.2699635141243153
Energy: 0.9903321634466836
Energy: 1.2699635141208059
Energy: 0.9903321634431744
Energy: 1.2699635141208059
Energy: 0.9903321634396652
Energy: 1.130159995776034
Energy: 1.117662429784889
Energy: 1.1301599957725246
Energy: 1.1739690089327655
Energy: 1.130159995779543
Energy: 1.1176624297919073
Energy: 1.1550922189362127
Energy: 1.1376455951319775
Energy: 1.1550922189327038
Energy: 1.1376455951319775
Energy: 1.1550922189291943
Energy: 1.1376455951319775
Energy: 1.2015429666377964
Energy: 1.3614338340833372
Energy: 1.2015196896869915
Energy: 1.3614338340868464
Energy: 1.2015429666377964
Energy: 1.3614338340868464
Energy: 1.2502634109379396
Energy: 1.1024828653442478
Energy: 1.2502634109379396
Energy: 1.1024828653442478
Energy: 1.2502634109379396
Energy: 1.1024828653442478
Energy: 1.146073277906386
Energy: 1.0831085444965853
Energy: 1.146073277906386
Energy: 1.1298769104316806
Energy: 1.1460732779028768
Energy: 1.0831085444965853
Energy: 1.1263933160383748
Energy: 1.0861222472461627
Energy: 1.1263933160383748
Energy: 1.0861222472496719
Energy: 1.1263933160383748
Energy: 1.0861222472496719
Energy: 1.3482816800446729
Energy: 1.1436854039637945
Energy: 1.3233711568373345
Energy: 1.1436854039637945
Energy: 1.3482816800411634
Energy: 1.1436854039637945
Energy: 1.301829618487952
Energy: 1.1085245905556693
Energy: 1.2499890138554235
Energy: 1.1085245905521603
Energy: 1.301829618487952
Energy: 1.1085245905521603
Energy: 1.1944121319197012
Energy: 1.098139193811109
Energy: 1.1944121319161922
Energy: 1.0981391938146183
Energy: 1.1944121319197012
Energy: 1.0981391938146183
Energy: 1.1202134366403724
Energy: 1.1392610516523851
Energy: 1.1202134366368632
Energy: 1.139261051648876
Energy: 1.1202134366368632
Energy: 1.139261051648876
Energy: 1.2869701466339292
Energy: 1.122283942753898
Energy: 1.2869701466374384
Energy: 1.122283942753898
Energy: 1.2869701466339292
Energy: 1.122283942753898
Energy: 1.2205768386990212
Energy: 1.3181200288580797
Energy: 1.2205768386990212
Energy: 1.3181200288615889
Energy: 1.2205768386990212
Energy: 1.3181200288615889
Energy: 1.2214088438987316
Energy: 1.1400558036808672
Energy: 1.221102062020113
Energy: 1.140055803677358
Energy: 1.221408843902241
Energy: 1.140055803677358
Energy: 1.1296835657996172
Energy: 1.192901442558448
Energy: 1.1296756854540402
Energy: 1.1929014425549391
Energy: 1.1296835658031268
Energy: 1.1929014425549391
Energy: 1.354323042518925
Energy: 0.9699426034963308
Energy: 1.354323042518925
Energy: 0.9699426034928216
Energy: 1.3543230425224344
Energy: 0.9699426034928216
Energy: 1.0708003596044968
Energy: 1.4380803416322017
Energy: 1.070800359608006
Energy: 1.4380803416322017
Energy: 1.070800359608006
Energy: 1.4380803416322017
Energy: 1.15319785892847
Energy: 1.1407463313683481
Energy: 1.15319785892847
Energy: 1.1407463313683481
Energy: 1.1531978589249607
Energy: 1.1407463313683481
Energy: 1.0963851357310586
Energy: 1.2191873579674424
Energy: 1.0963869027985549
Energy: 1.2191873579569148
Energy: 1.0963851357345678
Energy: 1.2191873579569148
Energy: 1.4309961078834397
Energy: 1.0555545202559222
Energy: 1.4309961078869489
Energy: 1.0555545202594314
Energy: 1.430996107890458
Energy: 1.0555545202594314
Energy: 1.0778855007421864
Energy: 1.4702579886286726
Energy: 1.0778855007421864
Energy: 1.4702579886286726
Energy: 1.0778855007421864
Energy: 1.4702579886286726
Energy: 1.1507591089578564
Energy: 1.0970802897635212
Energy: 1.1507591089543472
Energy: 1.097080289760012
Energy: 1.1507591089543472
Energy: 1.097080289760012
Energy: 1.1228668018201433
Energy: 1.122381252526752
Energy: 1.122866801816634
Energy: 1.122381252526752
Energy: 1.122866801816634
Energy: 1.122381252526752
Energy: 1.388555496521329
Energy: 1.150547240467084
Energy: 1.3885554965178197
Energy: 1.150547240467084
Energy: 1.3885554965178197
Energy: 1.150547240467084
Energy: 1.0842272663786658
Energy: 1.3258807775630923
Energy: 1.0842298609274066
Energy: 1.3258807775595831
Energy: 1.0842272663751564
Energy: 1.3258807775595831
Energy: 1.1381624027310786
Energy: 1.1061609850457936
Energy: 1.1381624027275694
Energy: 1.1061609850422842
Energy: 1.1381624027275694
Energy: 1.1061609850422842
Energy: 1.0959654674693007
Energy: 1.1526202749885732
Energy: 1.0959654674693007
Energy: 1.1526202749920826
Energy: 1.0959654674657915
Energy: 1.1526202749920826
Energy: 1.2511273416740951
Energy: 1.2743560989709395
Energy: 1.2511273416705857
Energy: 1.274356098963921
Energy: 1.2511273416740951
Energy: 1.274356098963921
Energy: 1.1098943664196237
Energy: 1.3284145516314159
Energy: 1.1099309737596639
Energy: 1.3284145516279067
Energy: 1.1098943664161143
Energy: 1.3284145516279067

minimum gb energy = 0.9699426034928216 eV
minimum distance =  2.30299399190447 Angstroms
sigma value = 81


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

Energy: 1.2384410912903163
Energy: 1.1345054815286606
Energy: 1.0163127420930995
Energy: 1.1345054815276974
Energy: 1.2384410912946509
Energy: 1.134505481525289
Energy: 1.2692862984237279
Energy: 1.2783489404757669
Energy: 1.2692862984227646
Energy: 1.313476414064871
Energy: 1.2692862984242095
Energy: 1.2783489404729211
Energy: 1.297437074041651
Energy: 1.3741090767106425
Energy: 1.310794304728282
Energy: 1.3741090767072712
Energy: 1.2974370740392427
Energy: 1.3741090767096795
Energy: 1.0000279072623133
Energy: 1.5646744831922612
Energy: 1.000027907258942
Energy: 1.5646744831927428
Energy: 1.00002790726135
Energy: 1.564674483193706
Energy: 1.337283085378858
Energy: 1.142564387095961
Energy: 1.3372830853769315
Energy: 1.142564387095961
Energy: 1.337283085378858
Energy: 1.1425643870940343
Energy: 1.152337726177774
Energy: 1.2557791778014733
Energy: 1.152337726180664
Energy: 1.2089332673890998
Energy: 1.1523377261811454
Energy: 1.2557791778000285
Energy: 1.0574638632672528
Energy: 1.1880420476790825
Energy: 1.0574638632677347
Energy: 1.0533669417780558
Energy: 1.0574638632653264
Energy: 1.1880420476810092
Energy: 1.3346315003357698
Energy: 1.4047353048038402
Energy: 1.334511711542733
Energy: 1.4047353048038402
Energy: 1.3346315003338434
Energy: 1.404735304802877
Energy: 1.3160688293327087
Energy: 1.1109409130254546
Energy: 1.3160688293327087
Energy: 1.1109409130264178
Energy: 1.3160688293331904
Energy: 1.1109409130283443
Energy: 1.226310558574469
Energy: 1.3671536099962598
Energy: 1.2263105585749507
Energy: 1.3671536099952963
Energy: 1.2263105585778407
Energy: 1.3671536099957782
Energy: 1.1541206812627853
Energy: 1.257194258545519
Energy: 1.1541206812598954
Energy: 1.2571942585450373
Energy: 1.154120681260377
Energy: 1.2571942585450373
Energy: 1.0034970686191769
Energy: 1.135480246353667
Energy: 1.1515719944927971
Energy: 1.135480246356557
Energy: 1.0034970686225482
Energy: 1.1354802463551121
Energy: 1.2738213563102982
Energy: 1.302046725691313
Energy: 1.273821356309335
Energy: 1.3026406957883612
Energy: 1.2738213563088534
Energy: 1.302046725691313
Energy: 1.26620024008625
Energy: 1.098899699030488
Energy: 1.2662002400872132
Energy: 1.0988996990328963
Energy: 1.2662002400857684
Energy: 1.098899699035786
Energy: 1.4049611515234912
Energy: 1.1859677186221533
Energy: 1.4049611515234912
Energy: 1.1859677186245616
Energy: 1.404961151523973
Energy: 1.1859677186245616
Energy: 1.3189073086306071
Energy: 1.153733986133516
Energy: 1.3189073086306071
Energy: 1.1537339861344795
Energy: 1.3189073086325336
Energy: 1.1537339861311078
Energy: 1.1369531493737577
Energy: 1.0187030576839664
Energy: 1.1369531493703862
Energy: 1.1678921146093868
Energy: 1.1369531493718312
Energy: 1.0187030576854113
Energy: 1.119957717531041
Energy: 1.2166708694692026
Energy: 1.1185501610760902
Energy: 1.2166708694711292
Energy: 1.1199577175339306
Energy: 1.2166708694692026
Energy: 1.105585097990974
Energy: 1.2910326390893332
Energy: 1.1055850979914557
Energy: 1.3140844066262438
Energy: 1.1055850979919373
Energy: 1.2910326390888516
Energy: 1.261793171131178
Energy: 1.114077611403206
Energy: 1.2617931711302148
Energy: 1.1140776114022428
Energy: 1.2617931711326231
Energy: 1.1140776114027244
Energy: 1.1788926170204093
Energy: 1.338235635787557
Energy: 1.1788926170204093
Energy: 1.338235635789002
Energy: 1.1788926170175194
Energy: 1.3382356357880387
Energy: 1.2220313334260844
Energy: 1.3793272694126566
Energy: 1.1399654198345037
Energy: 1.3793272694092853
Energy: 1.2220313334299375
Energy: 1.3793272694078402
Energy: 1.381498026883623
Energy: 1.1174115741753239
Energy: 1.2095634784009313
Energy: 1.1174115741767685
Energy: 1.3814980268807329
Energy: 1.1174115741772503
Energy: 1.4034435776265928
Energy: 1.3377900887999756
Energy: 1.4034435776256295
Energy: 1.3377889823339193
Energy: 1.4034435776265928
Energy: 1.3377900888009389
Energy: 1.1101147776548765
Energy: 1.2853080041734166
Energy: 1.1101147776534315
Energy: 1.28530800417149
Energy: 1.1101147776524682
Energy: 1.2853080041738982
Energy: 1.4310582265473437
Energy: 1.4036160296256284
Energy: 1.4310582265478253
Energy: 1.4036160296285183
Energy: 1.4310582265478253
Energy: 1.4036160296275548
Energy: 1.1326533930198304
Energy: 1.1166082172310914
Energy: 1.1326533930198304
Energy: 1.1166082172349445
Energy: 1.1326533930183855
Energy: 1.1166082172359078
Energy: 1.1332933877173552
Energy: 1.1664101031653717
Energy: 1.1332933877183184
Energy: 1.0185279342061035
Energy: 1.1332933877192817
Energy: 1.1664101031658534
Energy: 1.310059167668048
Energy: 1.2721976484831674
Energy: 1.3104611607686127
Energy: 1.272197648483649
Energy: 1.3100591676690112
Energy: 1.272197648486057
Energy: 1.0984055094888494
Energy: 1.0593525785423312
Energy: 1.0984055094874046
Energy: 1.0595163960548826
Energy: 1.0984055094874046
Energy: 1.0593525785461846
Energy: 1.3764047689520784
Energy: 1.4035656639280694
Energy: 1.3764047689515968
Energy: 1.4035656639295144
Energy: 1.3764047689515968
Energy: 1.4035656639275877
Energy: 1.1526449001283905
Energy: 1.3327526488009678
Energy: 1.1526449001283905
Energy: 1.332752648799523
Energy: 1.152644900128872
Energy: 1.3327526488019312
Energy: 1.0163091482964777
Energy: 1.1352793773312653
Energy: 1.1563933297560989
Energy: 1.1352793773346368
Energy: 1.0163091482935875
Energy: 1.1352793773360819
Energy: 1.0247911458794245
Energy: 1.0238384085346148
Energy: 1.187623387896528
Energy: 1.0238384085312433
Energy: 1.0247911458837593
Energy: 1.0238384085336516
Energy: 1.1455812627312765
Energy: 1.4291880754353263
Energy: 1.383997895382794
Energy: 1.4291880754377346
Energy: 1.145581262731758
Energy: 1.4291880754329183
Energy: 1.1123606969142095
Energy: 1.2099083965301145
Energy: 1.112360696914691
Energy: 1.2099083965325226
Energy: 1.1123606969156543
Energy: 1.209908396532041
Energy: 1.3037849555976067
Energy: 1.149571853731058
Energy: 1.30378495559568
Energy: 1.1495718537320214
Energy: 1.3037849555976067
Energy: 1.1495718537329844
Energy: 1.378690700347726
Energy: 1.031256048367234
Energy: 1.3786907003453615
Energy: 1.1210333870299638
Energy: 1.3786907003482076
Energy: 1.0312560483701239

minimum gb energy = 1.000027907258942 eV
minimum distance =  2.35940555181945 Angstroms
sigma value = 43


