Model name: model_name=EAM_MagneticCubic_MendelevHanSrolovitz_2003_Fe__MO_856295952425_002
a1: a1=[-1, 1, 0]
a2: a2=[0, 0, 1]
a3: a3=[1, 1, 0]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.855324655771256
cohesive_energy=4.122759316663293
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: 0.012772757535796582
Energy: 0.0133975770752732
Energy: 0.42638125654111114
Energy: 0.013397577076278564
Energy: 0.012772757535796582
Energy: 0.013397577074798446
Energy: 0.0133975770752732
Energy: 2.1573141830537925
Energy: 0.013397577074798446
Energy: 2.15731418306164
Energy: 0.013397577076753318
Energy: 2.1573141830601594
Energy: 0.42638125654063636
Energy: 0.013397577076278564
Energy: 0.0127727575352939
Energy: 0.013397577075775883
Energy: 0.42638125654111114
Energy: 0.013397577076278564
Energy: 0.013397577076753318
Energy: 2.1573141830621427
Energy: 0.013397577075775883
Energy: 2.1573141830601594
Energy: 0.013397577076278564
Energy: 2.1573141830591824
Energy: 0.012772757535796582
Energy: 0.013397577077730755
Energy: 0.42638125654111114
Energy: 0.013397577076278564
Energy: 0.0127727575352939
Energy: 0.013397577075775883
Energy: 0.013397577076278564
Energy: 2.1573141830601594
Energy: 0.0133975770752732
Energy: 2.1573141830611653
Energy: 0.013397577075775883
Energy: 2.15731418305477

minimum gb energy = 0.0127727575352939 eV
minimum distance =  2.45239198826398 Angstroms
sigma value = 1


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

Energy: 1.268465248226738
Energy: 1.3338061363055826
Energy: 1.1528872002032475
Energy: 1.3338061363043725
Energy: 1.268465248226738
Energy: 1.3338061363067926
Energy: 1.2285884450346716
Energy: 1.3021205122789423
Energy: 1.2613665516828618
Energy: 1.3021205122789423
Energy: 1.2285884450358815
Energy: 1.3021205122777322
Energy: 1.1185266426042642
Energy: 1.299715803775656
Energy: 1.2609351031686873
Energy: 1.299715803775656
Energy: 1.1185266426054743
Energy: 1.299715803776866
Energy: 1.2912189724994894
Energy: 1.2774598025571455
Energy: 1.1198291966194724
Energy: 1.2774598025547255
Energy: 1.2912189725031193
Energy: 1.2774598025510953
Energy: 1.2894778648052183
Energy: 1.321838936063668
Energy: 1.2881090202235532
Energy: 1.321838936062458
Energy: 1.2894778648003784
Energy: 1.321838936062458
Energy: 1.2619850481586674
Energy: 1.3036957860721785
Energy: 1.124428845647817
Energy: 1.3036957860709684
Energy: 1.2619850481586674
Energy: 1.3036957860733887
Energy: 1.2618394262612391
Energy: 1.29867837111381
Energy: 1.1244952488030977
Energy: 1.2986783711150196
Energy: 1.2618394262660793
Energy: 1.2986783711150196
Energy: 1.3113970341368226
Energy: 1.323308392851359
Energy: 1.1209141135584066
Energy: 1.323308392851359
Energy: 1.3113970341392427
Energy: 1.323308392851359
Energy: 1.3267275742183402
Energy: 1.269841064625043
Energy: 1.1196923304215074
Energy: 1.2698410646177831
Energy: 1.3267275742183402
Energy: 1.2698410646431932
Energy: 1.263292870062708
Energy: 1.2973866158267175
Energy: 1.125331098113445
Energy: 1.2973866158255076
Energy: 1.263292870062708
Energy: 1.2973866158267175
Energy: 1.190730398775496
Energy: 1.27729065041078
Energy: 1.226166579582415
Energy: 1.2772906503854249
Energy: 1.1907303987621856
Energy: 1.2772906504216701
Energy: 1.1220773371144828
Energy: 1.3214222344760562
Energy: 1.1220850966785558
Energy: 1.321422234474846
Energy: 1.1220773371144828
Energy: 1.3214222344760562
Energy: 1.226340969135103
Energy: 1.277290650395105
Energy: 1.1187332906069627
Energy: 1.27729065039868
Energy: 1.226340969130263
Energy: 1.2772906503842145
Energy: 1.1255702198220536
Energy: 1.297605657564515
Energy: 1.2632969069506172
Energy: 1.297605657563305
Energy: 1.1255702198220536
Energy: 1.297605657563305
Energy: 1.1195465564562745
Energy: 1.2712697335482381
Energy: 1.3264107092389301
Energy: 1.2712697335494483
Energy: 1.1195465564574845
Energy: 1.2712697335458183
Energy: 1.120870257158483
Energy: 1.323312662638965
Energy: 1.3114090936384222
Energy: 1.323312662638965
Energy: 1.120870257159693
Energy: 1.323312662638965
Energy: 1.12434378884947
Energy: 1.2984633923197517
Energy: 1.2624466982912692
Energy: 1.2984633923197517
Energy: 1.12434378884947
Energy: 1.2984633923197517
Energy: 1.1247885995515463
Energy: 1.3039305469145417
Energy: 1.264169529155676
Energy: 1.3039305469121214
Energy: 1.1247885995503364
Energy: 1.3039305469157514
Energy: 1.1934527818447138
Energy: 1.3219390973528957
Energy: 1.2890511069737896
Energy: 1.3219390973528957
Energy: 1.193452781843504
Energy: 1.3219390973528957
Energy: 1.1197553025302207
Energy: 1.2669759112144767
Energy: 1.2889694827313953
Energy: 1.2669759112156866
Energy: 1.119755302531431
Energy: 1.2669759112193169
Energy: 1.2608137387428353
Energy: 1.2997345358643522
Energy: 1.118510849068298
Energy: 1.2997345358643522
Energy: 1.2608137387416254
Energy: 1.2997345358643522
Energy: 1.2630442311847416
Energy: 1.301267335082661
Energy: 1.2281624286828436
Energy: 1.3012673350838713
Energy: 1.2630442311859518
Energy: 1.3012673350838713
Energy: 1.2261887629510206
Energy: 1.3338061363055826
Energy: 1.268465248227948
Energy: 1.3338061363067926
Energy: 1.2261887629510206
Energy: 1.3338061363067926

minimum gb energy = 1.118510849068298 eV
minimum distance =  2.23471966888133 Angstroms
sigma value = 33


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

Energy: 1.6676740126931566
Energy: 1.390857997884933
Energy: 1.2302815497019426
Energy: 1.3908579978842448
Energy: 1.6676740126924683
Energy: 1.3908579978842448
Energy: 1.235687456504592
Energy: 1.3564241300827018
Energy: 1.3890141785385524
Energy: 1.3564241300833901
Energy: 1.2356874565025273
Energy: 1.3564241300833901
Energy: 1.1634109036963576
Energy: 1.3874014993665256
Energy: 1.3612495875596367
Energy: 1.387401499367214
Energy: 1.1634109036963576
Energy: 1.387401499367214
Energy: 1.2635231613062614
Energy: 1.334353824673982
Energy: 1.375046473341288
Energy: 1.33435382467467
Energy: 1.2635231613048847
Energy: 1.334353824673982
Energy: 1.2631820016045607
Energy: 1.3879134375575652
Energy: 1.3386862672192357
Energy: 1.3879134375575652
Energy: 1.2631820016045607
Energy: 1.387913437556877
Energy: 1.2808687891765866
Energy: 1.366111141724137
Energy: 1.170004116361066
Energy: 1.3661111417255134
Energy: 1.2808687891765866
Energy: 1.366111141724137
Energy: 1.2809422576320697
Energy: 1.3660737569121046
Energy: 1.3020893758653937
Energy: 1.3660737569121046
Energy: 1.2809422576368876
Energy: 1.3660737569134809
Energy: 1.1958063511841739
Energy: 1.3679567337158474
Energy: 1.3250446632659338
Energy: 1.3679567337158474
Energy: 1.195806351184862
Energy: 1.367956733715159
Energy: 1.303768643993703
Energy: 1.3335526204290207
Energy: 1.3718737168029167
Energy: 1.3335526204262678
Energy: 1.3037686439950797
Energy: 1.33355262042145
Energy: 1.2328737268839975
Energy: 1.3872133007688854
Energy: 1.2378056113025968
Energy: 1.387213300768197
Energy: 1.2328737268839975
Energy: 1.387213300768197
Energy: 1.235180559665262
Energy: 1.3582263713744485
Energy: 1.2845768869084913
Energy: 1.3582263713737601
Energy: 1.235180559665262
Energy: 1.3582263713730718
Energy: 1.359943357499649
Energy: 1.3690237163210808
Energy: 1.255685668276632
Energy: 1.3690237163204237
Energy: 1.3599433574989606
Energy: 1.3690237163210808
Energy: 1.4270922902918985
Energy: 1.3380678870655989
Energy: 1.2349765623059683
Energy: 1.3380678870649108
Energy: 1.4270922902918985
Energy: 1.3380678870655989
Energy: 1.306565777509419
Energy: 1.3871119019143565
Energy: 1.2925349807377111
Energy: 1.3871119019143565
Energy: 1.306565777508731
Energy: 1.3871119019143565
Energy: 1.3609793083130657
Energy: 1.3748211187594286
Energy: 1.342191775378322
Energy: 1.3748211187594286
Energy: 1.3609793083178836
Energy: 1.374821118760805
Energy: 1.3614175738305134
Energy: 1.3878155316080718
Energy: 1.255049593253534
Energy: 1.3878155316073835
Energy: 1.3614175738339547
Energy: 1.3878155316073835
Energy: 1.3784393079776291
Energy: 1.3665164964040017
Energy: 1.240724403926601
Energy: 1.3665164964053471
Energy: 1.3784393079762527
Energy: 1.36651649640469
Energy: 1.3756972566646968
Energy: 1.3581073887856376
Energy: 1.373422379474195
Energy: 1.3581073887925201
Energy: 1.3756972566646968
Energy: 1.3581073887925201
Energy: 1.1701412451715376
Energy: 1.3687488516319857
Energy: 1.3250010183450833
Energy: 1.3687488516319857
Energy: 1.1701412451715376
Energy: 1.3687488516326738
Energy: 1.3157253608081656
Energy: 1.3286903497578897
Energy: 1.3725415364641138
Energy: 1.3286903497565132
Energy: 1.3157253608088226
Energy: 1.3286903497627074
Energy: 1.359539770587809
Energy: 1.3880695295485392
Energy: 1.2164516013040017
Energy: 1.3880695295478507
Energy: 1.359539770588497
Energy: 1.3880695295485392
Energy: 1.2357231823445318
Energy: 1.3587079785861633
Energy: 1.4274182668932796
Energy: 1.3587079785854754
Energy: 1.2357231823452204
Energy: 1.3587079785882283
Energy: 1.2375778414550487
Energy: 1.3689889926767307
Energy: 1.374422620892601
Energy: 1.3689889926774188
Energy: 1.2375778414550487
Energy: 1.3689889926767307
Energy: 1.4574101166954898
Energy: 1.3571994609649858
Energy: 1.2829959121911017
Energy: 1.3571994609656741
Energy: 1.4574101166968665
Energy: 1.357199460966362
Energy: 1.279392499836347
Energy: 1.3663283799878332
Energy: 1.361248738115881
Energy: 1.3663283799871448
Energy: 1.2793924998356587
Energy: 1.3663283799878332
Energy: 1.2916742304828905
Energy: 1.3879090897813364
Energy: 1.2469102973680786
Energy: 1.3879090897813364
Energy: 1.2916742304822022
Energy: 1.3879090897820248
Energy: 1.291743388595661
Energy: 1.3881161417227514
Energy: 1.1890384712800872
Energy: 1.3881161417227514
Energy: 1.291743388594973
Energy: 1.3881161417227514
Energy: 1.2794488971982996
Energy: 1.3663130883163586
Energy: 1.360695351775766
Energy: 1.3663130883163586
Energy: 1.2794488971982996
Energy: 1.3663130883163586
Energy: 1.456899135074906
Energy: 1.3574667596635874
Energy: 1.2839359293218093
Energy: 1.357466759662899
Energy: 1.4568991350769709
Energy: 1.3574667596642758
Energy: 1.238044633918214
Energy: 1.3690248815918613
Energy: 1.3019710143275633
Energy: 1.3690248815925492
Energy: 1.238044633918214
Energy: 1.3690248815932375
Energy: 1.2357350560312177
Energy: 1.3587079786026501
Energy: 1.4275585940991775
Energy: 1.358707978601274
Energy: 1.2357350560305296
Energy: 1.3587079785992089
Energy: 1.3594682149810735
Energy: 1.3886473486371915
Energy: 1.2164878181120762
Energy: 1.388647348635815
Energy: 1.3594682149803852
Energy: 1.388647348635127
Energy: 1.316135216167884
Energy: 1.33248090842477
Energy: 1.371584909107485
Energy: 1.332480908430276
Energy: 1.3161352161658193
Energy: 1.3324809084288995
Energy: 1.1701446665520414
Energy: 1.368729334339205
Energy: 1.2811902622231561
Energy: 1.368729334339205
Energy: 1.1701446665520414
Energy: 1.368729334339205
Energy: 1.3749119506076646
Energy: 1.357860167644201
Energy: 1.4379177038661153
Energy: 1.3578601676428244
Energy: 1.3749119506055998
Energy: 1.3578601676448894
Energy: 1.3736978886773776
Energy: 1.3664836491657488
Energy: 1.2400734030198681
Energy: 1.3664836491671253
Energy: 1.373697888678066
Energy: 1.3664836491671253
Energy: 1.3643430044363345
Energy: 1.388027762186359
Energy: 1.2084078734164037
Energy: 1.3880277621849826
Energy: 1.3643430044363345
Energy: 1.388027762185671
Energy: 1.3629446537948522
Energy: 1.3718984121962332
Energy: 1.3388191031739383
Energy: 1.3718984121948568
Energy: 1.3629446537962286
Energy: 1.3718984121948568
Energy: 1.304921653635652
Energy: 1.3871496962050591
Energy: 1.2923399923289607
Energy: 1.3871496962057475
Energy: 1.304921653635652
Energy: 1.3871496962057475
Energy: 1.4284331157827796
Energy: 1.3412408875492288
Energy: 1.2360079777105681
Energy: 1.3412408875485404
Energy: 1.4284331157820915
Energy: 1.341240887547164
Energy: 1.359935744597301
Energy: 1.3689838628277022
Energy: 1.2058142516374453
Energy: 1.3689838628277022
Energy: 1.359935744597301
Energy: 1.3689838628277022