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

Energy: 1.1478667473075057
Energy: 1.0870098505608947
Energy: 1.1478667473069142
Energy: 1.0870098505608947
Energy: 1.1478667473075057
Energy: 1.0870098505603032
Energy: 1.0866997183895977
Energy: 1.0434397588137896
Energy: 1.0866997183901894
Energy: 1.0434397588167477
Energy: 1.0866997183895977
Energy: 1.0434397588167477
Energy: 0.9806154902858325
Energy: 1.3014338871256939
Energy: 0.9806154902858325
Energy: 1.3014338871262856
Energy: 0.9806154902858325
Energy: 1.3014338871262856
Energy: 1.0906249004664919
Energy: 1.1097500130953517
Energy: 1.0906249004664919
Energy: 1.1097500130953517
Energy: 1.0906249004664919
Energy: 1.1097500130953517
Energy: 1.0898525637671899
Energy: 1.1240363825116828
Energy: 1.0898525637671899
Energy: 1.1240363825110913
Energy: 1.0898525637677816
Energy: 1.1240363825116828
Energy: 1.0546523408199044
Energy: 1.2361323899173198
Energy: 1.0546523408199044
Energy: 1.2361323899167285
Energy: 1.0546523408199044
Energy: 1.2361323899173198
Energy: 1.2177940403128569
Energy: 1.1189107830748215
Energy: 1.2177940403128569
Energy: 1.1189107830748215
Energy: 1.2177940403128569
Energy: 1.1189107830742298
Energy: 1.0576090839556263
Energy: 1.123949086636649
Energy: 1.0576090839556263
Energy: 1.1239490866360573
Energy: 1.0576090839556263
Energy: 1.1239490866360573
Energy: 1.1314354581428991
Energy: 1.0835818605160916
Energy: 1.1314354581423076
Energy: 1.0835818605160916
Energy: 1.1314354581423076
Energy: 1.0835818605154999
Energy: 1.0521397932199914
Energy: 1.2845781041364053
Energy: 1.0521397932199914
Energy: 1.2845781041364053
Energy: 1.0521397932199914
Energy: 1.2845781041364053
Energy: 1.3074998968596667
Energy: 1.109609128694683
Energy: 1.3074998968584837
Energy: 1.109609128694683
Energy: 1.3074998968584837
Energy: 1.1096091286940915
Energy: 1.062141510518275
Energy: 1.1222679169280152
Energy: 1.062141510518275
Energy: 1.1222679169280152
Energy: 1.0621415105188665
Energy: 1.1222679169280152
Energy: 1.1273193071207697
Energy: 1.1102144906016511
Energy: 1.127319307121953
Energy: 1.1102144906016511
Energy: 1.1273193071213612
Energy: 1.1102144906016511
Energy: 1.0646822312092994
Energy: 1.401362834557299
Energy: 1.0646822312104827
Energy: 1.4013628345567073
Energy: 1.064682231208708
Energy: 1.4013628345567073
Energy: 1.2078575051635283
Energy: 0.9811402558976237
Energy: 1.2078575051635283
Energy: 0.9811402558982152
Energy: 1.2078575051635283
Energy: 0.9811402558982152
Energy: 1.108060087069906
Energy: 1.1315621894088688
Energy: 1.108060087069906
Energy: 1.1315621894088688
Energy: 1.108060087069906
Energy: 1.1315621894088688
Energy: 1.134319807226821
Energy: 1.0535843083725116
Energy: 1.1343198072262295
Energy: 1.0535843083731031
Energy: 1.1343198072274125
Energy: 1.0535843083725116
Energy: 1.2928696409902682
Energy: 1.175483628647718
Energy: 1.2928696409902682
Energy: 1.175483628647718
Energy: 1.2928696409902682
Energy: 1.175483628647718
Energy: 1.2455317009997484
Energy: 1.009089423715598
Energy: 1.2455317009997484
Energy: 1.009089423715598
Energy: 1.2455317009997484
Energy: 1.009089423715598
Energy: 1.1340948296131101
Energy: 1.0497046450288643
Energy: 1.1340948296125184
Energy: 1.0497046450288643
Energy: 1.1340948296113353
Energy: 1.0497046450288643
Energy: 1.09977660544655
Energy: 1.1366419880093923
Energy: 1.09977660544655
Energy: 1.1366419880099838
Energy: 1.09977660544655
Energy: 1.1366419880099838
Energy: 1.2581433437876255
Energy: 1.0016512575497252
Energy: 1.2581433437876255
Energy: 1.0016512575497252
Energy: 1.2581433437882172
Energy: 1.0016512575497252
Energy: 1.1270940491749921
Energy: 1.1054962159236916
Energy: 1.1270940491744006
Energy: 1.105496215924283
Energy: 1.1270940491749921
Energy: 1.1054962159236916
Energy: 1.1067710518460587
Energy: 1.1077932835058677
Energy: 1.1067710518454672
Energy: 1.1077932835058677
Energy: 1.1067710518454672
Energy: 1.1077932835058677
Energy: 1.065043849621584
Energy: 1.035736078419984
Energy: 1.0650438496156678
Energy: 1.0357360784193925
Energy: 1.0650438496192176
Energy: 1.0357360784193925
Energy: 1.3013063347487506
Energy: 1.055180582568107
Energy: 1.3013063347475675
Energy: 1.0551805825675153
Energy: 1.3013063347481593
Energy: 1.055180582568107
Energy: 0.9972685296370226
Energy: 1.191415023788864
Energy: 0.9972685296370226
Energy: 1.191415023788864
Energy: 0.9972685296370226
Energy: 1.191415023788864
Energy: 1.130014762933159
Energy: 1.0936453383732234
Energy: 1.1300147629337505
Energy: 1.093645338373815
Energy: 1.1300147629337505
Energy: 1.093645338373815
Energy: 1.0631261752025005
Energy: 1.0308378694557385
Energy: 1.0631261752030923
Energy: 1.0308378694563303
Energy: 1.0631261752025005
Energy: 1.0308378694563303
Energy: 1.186550119750267
Energy: 1.3252756100512089
Energy: 1.186550119750267
Energy: 1.3252756100506171
Energy: 1.186550119750267
Energy: 1.3252756100512089
Energy: 1.0550831805863756
Energy: 1.2020649246508885
Energy: 1.0550831805863756
Energy: 1.2020649246508885
Energy: 1.0550831805863756
Energy: 1.202064924650297

minimum gb energy = 0.9806154902858325 eV
minimum distance =  2.32040467564706 Angstroms
sigma value = 57


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

Energy: 1.0911199632074986
Energy: 1.0229003744308078
Energy: 1.0911199632074986
Energy: 1.0229003744308078
Energy: 1.0911199632074986
Energy: 1.0229003744308078
Energy: 1.035847158946041
Energy: 1.0487377144340395
Energy: 1.035847158946041
Energy: 1.0487377144340395
Energy: 1.0358471589452751
Energy: 1.0487377144332735
Energy: 1.0618345183668867
Energy: 1.2673517776305179
Energy: 1.0618345183661557
Energy: 1.2673517776312837
Energy: 1.0618345183668867
Energy: 1.2673517776312837
Energy: 1.2379762059991968
Energy: 1.0973177314675837
Energy: 1.2379762059991968
Energy: 1.0973177314675837
Energy: 1.2379762059999626
Energy: 1.0973177314675837
Energy: 1.2537368949502332
Energy: 1.0950187407778798
Energy: 1.2537368949494674
Energy: 1.095018740777114
Energy: 1.2537368949502332
Energy: 1.0950187407778798
Energy: 1.0657217992191024
Energy: 1.1554958228311347
Energy: 1.0657217992191024
Energy: 1.1554958228311347
Energy: 1.0657217992191024
Energy: 1.1554958228311347
Energy: 1.0506041407431639
Energy: 1.0677687351520861
Energy: 1.05060414074393
Energy: 1.0677687351520861
Energy: 1.05060414074393
Energy: 1.0677687351520861
Energy: 1.0897131364598207
Energy: 1.0356910222317552
Energy: 1.0897131364598207
Energy: 1.0356910222317552
Energy: 1.0897131364598207
Energy: 1.0356910222317552
Energy: 1.1913423931037763
Energy: 1.037811537098123
Energy: 1.1913423931037763
Energy: 1.037811537098123
Energy: 1.1913423931037763
Energy: 1.037811537098123
Energy: 0.8770053308510669
Energy: 1.280380469021452
Energy: 0.8770053308510669
Energy: 1.280380469021452
Energy: 0.8770053308510669
Energy: 1.280380469021452
Energy: 1.1741716782783251
Energy: 1.0052605292837833
Energy: 1.174171678277559
Energy: 1.0052605292845496
Energy: 1.174171678277559
Energy: 1.0052605292822512
Energy: 1.196510957268296
Energy: 1.1186826642596261
Energy: 1.196510957269062
Energy: 1.1186826642596261
Energy: 1.196510957269062
Energy: 1.1186826642588599
Energy: 0.9881509185350911
Energy: 1.0482337882275765
Energy: 0.9881509185358222
Energy: 1.0482337882275765
Energy: 0.9881509185358222
Energy: 1.0482337882283423
Energy: 1.0426626569582838
Energy: 1.0666450288429077
Energy: 1.0426626569582838
Energy: 1.0666450288436737
Energy: 1.0426626569582838
Energy: 1.0666450288436737
Energy: 1.1796229880937963
Energy: 0.9394183453793787
Energy: 1.1796229880945623
Energy: 0.9394183453801446
Energy: 1.1796229880945623
Energy: 0.9394183453793787
Energy: 1.1859967810979595
Energy: 1.0445446054478622
Energy: 1.1859967811010235
Energy: 1.0445446054478622
Energy: 1.1859967811002576
Energy: 1.0445446054486283
Energy: 0.9412466470250466
Energy: 1.036103685498598
Energy: 0.9412466470250466
Energy: 1.036103685498598
Energy: 0.9412466470242805
Energy: 1.036103685498598
Energy: 1.1017347648123808
Energy: 0.9684678443168524
Energy: 1.1017347648123808
Energy: 0.9684678443168524
Energy: 1.1017347648123808
Energy: 0.9684678443168524
Energy: 0.9419194613348288
Energy: 1.0359654143459227
Energy: 0.9419194613340627
Energy: 1.0359654143443906
Energy: 0.9419194613340627
Energy: 1.0359654143451569
Energy: 1.1856793243623245
Energy: 1.044551536142656
Energy: 1.1856793243630905
Energy: 1.044551536142656
Energy: 1.1856793243646226
Energy: 1.044551536142656
Energy: 1.1797618210671108
Energy: 0.9395229328327053
Energy: 1.1797618210671108
Energy: 0.9395229328334712
Energy: 1.1797618210671108
Energy: 0.9395229328334712
Energy: 1.0430660484468695
Energy: 1.155694624036052
Energy: 1.0430660484468695
Energy: 1.155694624036052
Energy: 1.0430660484468695
Energy: 1.1556946240352861
Energy: 0.9882157414861013
Energy: 1.0483445194373109
Energy: 0.9882157414861013
Energy: 1.0483445194373109
Energy: 0.9882157414861013
Energy: 1.0483445194373109
Energy: 1.1967952491938258
Energy: 1.1185284817381766
Energy: 1.1967952491953233
Energy: 1.1185284817374106
Energy: 1.1967952491960892
Energy: 1.1185284817374106

minimum gb energy = 0.8770053308510669 eV
minimum distance =  2.33854116744766 Angstroms
sigma value = 17


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

Energy: 1.0266187605437362
Energy: 1.0482538303983002
Energy: 1.0266187605448196
Energy: 1.0482538303983002
Energy: 1.0266187605448196
Energy: 1.0482538303983002
Energy: 0.9240817179247722
Energy: 0.9950793694598998
Energy: 0.9240817179258556
Energy: 0.9950793694598998
Energy: 0.9240817179247722
Energy: 0.9950793694598998
Energy: 0.8972991140394547
Energy: 1.1351427941327825
Energy: 0.8972991140405382
Energy: 1.1351427941327825
Energy: 0.8972991140394547
Energy: 1.1351427941327825
Energy: 1.0006914537881901
Energy: 1.088709682594623
Energy: 1.0006914537881901
Energy: 1.088709682594623
Energy: 1.0006914537881901
Energy: 1.088709682594623
Energy: 1.0382720513706565
Energy: 1.095542459818379
Energy: 1.0382720513717396
Energy: 1.095542459818379
Energy: 1.0382720513706565
Energy: 1.095542459818379
Energy: 1.0474249096849122
Energy: 1.0757243858906704
Energy: 1.0474249096849122
Energy: 1.0757243858906704
Energy: 1.0474249096849122
Energy: 1.0757243858906704
Energy: 1.0489193176667926
Energy: 0.8330834927935457
Energy: 1.0489193176657092
Energy: 0.8330834927935457
Energy: 1.0489193176657092
Energy: 0.8330834927924623
Energy: 0.9861323661023489
Energy: 1.0721915044697667
Energy: 0.9861323661023489
Energy: 1.0721915044697667
Energy: 0.9861323661012658
Energy: 1.0721915044697667
Energy: 0.9273137640027747
Energy: 1.0826993252090578
Energy: 0.9273137640016913
Energy: 1.0826993252090578
Energy: 0.9273137640016913
Energy: 1.0826993252090578
Energy: 0.9862591254534667
Energy: 0.9780964624651051
Energy: 0.9862591254523836
Energy: 0.9780964624651051
Energy: 0.9862591254534667
Energy: 0.9780964624651051
Energy: 1.1217157953878925
Energy: 0.9224323152238258
Energy: 1.1217157953868089
Energy: 0.9224323152238258
Energy: 1.1217157953878925
Energy: 0.9224323152238258
Energy: 1.056212412067206
Energy: 1.0383909951101409
Energy: 1.0562124120682894
Energy: 1.0383909951101409
Energy: 1.056212412067206
Energy: 1.0383909951101409
Energy: 0.9789527610432885
Energy: 1.0215091472945659
Energy: 0.9789527610432885
Energy: 1.0215091472945659
Energy: 0.9789527610432885
Energy: 1.0215091472945659
Energy: 1.0510145044430963
Energy: 0.9095951402650956
Energy: 1.0510145044441794
Energy: 0.9095951402640122
Energy: 1.0510145044441794
Energy: 0.9095951402640122
Energy: 0.9959096491584082
Energy: 1.0245603086282067
Energy: 0.9959096491594915
Energy: 1.0245603086282067
Energy: 0.9959096491594915
Energy: 1.0245603086282067
Energy: 1.0079692728906013
Energy: 1.102935671479134
Energy: 1.0079692728916845
Energy: 1.102935671478051
Energy: 1.0079692728906013
Energy: 1.102935671478051
Energy: 0.9769767815224548
Energy: 0.9070488229547364
Energy: 0.9769767815224548
Energy: 0.9070488229547364
Energy: 0.9769767815224548
Energy: 0.9070488229547364

minimum gb energy = 0.8330834927924623 eV
minimum distance =  2.36686327022447 Angstroms
sigma value = 17


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

Energy: 0.9596070613008347
Energy: 0.9152667629125869
Energy: 0.959607061299998
Energy: 0.9152667629125869
Energy: 0.959607061299998
Energy: 0.9152667629130053
Energy: 0.8512540199799299
Energy: 0.9602664473664883
Energy: 0.8512540199795114
Energy: 0.9602664473673249
Energy: 0.8512540199799299
Energy: 0.9602664473664883
Energy: 0.8072300832345155
Energy: 0.9463205909318579
Energy: 0.8072300832340973
Energy: 0.9463205909318579
Energy: 0.8072300832345155
Energy: 0.9463205909318579
Energy: 0.910022662643063
Energy: 0.8029878802306494
Energy: 0.9100226626434812
Energy: 0.8029878802319043
Energy: 0.9100226626426445
Energy: 0.8029878802306494
Energy: 0.8455538879662293
Energy: 0.9259634082649782
Energy: 0.8455538879662293
Energy: 0.9259634082649782
Energy: 0.8455538879666477
Energy: 0.9259634082653966
Energy: 0.8098139369994526
Energy: 0.9632667272633669
Energy: 0.809813936999034
Energy: 0.9632667272629487
Energy: 0.809813936999034
Energy: 0.9632667272637851
Energy: 1.0789445220577891
Energy: 0.795293364129042
Energy: 1.0789445220598808
Energy: 0.7952933641294603
Energy: 1.0789445220573706
Energy: 0.7952933641298785
Energy: 0.9560520875633759
Energy: 0.9551461495448552
Energy: 0.9560520875633759
Energy: 0.955146149545692
Energy: 0.956052087562121
Energy: 0.955146149544437
Energy: 0.9248298507317859
Energy: 0.978621031930449
Energy: 0.9248298507313675
Energy: 0.9786210319308672
Energy: 0.9248298507317859
Energy: 0.9786210319300306
Energy: 0.9500625596727235
Energy: 0.7395052600649945
Energy: 0.9500625596731417
Energy: 0.7395052600645762
Energy: 0.9500625596723051
Energy: 0.7395052600649945
Energy: 0.9692395354342535
Energy: 0.9346744778047498
Energy: 0.9692395354350899
Energy: 0.9346744778043315
Energy: 0.9692395354346717
Energy: 0.9346744778039131
Energy: 0.8727258293000031
Energy: 0.9854838466967691
Energy: 0.8727258293000031
Energy: 0.9854838466971875
Energy: 0.8727258293008395
Energy: 0.9854838466967691
Energy: 0.9596630137180707
Energy: 0.879816249889686
Energy: 0.9596630137172341
Energy: 0.879816249889686
Energy: 0.9596630137180707
Energy: 0.879816249889686
Energy: 1.0233864237007078
Energy: 0.8312765531992502
Energy: 1.023386423699453
Energy: 0.8312765531988319
Energy: 1.023386423699453
Energy: 0.8312765531984135
Energy: 1.0024018498368408
Energy: 0.9824728730297343
Energy: 1.0024018498376774
Energy: 0.9824728730301525
Energy: 1.002401849837259
Energy: 0.982472873030571
Energy: 0.8855201484507842
Energy: 0.9037284688502794
Energy: 0.885520148451621
Energy: 0.9037284688494427
Energy: 0.8855201484499475
Energy: 0.9537014721371203
Energy: 1.006750234111277
Energy: 0.7914682331381324
Energy: 1.0067502341129504
Energy: 0.7914682331381324
Energy: 1.0067502341129504
Energy: 0.7914682331385507
Energy: 0.940242636344086
Energy: 0.9096797047220546
Energy: 0.9402426363445044
Energy: 0.9096797047220546
Energy: 0.940242636346558
Energy: 0.9096797047220546
Energy: 0.9789631585903882
Energy: 0.8600363112642692
Energy: 0.9789631585862049
Energy: 0.8600363112638508
Energy: 0.9789631585887147
Energy: 0.8600363112638508
Energy: 1.001711065855042
Energy: 0.7950582949672124
Energy: 1.001711065856297
Energy: 0.7950582949672124
Energy: 1.0017110658558788
Energy: 0.7950582949676307
Energy: 0.935959573682115
Energy: 0.8601567551355762
Energy: 0.935959573682115
Energy: 0.8601567551368312
Energy: 0.935959573679605
Energy: 0.8601567551364127
Energy: 0.9196807678535931
Energy: 0.9099204102084987
Energy: 0.919680767852338
Energy: 0.9099204102076619
Energy: 0.9196807678515014
Energy: 0.9099204102097537
Energy: 1.0076334238090199
Energy: 0.7911306430599278
Energy: 1.0076334238086015
Energy: 0.7911306430603461
Energy: 1.0076334238090199
Energy: 0.7911306430603461
Energy: 0.8844905591808963
Energy: 0.9296118251557492
Energy: 0.8844905591813147
Energy: 0.9296118251561676
Energy: 0.8844905591800596
Energy: 0.9296118251561676
Energy: 1.002468958493085
Energy: 0.9821543206750032
Energy: 1.0024689584922484
Energy: 0.982154320674585
Energy: 1.0024689584943398
Energy: 0.982154320674585
Energy: 1.0226641734901618
Energy: 0.8314329786377285
Energy: 1.022664173489325
Energy: 0.8314329786381467
Energy: 1.0226641734901618
Energy: 0.8314329786385652
Energy: 0.9593582788324153
Energy: 0.8787023548062807
Energy: 0.9593582788340886
Energy: 0.8787023548066991
Energy: 0.9593582788340886
Energy: 0.8787023548062807
Energy: 0.8722805622456057
Energy: 0.9856719538019897
Energy: 0.8722805622456057
Energy: 0.985671953802408
Energy: 0.8722805622464423
Energy: 0.9856719538028264
Energy: 0.968905072746752
Energy: 0.9342604729508146
Energy: 0.968905072746752
Energy: 0.9342604729491412
Energy: 0.9689050727471702
Energy: 0.9342604729491412
Energy: 0.9499620824612786
Energy: 0.8450963622098224
Energy: 0.9499620824612786
Energy: 0.8450963622098224
Energy: 0.9499620824621151
Energy: 0.8450963622098224
Energy: 0.924727499655336
Energy: 0.9781845989905161
Energy: 0.9247274996561726
Energy: 0.9781845989896796
Energy: 0.9247274996561726
Energy: 0.9781845989905161
Energy: 0.9557378320198349
Energy: 0.9549022809441217
Energy: 0.9557378320215081
Energy: 0.9549022809437034
Energy: 0.9557378320210898
Energy: 0.9549022809437034
Energy: 1.079230761413873
Energy: 0.7951926324357456
Energy: 1.0792307614134544
Energy: 0.7951926324349088
Energy: 1.079230761413873
Energy: 0.7951926324349088
Energy: 0.8098194345521165
Energy: 0.9756627479797759
Energy: 0.8098194345533714
Energy: 0.9756627479793577
Energy: 0.809819434551698
Energy: 0.9756627479801944
Energy: 0.8438250249028346
Energy: 0.9259729262413046
Energy: 0.8438250249024163
Energy: 0.9259729262413046
Energy: 0.8438250249028346
Energy: 0.9259729262413046
Energy: 0.9102774070062337
Energy: 0.8028198008420299
Energy: 0.9102774070049788
Energy: 0.8028198008420299
Energy: 0.9102774070058155
Energy: 0.8028198008420299
Energy: 0.8075803286453523
Energy: 0.9266674860341871
Energy: 0.8075803286449339
Energy: 0.9266674860341871
Energy: 0.8075803286445157
Energy: 0.9266674860341871
Energy: 0.8511915836292797
Energy: 0.8938109791253955
Energy: 0.851191583627188
Energy: 0.8938109791266505
Energy: 0.8511915836280248
Energy: 0.8938109791253955
Energy: 0.9596070612983246
Energy: 0.915266762913842
Energy: 0.9596070612970696
Energy: 0.9152667629130053
Energy: 0.9596070612966514
Energy: 0.9152667629134236
Energy: 0.8512540199778382
Energy: 0.9602664473677432
Energy: 0.8512540199765833
Energy: 0.9602664473681617
Energy: 0.8512540199765833
Energy: 0.9602664473685799
Energy: 0.8072300832324238
Energy: 0.9463205909331129
Energy: 0.8072300832320055
Energy: 0.9463205909331129
Energy: 0.8072300832311688
Energy: 0.9463205909335312
Energy: 0.9100226626434812
Energy: 0.8089736333827353
Energy: 0.9100226626426445
Energy: 0.8089736333844084
Energy: 0.910022662643063
Energy: 0.808973633383572
Energy: 0.8455538879670661
Energy: 0.9259634082649782
Energy: 0.845553887965811
Energy: 0.9259634082649782
Energy: 0.8455538879679027
Energy: 0.9259634082653966

minimum gb energy = 0.7395052600645762 eV
minimum distance =  2.31667231397658 Angstroms
sigma value = 57


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

Energy: 0.930146982293806
Energy: 0.8770211283160804
Energy: 0.9301469822924436
Energy: 0.8770211283181237
Energy: 0.9301469822972116
Energy: 0.8770211283167615
Energy: 0.7676558525679956
Energy: 0.8533207533596804
Energy: 0.7676558525673145
Energy: 0.8533207533596804
Energy: 0.7676558525673145
Energy: 0.8533207533596804
Energy: 0.7396751963008916
Energy: 0.8393475488000732
Energy: 0.7396751963002104
Energy: 0.8393475488000732
Energy: 0.7396751963022538
Energy: 0.8393475488000732
Energy: 0.8882131050941753
Energy: 0.7784298470204318
Energy: 0.8882131050934942
Energy: 0.778429847021794
Energy: 0.8882131050941753
Energy: 0.778429847021113
Energy: 0.7655414028380888
Energy: 0.8931615624829305
Energy: 0.7655414028380888
Energy: 0.8931615624842929
Energy: 0.7655414028374077
Energy: 0.8931615624842929
Energy: 0.7543030719270881
Energy: 0.82371297575385
Energy: 0.7543030719277692
Energy: 0.8237129757511257
Energy: 0.7543030719270881
Energy: 0.82371297575385
Energy: 0.8310056527291401
Energy: 0.7575659403093701
Energy: 0.831005652728459
Energy: 0.7575659403114134
Energy: 0.831005652728459
Energy: 0.7575659403120946
Energy: 0.8657910144160694
Energy: 0.9088230412270875
Energy: 0.8657910144160694
Energy: 0.9088230412270875
Energy: 0.8657910144153883
Energy: 0.9088230412270875
Energy: 0.6999654762239964
Energy: 0.9067446895565521
Energy: 0.6999654762233154
Energy: 0.9067446895558712
Energy: 0.6999654762226343
Energy: 0.9067446895565521
Energy: 0.8851051074596269
Energy: 0.7281372543465616
Energy: 0.8851051074609892
Energy: 0.7281372543465616
Energy: 0.8851051074596269
Energy: 0.7281372543465616
Energy: 0.8308092234445439
Energy: 0.8897768913655618
Energy: 0.8308092234445439
Energy: 0.8897768913648806
Energy: 0.8308092234445439
Energy: 0.8897768913655618
Energy: 0.7193370738548772
Energy: 0.8868212786054335
Energy: 0.7193370738576018
Energy: 0.8868212786061147
Energy: 0.7193370738569207
Energy: 0.8868212786061147
Energy: 0.7978979939639381
Energy: 0.7525575779938501
Energy: 0.7978979939625759
Energy: 0.7525575779952125
Energy: 0.7978979939639381
Energy: 0.7525575779952125
Energy: 0.8947932606727562
Energy: 0.7997227654746055
Energy: 0.8947932606734373
Energy: 0.7997227654746055
Energy: 0.8947932606727562
Energy: 0.7997227654739244
Energy: 0.7378767734147932
Energy: 0.9076097082797032
Energy: 0.7378767734127497
Energy: 0.9076097082824276
Energy: 0.737876773414112
Energy: 0.9076097082803843
Energy: 0.862157639678929
Energy: 0.796687336766996
Energy: 0.86215763967961
Energy: 0.7966873367683583
Energy: 0.86215763967961
Energy: 0.7966873367690395
Energy: 0.9445018512968861
Energy: 0.7658052138405206
Energy: 0.9445018512975673
Energy: 0.7658052138412017
Energy: 0.9445018512975673
Energy: 0.7658052138412017
Energy: 0.8618588370874269
Energy: 0.9057818466773129
Energy: 0.8618588370860648
Energy: 0.9057818466773129
Energy: 0.8618588370881081
Energy: 0.9057818466779941
Energy: 0.8444241777732405
Energy: 0.8076947931719978
Energy: 0.8444241777725594
Energy: 0.8076947931719978
Energy: 0.8444241777732405
Energy: 0.8076947931713166
Energy: 0.9017259143654514
Energy: 0.7268546545859471
Energy: 0.9017259143661323
Energy: 0.7268546545859471
Energy: 0.9017259143647701
Energy: 0.726854654585266
Energy: 0.8240460250004694
Energy: 0.835323265941872
Energy: 0.8240460249997883
Energy: 0.8353232659411909
Energy: 0.8240460249991072
Energy: 0.835323265941872
Energy: 0.6909141935623255
Energy: 0.7905862417591611
Energy: 0.690914193560282
Energy: 0.7905862417577988
Energy: 0.6909141935568763
Energy: 0.7905862417598423
Energy: 0.9252524851454744
Energy: 0.7217793890700359
Energy: 0.9252524851441123
Energy: 0.721779389070717
Energy: 0.9252524851447933
Energy: 0.721779389070717
Energy: 0.7345286463277833
Energy: 0.8968469521592916
Energy: 0.7345286463271021
Energy: 0.8968469521599725
Energy: 0.7345286463277833
Energy: 0.8968469521599725
Energy: 0.8080251937187131
Energy: 0.8369924556714747
Energy: 0.8080251937187131
Energy: 0.8369924556714747
Energy: 0.8080251937180318
Energy: 0.8369924556721556
Energy: 0.8918003706825943
Energy: 0.7224659594194682
Energy: 0.8918003706825943
Energy: 0.7224659594201494
Energy: 0.8918003706839565
Energy: 0.7224659594201494
Energy: 0.6884682959372721
Energy: 0.806506023749525
Energy: 0.6884682959372721
Energy: 0.8065060237502062
Energy: 0.6884682959399966
Energy: 0.8065060237502062