minimum gb energy = 1.1634109036963576 eV
minimum distance =  2.22798678077437 Angstroms
sigma value = 51


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

Energy: 1.4365261224375863
Energy: 1.4072423219176238
Energy: 1.3644751230621248
Energy: 1.4072423219160288
Energy: 1.4365261224375863
Energy: 1.4072423219160288
Energy: 1.2901943920540972
Energy: 1.4441403378383355
Energy: 1.638425947167207
Energy: 1.444140526852203
Energy: 1.2901943920540972
Energy: 1.444139912363127
Energy: 1.1699079825682779
Energy: 1.4075864317152478
Energy: 1.5018784715027595
Energy: 1.4075864317152478
Energy: 1.1699079825682779
Energy: 1.4075864317152478
Energy: 1.1817211993619066
Energy: 1.3482451943473754
Energy: 1.5056703790661004
Energy: 1.3482451943473754
Energy: 1.1817211993619066
Energy: 1.3482451943473754
Energy: 1.1806990146958287
Energy: 1.3521025583232136
Energy: 1.4220584030993066
Energy: 1.3521025583200241
Energy: 1.1806990146974232
Energy: 1.3521025583168347
Energy: 1.4374611077766823
Energy: 1.3514423251613894
Energy: 1.5490995697623726
Energy: 1.351442325159795
Energy: 1.4374611077766823
Energy: 1.351442325159795
Energy: 1.438143993816783
Energy: 1.3512661524780183
Energy: 1.305903642485902
Energy: 1.3512661524748288
Energy: 1.4381439938183778
Energy: 1.3512661524780183
Energy: 1.1819968297208674
Energy: 1.3484544211811103
Energy: 1.1618851166004793
Energy: 1.3484544211795157
Energy: 1.1819968297208674
Energy: 1.3484544211842997
Energy: 1.4379726092707097
Energy: 1.37441014439803
Energy: 1.1924852136326123
Energy: 1.3744101444075982
Energy: 1.437972609264331
Energy: 1.3744101443932462
Energy: 1.172482511419471
Energy: 1.4361009811409204
Energy: 1.161812295474774
Energy: 1.4361009811409204
Energy: 1.172482511419471
Energy: 1.4361009811409204
Energy: 1.509390256482342
Energy: 1.3497006598078214
Energy: 1.5189742482932547
Energy: 1.3497006598062269
Energy: 1.5093902564775583
Energy: 1.3497006598062269
Energy: 1.4387298358493141
Energy: 1.4075464970421288
Energy: 1.5490437091728309
Energy: 1.4075464970421288
Energy: 1.4387298358493141
Energy: 1.4075464970421288
Energy: 1.3139111815962707
Energy: 1.3634132581764822
Energy: 1.5063901005744746
Energy: 1.3634132581796714
Energy: 1.313911181593081
Energy: 1.3634132581732927
Energy: 1.172640426546952
Energy: 1.4074896160318786
Energy: 1.5155558493613361
Energy: 1.4074896160302839
Energy: 1.172640426546952
Energy: 1.4074896160318786
Energy: 1.1698812736397088
Energy: 1.4078843327247104
Energy: 1.5096236551852165
Energy: 1.4078843327231156
Energy: 1.1698812736397088
Energy: 1.4078843327247104
Energy: 1.18071220633752
Energy: 1.3501517572739905
Energy: 1.5035410021218958
Energy: 1.3501517572755852
Energy: 1.1807122063391147
Energy: 1.3501517572755852
Energy: 1.4371709320940906
Energy: 1.4080353622207955
Energy: 1.5450951015591872
Energy: 1.4080353622207955
Energy: 1.4371709320924957
Energy: 1.4080353622207955
Energy: 1.437179139434107
Energy: 1.351708493155208
Energy: 1.5059045436299383
Energy: 1.351708493155208
Energy: 1.4371791394245388
Energy: 1.3517084931568026

minimum gb energy = 1.161812295474774 eV
minimum distance =  2.20474066109754 Angstroms
sigma value = 19


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

Energy: 1.5463370215745151
Energy: 1.513322249409872
Energy: 1.2719479563106362
Energy: 1.513322249409872
Energy: 1.5463370215745151
Energy: 1.51332224940798
Energy: 1.2623109933479297
Energy: 1.482792354479053
Energy: 1.4216154669760044
Energy: 1.482792354479053
Energy: 1.2623109933479297
Energy: 1.482792354479053
Energy: 1.2120972551946403
Energy: 1.4618509355549871
Energy: 1.3741371681075032
Energy: 1.4618509355549871
Energy: 1.2120972551946403
Energy: 1.4618509355549871
Energy: 1.2333009968345743
Energy: 1.4492792148794569
Energy: 1.3746163884458982
Energy: 1.4492792148794569
Energy: 1.2333009968345743
Energy: 1.4492792148794569
Energy: 1.2978956495113332
Energy: 1.5272891774338453
Energy: 1.5699110710312354
Energy: 1.5272891774338453
Energy: 1.2978956495113332
Energy: 1.5272891774338453
Energy: 1.5697479100166358
Energy: 1.5273482003362333
Energy: 1.2977374587421064
Energy: 1.5273482003371792
Energy: 1.5697479100156904
Energy: 1.5273482003362333
Energy: 1.3742881968465221
Energy: 1.449152093247886
Energy: 1.2328201041700861
Energy: 1.449152093248832
Energy: 1.3742881967954643
Energy: 1.449152093249778
Energy: 1.3742612694922371
Energy: 1.4619022315459944
Energy: 1.212062330134031
Energy: 1.4619022315459944
Energy: 1.374261269493183
Energy: 1.4619022315459944
Energy: 1.4215303361736165
Energy: 1.4828396180944532
Energy: 1.280241325538392
Energy: 1.4828396180935075
Energy: 1.4215303361717246
Energy: 1.4828396180944532
Energy: 1.2815437438058004
Energy: 1.5133222494108178
Energy: 1.5463370215745151
Energy: 1.5133222494070344
Energy: 1.2815437438048543
Energy: 1.513322249408926
Energy: 1.4216154669741126
Energy: 1.482792354479999
Energy: 1.293057224491927
Energy: 1.482792354479053
Energy: 1.4216154669750587
Energy: 1.482792354479999
Energy: 1.3741371681075032
Energy: 1.4618509355549871
Energy: 1.2120972551955647
Energy: 1.4618509355549871
Energy: 1.3741371681037193
Energy: 1.4618509355549871
Energy: 1.3746163884477898
Energy: 1.4492792148794569
Energy: 1.2333009968345743
Energy: 1.4492792148794569
Energy: 1.3746163884440061
Energy: 1.4492792148794569
Energy: 1.5699110710312354
Energy: 1.5272891774328994
Energy: 1.2978956495103875
Energy: 1.5272891774328994
Energy: 1.5699110710302893
Energy: 1.5272891774328994
Energy: 1.2977374587421064
Energy: 1.5273482003371792
Energy: 1.517597740801043
Energy: 1.5273482003371792
Energy: 1.2977374587421064
Energy: 1.5273482003371792
Energy: 1.3041556419536093
Energy: 1.449152093247886
Energy: 1.374288196697132
Energy: 1.449152093247886
Energy: 1.3041556419545552
Energy: 1.449152093247886
Energy: 1.2120623301330853
Energy: 1.4619022315459944
Energy: 1.374261269493183
Energy: 1.4619022315459944
Energy: 1.212062330134031
Energy: 1.4619022315459944
Energy: 1.280241325537446
Energy: 1.4828396180935075
Energy: 1.4215303361736165
Energy: 1.4828396180935075
Energy: 1.280241325537446
Energy: 1.4828396180935075
Energy: 1.546337021573569
Energy: 1.5133222494070344
Energy: 1.3136552386184235
Energy: 1.5133222494070344
Energy: 1.5463370215745151
Energy: 1.513322249408926
Energy: 1.293057224491927
Energy: 1.482792354479053
Energy: 1.4216154669760044
Energy: 1.482792354478107
Energy: 1.2930572244928729
Energy: 1.482792354479999
Energy: 1.2120972551946403
Energy: 1.4618509355549871
Energy: 1.3741371681065573
Energy: 1.4618509355559328
Energy: 1.2120972551946403
Energy: 1.4618509355549871
Energy: 1.2333009968364659
Energy: 1.4492792148794569
Energy: 1.374616388448736
Energy: 1.4492792148794569
Energy: 1.2333009968364659
Energy: 1.4492792148794569
Energy: 1.2978956495113332
Energy: 1.5272891774338453
Energy: 1.5699110710302893
Energy: 1.5272891774338453
Energy: 1.2978956495113332
Energy: 1.5272891774338453
Energy: 1.4588867207646201
Energy: 1.5273482003371792
Energy: 1.2977374587421064
Energy: 1.5273482003371792
Energy: 1.4588867207646201
Energy: 1.5273482003371792
Energy: 1.3742881968143612
Energy: 1.449152093248832
Energy: 1.3041556419536093
Energy: 1.449152093247886
Energy: 1.3742881967850593
Energy: 1.449152093247886
Energy: 1.3742612694941287
Energy: 1.4619022315459944
Energy: 1.212062330134031
Energy: 1.4619022315459944
Energy: 1.3742612694922371
Energy: 1.4619022315459944
Energy: 1.4215303361726708
Energy: 1.4828396180944532
Energy: 1.280241325537446
Energy: 1.4828396180944532
Energy: 1.4215303361736165
Energy: 1.4828396180944532
Energy: 1.3136552386600222
Energy: 1.5133222494108178
Energy: 1.5463370215745151
Energy: 1.51332224940798
Energy: 1.313655238660968
Energy: 1.5133222494070344
Energy: 1.4216154669731667
Energy: 1.482792354479999
Energy: 1.293057224491927
Energy: 1.482792354479999
Energy: 1.4216154669769503
Energy: 1.482792354479053
Energy: 1.3741371681065573
Energy: 1.4618509355559328
Energy: 1.2120972551946403
Energy: 1.4618509355549871
Energy: 1.374137168108449
Energy: 1.4618509355549871