minimum gb energy = 0.6884682959372721 eV
minimum distance =  2.32111693400054 Angstroms
sigma value = 43


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

Energy: 0.798617061685843
Energy: 0.7699742327753821
Energy: 0.7986170616853469
Energy: 0.7699742327758784
Energy: 0.7986170616838578
Energy: 0.7699742327758784
Energy: 0.6376436281764329
Energy: 0.7262841734109156
Energy: 0.6376436281769292
Energy: 0.7262841734104193
Energy: 0.6376436281769292
Energy: 0.7262841734104193
Energy: 0.607779412962227
Energy: 0.7799674099028503
Energy: 0.6077794129617308
Energy: 0.7799674099038428
Energy: 0.6077794129617308
Energy: 0.7799674099038428
Energy: 0.7732852445499225
Energy: 0.6217737958157509
Energy: 0.7732852445504187
Energy: 0.6217737958172399
Energy: 0.7732852445504187
Energy: 0.6217737958157509
Energy: 0.6361419442011982
Energy: 0.7976525978638862
Energy: 0.6361419442016946
Energy: 0.7976525978633899
Energy: 0.6361419442016946
Energy: 0.7976525978633899
Energy: 0.5977580481826449
Energy: 0.7561841832103632
Energy: 0.5977580481831412
Energy: 0.7561841832108595
Energy: 0.5977580481831412
Energy: 0.7561841832103632
Energy: 0.7395536953406207
Energy: 0.6291219880801883
Energy: 0.7395536953401244
Energy: 0.629121988079692
Energy: 0.7395536953401244
Energy: 0.6291219880801883
Energy: 0.7749966570217256
Energy: 0.7238919874893153
Energy: 0.7749966570207331
Energy: 0.7238919874893153
Energy: 0.7749966570212293
Energy: 0.7238919874893153
Energy: 0.5856793166539326
Energy: 0.7420760945020071
Energy: 0.58567931665294
Energy: 0.7420760945025033
Energy: 0.5856793166539326
Energy: 0.7420760945020071
Energy: 0.7617308681197937
Energy: 0.593246568053435
Energy: 0.7617308681197937
Energy: 0.5932465680529387
Energy: 0.7617308681197937
Energy: 0.5932465680519461
Energy: 0.7200822097104842
Energy: 0.7358731209725398
Energy: 0.7200822097104842
Energy: 0.7358731209725398
Energy: 0.7200822097099879
Energy: 0.7358731209730361
Energy: 0.5669898505649998
Energy: 0.7538862263598813
Energy: 0.5669898505654961
Energy: 0.7538862263603776
Energy: 0.5669898505645035
Energy: 0.7538862263603776
Energy: 0.7471034751804861
Energy: 0.5667519357017282
Energy: 0.7471034751794936
Energy: 0.5667519357017282
Energy: 0.7471034751804861
Energy: 0.5667519357017282
Energy: 0.6936373521246093
Energy: 0.7333470332000552
Energy: 0.6936373521251057
Energy: 0.7333470332000552
Energy: 0.6936373521246093
Energy: 0.7333470331995591
Energy: 0.5894120427257273
Energy: 0.7908075575308864
Energy: 0.5894120427252311
Energy: 0.7908075575308864
Energy: 0.5894120427242384
Energy: 0.79080755753039
Energy: 0.7158180995821128
Energy: 0.6033229662216589
Energy: 0.7158180995816165
Energy: 0.6033229662221553
Energy: 0.7158180995816165
Energy: 0.6033229662221553
Energy: 0.7439798331076363
Energy: 0.7743699938227583
Energy: 0.7439798331081326
Energy: 0.7743699938232547
Energy: 0.7439798331081326
Energy: 0.7743699938227583
Energy: 0.6043561388776547
Energy: 0.7579390330853862
Energy: 0.6043561388781509
Energy: 0.7579390330853862
Energy: 0.6043561388781509
Energy: 0.7579390330853862
Energy: 0.6760869993386919
Energy: 0.6207029937087786
Energy: 0.6760869993372031
Energy: 0.6207029937082823
Energy: 0.6760869993391881
Energy: 0.6207029937082823
Energy: 0.7819710815320772
Energy: 0.7597381619877733
Energy: 0.7819710815315809
Energy: 0.7597381619877733
Energy: 0.7819710815315809
Energy: 0.7597381619877733
Energy: 0.6122208405772197
Energy: 0.7963739642274311
Energy: 0.6122208405797012
Energy: 0.7963739642269347
Energy: 0.6122208405816862
Energy: 0.7963739642254458
Energy: 0.7300317422431035
Energy: 0.6413534627103689
Energy: 0.7300317422426073
Energy: 0.6413534627118577
Energy: 0.7300317422421109
Energy: 0.6413534627098726
Energy: 0.7974369450787314
Energy: 0.6292584107118553
Energy: 0.7974369450772424
Energy: 0.6292584107118553
Energy: 0.7974369450782351
Energy: 0.6292584107118553
Energy: 0.6999581325559515
Energy: 0.7951728433430715
Energy: 0.6999581325559515
Energy: 0.7951728433425751
Energy: 0.6999581325559515
Energy: 0.7951728433435677
Energy: 0.6986583713980903
Energy: 0.6325846609110781
Energy: 0.6986583713980903
Energy: 0.6325846609110781
Energy: 0.6986583713966014
Energy: 0.6325846609110781
Energy: 0.7502458212934889
Energy: 0.5997460161116114
Energy: 0.7502458212934889
Energy: 0.5997460161116114
Energy: 0.7502458212939852
Energy: 0.5997460161121076
Energy: 0.6876752868258394
Energy: 0.7277395634337843
Energy: 0.6876752868268321
Energy: 0.7277395634337843
Energy: 0.6876752868258394
Energy: 0.727739563433288
Energy: 0.6579209066915116
Energy: 0.620204886337793
Energy: 0.6579209066925041
Energy: 0.6202048863353117
Energy: 0.657920906692008
Energy: 0.620204886335808
Energy: 0.7495891747992335
Energy: 0.5821861390466805
Energy: 0.7495891747987371
Energy: 0.5821861390466805
Energy: 0.7495891747987371
Energy: 0.5821861390466805
Energy: 0.5948920999829609
Energy: 0.6998479462674394
Energy: 0.5948920999814721
Energy: 0.6998479462679357
Energy: 0.5948920999824646
Energy: 0.6998479462679357
Energy: 0.716063996934203
Energy: 0.7804237275003307
Energy: 0.716063996934203
Energy: 0.7804237275003307
Energy: 0.7160639969346992
Energy: 0.7804237275003307
Energy: 0.7502143887343123
Energy: 0.5766142729673535
Energy: 0.7502143887338161
Energy: 0.5766142729668572
Energy: 0.7502143887343123
Energy: 0.5766142729673535
Energy: 0.5757874677440836
Energy: 0.7493414509505427
Energy: 0.5757874677445799
Energy: 0.7493414509505427
Energy: 0.5757874677440836
Energy: 0.749341450951039
Energy: 0.7294064551240146
Energy: 0.7289987680201576
Energy: 0.7294064551240146
Energy: 0.7289987680201576
Energy: 0.729406455124511
Energy: 0.7289987680201576
Energy: 0.7517361959244785
Energy: 0.5613395338439252
Energy: 0.7517361959239822
Energy: 0.5613395338419401
Energy: 0.7517361959239822
Energy: 0.5613395338459104
Energy: 0.539259825531813
Energy: 0.7871430508003856
Energy: 0.5392598255328055
Energy: 0.7871430508008818
Energy: 0.5392598255323092
Energy: 0.7871430508003856

minimum gb energy = 0.539259825531813 eV
minimum distance =  2.31071661702233 Angstroms
sigma value = 81


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

Energy: 0.018206740060929004
Energy: 0.04492338834930354
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.018206740060929004
Energy: 0.04492338834930354
Energy: 0.22764017509314957
Energy: 0.26844068095529044
Energy: 0.2276401750913261
Energy: 0.26844068095529044
Energy: 0.2276401750913261
Energy: 0.26844068095711393
Energy: 0.23108042588878958
Energy: 0.019053526139184932
Energy: 0.23108042588878958
Energy: 0.019053526142831834
Energy: 0.23108042588878958
Energy: 0.019053526166536685
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.018206740060929004
Energy: 0.04492338834930354
Energy: 0.2276401750913261
Energy: 0.2684406809862891
Energy: 0.2276401750913261
Energy: 0.268440680989936
Energy: 0.2276401750913261
Energy: 0.2684406809954063
Energy: 0.23108042588878958
Energy: 0.01905352730022529
Energy: 0.23108042588878958
Energy: 0.019053526948465207
Energy: 0.23108042588878958
Energy: 0.019053527021361764
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.22764017509679643
Energy: 0.2684406810482449
Energy: 0.2276401750913261
Energy: 0.26844068105371527
Energy: 0.2276401750913261
Energy: 0.26844068105371527
Energy: 0.23108042588878958
Energy: 0.019053530469795833
Energy: 0.23108042588878958
Energy: 0.019053530344019225
Energy: 0.23108042588878958
Energy: 0.019053530453384787
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.01820674006275245
Energy: 0.04492338834930354
Energy: 0.01820674006275245
Energy: 0.04492338834930354

minimum gb energy = 0.018206740060929004 eV
minimum distance =  2.49164948957836 Angstroms
sigma value = 3