minimum gb energy = 1.2120623301330853 eV
minimum distance =  2.19725031724468 Angstroms
sigma value = 27


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

Energy: 1.1716960496156243
Energy: 1.3584750525408298
Energy: 1.3976368992428585
Energy: 1.358475052540593
Energy: 1.1716960496163353
Energy: 1.358475052541067
Energy: 1.1631742449292708
Energy: 1.4372449297827927
Energy: 1.2098558886021444
Energy: 1.4372449297807128
Energy: 1.1631742449297446
Energy: 1.4372449297809495
Energy: 1.1928353024222504
Energy: 1.4977898861864347
Energy: 1.2076840969712976
Energy: 1.497789886185987
Energy: 1.1928353024215659
Energy: 1.4977898861857502
Energy: 1.169450674728385
Energy: 1.3583054714692275
Energy: 1.1913116649523616
Energy: 1.3583054714687801
Energy: 1.169450674728385
Energy: 1.3583054714692275
Energy: 1.2093479946529668
Energy: 1.365330717105077
Energy: 1.1934705702267052
Energy: 1.36533071710484
Energy: 1.2093479946525192
Energy: 1.365330717105077
Energy: 1.1910990835352744
Energy: 1.5092542589226532
Energy: 1.2074233925957767
Energy: 1.509254258925655
Energy: 1.1910990835350372
Energy: 1.509254258925892
Energy: 1.207403243127593
Energy: 1.3831387287868038
Energy: 1.1913034000621892
Energy: 1.3831387287847237
Energy: 1.2074032431255128
Energy: 1.3831387287856454
Energy: 1.169233144923889
Energy: 1.3653325238234755
Energy: 1.2112481298072926
Energy: 1.3653325238237126
Energy: 1.1692331449241262
Energy: 1.3653325238239495
Energy: 1.1912708083493626
Energy: 1.440753513611531
Energy: 1.207450153152651
Energy: 1.4407535136173235
Energy: 1.1912708083491255
Energy: 1.4407535136122418
Energy: 1.191160957065682
Energy: 1.4553109708496748
Energy: 1.1911545997739257
Energy: 1.4553109708496748
Energy: 1.191160957065919
Energy: 1.4553109708496748
Energy: 1.2042250805077515
Energy: 1.4402268651089163
Energy: 1.1912170048866255
Energy: 1.4402268651082055
Energy: 1.2042250805070671
Energy: 1.4402268651082055
Energy: 1.2111505913997425
Energy: 1.3652917116314018
Energy: 1.1691951025671645
Energy: 1.3652917116309542
Energy: 1.2111505914006642
Energy: 1.3652917116302437

minimum gb energy = 1.1631742449292708 eV
minimum distance =  2.23073283789329 Angstroms
sigma value = 9


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

Energy: 1.5964531059045122
Energy: 1.5554906741569814
Energy: 1.3091095256614544
Energy: 1.5554906741563306
Energy: 1.596453105905814
Energy: 1.5554906741563306
Energy: 1.4153927231284713
Energy: 1.526237002132897
Energy: 1.3144462928867657
Energy: 1.506972976189476
Energy: 1.4153927231271695
Energy: 1.526237002132246
Energy: 1.2845066525060025
Energy: 1.5088422322359403
Energy: 1.3050823053375173
Energy: 1.5088422322359403
Energy: 1.2845066525053517
Energy: 1.5088422322359403
Energy: 1.239824067283093
Energy: 1.4746458633062545
Energy: 1.214694195746857
Energy: 1.4746458633056034
Energy: 1.239824067283093
Energy: 1.4746458633056034
Energy: 1.238445438064206
Energy: 1.4743777869404076
Energy: 1.2152890440989594
Energy: 1.4743777869410586
Energy: 1.2384454380635845
Energy: 1.4743777869410586
Energy: 1.2208513328432287
Energy: 1.4556886635219684
Energy: 1.2865287246433612
Energy: 1.4427088124037515
Energy: 1.2208513328432287
Energy: 1.4556886635206665
Energy: 1.476853359643631
Energy: 1.507876765472463
Energy: 1.318506598305841
Energy: 1.507876765472463
Energy: 1.4768533596449034
Energy: 1.5078767654718124
Energy: 1.4201721520011699
Energy: 1.4732831454168067
Energy: 1.3952428638971344
Energy: 1.4732831454161557
Energy: 1.4201721520017911
Energy: 1.4732831454168067
Energy: 1.411519654617339
Energy: 1.5007242725751138
Energy: 1.3189439502452902
Energy: 1.5007242725757646
Energy: 1.4115196546212452
Energy: 1.5007242725764156
Energy: 1.422739607911391
Energy: 1.5243293414921864
Energy: 1.2378948662447309
Energy: 1.5243293414921864
Energy: 1.42273960791074
Energy: 1.5243293414921864
Energy: 1.4059373606305323
Energy: 1.496743302809066
Energy: 1.3189273537779076
Energy: 1.4967433028084152
Energy: 1.4059373606298815
Energy: 1.496743302809717
Energy: 1.2918220023810278
Energy: 1.4727045755025656
Energy: 1.29085393644858
Energy: 1.4727045755019148
Energy: 1.2918220023810278
Energy: 1.4727045755012638
Energy: 1.2250613876711471
Energy: 1.4245961115031318
Energy: 1.2206679291465408
Energy: 1.4245961115057064
Energy: 1.2250613876717982
Energy: 1.4245961115037828
Energy: 1.4781943282369543
Energy: 1.5448214007717869
Energy: 1.2218319031151819
Energy: 1.5448214007724377
Energy: 1.4781943282376053
Energy: 1.5448214007717869
Energy: 1.294629012117896
Energy: 1.4954318423403108
Energy: 1.3437394965549112
Energy: 1.4954318423416129
Energy: 1.294629012117896
Energy: 1.4954318423403108
Energy: 1.3616541004634093
Energy: 1.4772102550403565
Energy: 1.2905065652218053
Energy: 1.4772102550416586
Energy: 1.3616541004627583
Energy: 1.4772102550416586
Energy: 1.4250434248472834
Energy: 1.5175165316901171
Energy: 1.3133028318834146
Energy: 1.5175165316907682
Energy: 1.4250434248472834
Energy: 1.5175165316914192
Energy: 1.289306934495155
Energy: 1.4280796674680556
Energy: 1.307958477291549
Energy: 1.4280796674661025
Energy: 1.2893069344919001
Energy: 1.4280796674628473
Energy: 1.4224767349279894
Energy: 1.539750270337374
Energy: 1.2254595859129371
Energy: 1.5397502703380253
Energy: 1.4224767349279894
Energy: 1.539750270337374
Energy: 1.220047068858596
Energy: 1.5779362606237104
Energy: 1.2222309089887244
Energy: 1.5655188201020263
Energy: 1.220047068858596
Energy: 1.5655188201026773
Energy: 1.2253286499529905
Energy: 1.5398167632714297
Energy: 1.422375128976121
Energy: 1.5398167632714297
Energy: 1.2253286499529905
Energy: 1.5398167632720807
Energy: 1.3080132087025027
Energy: 1.4304837292362602
Energy: 1.2896608185874001
Energy: 1.4304837292336563
Energy: 1.3080132087025027
Energy: 1.4304837292349581
Energy: 1.313358905762614
Energy: 1.5173804767063748
Energy: 1.4248508979094299
Energy: 1.5173804767057237
Energy: 1.3133589057619628
Energy: 1.5173804767076768
Energy: 1.2916042812451973
Energy: 1.477497396101646
Energy: 1.362123134577937
Energy: 1.477497396102948
Energy: 1.2916042812458484
Energy: 1.477497396103599
Energy: 1.3502785199468061
Energy: 1.4956091757679197
Energy: 1.294274227796949
Energy: 1.4956091757679197
Energy: 1.3502785199461549
Energy: 1.4956091757679197
Energy: 1.2219370299827506
Energy: 1.5453703023051708
Energy: 1.478138341200675
Energy: 1.5453703023058216
Energy: 1.2219370299834016
Energy: 1.5453703023038685
Energy: 1.220625684962088
Energy: 1.4251247278846442
Energy: 1.2242853222389263
Energy: 1.4251247278846442
Energy: 1.220625684964041
Energy: 1.4251247278839931
Energy: 1.2851330811135675
Energy: 1.4726739553621189
Energy: 1.2918480793164293
Energy: 1.4726739553608168
Energy: 1.2851330811109638
Energy: 1.4726739553608168
Energy: 1.318925274236635
Energy: 1.4968365369501417
Energy: 1.3365657091923997
Energy: 1.4968365369514438
Energy: 1.318925274236635
Energy: 1.4968365369507928
Energy: 1.2384697875056565
Energy: 1.5248922974607324
Energy: 1.4228383065635002
Energy: 1.5248922974600814
Energy: 1.2384697875050055
Energy: 1.5248922974620347
Energy: 1.3221475603464625
Energy: 1.500724272577718
Energy: 1.411997298802053
Energy: 1.5007242725770666
Energy: 1.3221475603458113
Energy: 1.5007242725790197
Energy: 1.339150475848082
Energy: 1.4732521165332964
Energy: 1.4200693041082544
Energy: 1.4732521165339474
Energy: 1.3391504758591495
Energy: 1.4732521165345982
Energy: 1.3133637270651988
Energy: 1.5078898433551007
Energy: 1.6362091178657938
Energy: 1.5078898433544496
Energy: 1.3133637270651988
Energy: 1.5078898433551007
Energy: 1.3147615441359304
Energy: 1.425698535693713
Energy: 1.2209727949544238
Energy: 1.4256985356950151
Energy: 1.3147615441326752
Energy: 1.425698535693062
Energy: 1.2523048672939292
Energy: 1.4741964295433285
Energy: 1.238618478847641
Energy: 1.4741964295433285
Energy: 1.2523048672776536
Energy: 1.4741964295433285
Energy: 1.2155877953950396
Energy: 1.4763898185680453
Energy: 1.2398229300788417
Energy: 1.4763898185686963
Energy: 1.2155877953943885
Energy: 1.4763898185680453
Energy: 1.3053120983965534
Energy: 1.5087021060004404
Energy: 1.2839127670410562
Energy: 1.5087021060004404
Energy: 1.3053120983991575
Energy: 1.5087021060004404
Energy: 1.3156165899898569
Energy: 1.4900921824649547
Energy: 1.4156480554508006
Energy: 1.4900921824649547
Energy: 1.3156165899918097
Energy: 1.4900921824636526
Energy: 1.4842791990713597
Energy: 1.5554906741563306
Energy: 1.596453105905163
Energy: 1.5554906741550283
Energy: 1.4842791990720106
Energy: 1.5554906741550283
Energy: 1.3144462928854637
Energy: 1.526237002132246
Energy: 1.4153927231284713
Energy: 1.526237002132897
Energy: 1.3144462928854637
Energy: 1.526237002132246
Energy: 1.3050823053375173
Energy: 1.5088422322359403
Energy: 1.2845066525053517
Energy: 1.5088422322359403
Energy: 1.3050823053336114
Energy: 1.5088422322359403
Energy: 1.214694195745555
Energy: 1.4746458633062545
Energy: 1.2398240672824419
Energy: 1.4746458633056034
Energy: 1.214694195745555
Energy: 1.4746458633056034
Energy: 1.2152890440963553
Energy: 1.4743777869417096
Energy: 1.2384454380629335
Energy: 1.4743777869417096
Energy: 1.2152890440976576
Energy: 1.4743777869417096