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

Energy: 0.8735323707853203
Energy: 0.6241220794201437
Energy: 0.8735323707853203
Energy: 0.6241220794195981
Energy: 0.8735323707847745
Energy: 0.6241220794195981
Energy: 0.6495240444617029
Energy: 0.5913345279893174
Energy: 0.6495240444622485
Energy: 0.5913345279893174
Energy: 0.6495240444627942
Energy: 0.5913345279898631
Energy: 0.6138576057459416
Energy: 0.5831703321875281
Energy: 0.6138576057464873
Energy: 0.5831703321858911
Energy: 0.6138576057464873
Energy: 0.5831703321869824
Energy: 0.7096300417880087
Energy: 0.6193631203854697
Energy: 0.7096300417885545
Energy: 0.6193631203854697
Energy: 0.7096300417874631
Energy: 0.6193631203854697
Energy: 0.6059664321707025
Energy: 0.6195061086730792
Energy: 0.6059664321707025
Energy: 0.6195061086768989
Energy: 0.6059664321685199
Energy: 0.619506108671988
Energy: 0.6573309594009543
Energy: 0.6207427401696853
Energy: 0.6573309594020457
Energy: 0.6207427401713224
Energy: 0.6573309594025913
Energy: 0.6207427401691396
Energy: 0.6623727661611535
Energy: 0.6759411518986519
Energy: 0.6623727661595165
Energy: 0.6759411518986519
Energy: 0.6623727661595165
Energy: 0.6759411518986519
Energy: 0.669011456643693
Energy: 0.6199224968042836
Energy: 0.6690114566442387
Energy: 0.6199224968004639
Energy: 0.6690114566447843
Energy: 0.6199224968021008
Energy: 0.6392548596039126
Energy: 0.6537529447464786
Energy: 0.6392548596066409
Energy: 0.6537529447464786
Energy: 0.6392548596066409
Energy: 0.6537529447464786
Energy: 0.8427067323814716
Energy: 0.637957808302307
Energy: 0.8427067323814716
Energy: 0.6379578083017613
Energy: 0.8427067323814716
Energy: 0.6379578083012156
Energy: 0.573234984595816
Energy: 0.6746356768536483
Energy: 0.5732349846018183
Energy: 0.6746356768531027
Energy: 0.57323498459909
Energy: 0.6746356768531027
Energy: 0.6822662239191066
Energy: 0.6996462945637345
Energy: 0.6822662239191066
Energy: 0.6996462945642802
Energy: 0.6822662239191066
Energy: 0.6996462945637345
Energy: 0.62556071706493
Energy: 0.6014290690402889
Energy: 0.6255607170654757
Energy: 0.6014290690397432
Energy: 0.625560717066567
Energy: 0.6014290690397432
Energy: 0.6570662885399473
Energy: 0.6502938930884535
Energy: 0.6570662885399473
Energy: 0.6502938930884535
Energy: 0.6570662885399473
Energy: 0.6502938930879079
Energy: 0.5670501236264953
Energy: 0.6216878712458763
Energy: 0.567050123627041
Energy: 0.6216878712447851
Energy: 0.567050123627041
Energy: 0.6216878712442393
Energy: 0.6224533839891083
Energy: 0.6677204365933807
Energy: 0.6224533839891083
Energy: 0.6677204365933807
Energy: 0.6224533839907453
Energy: 0.6677204365933807
Energy: 0.626467426737652
Energy: 0.6829064594957426
Energy: 0.6264674267371062
Energy: 0.6829064594962883
Energy: 0.6264674267371062
Energy: 0.6829064595006538
Energy: 0.5786267882912024
Energy: 0.6233109676655221
Energy: 0.5786267882912024
Energy: 0.6233109676655221
Energy: 0.5786267882917481
Energy: 0.6233109676655221
Energy: 0.5770202065011886
Energy: 0.6908527289087462
Energy: 0.5770202065011886
Energy: 0.6908527289092917
Energy: 0.5770202065011886
Energy: 0.6908527289082004
Energy: 0.5208211404677524
Energy: 0.7289902859017671
Energy: 0.5208211404677524
Energy: 0.7289902858990387
Energy: 0.5208211404682981
Energy: 0.7289902859012214
Energy: 0.6312256347663561
Energy: 0.6579135433067527
Energy: 0.6312256347658104
Energy: 0.657913543306207
Energy: 0.6312256347669017
Energy: 0.6579135433056614
Energy: 0.6918347870954507
Energy: 0.6687278305259358
Energy: 0.6918347871030901
Energy: 0.6687278305253902
Energy: 0.6918347870889027
Energy: 0.6687278305259358
Energy: 0.6470524751924018
Energy: 0.7160428027448793
Energy: 0.6470524751924018
Energy: 0.7160428027448793
Energy: 0.6470524751924018
Energy: 0.7160428027443335
Energy: 0.6380722570833067
Energy: 0.6198991571757523
Energy: 0.6380722570816697
Energy: 0.6198991571757523
Energy: 0.6380722570805784
Energy: 0.619899157176298
Energy: 0.7023689976069515
Energy: 0.6148508418464461
Energy: 0.7023689976058602
Energy: 0.6148508418491744
Energy: 0.7023689976064058
Energy: 0.6148508418497202
Energy: 0.6282768407428417
Energy: 0.673981675331938
Energy: 0.6282768407417504
Energy: 0.673981675331938
Energy: 0.6282768407417504
Energy: 0.673981675331938
Energy: 0.7455099665307063
Energy: 0.6085949077622853
Energy: 0.7455099665307063
Energy: 0.608594907762831
Energy: 0.7455099665312519
Energy: 0.6085949077622853
Energy: 0.6638030366090971
Energy: 0.6087370364079168
Energy: 0.6638030366090971
Energy: 0.6087370364084624
Energy: 0.6638030366096429
Energy: 0.6087370364084624
Energy: 0.6261081658828147
Energy: 0.8577846294813242
Energy: 0.6261081658817235
Energy: 0.8577846294813242
Energy: 0.6261081658817235
Energy: 0.8577846294813242
Energy: 0.7656781660222965
Energy: 0.5833643709286682
Energy: 0.7656781660222965
Energy: 0.583364370937399
Energy: 0.7656781660228421
Energy: 0.5833643709363077
Energy: 0.651705743837635
Energy: 0.5677440485722464
Energy: 0.651705743837635
Energy: 0.5677440485717006
Energy: 0.651705743837635
Energy: 0.567744048571155
Energy: 0.6149134718356499
Energy: 0.6235130737511945
Energy: 0.6149134718356499
Energy: 0.6235130737517401
Energy: 0.6149134718356499
Energy: 0.6235130737517401
Energy: 0.6664224559455392
Energy: 0.565294775091289
Energy: 0.6664224559449934
Energy: 0.5652947750923804
Energy: 0.6664224559455392
Energy: 0.5652947750918346

minimum gb energy = 0.5208211404677524 eV
minimum distance =  2.39413919650139 Angstroms
sigma value = 67


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

Energy: 0.863313935946506
Energy: 0.7775733324340566
Energy: 0.863313935949616
Energy: 0.7775733324340566
Energy: 0.8633139359395081
Energy: 0.7775733324348342
Energy: 0.7329704591355372
Energy: 0.8342787926296452
Energy: 0.7329704591332046
Energy: 0.8342787926296452
Energy: 0.7329704591013969
Energy: 0.8342787926296452
Energy: 0.7845499451143623
Energy: 0.7942583937461034
Energy: 0.7845499451159174
Energy: 0.7942583937461034
Energy: 0.7845499451159174
Energy: 0.7942583937461034
Energy: 0.8172874910697738
Energy: 0.8025984076192024
Energy: 0.8172874910705511
Energy: 0.8025984076192024
Energy: 0.8172874910705511
Energy: 0.8025984076192024
Energy: 0.7939850590688879
Energy: 0.801883540759738
Energy: 0.7939850590681103
Energy: 0.801883540759738
Energy: 0.7939850590681103
Energy: 0.801883540759738
Energy: 0.8413796254710225
Energy: 0.807324012522512
Energy: 0.8413796254710225
Energy: 0.8073240125217345
Energy: 0.8413796254710225
Energy: 0.8073240125217345
Energy: 1.0439819263986865
Energy: 0.8182854059084542
Energy: 1.0439819263979089
Energy: 0.8182854059107867
Energy: 1.0439819263979089
Energy: 0.8182854059092318
Energy: 0.8306861870953854
Energy: 0.8044502775864286
Energy: 0.8306861870953854
Energy: 0.8044502775864286
Energy: 0.8306861870953854
Energy: 0.8044502775872061
Energy: 0.8326097340721644
Energy: 0.8528474975803316
Energy: 0.8326097340713869
Energy: 0.8528474975803316
Energy: 0.8326097340721644
Energy: 0.8528474975803316
Energy: 0.8223206549461989
Energy: 0.7695020761818909
Energy: 0.8223206549461989
Energy: 0.7695020761803358
Energy: 0.8223206549461989
Energy: 0.7695020761818909
Energy: 0.814570087538742
Energy: 0.8177480547522228
Energy: 0.814570087537187
Energy: 0.8177480547514453
Energy: 0.8145700875379644
Energy: 0.8177480547522228
Energy: 0.774214947516912
Energy: 0.7685479077680338
Energy: 0.7742149475161345
Energy: 0.7685479077672563
Energy: 0.7742149475176895
Energy: 0.7685479077695889
Energy: 0.7810725768829938
Energy: 0.8842130164880987
Energy: 0.7810725768822163
Energy: 0.8842130164880987
Energy: 0.7810725768829938
Energy: 0.8842130164880987
Energy: 0.8393700249526174
Energy: 0.832835444623667
Energy: 0.8393700249526174
Energy: 0.8328354446252219
Energy: 0.8393700249518399
Energy: 0.8328354446252219
Energy: 0.7955304598607377
Energy: 0.7550186834228373
Energy: 0.7955304598607377
Energy: 0.7550186835417274
Energy: 0.7955304598599602
Energy: 0.7550186835401723
Energy: 0.8682724926672979
Energy: 0.8358790648041343
Energy: 0.8682724926680754
Energy: 0.8358790648041343
Energy: 0.8682724926672979
Energy: 0.8358790648033568
Energy: 0.8145005167844384
Energy: 0.8262993120026141
Energy: 0.8145005167844384
Energy: 0.8262993120026141
Energy: 0.8145005167844384
Energy: 0.8262993120041692
Energy: 0.8234489774554326
Energy: 0.759481674589084
Energy: 0.8234489774554326
Energy: 0.7594816745898615
Energy: 0.8234489774546553
Energy: 0.7594816745898615
Energy: 0.8329213656348109
Energy: 0.8251759037251284
Energy: 0.8329213656348109
Energy: 0.8251759037251284
Energy: 0.8329213656348109
Energy: 0.8251759037251284
Energy: 0.8809534777805051
Energy: 1.052498900948151
Energy: 0.8809534777805051
Energy: 1.0524989009473733
Energy: 0.8809534777805051
Energy: 1.052498900948151
Energy: 0.7923856155387858
Energy: 0.7540833656777077
Energy: 0.7923856155380082
Energy: 0.7540833656784852
Energy: 0.7923856155387858
Energy: 0.7540833656777077
Energy: 0.7708899609056687
Energy: 0.7607613569245896
Energy: 0.7708899609064462
Energy: 0.7607613569245896
Energy: 0.7708899609056687
Energy: 0.7607613569238121
Energy: 0.7594436333454367
Energy: 0.8357940051929528
Energy: 0.7594436333446593
Energy: 0.8357940051937303
Energy: 0.7594436333438817
Energy: 0.8357940051937303

minimum gb energy = 0.7329704591013969 eV
minimum distance =  2.32671848495063 Angstroms
sigma value = 33


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

Energy: 0.9620086516564794
Energy: 0.8654584067903173
Energy: 0.9620086516554929
Energy: 0.8654584067908107
Energy: 0.9620086516540132
Energy: 0.8654584067913037
Energy: 0.9341081276925338
Energy: 0.9257891551187639
Energy: 0.9341081276925338
Energy: 0.9257891551187639
Energy: 0.9341081276930271
Energy: 0.9257891551187639
Energy: 0.9325926672730748
Energy: 0.8718410127615492
Energy: 0.9325926672725815
Energy: 0.8718410127610562
Energy: 0.9325926672730748
Energy: 0.8718410127610562
Energy: 0.9341528486537388
Energy: 0.9034105978939351
Energy: 0.9341528486547253
Energy: 0.9034105978944283
Energy: 0.9341528486547253
Energy: 0.9034105978944283
Energy: 0.9459698806945431
Energy: 0.948881607847765
Energy: 0.9459698806945431
Energy: 0.9488816078482583
Energy: 0.9459698806945431
Energy: 0.948881607847765
Energy: 1.030948011753261
Energy: 0.8795313315428419
Energy: 1.030948011753261
Energy: 0.8795313315428419
Energy: 1.0309480117537542
Energy: 0.8795313315433352
Energy: 0.8648332780285448
Energy: 0.921294804198905
Energy: 0.8648332780295314
Energy: 0.9212948041993982
Energy: 0.8648332780295314
Energy: 0.9212948041993982
Energy: 0.8802388688447345
Energy: 0.9445633153848692
Energy: 0.8802388688437481
Energy: 0.9445633153853624
Energy: 0.8802388688437481
Energy: 0.9445633153853624
Energy: 0.8775196996813732
Energy: 0.8837246907737956
Energy: 0.8775196996818665
Energy: 0.883724690776755
Energy: 0.87751969968088
Energy: 0.8837246907747819
Energy: 0.9385509690065906
Energy: 0.9595341816021832
Energy: 0.9385509690065906
Energy: 0.8933044813912471
Energy: 0.9385509690060974
Energy: 0.8933044813912471
Energy: 0.8880461780674992
Energy: 0.9803471975099051
Energy: 0.8880461780655262
Energy: 0.9803471975099051
Energy: 0.8880461780655262
Energy: 0.9803471975099051
Energy: 0.8948054733729423
Energy: 0.9228188356823799
Energy: 0.8948054733729423
Energy: 0.9228188356813936
Energy: 0.8948054733729423
Energy: 0.9228188356828733
Energy: 0.9445524707343531
Energy: 0.9304212107364062
Energy: 0.9445524707333667
Energy: 0.9304212107359128
Energy: 0.9445524707343531
Energy: 0.9304212107359128
Energy: 0.8734926973365673
Energy: 0.9180060219724765
Energy: 0.8734926973365673
Energy: 0.9180060219724765
Energy: 0.8734926973331146
Energy: 0.9180060219724765
Energy: 0.9574296887540817
Energy: 0.8541754375416796
Energy: 0.9574296887521088
Energy: 0.8541754375416796
Energy: 0.9574296887521088
Energy: 0.8541754375416796
Energy: 0.9342247203303731
Energy: 0.9110042162570744
Energy: 0.9342247203313596
Energy: 0.911004216256581
Energy: 0.9342247203288933
Energy: 0.9110042162570744
Energy: 1.0304569633499934
Energy: 0.9132287962497554
Energy: 1.0304569633504868
Energy: 0.9132287962497554
Energy: 1.0304569633495002
Energy: 0.9132287962502487
Energy: 0.8947266515941964
Energy: 0.9206977143700463
Energy: 0.8947266515946897
Energy: 0.9206977143700463
Energy: 0.8947266515937031
Energy: 0.9206977143700463
Energy: 0.9262625102043107
Energy: 0.9255047870798417
Energy: 0.9262625102023379
Energy: 0.9255047870798417
Energy: 0.9262625102038176
Energy: 0.9255047870798417
Energy: 0.8878747173838668
Energy: 0.9117241948137008
Energy: 0.8878747173843601
Energy: 0.9117241948137008
Energy: 0.8878747173833734
Energy: 0.9117241948132077
Energy: 0.8651743951016094
Energy: 0.9075868813713818
Energy: 0.8651743951085149
Energy: 0.9075868813713818
Energy: 0.8651743951050622
Energy: 0.9075868813713818
Energy: 0.86141637066942
Energy: 0.8778295545612042
Energy: 0.8614163706477621
Energy: 0.877829554560711
Energy: 0.8614163706492418
Energy: 0.877829554560711
Energy: 0.9164288148371461
Energy: 0.9802608030790253
Energy: 0.91642881483468
Energy: 0.9802608030785321
Energy: 0.9164288148381328
Energy: 0.9802608030785321
Energy: 0.9031614751668805
Energy: 0.8714684572176568
Energy: 0.9031614751654008
Energy: 0.8714684572156838
Energy: 0.9031614751658942
Energy: 0.8714684572181499
Energy: 0.9282401673546705
Energy: 0.8518991701701285
Energy: 0.9282401673541772
Energy: 0.8518991701676621
Energy: 0.9282401673551637
Energy: 0.851899170169142
Energy: 0.9283669871467006
Energy: 0.9984227760176088
Energy: 0.9283669871462074
Energy: 0.9984227760171157
Energy: 0.9283669871457142
Energy: 0.9984227760171157
Energy: 0.8682277146695779
Energy: 0.8810935593294086
Energy: 0.8682277146710576
Energy: 0.8810935593279288
Energy: 0.8682277146641522
Energy: 0.881093559328422
Energy: 0.8407659062394582
Energy: 0.9754680201128579
Energy: 0.8407659062429111
Energy: 0.910895538590247
Energy: 0.840765906238965
Energy: 0.910895538590247
Energy: 0.8883508695555089
Energy: 0.9498989750971719
Energy: 0.8883508695564954
Energy: 0.9498989750971719
Energy: 0.8883508695550156
Energy: 0.9498989750966785
Energy: 0.9379087941764455
Energy: 0.9189496507867897
Energy: 0.9379087941764455
Energy: 0.9189496507867897
Energy: 0.9379087941769388
Energy: 0.9189496507877761
Energy: 0.908589252940374
Energy: 0.92060022149552
Energy: 0.9085892529408671
Energy: 0.9206002214960132
Energy: 0.9085892529398807
Energy: 0.9206002214960132
Energy: 0.9534703533925856
Energy: 0.9146749286471386
Energy: 0.9534703533925856
Energy: 0.9146749286471386
Energy: 0.953470353391599
Energy: 0.9146749286471386
Energy: 0.7762304739998397
Energy: 0.9149519970047758
Energy: 0.7762304739998397
Energy: 0.9149519970047758
Energy: 0.7762304740003331
Energy: 0.9149519970052691
Energy: 0.9562995639114366
Energy: 0.8790774424701124
Energy: 0.9562995639094636
Energy: 0.8790774424701124
Energy: 0.9562995639089703
Energy: 0.8790774424701124
Energy: 0.917363082542724
Energy: 0.8726799669630118
Energy: 0.9173630825442037
Energy: 0.8726799669620251
Energy: 0.9173630825432174
Energy: 0.8726799669620251
Energy: 0.9836649863447555
Energy: 0.8959862347840984
Energy: 0.9836649863452488
Energy: 0.8959862347840984
Energy: 0.9836649863452488
Energy: 0.8959862347836053
Energy: 0.9195479613226726
Energy: 0.9158553614217149
Energy: 0.9195479613246456
Energy: 0.9158553614212217
Energy: 0.9195479613246456
Energy: 0.9158553614212217

minimum gb energy = 0.7762304739998397 eV
minimum distance =  2.32701185478876 Angstroms
sigma value = 41


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

Energy: 1.108205726853641
Energy: 1.1254710422671
Energy: 1.108205726852294
Energy: 1.1254710422671
Energy: 1.108205726853641
Energy: 1.1254710422671
Energy: 1.0085949224081572
Energy: 1.071782014341647
Energy: 1.008594922413544
Energy: 1.071782014341647
Energy: 1.008594922409504
Energy: 1.071782014341647
Energy: 1.1383387211786582
Energy: 1.0396708787753004
Energy: 1.138338721180005
Energy: 1.0396708787739537
Energy: 1.138338721180005
Energy: 1.039670878772607
Energy: 1.0882905854041782
Energy: 1.111380575240998
Energy: 1.0882905854028317
Energy: 1.111380575240998
Energy: 1.0882905854041782
Energy: 1.111380575240998
Energy: 1.1373774226018405
Energy: 1.0710750045916175
Energy: 1.1373774226031874
Energy: 1.0710750045929642
Energy: 1.1373774226018405
Energy: 1.0710750045929642
Energy: 1.1051407026775535
Energy: 1.175359232195467
Energy: 1.1051407026789004
Energy: 1.1753592321968136
Energy: 1.1051407026775535
Energy: 1.175359232195467
Energy: 1.092177287363658
Energy: 1.240722588567331
Energy: 1.092177287363658
Energy: 1.240722588567331
Energy: 1.092177287363658
Energy: 1.2407225885646376
Energy: 1.102352884382195
Energy: 1.0739111799264425
Energy: 1.102352884382195
Energy: 1.0739111799277892
Energy: 1.102352884382195
Energy: 1.0739111799277892
Energy: 1.0617341092926995
Energy: 1.0752561191857228
Energy: 1.0617341092926995
Energy: 1.0752561191884162
Energy: 1.0617341092940462
Energy: 1.0752561191830294
Energy: 1.094874115204263
Energy: 1.0599316143022077
Energy: 1.0948741152029164
Energy: 1.0599316143022077
Energy: 1.0948741152029164
Energy: 1.0599316143022077
Energy: 1.0126520480859431
Energy: 1.0387648587024394
Energy: 1.0126520480859431
Energy: 1.038764858703786
Energy: 1.0126520480859431
Energy: 1.0387648587078262
Energy: 1.0827859277490766
Energy: 1.0475387341547002
Energy: 1.0827859277477299
Energy: 1.0475387341533535
Energy: 1.0827859277477299
Energy: 1.0475387341533535
Energy: 1.103701582798869
Energy: 1.1107869037233769
Energy: 1.103701582798869
Energy: 1.1107869037233769
Energy: 1.103701582798869
Energy: 1.11078690372203
Energy: 1.1259999220000712
Energy: 1.0660457570107635
Energy: 1.1259999220000712
Energy: 1.0660457570107635
Energy: 1.1259999219987245
Energy: 1.06604575701211

minimum gb energy = 1.0085949224081572 eV
minimum distance =  2.33175236392556 Angstroms
sigma value = 11


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

Energy: 1.2472712662480905
Energy: 1.2207811759702825
Energy: 1.2472712662480905
Energy: 1.2207811759708738
Energy: 1.2472712662469072
Energy: 1.2207811759708738
Energy: 1.1804715794290626
Energy: 1.182013626541823
Energy: 1.180471579429654
Energy: 1.182013626541823
Energy: 1.1804715794308374
Energy: 1.182013626541823
Energy: 1.247391633554501
Energy: 1.187309948412288
Energy: 1.247391633554501
Energy: 1.1873099484116965
Energy: 1.247391633554501
Energy: 1.187309948412288
Energy: 1.182848187388506
Energy: 1.1734327263717585
Energy: 1.182848187388506
Energy: 1.1734327263717585
Energy: 1.1828481873890977
Energy: 1.1734327263717585
Energy: 1.2450451350149332
Energy: 1.1592573255920058
Energy: 1.2450451350149332
Energy: 1.1592573255920058
Energy: 1.245045135015525
Energy: 1.1592573255920058
Energy: 1.1514791993173494
Energy: 1.2043987291494558
Energy: 1.1514791993167577
Energy: 1.2043987291447231
Energy: 1.1514791993161662
Energy: 1.2043987291470897
Energy: 1.1870689842819393
Energy: 1.22997877286332
Energy: 1.1870689842819393
Energy: 1.22997877286332
Energy: 1.1870689842819393
Energy: 1.22997877286332
Energy: 1.1945958626273734
Energy: 1.1910866512302496
Energy: 1.1945958626273734
Energy: 1.1910866512302496
Energy: 1.1945958626273734
Energy: 1.1910866512302496
Energy: 1.2089967821239713
Energy: 1.1677905497799554
Energy: 1.2089967821239713
Energy: 1.1677905497799554
Energy: 1.2089967821239713
Energy: 1.1677905497799554
Energy: 1.1367993017267586
Energy: 1.2419017596637283
Energy: 1.1367993017267586
Energy: 1.2419017596637283
Energy: 1.1367993017267586
Energy: 1.2419017596637283
Energy: 1.1688098882741254
Energy: 1.1947750094768865
Energy: 1.168809888274717
Energy: 1.1947750094768865
Energy: 1.168809888274717
Energy: 1.1947750094768865
Energy: 1.1832756429339428
Energy: 1.205058826638083
Energy: 1.183275642933351
Energy: 1.2050588266374918
Energy: 1.1832756429339428
Energy: 1.205058826638083
Energy: 1.189496393969001
Energy: 1.2214165561409396
Energy: 1.189496393969001
Energy: 1.2214165561403483
Energy: 1.189496393969001
Energy: 1.2214165561409396
Energy: 1.2246223242228897
Energy: 1.2133567839465311
Energy: 1.2246223242222982
Energy: 1.2133567839465311
Energy: 1.2246223242228897
Energy: 1.2133567839465311
Energy: 1.1628090328951404
Energy: 1.1876568213105863
Energy: 1.1628090328957321
Energy: 1.1876568213111778
Energy: 1.1628090328951404
Energy: 1.1876568213105863
Energy: 1.1890568775583876
Energy: 1.2260036904617546
Energy: 1.1890568775583876
Energy: 1.2260036904617546
Energy: 1.189056877557796
Energy: 1.2260036904623464
Energy: 1.1333898636271817
Energy: 1.2131486881788498
Energy: 1.1333898636271817
Energy: 1.2131486881788498
Energy: 1.1333898636277735
Energy: 1.2131486881788498
Energy: 1.187851765596024
Energy: 1.19030850476016
Energy: 1.187851765597207
Energy: 1.19030850476016
Energy: 1.187851765597207
Energy: 1.1903085047607518
Energy: 1.155497293164203
Energy: 1.1683838111840834
Energy: 1.155497293165386
Energy: 1.1683838111840834
Energy: 1.155497293164203
Energy: 1.1683838111840834
Energy: 1.2261829643892168
Energy: 1.1772106115913652
Energy: 1.2261829643892168
Energy: 1.1772106115919567
Energy: 1.2261829643892168
Energy: 1.1772106115919567
Energy: 1.2947648037676078
Energy: 1.1989233545446853
Energy: 1.2947648037676078
Energy: 1.1989233545458686
Energy: 1.2947648037681991
Energy: 1.1989233545452769
Energy: 1.2439694732471112
Energy: 1.1830302947445572
Energy: 1.2439694732471112
Energy: 1.1830302947439655
Energy: 1.2439694732471112
Energy: 1.1830302947274005
Energy: 1.2324248899613615
Energy: 1.190105619620264
Energy: 1.2324248899613615
Energy: 1.190105619620264
Energy: 1.2324248899613615
Energy: 1.190105619620264
Energy: 1.1889135143467353
Energy: 1.184052800670085
Energy: 1.1889135143461436
Energy: 1.184052800670085
Energy: 1.1889135143461436
Energy: 1.184052800670085
Energy: 1.1549419067890316
Energy: 1.2039063878829097
Energy: 1.1549419067890316
Energy: 1.2039063878835015
Energy: 1.1549419067896234
Energy: 1.2039063878835015
Energy: 1.1905143798927138
Energy: 1.2065994018051385
Energy: 1.1905143798927138
Energy: 1.20659940180573
Energy: 1.1905143798927138
Energy: 1.20659940180573
Energy: 1.15893320447068
Energy: 1.228780251940924
Energy: 1.1589332044712717
Energy: 1.2287802519403326
Energy: 1.15893320447068
Energy: 1.228780251940924
Energy: 1.1951695898775463
Energy: 1.245806375485335
Energy: 1.1951695898775463
Energy: 1.2458063754847435
Energy: 1.1951695898775463
Energy: 1.2458063754847435
Energy: 1.216709116957412
Energy: 1.213788133848933
Energy: 1.216709116957412
Energy: 1.2137881338495247
Energy: 1.216709116957412
Energy: 1.2137881338495247
Energy: 1.1752733148498553
Energy: 1.2002991978035726
Energy: 1.1752733148504466
Energy: 1.2002991978035726
Energy: 1.1752733148498553
Energy: 1.2002991978035726
Energy: 1.158576014838518
Energy: 1.2471520973540469
Energy: 1.158576014838518
Energy: 1.2471520973540469
Energy: 1.158576014838518
Energy: 1.2471520973528636

minimum gb energy = 1.1333898636271817 eV
minimum distance =  2.3358316309213 Angstroms
sigma value = 57