minimum gb energy = 1.214694195745555 eV
minimum distance =  2.1851608102203 Angstroms
sigma value = 57


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

Energy: 1.605953144903718
Energy: 1.508515162683984
Energy: 1.1620402753002501
Energy: 1.508515162683984
Energy: 1.6059531449022362
Energy: 1.508515162683984
Energy: 1.6873071892695326
Energy: 1.4634224928232415
Energy: 1.2056589779693454
Energy: 1.4634224928232415
Energy: 1.6873071892680507
Energy: 1.4634224928232415
Energy: 1.194776512101329
Energy: 1.4661567166390084
Energy: 1.202622349795959
Energy: 1.4661567166390084
Energy: 1.194776512101329
Energy: 1.4661567166390084
Energy: 1.283211999203077
Energy: 1.43659281280841
Energy: 1.3652720178978348
Energy: 1.4365928128098922
Energy: 1.283211999203077
Energy: 1.4365928128098922
Energy: 1.2012634981061667
Energy: 1.422309797286428
Energy: 1.174908011823857
Energy: 1.4223097972893919
Energy: 1.2012634981061667
Energy: 1.422309797286428
Energy: 1.5774140321505514
Energy: 1.3946439480520223
Energy: 1.1147284275224183
Energy: 1.3946439480505401
Energy: 1.5774140321505514
Energy: 1.3946439480520223
Energy: 1.5748326599055664
Energy: 1.3950747534834842
Energy: 1.1141584475725623
Energy: 1.395074753482002
Energy: 1.5748326599070483
Energy: 1.395074753482002
Energy: 1.2010626938082427
Energy: 1.4223602608508232
Energy: 1.208523176240512
Energy: 1.4223602608523052
Energy: 1.201062693809725
Energy: 1.4223602608523052
Energy: 1.283800543115124
Energy: 1.4364731654962506
Energy: 1.3690353165536997
Energy: 1.4364731654947689
Energy: 1.283800543115124
Energy: 1.4364731654962506
Energy: 1.1948112844112648
Energy: 1.4399974817154235
Energy: 1.3109463370767245
Energy: 1.4399974817154235
Energy: 1.1948112844112648
Energy: 1.4399974817154235
Energy: 1.6885884086956624
Energy: 1.4634224928232415
Energy: 1.1436515971608339
Energy: 1.4634224928262054
Energy: 1.6885884086971106
Energy: 1.4634224928247235
Energy: 1.605953144903718
Energy: 1.508515162683984
Energy: 1.1620402717065952
Energy: 1.5085151626854663
Energy: 1.605953144903718
Energy: 1.5085151626854663
Energy: 1.6873071892695326
Energy: 1.4634224928217596
Energy: 1.2056589779693454
Energy: 1.4634224928247235
Energy: 1.6873071892695326
Energy: 1.4634224928232415
Energy: 1.194776512101329
Energy: 1.4661567166390084
Energy: 1.202622349795959
Energy: 1.4661567166390084
Energy: 1.194776512101329
Energy: 1.4661567166390084
Energy: 1.283211999203077
Energy: 1.4365928128098922
Energy: 1.1973039980361622
Energy: 1.4365928128098922
Energy: 1.283211999203077
Energy: 1.4365928128098922
Energy: 1.2012634981061667
Energy: 1.42230979728791
Energy: 1.283463021013522
Energy: 1.4223097972893919
Energy: 1.2012634981061667
Energy: 1.422309797286428
Energy: 1.5774140321505514
Energy: 1.3946439480490582
Energy: 1.1147284275209364
Energy: 1.3946439480520223
Energy: 1.5774140321505514
Energy: 1.3946439480520223
Energy: 1.5748326599070483
Energy: 1.3950747534849661
Energy: 1.1141584475710806
Energy: 1.3950747534834842
Energy: 1.5748326599055664
Energy: 1.3950747534849661
Energy: 1.2010626938082427
Energy: 1.4223602608523052
Energy: 1.20852317623903
Energy: 1.4223602608523052
Energy: 1.201062693809725
Energy: 1.422360260853787

minimum gb energy = 1.1141584475710806 eV
minimum distance =  2.18029641847796 Angstroms
sigma value = 11


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

Energy: 1.2433384984769706
Energy: 1.3644208014405688
Energy: 1.193260158494575
Energy: 1.3644208014405688
Energy: 1.2433384984769706
Energy: 1.3644208014405688
Energy: 1.719771818519715
Energy: 1.311002035357394
Energy: 1.053607618407951
Energy: 1.3110020353584793
Energy: 1.7197718185208002
Energy: 1.3110020353563083
Energy: 1.2277153470159408
Energy: 1.295075533108836
Energy: 1.1992870749107576
Energy: 1.2950755331077504
Energy: 1.2277153470159408
Energy: 1.2950755331099213
Energy: 1.2522974352255611
Energy: 1.2852452401524095
Energy: 1.0544897091282301
Energy: 1.2852452401567518
Energy: 1.252297435224476
Energy: 1.285245240153495
Energy: 1.0527487256221535
Energy: 1.3646843658168162
Energy: 1.0747870073726198
Energy: 1.3646843658168162
Energy: 1.0527487256232386
Energy: 1.364684365814645
Energy: 1.0663896553176417
Energy: 1.3497327308310045
Energy: 1.0531898572204246
Energy: 1.34973273083209
Energy: 1.0663896553187275
Energy: 1.34973273083209
Energy: 1.065375816053324
Energy: 1.38268286282485
Energy: 1.0633866913756924
Energy: 1.3826828628226788
Energy: 1.065375816053324
Energy: 1.3826828628259353
Energy: 1.467200640766937
Energy: 1.3605746410338921
Energy: 1.0754953287447637
Energy: 1.3605746410349777
Energy: 1.467200640766937
Energy: 1.3605746410338921
Energy: 1.4656990478256755
Energy: 1.3578048850607194
Energy: 1.496301183318059
Energy: 1.3578048850563773
Energy: 1.46569904782459
Energy: 1.3578048850563773
Energy: 1.0663619199434207
Energy: 1.2963116303500541
Energy: 1.053055000217615
Energy: 1.2963116303500541
Energy: 1.0663619199434207
Energy: 1.296311630357653
Energy: 1.0656585178209779
Energy: 1.346746478877069
Energy: 1.0648667904625073
Energy: 1.346746478877069
Energy: 1.0656585178209779
Energy: 1.3467464788759838
Energy: 1.053692082745185
Energy: 1.3603093052296846
Energy: 1.054386401164371
Energy: 1.3603093052296846
Energy: 1.0536920827440996
Energy: 1.3603093052296846
Energy: 1.4687345827687657
Energy: 1.1933296065952186
Energy: 1.0753886304851576
Energy: 1.1933296065930477
Energy: 1.4687345827698512
Energy: 1.1933296065930477
Energy: 1.055764414569415
Energy: 1.2986072472657182
Energy: 1.0779022071980224
Energy: 1.2986072472624615
Energy: 1.0557644113054634
Energy: 1.2986072472646328
Energy: 1.716412063395071
Energy: 1.311978953729685
Energy: 1.0642009628433162
Energy: 1.311978953744883
Energy: 1.7164120633939852
Energy: 1.3119789537340276
Energy: 1.2365413033785646
Energy: 1.359997089218344
Energy: 1.27265678671096
Energy: 1.3599970892172584
Energy: 1.2365413033785646
Energy: 1.3599970892172584
Energy: 1.728934715904924
Energy: 1.3101343328151258
Energy: 1.07551007527469
Energy: 1.310134332820554
Energy: 1.7289347159038384
Energy: 1.310134332820554
Energy: 1.055223270421698
Energy: 1.2985105603438634
Energy: 1.0837997859577149
Energy: 1.29851056034712
Energy: 1.0552232704043287
Energy: 1.2985105603482054
Energy: 1.2519996294509337
Energy: 1.2849678007615055
Energy: 1.052465768128347
Energy: 1.2849678007615055
Energy: 1.251999629449848
Energy: 1.2849678007604197
Energy: 1.053313369299124
Energy: 1.364708565630072
Energy: 1.0711317855630884
Energy: 1.3647085656311573
Energy: 1.053313369298038
Energy: 1.3647085656289861
Energy: 1.5115362197043845
Energy: 1.346857221824071
Energy: 1.0576183234380125
Energy: 1.3468572218251569
Energy: 1.5115362197043845
Energy: 1.346857221824071
Energy: 1.0664654675166745
Energy: 1.3767733818169154
Energy: 1.061150551020907
Energy: 1.3767733818190864
Energy: 1.066465467515589
Energy: 1.376773381818001
Energy: 1.4706127713866204
Energy: 1.3576302411430747
Energy: 1.0743615725359617
Energy: 1.3576302411419894
Energy: 1.4706127713887913
Energy: 1.3576302411419894
Energy: 1.0541626106179405
Energy: 1.3654125783781368
Energy: 1.4772472962171017
Energy: 1.3654125783781368
Energy: 1.0541626106179405
Energy: 1.3654125783781368
Energy: 1.0679143481310949
Energy: 1.2931208937394492
Energy: 1.0568587364267135
Energy: 1.2931208937383636
Energy: 1.06791434813218
Energy: 1.2931208937383636
Energy: 1.0665710451835066
Energy: 1.3452083080876855
Energy: 1.0607791216205895
Energy: 1.3452083080855146
Energy: 1.0665710451835066
Energy: 1.3452083080866

minimum gb energy = 1.052465768128347 eV
minimum distance =  2.23884131115735 Angstroms
sigma value = 41