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

Energy: 1.0865174191860822
Energy: 1.1884635958244383
Energy: 1.0865174191850295
Energy: 1.1884635958244383
Energy: 1.0865174191850295
Energy: 1.1884635958244383
Energy: 1.1963917980578873
Energy: 1.2186105747689597
Energy: 1.1963917980568346
Energy: 1.218610574767907
Energy: 1.1963917980568346
Energy: 1.218610574767907
Energy: 1.2476896186037865
Energy: 1.1623379322913676
Energy: 1.2476896186037865
Energy: 1.1623379322903147
Energy: 1.2476896186037865
Energy: 1.1623379322913676
Energy: 1.180463117992835
Energy: 1.2732684742895617
Energy: 1.180463117992835
Energy: 1.2732684742895617
Energy: 1.1804631179938878
Energy: 1.2732684742895617
Energy: 1.2493332697639628
Energy: 1.162705619117645
Energy: 1.2493332697639628
Energy: 1.162705619117645
Energy: 1.2493332697639628
Energy: 1.162705619117645
Energy: 1.196635303147243
Energy: 1.248808132251996
Energy: 1.1966353031461903
Energy: 1.248808132251996
Energy: 1.1966353031451373
Energy: 1.248808132251996
Energy: 1.0865174191839768
Energy: 1.1884635958254908
Energy: 1.0865174191850295
Energy: 1.1884635958254908
Energy: 1.0865174191860822
Energy: 1.1884635958244383
Energy: 1.1963917980589402
Energy: 1.2186105747689597
Energy: 1.1963917980578873
Energy: 1.2186105747689597
Energy: 1.1963917980589402
Energy: 1.2186105747689597
Energy: 1.2476896186037865
Energy: 1.1623379322913676
Energy: 1.2476896186037865
Energy: 1.1623379322913676
Energy: 1.2476896186037865
Energy: 1.1623379322913676
Energy: 1.1804631179938878
Energy: 1.3494290045851998
Energy: 1.1804631179938878
Energy: 1.3494290045851998
Energy: 1.1804631179938878
Energy: 1.3494290045851998
Energy: 1.2493332697670732
Energy: 1.1627056191165923
Energy: 1.2493332697670732
Energy: 1.1627056191165923
Energy: 1.2493332697670732
Energy: 1.1627056191165923
Energy: 1.196635303147243
Energy: 1.1580132173173943
Energy: 1.196635303148296
Energy: 1.1580132173194997
Energy: 1.196635303147243
Energy: 1.1580132173194997
Energy: 1.0865174191860822
Energy: 1.1884635958244383
Energy: 1.0865174191850295
Energy: 1.1884635958244383
Energy: 1.0865174191871352
Energy: 1.1884635958244383
Energy: 1.1963917980568346
Energy: 1.2186105747689597
Energy: 1.1963917980578873
Energy: 1.2186105747689597
Energy: 1.1963917980568346
Energy: 1.2186105747689597
Energy: 1.2476896186037865
Energy: 1.1623379322903147
Energy: 1.2476896186048392
Energy: 1.1623379322903147
Energy: 1.2476896186037865
Energy: 1.1623379322913676
Energy: 1.180463117992835
Energy: 1.4747849744396324
Energy: 1.180463117992835
Energy: 1.4747849744375272
Energy: 1.180463117992835
Energy: 1.4747849744312105
Energy: 1.2493332697639628
Energy: 1.162705619117645
Energy: 1.2493332697639628
Energy: 1.162705619117645
Energy: 1.24933326976291
Energy: 1.162705619117645

minimum gb energy = 1.0865174191839768 eV
minimum distance =  2.34794183878036 Angstroms
sigma value = 9


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

Energy: 1.2607746389428194
Energy: 1.2202282259801533
Energy: 1.2607746389453982
Energy: 1.2202282259801533
Energy: 1.2607746389428194
Energy: 1.2202282259801533
Energy: 1.2822258609619128
Energy: 1.2853667594072669
Energy: 1.282225860961053
Energy: 1.2853667594072669
Energy: 1.282225860961053
Energy: 1.2853667594072669
Energy: 1.2579735409890558
Energy: 1.2331740959073298
Energy: 1.2579735409899155
Energy: 1.2331740959064703
Energy: 1.2579735409890558
Energy: 1.2331740959073298
Energy: 1.2956469682258958
Energy: 1.314277795430521
Energy: 1.2956469682258958
Energy: 1.314277795430521
Energy: 1.295646968224177
Energy: 1.3142777954313807
Energy: 1.320001690879435
Energy: 1.270687346916473
Energy: 1.320001690879435
Energy: 1.270687346916473
Energy: 1.320001690879435
Energy: 1.270687346916473
Energy: 1.316233126457223
Energy: 1.3256881364532063
Energy: 1.3162331264580824
Energy: 1.3256881364540658
Energy: 1.3162331264580824
Energy: 1.3256881364540658
Energy: 1.2791320018462098
Energy: 1.2962599226509968
Energy: 1.2791320018462098
Energy: 1.2962599226509968
Energy: 1.2791320018462098
Energy: 1.2962599226509968
Energy: 1.2400891544868693
Energy: 1.3602490445302755
Energy: 1.24008915448515
Energy: 1.3602490445311353
Energy: 1.24008915448515
Energy: 1.3602490445311353
Energy: 1.357635827481998
Energy: 1.2919858359601457
Energy: 1.3576358274828577
Energy: 1.2919858359601457
Energy: 1.357635827481998
Energy: 1.2919858359610052
Energy: 1.277302581414854
Energy: 1.2458990092200004
Energy: 1.277302581414854
Energy: 1.2458990092200004
Energy: 1.2773025814139944
Energy: 1.2458990092200004
Energy: 1.2762818049562408
Energy: 1.2427976696647982
Energy: 1.2762818049545215
Energy: 1.242797669663939
Energy: 1.2762818049545215
Energy: 1.2427976696647982
Energy: 1.2687779968716544
Energy: 1.2366442889648643
Energy: 1.2687779968716544
Energy: 1.2366442889648643
Energy: 1.2687779968716544
Energy: 1.2366442889648643
Energy: 1.3333459462306896
Energy: 1.3791627879409036
Energy: 1.3333459462298303
Energy: 1.3791627879409036
Energy: 1.3333459462306896
Energy: 1.3791627879409036
Energy: 1.2686340133678948
Energy: 1.268250735963895
Energy: 1.2686340133678948
Energy: 1.268250735963895
Energy: 1.2686340133678948
Energy: 1.268250735963895
Energy: 1.3585703221090488
Energy: 1.340453094235547
Energy: 1.3585703221090488
Energy: 1.3404530942346875
Energy: 1.3585703221090488
Energy: 1.340453094235547
Energy: 1.311066403327504
Energy: 1.244361212889784
Energy: 1.311066403327504
Energy: 1.2443612128889245
Energy: 1.3110664033283632
Energy: 1.2443612128889245
Energy: 1.303310245630515
Energy: 1.3310508314777354
Energy: 1.303310245630515
Energy: 1.3310508314777354
Energy: 1.3033102456296557
Energy: 1.3310508314777354
Energy: 1.267693884302331
Energy: 1.2523896403419974
Energy: 1.267693884302331
Energy: 1.2523896403583294
Energy: 1.267693884302331
Energy: 1.252389640354891
Energy: 1.2539887219753691
Energy: 1.2646762195575592
Energy: 1.2539887219753691
Energy: 1.2646762195575592
Energy: 1.2539887219745092
Energy: 1.2646762195575592
Energy: 1.3329076096061736
Energy: 1.2640942212445772
Energy: 1.3329076096061736
Energy: 1.2640942212445772
Energy: 1.3329076096053143
Energy: 1.2640942212445772
Energy: 1.264572106635355
Energy: 1.2368699805335182
Energy: 1.264572106635355
Energy: 1.2368699805335182
Energy: 1.264572106635355
Energy: 1.2368699805335182

minimum gb energy = 1.2202282259801533 eV
minimum distance =  2.34367073576994 Angstroms
sigma value = 27


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

Energy: 1.250170983037667
Energy: 1.3251244686387544
Energy: 1.2501709830369423
Energy: 1.3251244686387544
Energy: 1.2501709830369423
Energy: 1.3251244686387544
Energy: 1.2169110955311417
Energy: 1.2534102420944815
Energy: 1.216911095536938
Energy: 1.2534102420944815
Energy: 1.2169110955166502
Energy: 1.2534102420944815
Energy: 1.258135221883387
Energy: 1.2828725781463457
Energy: 1.258135221883387
Energy: 1.2828725781463457
Energy: 1.2581352218826625
Energy: 1.2828725781463457
Energy: 1.2523065086990828
Energy: 1.1906260316373272
Energy: 1.2523065086990828
Energy: 1.1906260316380517
Energy: 1.252306508698358
Energy: 1.1906260316395005
Energy: 1.2083681841280316
Energy: 1.183438845714842
Energy: 1.2083681841287561
Energy: 1.1834388457141174
Energy: 1.2083681841287561
Energy: 1.183438845714842
Energy: 1.1579866538173609
Energy: 1.2092965572128742
Energy: 1.1579866538166361
Energy: 1.2092965572128742
Energy: 1.1579866538173609
Energy: 1.2092965572128742
Energy: 1.2556149569787132
Energy: 1.2178688521380394
Energy: 1.2556149569794375
Energy: 1.2178688521380394
Energy: 1.2556149569794375
Energy: 1.2178688521380394
Energy: 1.183179314510562
Energy: 1.258483866815773
Energy: 1.1831793145069394
Energy: 1.258483866815773
Energy: 1.1831793144830285
Energy: 1.2584838668150484
Energy: 1.2073845527848244
Energy: 1.2081295232913551
Energy: 1.2073845527848244
Energy: 1.2081295232913551
Energy: 1.2073845527848244
Energy: 1.2081295232913551
Energy: 1.2029618978645644
Energy: 1.1653167517565441
Energy: 1.2029618978638725
Energy: 1.1653167517565441
Energy: 1.202961897866738
Energy: 1.1653167517565441
Energy: 1.2016887685372322
Energy: 1.2300102387334193
Energy: 1.2016887685350583
Energy: 1.2300102387334193
Energy: 1.2016887685350583
Energy: 1.230010238734144
Energy: 1.2146425958283136
Energy: 1.2160053750937883
Energy: 1.214642595827589
Energy: 1.216005375094513
Energy: 1.214642595827589
Energy: 1.216005375094513
Energy: 1.2591235782756376
Energy: 1.181597850278714
Energy: 1.2591235782763621
Energy: 1.181597850278714
Energy: 1.2591235782763621
Energy: 1.1815978502779896
Energy: 1.2111169663805594
Energy: 1.2056384475066095
Energy: 1.2111169663805594
Energy: 1.2056384475066095
Energy: 1.2111169663805594
Energy: 1.2056384475066095
Energy: 1.1469017991823056
Energy: 1.2085307340686953
Energy: 1.1469017991823056
Energy: 1.2085307340686953
Energy: 1.146901799181581
Energy: 1.2085307340686953
Energy: 1.263203828334095
Energy: 1.1977770249427495
Energy: 1.2632038283333704
Energy: 1.1977770249427495
Energy: 1.263203828334095
Energy: 1.1977770249434738
Energy: 1.2323074515138006
Energy: 1.2587932698170428
Energy: 1.2323074515138006
Energy: 1.2587932698163182
Energy: 1.2323074515138006
Energy: 1.258793269814869
Energy: 1.1837067597047966
Energy: 1.2268695162810346
Energy: 1.183706759705521
Energy: 1.22686951628031
Energy: 1.1837067597047966
Energy: 1.22686951628031
Energy: 1.1748625418080973
Energy: 1.208207889084476
Energy: 1.174862541806648
Energy: 1.2082078890823023
Energy: 1.174862541755204
Energy: 1.208207889083027
Energy: 1.2501709830355263
Energy: 1.3251244686387544
Energy: 1.2501709830355263
Energy: 1.3251244686402037
Energy: 1.2501709830355263
Energy: 1.325124468639479
Energy: 1.2169110955492557
Energy: 1.2534102420952062
Energy: 1.2169110955347644
Energy: 1.2534102420952062
Energy: 1.2169110955441838
Energy: 1.2534102420952062
Energy: 1.258135221883387
Energy: 1.2828725781456212
Energy: 1.258135221883387
Energy: 1.2828725781456212
Energy: 1.2581352218841115
Energy: 1.2828725781456212
Energy: 1.252306508699807
Energy: 1.190626031638776
Energy: 1.252306508698358
Energy: 1.1906260316373272
Energy: 1.2523065086990828
Energy: 1.1906260316373272
Energy: 1.2083681841258578
Energy: 1.18343884571774
Energy: 1.2083681841258578
Energy: 1.1834388457170153
Energy: 1.2083681841265823
Energy: 1.1834388457162908
Energy: 1.1579866538159118
Energy: 1.2092965572143233
Energy: 1.1579866538159118
Energy: 1.2092965572143233
Energy: 1.1579866538166361
Energy: 1.209296557215048

minimum gb energy = 1.146901799181581 eV
minimum distance =  2.35414578766255 Angstroms
sigma value = 19


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

Energy: 1.2505034860128232
Energy: 1.1150779525021275
Energy: 1.2505034860134487
Energy: 1.1150779525021275
Energy: 1.2505034860128232
Energy: 1.1150779525021275
Energy: 1.2445585699507986
Energy: 1.2357170251639407
Energy: 1.2445585699501733
Energy: 1.2357170251645662
Energy: 1.2445585699507986
Energy: 1.2357170251645662
Energy: 1.2259877801186874
Energy: 1.2447378375826814
Energy: 1.2259877801186874
Energy: 1.244737837582056
Energy: 1.2259877801180619
Energy: 1.244737837582056
Energy: 1.194864678194133
Energy: 1.2123837612462394
Energy: 1.1948646781935075
Energy: 1.2123837612462394
Energy: 1.1948646781935075
Energy: 1.2123837612462394
Energy: 1.2505482195607285
Energy: 1.2302717738442563
Energy: 1.2505482195607285
Energy: 1.2302717738442563
Energy: 1.2505482195607285
Energy: 1.2302717738436308
Energy: 1.1505528084371033
Energy: 1.2152159678379837
Energy: 1.1505528084371033
Energy: 1.2152159678379837
Energy: 1.1505528084377288
Energy: 1.2152159678386092
Energy: 1.2231569368723878
Energy: 1.2128375496746022
Energy: 1.2231569368723878
Energy: 1.2128375496746022
Energy: 1.2231569368723878
Energy: 1.2128375496577153
Energy: 1.1959488929091007
Energy: 1.2133781940114798
Energy: 1.1959488929091007
Energy: 1.2133781940121053
Energy: 1.1959488929091007
Energy: 1.2133781940114798
Energy: 1.151308788867397
Energy: 1.192604881339505
Energy: 1.1513087888667715
Energy: 1.192604881339505
Energy: 1.1513087888667715
Energy: 1.192604881339505
Energy: 1.2648399671381676
Energy: 1.245188169074637
Energy: 1.2648399671387929
Energy: 1.245188169074637
Energy: 1.2648399671381676
Energy: 1.245188169074637
Energy: 1.1973420957608698
Energy: 1.2022205768652048
Energy: 1.1973420957608698
Energy: 1.2022205768652048
Energy: 1.1973420957608698
Energy: 1.2022205768652048
Energy: 1.271897123431917
Energy: 1.2093032595463584
Energy: 1.2718971234325422
Energy: 1.2093032595463584
Energy: 1.2718971234325422
Energy: 1.2093032595463584
Energy: 1.2100322029441815
Energy: 1.226413258718314
Energy: 1.2100322029441815
Energy: 1.226413258718314
Energy: 1.2100322029441815
Energy: 1.2264132587189394
Energy: 1.2116727538521812
Energy: 1.156291341334435
Energy: 1.2116727538521812
Energy: 1.1562913413350602
Energy: 1.2116727538521812
Energy: 1.156291341334435
Energy: 1.2249215918425214
Energy: 1.2127139835114058
Energy: 1.2249215918418956
Energy: 1.2127139835114058
Energy: 1.2249215918425214
Energy: 1.2127139835114058
Energy: 1.2508809818602133
Energy: 1.191968279815231
Energy: 1.2508809818602133
Energy: 1.191968279815231
Energy: 1.2508809818608388
Energy: 1.191968279815231
Energy: 1.2150561409530132
Energy: 1.2330186802578902
Energy: 1.2150561409523875
Energy: 1.2330186802578902
Energy: 1.2150561409523875
Energy: 1.2330186802572647
Energy: 1.2485065152119108
Energy: 1.2374605209471632
Energy: 1.2485065152125363
Energy: 1.2374605209471632
Energy: 1.2485065152125363
Energy: 1.2374605209471632
Energy: 1.0928309193595311
Energy: 1.2129667197149612
Energy: 1.0928309193595311
Energy: 1.2129667197149612
Energy: 1.0928309193589056
Energy: 1.2129667197149612
Energy: 1.215755895823226
Energy: 1.1802861227346573
Energy: 1.215755895823851
Energy: 1.1802861227340318
Energy: 1.215755895823851
Energy: 1.1802861227346573
Energy: 1.1861304378669733
Energy: 1.2099300899330587
Energy: 1.186130437867599
Energy: 1.2099300899336842
Energy: 1.186130437867599
Energy: 1.2099300899336842
Energy: 1.212424843006902
Energy: 1.1998926757890729
Energy: 1.212424843006902
Energy: 1.1998926757890729
Energy: 1.2124248430075273
Energy: 1.1998926757890729
Energy: 1.2679854375822293
Energy: 1.2625869998514643
Energy: 1.2679854375822293
Energy: 1.2625869998514643
Energy: 1.2679854375822293
Energy: 1.2625869998514643
Energy: 1.2470627672379377
Energy: 1.1354937929592515
Energy: 1.2470627672379377
Energy: 1.1354937929592515
Energy: 1.2470627672379377
Energy: 1.1354937929592515
Energy: 1.1732677578444821
Energy: 1.1990864433083563
Energy: 1.1732677578451076
Energy: 1.1990864433083563
Energy: 1.1732677578451076
Energy: 1.1990864433083563
Energy: 1.2032304709026043
Energy: 1.2351975723807984
Energy: 1.203230470900728
Energy: 1.2351975723814241
Energy: 1.203230470900728
Energy: 1.2351975723814241
Energy: 1.1861127323627698
Energy: 1.1586783128330522
Energy: 1.1861127323627698
Energy: 1.1586783128324267
Energy: 1.1861127323633953
Energy: 1.1586783128330522
Energy: 1.2001101275591524
Energy: 1.246997381630102
Energy: 1.2001101275591524
Energy: 1.246997381630102
Energy: 1.2001101275591524
Energy: 1.2469973816307276
Energy: 1.2207826052367745
Energy: 1.2129004367623468
Energy: 1.2207826052367745
Energy: 1.2129004367617213
Energy: 1.2207826052361492
Energy: 1.2129004367623468

minimum gb energy = 1.0928309193589056 eV
minimum distance =  2.3345262360153 Angstroms
sigma value = 101


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

Energy: 1.1995646423337485
Energy: 1.1571243917312874
Energy: 1.1995646423353978
Energy: 1.1571243917318375
Energy: 1.1995646423331987
Energy: 1.1571243917312874
Energy: 1.1446445485730696
Energy: 1.2283076450292068
Energy: 1.14464454857142
Energy: 1.2283076450303063
Energy: 1.1446445485725196
Energy: 1.2283076450297565
Energy: 1.1638235512005226
Energy: 1.1591286428712193
Energy: 1.1638235512005226
Energy: 1.1591286428706695
Energy: 1.1638235511999728
Energy: 1.1591286428712193
Energy: 1.1430576269168862
Energy: 1.1796562634939582
Energy: 1.1430576269168862
Energy: 1.1796562633988945
Energy: 1.1430576269163362
Energy: 1.1796562635143004
Energy: 1.227983963327177
Energy: 1.1475240713450108
Energy: 1.2279839633288263
Energy: 1.1475240713455608
Energy: 1.2279839633282765
Energy: 1.1475240713450108
Energy: 1.1115808303112655
Energy: 1.1630250284555754
Energy: 1.1115808303107158
Energy: 1.1630250284561252
Energy: 1.1115808303112655
Energy: 1.1630250284550254
Energy: 1.2071818808679415
Energy: 1.1690184701556756
Energy: 1.207181880866842
Energy: 1.169018470154026
Energy: 1.2071818808657424
Energy: 1.1690184701551256
Energy: 1.1599806532700325
Energy: 1.1662515647152056
Energy: 1.1599806532705823
Energy: 1.166251564716855
Energy: 1.1599806532700325
Energy: 1.1662515647152056
Energy: 1.1611623365446024
Energy: 1.1507179683366404
Energy: 1.1611623365446024
Energy: 1.1507179683360909
Energy: 1.1611623365451522
Energy: 1.1507179683360909
Energy: 1.2139499947605625
Energy: 1.2552939429777026
Energy: 1.213949994761662
Energy: 1.2552939429777026
Energy: 1.213949994761662
Energy: 1.2552939429771526
Energy: 1.1467478566818277
Energy: 1.1720523444324424
Energy: 1.1467478566823774
Energy: 1.1720523444324424
Energy: 1.1467478566823774
Energy: 1.1720523444318924
Energy: 1.1891648290416628
Energy: 1.1912997912676113
Energy: 1.1891648290422123
Energy: 1.1912997912676113
Energy: 1.1891648290422123
Energy: 1.1912997912670615
Energy: 1.076980546493151
Energy: 1.1537333635503288
Energy: 1.076980546493151
Energy: 1.1537333635508786
Energy: 1.0769805464937008
Energy: 1.1537333635508786
Energy: 1.194712975788855
Energy: 1.100696327116954
Energy: 1.194712975788855
Energy: 1.0680833209407934
Energy: 1.1947129757894046
Energy: 1.1006963271186037
Energy: 1.2154310979618608
Energy: 1.1359036239587958
Energy: 1.215431097960761
Energy: 1.1359036239593454
Energy: 1.215431097960761
Energy: 1.1359036239587958
Energy: 1.1346190390596618
Energy: 1.1570078321277106
Energy: 1.1346190390602116
Energy: 1.1570078321277106
Energy: 1.1346190390602116
Energy: 1.1570078321277106
Energy: 1.1490608763934216
Energy: 1.1795050034298846
Energy: 1.1490608763934216
Energy: 1.1795050034397807
Energy: 1.1490608763939714
Energy: 1.179505003428785
Energy: 1.1519025036409813
Energy: 1.1742852993072723
Energy: 1.1519025036409813
Energy: 1.1742852993067225
Energy: 1.1519025036409813
Energy: 1.1742852993067225
Energy: 1.1260279378996816
Energy: 1.1508518073586267
Energy: 1.1260279378996816
Energy: 1.1508518073586267
Energy: 1.1260279378985818
Energy: 1.1508518073586267
Energy: 1.1443543429470782
Energy: 1.1661492109588887
Energy: 1.144354342948178
Energy: 1.1661492109588887
Energy: 1.144354342947628
Energy: 1.1661492109588887
Energy: 1.1621810009346178
Energy: 1.1447898453179208
Energy: 1.1621810009346178
Energy: 1.1447898453157217
Energy: 1.1621810009346178
Energy: 1.1447898453157217
Energy: 1.1457242636829983
Energy: 1.1581044614767086
Energy: 1.1457242636824483
Energy: 1.1581044614767086
Energy: 1.1457242636824483
Energy: 1.1581044614761586
Energy: 1.1291835057892075
Energy: 1.151390350976123
Energy: 1.1291835057897575
Energy: 1.1513903509772223
Energy: 1.1291835057897575
Energy: 1.1513903509772223
Energy: 1.1432165735642226
Energy: 1.1921717095670898
Energy: 1.1432165735642226
Energy: 1.154456589763155
Energy: 1.1432165735642226
Energy: 1.0760964383585945
Energy: 1.1863014974376886
Energy: 1.2015587331276083
Energy: 1.1863014974387882
Energy: 1.2015587331281583
Energy: 1.1863014974382384
Energy: 1.2015587331281583
Energy: 1.0743700687199085
Energy: 1.1644420184307518
Energy: 1.0743700687193587
Energy: 1.1644420184302022
Energy: 1.074370068718809
Energy: 1.1644420184302022
Energy: 1.1952039935803744
Energy: 1.0344787812695893
Energy: 1.1952039935803744
Energy: 1.0344787812695893
Energy: 1.1952039935809244
Energy: 1.0344787812695893
Energy: 1.2161411293692876
Energy: 1.1362948664152468
Energy: 1.2161411293692876
Energy: 1.1362948664157968
Energy: 1.2161411293692876
Energy: 1.1362948664157968
Energy: 1.076338908700885
Energy: 1.15976936795272
Energy: 1.076338908700885
Energy: 1.15976936795272
Energy: 1.076338908700885
Energy: 1.15976936795272
Energy: 1.1519479162908854
Energy: 1.1783835571740007
Energy: 1.1519479162914352
Energy: 1.1783835571740007
Energy: 1.1519479162914352
Energy: 1.1783835571740007
Energy: 1.1497614467079886
Energy: 1.023285096982984
Energy: 1.1497614467079886
Energy: 1.023285096983534
Energy: 1.149761446706889
Energy: 1.023285096983534
Energy: 1.1450291162168422
Energy: 1.1577918533833065
Energy: 1.1450291162168422
Energy: 1.1577918533838563
Energy: 1.1450291162162924
Energy: 1.1577918533833065
Energy: 1.143606101372456
Energy: 1.1517443001499568
Energy: 1.1436061013719063
Energy: 1.1517443001494072
Energy: 1.1436061013730061
Energy: 1.1517443001499568

minimum gb energy = 1.023285096982984 eV
minimum distance =  2.33718447062231 Angstroms
sigma value = 33


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

Energy: 0.019807742912365624
Energy: 0.6421021982533655
Energy: 0.019807742912365624
Energy: 0.642102198251589
Energy: 0.019807742912365624
Energy: 0.642102198246209
Energy: 0.020405094849491344
Energy: 0.2784352787849618
Energy: 0.020405094849491344
Energy: 0.27843527878541857
Energy: 0.020405094849491344
Energy: 0.2784352787849618
Energy: 0.014069484396519671
Energy: 0.2780174002556684
Energy: 0.02300359886416681
Energy: 0.2780174002560744
Energy: 0.0035759237077615845
Energy: 0.2780174002556684
Energy: 0.020405094849085294
Energy: 0.2784352787849618
Energy: 0.020405094849491344
Energy: 0.27843527878587543
Energy: 0.020405094849491344
Energy: 0.2784352787849618

minimum gb energy = 0.0035759237077615845 eV
minimum distance =  2.51185816405559 Angstroms
sigma value = 1