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

Energy: 1.5367627755547062
Energy: 1.2958392105510694
Energy: 1.0410960860663192
Energy: 1.2958392105502137
Energy: 1.536762775555562
Energy: 1.2958392105527807
Energy: 1.9397954414798781
Energy: 1.193204850342646
Energy: 0.9831916648323414
Energy: 1.1932048503452126
Energy: 1.9397954414798781
Energy: 1.1932048503435015
Energy: 1.1245381587579932
Energy: 1.2516008019431746
Energy: 1.0148847042356335
Energy: 1.2516008019431746
Energy: 1.1245381587579932
Energy: 1.2516008019431746
Energy: 1.4948235147742408
Energy: 1.1676755699035473
Energy: 0.9830570291362624
Energy: 1.1676755699009804
Energy: 1.4948235147750966
Energy: 1.167675569901836
Energy: 1.1040864216576938
Energy: 1.1796857288327336
Energy: 1.0049237236592081
Energy: 1.1796857288327336
Energy: 1.104086421658549
Energy: 1.1796857288335891
Energy: 1.2920491076613692
Energy: 1.2308100904198103
Energy: 0.983071830893498
Energy: 1.2308100904198103
Energy: 1.292049107662225
Energy: 1.2308100904189545
Energy: 0.9833282670205975
Energy: 1.2394370849196172
Energy: 0.9850717468881219
Energy: 1.2394370849187617
Energy: 0.9833282670205975
Energy: 1.2394370849196172
Energy: 1.3391781543259311
Energy: 1.239455313175485
Energy: 1.0027134199999166
Energy: 1.239455313172918
Energy: 1.3391781543259311
Energy: 1.2394553131763406
Energy: 0.9986468208313103
Energy: 1.2463702143403277
Energy: 1.2937744714858652
Energy: 1.2463702143377606
Energy: 0.9986468208313103
Energy: 1.2463702143411832
Energy: 1.3039289372094738
Energy: 1.2394466054784674
Energy: 1.304803867116532
Energy: 1.239446605477612
Energy: 1.3039289372094738
Energy: 1.2394466054793232
Energy: 1.2973510163499105
Energy: 1.2969844480009625
Energy: 1.297406034753654
Energy: 1.2969844480009625
Energy: 1.2973510163499105
Energy: 1.2969844480009625
Energy: 0.9946261520654418
Energy: 1.239462667448307
Energy: 1.004359925082464
Energy: 1.2585091698299968
Energy: 0.9946261520654418
Energy: 1.239462667448307
Energy: 0.9985501011206479
Energy: 1.2310356037002457
Energy: 1.278635416515077
Energy: 1.2310356037011017
Energy: 0.9985501011215037
Energy: 1.2310356037011017
Energy: 0.9823149434607615
Energy: 1.2394751005197449
Energy: 0.982678386178456
Energy: 1.2394751005223117
Energy: 0.9823149434607615
Energy: 1.2394751005206006
Energy: 1.3002438975952857
Energy: 1.2313183613943754
Energy: 0.9843133166950403
Energy: 1.2313183613943754
Energy: 1.3002438975944302
Energy: 1.2313183613943754
Energy: 0.9859327281680063
Energy: 1.2403001496461563
Energy: 0.982855127256135
Energy: 1.2403001496461563
Energy: 0.9859327281671506
Energy: 1.2403001496461563
Energy: 1.2789279733894785
Energy: 1.2573571939566979
Energy: 1.0053401160641848
Energy: 1.2573571939558423
Energy: 1.2789279733860561
Energy: 1.2573571939549866
Energy: 1.0057548246647354
Energy: 1.2394085849564784
Energy: 0.9942916375565704
Energy: 1.2394085849564784
Energy: 1.0057548246655912
Energy: 1.2394085849564784
Energy: 1.7094375034508003
Energy: 1.1966768687861031
Energy: 0.9844238945979356
Energy: 1.1966768688485239
Energy: 1.7094375034499447
Energy: 1.1966768687869587
Energy: 1.293949718435684
Energy: 1.2394138367400567
Energy: 1.2964343095445943
Energy: 1.2394138367417677
Energy: 1.2939497184373951
Energy: 1.2394138367426235
Energy: 1.6950553563163417
Energy: 1.193655146838316
Energy: 0.9960327354779254
Energy: 1.1936551468391716
Energy: 1.6950553563171973
Energy: 1.193655146836605
Energy: 1.0067214010451149
Energy: 1.2398719311587254
Energy: 0.9956764794702514
Energy: 1.2398719311595812
Energy: 1.0067214010340308
Energy: 1.2398719311595812
Energy: 1.513034309078013
Energy: 1.168195963215114
Energy: 0.9846333487658827
Energy: 1.1681959632159695
Energy: 1.5130343090788683
Energy: 1.1681959632142582
Energy: 0.9856669136693113
Energy: 1.2305831723517013
Energy: 1.144204783560201
Energy: 1.2305831723517013
Energy: 0.9856669136684556
Energy: 1.2305831723517013
Energy: 1.1433198698570866
Energy: 1.2303007655459746
Energy: 0.9830459610388701
Energy: 1.23030076554683
Energy: 1.1433198698570866
Energy: 1.23030076554683
Energy: 0.9821786339624231
Energy: 1.167645806781548
Energy: 1.1304074065353045
Energy: 1.1676458067806925
Energy: 0.9821786339624231
Energy: 1.1676458067798368
Energy: 1.3400835378671732
Energy: 1.2393413127602095
Energy: 1.0035684389994994
Energy: 1.2393413127610649
Energy: 1.3400835378671732
Energy: 1.2393413127602095
Energy: 0.9948943499735949
Energy: 1.2426975743976856
Energy: 1.485562669291606
Energy: 1.2426975743985411
Energy: 0.9948943499735949
Energy: 1.2426975743985411
Energy: 1.3052334611381113
Energy: 1.2391440021484095
Energy: 1.2924967445527882
Energy: 1.2391440021484095
Energy: 1.3052334611381113
Energy: 1.2391440021484095
Energy: 0.9824667675084676
Energy: 1.2092748333757766
Energy: 1.2930098741031677
Energy: 1.209274833374921
Energy: 0.9824667675084676
Energy: 1.209274833376632
Energy: 0.9954387360971236
Energy: 1.2393283736418612
Energy: 1.003663065690934
Energy: 1.2393283736427168
Energy: 0.9954387360971236
Energy: 1.2393283736418612
Energy: 0.9950208433966167
Energy: 1.2990755061732382
Energy: 1.2821201371095456
Energy: 1.2990755061732382
Energy: 0.9950208433966167
Energy: 1.2990755061740937
Energy: 0.9846996213529362
Energy: 1.2393602246936042
Energy: 0.9850299102756644
Energy: 1.2393602246927486
Energy: 0.9846996213529362
Energy: 1.2393602246936042

minimum gb energy = 0.9821786339624231 eV
minimum distance =  2.2350441650513 Angstroms
sigma value = 33


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

Energy: 1.270230449501756
Energy: 1.1224286544622644
Energy: 0.9123981962827694
Energy: 1.122428654461664
Energy: 1.2702304494975525
Energy: 1.1224286544622644
Energy: 1.8457525959473977
Energy: 1.0309611662247418
Energy: 0.8861838136385064
Energy: 1.0309611662337488
Energy: 1.845752595946797
Energy: 1.0309611662253422
Energy: 1.263257925588494
Energy: 1.12045714290647
Energy: 1.0356661739003543
Energy: 1.1204571429052692
Energy: 1.2632579255872929
Energy: 1.1204571429070707
Energy: 1.7047101532197069
Energy: 1.0146729047320864
Energy: 0.886219991041594
Energy: 1.014672904731486
Energy: 1.7047101532197069
Energy: 1.0146729047350886
Energy: 0.9423604262036881
Energy: 1.094858890139659
Energy: 0.8874350870142753
Energy: 1.0948588901402594
Energy: 0.9423604261988843
Energy: 1.094858890137257
Energy: 1.366926810586702
Energy: 1.0657411449057779
Energy: 0.8861369158836518
Energy: 1.0657411449051775
Energy: 1.3669268105861019
Energy: 1.0657411449057779
Energy: 0.92320841068713
Energy: 1.079707601932072
Energy: 0.883494017845775
Energy: 1.079707601932072
Energy: 0.9232084106811254
Energy: 1.079707601932072
Energy: 1.2258722583744486
Energy: 1.0692531060754813
Energy: 0.8944486984282978
Energy: 1.06925310607428
Energy: 1.2258722583678434
Energy: 1.0692531060748807
Energy: 0.9017535900114707
Energy: 1.0943470702607436
Energy: 1.0656990184488013
Energy: 1.0943470702595426
Energy: 0.9017535900120712
Energy: 1.0943470702595426
Energy: 1.0855004843568496
Energy: 1.0980190067537274
Energy: 1.0912516583446668
Energy: 1.098019006753127
Energy: 1.0855004843568496
Energy: 1.098019006753127
Energy: 0.8958752977237193
Energy: 1.0798654610494085
Energy: 1.1160560313821306
Energy: 1.0798654610488079
Energy: 0.8958752977243197
Energy: 1.0798654610488079
Energy: 1.3867213723137397
Energy: 1.1138951685256393
Energy: 1.1126705847172451
Energy: 1.1138951685262397
Energy: 1.3867213723143401
Energy: 1.1138951685256393
Energy: 1.0900646638781863
Energy: 1.094428369022209
Energy: 1.392639411553437
Energy: 1.0944283690234098
Energy: 1.0900646638757843
Energy: 1.0944283690198071
Energy: 1.0989342386561625
Energy: 1.1150330122074201
Energy: 1.3937730926777603
Energy: 1.1150330122080205
Energy: 1.0989342386651697
Energy: 1.1150330122074201
Energy: 1.098318438372496
Energy: 1.0711800126380826
Energy: 1.3944437540910837
Energy: 1.071180012635681
Energy: 1.0983184383748976
Energy: 1.0711800126332787
Energy: 1.0939344408314702
Energy: 1.1145553618541704
Energy: 1.1169719814782542
Energy: 1.1145553618541704
Energy: 1.0939344408320704
Energy: 1.1145553618535695
Energy: 1.0871951800473476
Energy: 1.0952511061092176
Energy: 1.3140750725262118
Energy: 1.095251106111019
Energy: 1.0871951800473476
Energy: 1.0952511061092176
Energy: 0.883092085243577
Energy: 1.11411355082211
Energy: 1.1026538646238688
Energy: 1.1141135508227105
Energy: 0.8830920852429764
Energy: 1.11411355082211
Energy: 1.097554423568171
Energy: 1.0927107545654053
Energy: 1.1001254745761195
Energy: 1.092710754563604
Energy: 1.0975544235747763
Energy: 1.0927107545654053
Energy: 0.891917861467209
Energy: 1.1148012946537893
Energy: 0.8951780872206557
Energy: 1.1148012946537893
Energy: 0.8919178614678095
Energy: 1.1148012946543897
Energy: 1.0906371822801924
Energy: 1.0927469165467363
Energy: 1.083194449010293
Energy: 1.0927469165485377
Energy: 1.0906371822813932
Energy: 1.0927469165497388
Energy: 0.8969354997772563
Energy: 1.1142884000828466
Energy: 0.886424778556903
Energy: 1.1142884000840476
Energy: 0.8969354997874098
Energy: 1.114288400084648
Energy: 1.3747612321993175
Energy: 1.1036753270841828
Energy: 0.8831628462467261
Energy: 1.103675327084783
Energy: 1.3747612321993175
Energy: 1.10367532708058
Energy: 0.9238539563040016
Energy: 1.1141553812271368
Energy: 0.886169562579737
Energy: 1.1141553812271368
Energy: 0.9238539563009992
Energy: 1.1141553812271368
Energy: 1.3697646627026234
Energy: 1.0945192361226628
Energy: 1.0505068638327792
Energy: 1.0945192361238634
Energy: 1.3697646627086282
Energy: 1.094519236126866
Energy: 1.1245391616933489
Energy: 1.1142299006736098
Energy: 0.8903894027798468
Energy: 1.1142299006736098
Energy: 1.1245391616957505
Energy: 1.1142299006742102
Energy: 1.8463097157001442
Energy: 1.0444800911022945
Energy: 0.883149126932865
Energy: 1.0444800911028946
Energy: 1.8463097157013453
Energy: 1.0444800911028946
Energy: 1.1407514299340809
Energy: 1.1141696482970573
Energy: 1.107108277175036
Energy: 1.1141696482970573
Energy: 1.1407514299274757
Energy: 1.114169648296457
Energy: 1.5241288387532386
Energy: 1.0853405204587199
Energy: 1.0911789444710434
Energy: 1.0853405204533153
Energy: 1.5241288387526382
Energy: 1.085340520456318
Energy: 1.1235913658788763
Energy: 1.113726173273403
Energy: 1.10620728472302
Energy: 1.113726173273403
Energy: 1.1235913658938883
Energy: 1.113726173273403
Energy: 1.5306335236851452
Energy: 1.0157693032215676
Energy: 0.8830254476496777
Energy: 1.0157693032317756
Energy: 1.5306335236851452
Energy: 1.0157693032353785
Energy: 0.9265656844749635
Energy: 1.0979559660555729
Energy: 1.1150333409996238
Energy: 1.0979559660555729
Energy: 0.9265656844737624
Energy: 1.0979559660555729
Energy: 1.2268732660688921
Energy: 1.0662866237269952
Energy: 0.8914812023844821
Energy: 1.0662866237251938
Energy: 1.2268732660646888
Energy: 1.0662866237257942
Energy: 0.9029110385062211
Energy: 1.0688670237328681
Energy: 1.4065769831455506
Energy: 1.0688670237328681
Energy: 0.9029110385068215
Energy: 1.0688670237328681
Energy: 1.4066828080507665
Energy: 1.0690091693045791
Energy: 0.9030266079141953
Energy: 1.0690091693051795
Energy: 1.4066828080501659
Energy: 1.0690091693039785
Energy: 0.8914545207050719
Energy: 1.0657600161557617
Energy: 1.226581035336239
Energy: 1.0657600161557617
Energy: 0.8914545207050719
Energy: 1.0657600161557617
Energy: 1.1153543501598016
Energy: 1.0979386709409136
Energy: 0.9236983330795753
Energy: 1.0979386709403132
Energy: 1.1153543501598016
Energy: 1.0979386709403132
Energy: 0.8830544546016212
Energy: 1.014448491413344
Energy: 1.5296542728972924
Energy: 1.0144484914127434
Energy: 0.8830544546016212
Energy: 1.0144484914127434
Energy: 1.1062072847236204
Energy: 1.1137095167007416
Energy: 1.1259595286703443
Energy: 1.1137095167007416
Energy: 1.1062072847224191
Energy: 1.1137095167007416
Energy: 0.995465065069803
Energy: 1.085021151633504
Energy: 1.5238143490881262
Energy: 1.0850211516341044
Energy: 0.995465065069803
Energy: 1.0850211516317025
Energy: 1.1058433129516891
Energy: 1.1142052184873363
Energy: 1.1428708854925225
Energy: 1.1142052184873363
Energy: 1.1058433129667011
Energy: 1.1142052184867357
Energy: 0.883081277593219
Energy: 1.0452487760323406
Energy: 1.8467101864505167
Energy: 1.045248776032941
Energy: 0.8830812775938194
Energy: 1.0452487760323406
Energy: 0.8900147613591013
Energy: 1.1141685092409168
Energy: 1.1217781772050368
Energy: 1.1141685092415177
Energy: 0.8900147613591013
Energy: 1.1141685092421179
Energy: 0.9958605156762361
Energy: 1.094485888789939
Energy: 1.369710847980164
Energy: 1.0944858887893383
Energy: 0.9958605156714322
Energy: 1.0944858887911397
Energy: 0.886118822677527
Energy: 1.1140997124717078
Energy: 0.9266665524395237
Energy: 1.1140997124717078
Energy: 0.8861188226781275
Energy: 1.1140997124711074
Energy: 0.8830914648333391
Energy: 1.1036753270829815
Energy: 1.3736420263562625
Energy: 1.1036753270811803
Energy: 0.8830914648333391
Energy: 1.1036753270769768
Energy: 0.8863095687212685
Energy: 1.11430831203807
Energy: 0.9032403361051577
Energy: 1.1143083120374695
Energy: 0.88630956872307
Energy: 1.1143083120386703

minimum gb energy = 0.8830254476496777 eV
minimum distance =  2.23346654546244 Angstroms
sigma value = 67


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

Energy: 0.339825235315869
Energy: 0.29428167309344
Energy: 1.696084213079042
Energy: 0.29428167309344
Energy: 0.33982523531627945
Energy: 0.29428167309385045
Energy: 0.2781358378388078
Energy: 0.7048515407257123
Energy: 0.7148210244142474
Energy: 0.7048515407253019
Energy: 0.27813583783962864
Energy: 0.7048515407257123
Energy: 0.3398252353170774
Energy: 0.29428167309305236
Energy: 1.7409067207287423
Energy: 0.29428167309385045
Energy: 0.33982523531627945
Energy: 0.29428167309385045
Energy: 0.27813583783842016
Energy: 0.7048515407257123
Energy: 0.7148208206285095
Energy: 0.7048515407253019
Energy: 0.2781358378388078
Energy: 0.7048515407257123
Energy: 0.33982523531666703
Energy: 0.29428167309344
Energy: 1.7409067215887921
Energy: 0.29428167309344
Energy: 0.339825235315869
Energy: 0.29428167309305236
Energy: 0.2781358378388078
Energy: 0.7048515407257123
Energy: 0.7148210570127937
Energy: 0.7048515407253019
Energy: 0.2781358378388078
Energy: 0.7048515407253019
Energy: 0.33982523531627945
Energy: 0.29428167309385045
Energy: 1.7409067229141415
Energy: 0.29428167309385045
Energy: 0.339825235315869
Energy: 0.29428167309344

minimum gb energy = 0.27813583783842016 eV
minimum distance =  2.40058206096003 Angstroms
sigma value = 3


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

Energy: 1.4980884313196563
Energy: 1.120144768034905
Energy: 0.9459580930640011
Energy: 1.1201447680359973
Energy: 1.4980884313218408
Energy: 1.1201447680354513
Energy: 1.8856550624848583
Energy: 0.8778641409048579
Energy: 0.8701424731302851
Energy: 0.8778641409081347
Energy: 1.8856550624859505
Energy: 0.8778641409048579
Energy: 1.3403343021842697
Energy: 1.0973493808440666
Energy: 1.137125762325124
Energy: 1.0973493808440666
Energy: 1.3403343021842697
Energy: 1.0973493808440666
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Energy: 1.446650521970934
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Energy: 1.1806514869146567
Energy: 1.0757485319209428
Energy: 0.9220008998284484
Energy: 1.0757485319154814
Energy: 0.877155445809076
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Energy: 1.448662990841665
Energy: 1.0101788945342236
Energy: 0.8771554458096222
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Energy: 1.0890305388691608
Energy: 0.9224002854961835
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Energy: 0.8695264883063033
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Energy: 1.6675170231760799
Energy: 0.9217369714039573
Energy: 0.8695264883068494
Energy: 0.9217369714050496
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Energy: 1.4035702473533758
Energy: 1.097829966390575
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Energy: 1.097829966390575
Energy: 0.8584306386602475
Energy: 0.9221935050540109
Energy: 1.526576766368723
Energy: 0.9221935050551032
Energy: 0.8584306386569709
Energy: 0.9221935050578337
Energy: 0.9244323621787487
Energy: 1.0910670613909912
Energy: 1.4576975600347328
Energy: 1.091067061389899
Energy: 0.9244323621782025
Energy: 1.0910670613915374
Energy: 0.8730801587276209
Energy: 0.9141143651132136
Energy: 1.6000890874284273
Energy: 0.9141143651121214
Energy: 0.8730801587276209
Energy: 0.9141143651126674
Energy: 0.9164627037324069
Energy: 1.0779379308974235
Energy: 1.180439443739417
Energy: 1.0779379308974235
Energy: 0.9164627037307685
Energy: 1.0779379308974235
Energy: 0.9284856439279927
Energy: 1.037288043616766
Energy: 1.3246732158797838
Energy: 1.037288043616766
Energy: 0.9284856439274465
Energy: 1.037288043616766
Energy: 1.1752827883535302
Energy: 1.0670006377994872
Energy: 1.1619983308358126
Energy: 1.067000637798395
Energy: 1.175282788352984
Energy: 1.067000637798941

minimum gb energy = 0.8530889427427861 eV
minimum distance =  2.26116482685378 Angstroms
sigma value = 81


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

Energy: 1.4916859496512285
Energy: 1.266930340513628
Energy: 1.0215356228272603
Energy: 1.2669303405113794
Energy: 1.491685949651978
Energy: 1.266930340513628
Energy: 1.7740738829117204
Energy: 0.9863865022341662
Energy: 0.9720265458534314
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Energy: 1.2470829443335585
Energy: 1.0913500729864543
Energy: 1.2470829443320592
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Energy: 0.974217371166742
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Energy: 0.9781911871765204
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Energy: 1.2280276813807116
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Energy: 1.226087538172814
Energy: 1.0330564905032575
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Energy: 1.357592785770185
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Energy: 1.3575070278371446
Energy: 1.2070960008098366
Energy: 1.043183434082863
Energy: 1.2070960008090872
Energy: 1.3575070278371446
Energy: 1.2070960008090872
Energy: 1.042659287658052
Energy: 1.1939584258794564
Energy: 1.3671101163723614
Energy: 1.1939584258794564
Energy: 1.042659287658052
Energy: 1.1939584258794564
Energy: 1.0427129364787824
Energy: 1.2279487407948981
Energy: 1.086885878444511
Energy: 1.2279487407941487
Energy: 1.0427129364795318
Energy: 1.2279487407948981
Energy: 1.0431685384997573
Energy: 1.1780085779026845
Energy: 1.3581314538888922
Energy: 1.178008577900436
Energy: 1.0431685384997573
Energy: 1.1780085779026845
Energy: 1.0432482390226665
Energy: 1.2193036050241421
Energy: 1.3867573956584562
Energy: 1.2193036050241421
Energy: 1.0432482390226665
Energy: 1.2193036050241421
Energy: 0.9682366796331358
Energy: 1.1892397770752745
Energy: 1.686777396903186
Energy: 1.1892397770760241
Energy: 0.9682366796331358
Energy: 1.1892397770752745
Energy: 0.9616375075953955
Energy: 1.2279218091142519
Energy: 1.372781182489134
Energy: 1.2279218091135025
Energy: 0.9616375075938963
Energy: 1.2279218091135025
Energy: 0.9687222518137818
Energy: 1.032767705513114
Energy: 1.495875929901328
Energy: 1.0327677055108992
Energy: 0.9687222518145313
Energy: 1.032767705513114
Energy: 1.05565977834615
Energy: 1.2296048858038178
Energy: 1.378960712769741
Energy: 1.2296048858030684
Energy: 1.0556597783454005
Energy: 1.2296048858038178
Energy: 0.9744437859027646
Energy: 1.079792437684888
Energy: 1.5822855267662232
Energy: 1.0797924376871366
Energy: 0.9744437859027646
Energy: 1.0797924376908843
Energy: 1.0330334537086514
Energy: 1.1948064936852965
Energy: 1.0866171937914249
Energy: 1.1948064936852965
Energy: 1.0330334537086514
Energy: 1.1948064936867957
Energy: 1.0592943613748662
Energy: 1.2241837943294547
Energy: 1.2090843980237507
Energy: 1.224183794330954
Energy: 1.0592943613748662
Energy: 1.2241837943287055

minimum gb energy = 0.9554097430692197 eV
minimum distance =  2.18067426120866 Angstroms
sigma value = 43


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

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Energy: 1.3495237249560144
Energy: 1.0401171020203275
Energy: 1.3495237249560144
Energy: 1.5305300688783798
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Energy: 1.4055601351563813
Energy: 1.2901139823529024
Energy: 1.3355316009099607
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Energy: 1.405560135157302
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Energy: 1.4380586135267903
Energy: 1.3216027876507201
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Energy: 1.4380586135267903
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Energy: 1.4388944885207566
Energy: 1.3229008296932043
Energy: 1.0337817696800515
Energy: 1.3229008296932043
Energy: 1.4388944885207566
Energy: 1.3229008296922837
Energy: 1.4046230405302693
Energy: 1.3386813727977256
Energy: 1.0325940962175344
Energy: 1.3386813727977256
Energy: 1.4046230405302693
Energy: 1.3386813727977256
Energy: 1.405526796184163
Energy: 1.3561419723803674
Energy: 1.0325479465400316
Energy: 1.3561419723803674
Energy: 1.405526796184163
Energy: 1.3561419723803674
Energy: 1.0316421327339986
Energy: 1.2971748695725869
Energy: 1.0251456833581696
Energy: 1.2971748695735075
Energy: 1.0316421327339986
Energy: 1.2971748695716663
Energy: 1.0331517072311782
Energy: 1.3131482779403847
Energy: 1.0319234539507454
Energy: 1.3131482779403847
Energy: 1.0331517072311782
Energy: 1.3131482779413055
Energy: 1.0409985894459777
Energy: 1.3227682035924055
Energy: 1.0313197246051131
Energy: 1.3227682035924055
Energy: 1.0409985894459777
Energy: 1.3227682035924055
Energy: 1.043073566967788
Energy: 1.3561802037675776
Energy: 1.076275204626327
Energy: 1.3561802037675776
Energy: 1.043073566967788
Energy: 1.3561802037675776
Energy: 1.0338363946470948
Energy: 1.3256754469788141
Energy: 1.4047870741558923
Energy: 1.3256754469788141
Energy: 1.0338363946470948
Energy: 1.3256754469788141
Energy: 1.033286022890403
Energy: 1.323240056300797
Energy: 1.438172078882179
Energy: 1.323240056300797
Energy: 1.033286022890403
Energy: 1.323240056300797
Energy: 1.0437929024193897
Energy: 1.3284227954946592
Energy: 1.2960967973283755
Energy: 1.3284227954946592
Energy: 1.0437929024203103
Energy: 1.3284227954946592
Energy: 1.0605455648425228
Energy: 1.2899794807679215
Energy: 1.0762671144405245
Energy: 1.2899794807679215
Energy: 1.0605455648425228
Energy: 1.289979480768842
Energy: 1.0335562696864231
Energy: 1.177564097128432
Energy: 1.2252515016394963
Energy: 1.177564097128432
Energy: 1.0335562696873437
Energy: 1.177564097128432
Energy: 1.0461532019744275
Energy: 1.2973260832248354
Energy: 1.0316518501381684
Energy: 1.2973260832248354
Energy: 1.0461532019744275
Energy: 1.2973260832239148

minimum gb energy = 1.0237019065977255 eV
minimum distance =  2.23091748322642 Angstroms
sigma value = 57


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

Energy: 1.2070465895135083
Energy: 1.4583190043352714
Energy: 1.1682258464036446
Energy: 1.4583190043340792
Energy: 1.2070465895147002
Energy: 1.4583190043364633
Energy: 1.4097637472711069
Energy: 1.2021157649218712
Energy: 1.1206178117012542
Energy: 1.2021157649218712
Energy: 1.4097637472711069
Energy: 1.2021157649349845
Energy: 1.1366485158916697
Energy: 1.4483176413670318
Energy: 1.3312477609707238
Energy: 1.4483176413658394
Energy: 1.1366485158916697
Energy: 1.4483176413658394
Energy: 1.144036469501946
Energy: 1.1343064410984036
Energy: 1.1240627200118705
Energy: 1.1343064410972115
Energy: 1.1440364695007539
Energy: 1.134306441100788
Energy: 1.1203451789587466
Energy: 1.147731150309642
Energy: 1.1421721210710116
Energy: 1.147731150309642
Energy: 1.1203451789587466
Energy: 1.147731150310834
Energy: 1.15396541803183
Energy: 1.4350760385296673
Energy: 1.1241960203360049
Energy: 1.4350760385296673
Energy: 1.153965418030638
Energy: 1.4350760385296673
Energy: 1.1344532929374707
Energy: 1.316393287593737
Energy: 1.409159146548591
Energy: 1.316393287593737
Energy: 1.1344532929374707
Energy: 1.316393287593737
Energy: 1.1324641991984623
Energy: 1.4451213428258616
Energy: 1.1859697456581009
Energy: 1.4451213428246696
Energy: 1.1324641991984623
Energy: 1.4451213428246696
Energy: 1.1206297388638846
Energy: 1.1972506538041765
Energy: 1.28394666346101
Energy: 1.1972506538006273
Energy: 1.1206297388638846
Energy: 1.1972506538053684
Energy: 1.1397898836212361
Energy: 1.430546700188384
Energy: 1.124170027817315
Energy: 1.430546700188384
Energy: 1.139789883622428
Energy: 1.430546700187192
Energy: 1.1339569614864897
Energy: 1.1324874391018669
Energy: 1.1260947725415933
Energy: 1.1324874391018669
Energy: 1.1339569614876817
Energy: 1.1324874391006747
Energy: 1.1209924797827602
Energy: 1.3066596360058038
Energy: 1.123993498193741
Energy: 1.3066596360046119
Energy: 1.1209924797827602
Energy: 1.3066596360022278
Energy: 1.120835657788243
Energy: 1.4350649967436773
Energy: 1.1669442437541528
Energy: 1.4350649967436773
Energy: 1.120835657788243
Energy: 1.4350649967436773
Energy: 1.392320201644585
Energy: 1.4575019267548446
Energy: 1.1309669231851922
Energy: 1.4575019267560365
Energy: 1.392320201644585
Energy: 1.4575019267548446
Energy: 1.647598677864178
Energy: 1.4420225086371787
Energy: 1.1314414298649786
Energy: 1.4420225086359866
Energy: 1.647598677864178
Energy: 1.4420225086359866
Energy: 1.1212323737819545
Energy: 1.466502487086238
Energy: 1.1208606537493964
Energy: 1.466502487085046
Energy: 1.1212323737819545
Energy: 1.466502487085046
Energy: 1.121096155434942
Energy: 1.3163596717273205
Energy: 1.1333051726177052
Energy: 1.3163596717273205
Energy: 1.121096155434942
Energy: 1.3163596717273205
Energy: 1.132142763980821
Energy: 1.3291239602421567
Energy: 1.1320176471896837
Energy: 1.3291239602373885
Energy: 1.132142763980821
Energy: 1.3291239602481173
Energy: 1.1332878796870647
Energy: 1.316763980896902
Energy: 1.1211177640416916
Energy: 1.3167639808992864
Energy: 1.1332878796870647
Energy: 1.3167639808980942
Energy: 1.1207796322667392
Energy: 1.4666822112591638
Energy: 1.121483273373525
Energy: 1.4666822112591638
Energy: 1.120779632267931
Energy: 1.4666822112591638
Energy: 1.1318876549276313
Energy: 1.4421694857878407
Energy: 1.647581446459722
Energy: 1.4421694857878407
Energy: 1.1318876549276313
Energy: 1.4421694857878407
Energy: 1.13126925551064
Energy: 1.3032401026252087
Energy: 1.3925272032333251
Energy: 1.3032401026264007
Energy: 1.13126925551064
Energy: 1.3032401026240166
Energy: 1.1798956505967197
Energy: 1.435217772865799
Energy: 1.1207324535600012
Energy: 1.435217772865799
Energy: 1.1798956505967197
Energy: 1.435217772865799
Energy: 1.123994389312485
Energy: 1.306291167900989
Energy: 1.1209913954478012
Energy: 1.3062911679021811
Energy: 1.1239943893136772
Energy: 1.306291167900989

minimum gb energy = 1.1203451789587466 eV
minimum distance =  2.22250159471867 Angstroms
sigma value = 17


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

Energy: 1.5072851220754118
Energy: 1.2794827869502239
Energy: 1.7480982937162246
Energy: 1.2794827869502239
Energy: 1.5072851220754118
Energy: 1.2794827869485383
Energy: 1.483708620881661
Energy: 1.236254756625979
Energy: 1.2355464593624448
Energy: 1.236254756625979
Energy: 1.483708620881661
Energy: 1.2362547566276647
Energy: 1.4868853700761318
Energy: 1.4182967192040707
Energy: 1.6450656742466512
Energy: 1.4182967192040707
Energy: 1.4868853700744458
Energy: 1.4182967192023848
Energy: 1.2678258160397593
Energy: 1.4058414418926322
Energy: 1.4550436015649686
Energy: 1.4058414418926322
Energy: 1.2678258160397593
Energy: 1.4058414418926322
Energy: 1.2491505702532026
Energy: 1.241868454460743
Energy: 1.2462004886181033
Energy: 1.2418684544556857
Energy: 1.2491505702532026
Energy: 1.241868454504576
Energy: 1.2447665683971456
Energy: 1.2414174892651832
Energy: 1.2253498337637336
Energy: 1.2414174892651832
Energy: 1.2447665683971456
Energy: 1.2414174892651832
Energy: 1.249986624040041
Energy: 1.4453283911001544
Energy: 1.4871942443742077
Energy: 1.4453283911001544
Energy: 1.249986624040041
Energy: 1.445328391106898
Energy: 1.447404338363306
Energy: 1.4753887959779368
Energy: 1.4543981558370633
Energy: 1.4753887959779368
Energy: 1.447404338363306
Energy: 1.4753887959762508
Energy: 1.465317017620175
Energy: 1.4495190848765809
Energy: 1.2708033201343256
Energy: 1.4495190848765809
Energy: 1.465317017620175
Energy: 1.4495190848765809
Energy: 1.4907326458779981
Energy: 1.234564650967504
Energy: 1.237324640523523
Energy: 1.234564650967504
Energy: 1.4907326458779981
Energy: 1.2345646509691899
Energy: 1.4919821105213902
Energy: 1.4270085866044373
Energy: 1.2588266532333787
Energy: 1.4270085866044373
Energy: 1.4919821105213902
Energy: 1.4270085866027515
Energy: 1.459341374473624
Energy: 1.4712436764012802
Energy: 1.2338475922196126
Energy: 1.471243676402966
Energy: 1.459341374473624
Energy: 1.471243676402966
Energy: 1.4525696912985586
Energy: 1.4574894393598345
Energy: 1.4502478961486074
Energy: 1.4574894393598345
Energy: 1.4525696912985586
Energy: 1.4574894393598345
Energy: 1.2319944754035523
Energy: 1.4074301112547376
Energy: 1.4505063737578907
Energy: 1.4074301112513656
Energy: 1.2319944754018666
Energy: 1.4074301112530518
Energy: 1.2371053983156173
Energy: 1.5612217149139305
Energy: 1.2254403369138134
Energy: 1.5612217149139305
Energy: 1.2371053983139315
Energy: 1.5612217149139305
Energy: 1.242001350450389
Energy: 1.3838366670910698
Energy: 1.227146823863091
Energy: 1.3838366670927553
Energy: 1.242001350450389
Energy: 1.3838366670927553
Energy: 1.245671864480345
Energy: 1.449802239516147
Energy: 1.4597171279629144
Energy: 1.449802239516147
Energy: 1.245671864480345
Energy: 1.449802239516147

minimum gb energy = 1.2253498337637336 eV
minimum distance =  2.23949395720712 Angstroms
sigma value = 17


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

Energy: 1.6838223348769943
Energy: 1.6711701011221318
Energy: 1.3846320321347023
Energy: 1.6711701011214808
Energy: 1.6838223348782964
Energy: 1.6711701011221318
Energy: 1.5046012387404362
Energy: 1.2911487460315114
Energy: 1.2761552914283718
Energy: 1.291148746032813
Energy: 1.5046012387436913
Energy: 1.2911487460321625
Energy: 1.28239841426983
Energy: 1.3605349602961285
Energy: 1.3005973526960979
Energy: 1.3605349602961285
Energy: 1.28239841426983
Energy: 1.3605349602993837
Energy: 1.3118012061156157
Energy: 1.5476684057636592
Energy: 1.3235061539900037
Energy: 1.5476684057643102
Energy: 1.3118012061162667
Energy: 1.5476684057636592
Energy: 1.2847297504711046
Energy: 1.3413264451599036
Energy: 1.5187727383756
Energy: 1.3413264451612057
Energy: 1.2847297504698025
Energy: 1.3413264451651117
Energy: 1.340325973969964
Energy: 1.556731828141058
Energy: 1.3408604148975176
Energy: 1.5567318281384537
Energy: 1.340325973971266
Energy: 1.5567318281384537
Energy: 1.275270944130496
Energy: 1.3448022146890501
Energy: 1.508558770491139
Energy: 1.3448022146858247
Energy: 1.275270944130496
Energy: 1.3448022146851737
Energy: 1.6009668280686948
Energy: 1.4164955544827662
Energy: 1.2787405498482711
Energy: 1.4164955544866722
Energy: 1.6009668280706482
Energy: 1.416495554483417
Energy: 1.3505648400616677
Energy: 1.6218091764329878
Energy: 1.3015184396527912
Energy: 1.6218091764323666
Energy: 1.3505648400629697
Energy: 1.6218091764323666
Energy: 1.6011621566515701
Energy: 1.3280757204119606
Energy: 1.2757292349064244
Energy: 1.3302845807674508
Energy: 1.601162156652221
Energy: 1.341584945733147
Energy: 1.319973080362708
Energy: 1.6168287120215066
Energy: 1.3220824024412443
Energy: 1.6168287120208553
Energy: 1.3199730803633591
Energy: 1.6168287120215066
Energy: 1.2971543593299817
Energy: 1.5650643506659936
Energy: 1.275388870448685
Energy: 1.5650643506679467
Energy: 1.2971543593293307
Energy: 1.5650643506646915
Energy: 1.2795688723407002
Energy: 1.4194961047421937
Energy: 1.6650534279150826
Energy: 1.4194961047421937
Energy: 1.2795688723407002
Energy: 1.4194961047441468
Energy: 1.28992018865758
Energy: 1.531196824259608
Energy: 1.668090613150744
Energy: 1.5311968242713263
Energy: 1.289920188658231
Energy: 1.5311968242752325
Energy: 1.2888139588742036
Energy: 1.6406826862119328
Energy: 1.3248435448217353
Energy: 1.6406826862119328
Energy: 1.2888139588729015
Energy: 1.6406826862119328
Energy: 1.3216529971066542
Energy: 1.6401554983732614
Energy: 1.2754703153487108
Energy: 1.6807655793659475
Energy: 1.3216529971060031
Energy: 1.6401554983739124
Energy: 1.3166222006700712
Energy: 1.6428396814125377
Energy: 1.2882681924145216
Energy: 1.6428396814125377
Energy: 1.3166222006694202
Energy: 1.6428396814131887
Energy: 1.6557100469917552
Energy: 1.5152369946181876
Energy: 1.2999282832622456
Energy: 1.5152369946188389
Energy: 1.6557100469911041
Energy: 1.5152369946201407
Energy: 1.5739943356942416
Energy: 1.5171208291698512
Energy: 1.2756367864064613
Energy: 1.5171208291698512
Energy: 1.5739943356935906
Energy: 1.5171208291692002
Energy: 1.2787249406145564
Energy: 1.5880483513574086
Energy: 1.2790858523925859
Energy: 1.5011667652357426
Energy: 1.2787249406152073
Energy: 1.5872884585713904
Energy: 1.2754205649086994
Energy: 1.5168103818378438
Energy: 1.4920599101708716
Energy: 1.5168103818391458
Energy: 1.2754205649080483
Energy: 1.5168103818378438
Energy: 1.2979177369062456
Energy: 1.5132911773021651
Energy: 1.6556208371728554
Energy: 1.5132911772982591
Energy: 1.2979177369068966
Energy: 1.513291177297608
Energy: 1.292481679138321
Energy: 1.6430826329494492
Energy: 1.3166710737125193
Energy: 1.6430826329501003
Energy: 1.292481679138321
Energy: 1.6430826329487984
Energy: 1.275536049003493
Energy: 1.6144563791794042
Energy: 1.3223451360083447
Energy: 1.6144563791813573
Energy: 1.275536049003493
Energy: 1.5894470153835236
Energy: 1.3223193717165285
Energy: 1.6408385623383859
Energy: 1.2802619561703912
Energy: 1.6408385623377346
Energy: 1.3223193717146051
Energy: 1.6408385623377346
Energy: 1.6684254777396683
Energy: 1.5415602648980677
Energy: 1.2898826435931503
Energy: 1.5415602648746307
Energy: 1.6684254777409704
Energy: 1.5415602648460156
Energy: 1.665411275210717
Energy: 1.418236939044488
Energy: 1.2795708632963552
Energy: 1.4182369390288636
Energy: 1.6654112752113677
Energy: 1.4182369390405822
Energy: 1.2754064669985155
Energy: 1.5580581793016388
Energy: 1.2977452607841065
Energy: 1.5580581793081492
Energy: 1.2754064669985155
Energy: 1.5580581793016388
Energy: 1.3233469243484566
Energy: 1.6171748532345513
Energy: 1.3198912046175062
Energy: 1.6171748532306451
Energy: 1.3233469243510605
Energy: 1.6171748532319472
Energy: 1.2756606738514744
Energy: 1.341584945726637
Energy: 1.6012651440479646
Energy: 1.3415849457233817
Energy: 1.2756606738508234
Energy: 1.341584945726637
Energy: 1.2955064380847512
Energy: 1.6195295291370926
Energy: 1.3506536438823318
Energy: 1.6195295291364415
Energy: 1.295506438086053
Energy: 1.6195295291370926
Energy: 1.2787829283817946
Energy: 1.4161885690905414
Energy: 1.6011429549466847
Energy: 1.4161885690859841
Energy: 1.2787829283824457
Energy: 1.4161885690911926
Energy: 1.5083120331264048
Energy: 1.3408897493540004
Energy: 1.2755260338790484
Energy: 1.3408897494620111
Energy: 1.5083120331257538
Energy: 1.3408897494724272
Energy: 1.3436611924861088
Energy: 1.5579687089606964
Energy: 1.3399684926388173
Energy: 1.5579687089593943
Energy: 1.3436611924900148
Energy: 1.5579687089580923
Energy: 1.518562861726628
Energy: 1.3413264451625078
Energy: 1.280596805380782
Energy: 1.3413264451559974
Energy: 1.518562861719467
Energy: 1.3413264451735751
Energy: 1.3246554206949983
Energy: 1.565913737393099
Energy: 1.3102760659375103
Energy: 1.565913737390495
Energy: 1.3246554206956491
Energy: 1.565913737391146
Energy: 1.3114241536473377
Energy: 1.3390963547796708
Energy: 1.2824087552250236
Energy: 1.339096354778369
Energy: 1.3114241536427804
Energy: 1.339096354775114
Energy: 1.2761161896971636
Energy: 1.2913860534908663
Energy: 1.5151944791658611
Energy: 1.2913860534902155
Energy: 1.2761161896971636
Energy: 1.2913860534915174
Energy: 1.5308019127979944
Energy: 1.6711701011234341
Energy: 1.6838223348782964
Energy: 1.671170101122783
Energy: 1.5308019127953905
Energy: 1.6711701011234341
Energy: 1.2761552914296737
Energy: 1.291148746033464
Energy: 1.504601238742389
Energy: 1.2911487460321625
Energy: 1.2761552914309757
Energy: 1.2911487460321625
Energy: 1.3005973528496801
Energy: 1.3605349602980819
Energy: 1.282398414271132
Energy: 1.3605349602948267
Energy: 1.3005973530195079
Energy: 1.3605349602961285
Energy: 1.3235061539867485
Energy: 1.5476684057643102
Energy: 1.3118012061220965
Energy: 1.5476684057636592
Energy: 1.323506153999769
Energy: 1.5476684057630081
Energy: 1.518772738376251
Energy: 1.3413264451651117
Energy: 1.2847297504678494
Energy: 1.3413264451625078
Energy: 1.518772738376251
Energy: 1.3413264451696691

minimum gb energy = 1.275270944130496 eV
minimum distance =  2.20543643018668 Angstroms
sigma value = 57


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

Energy: 1.404411616173029
Energy: 1.641597796373
Energy: 1.5338446433839001
Energy: 1.641597796373
Energy: 1.4044116161719686
Energy: 1.6415977963740602
Energy: 1.3592926811452877
Energy: 1.2959908812592562
Energy: 1.295310621863008
Energy: 1.2959908812571361
Energy: 1.3592926811463477
Energy: 1.2959908812645562
Energy: 1.266266400549855
Energy: 1.36938334719376
Energy: 1.4830534866828764
Energy: 1.369383320880938
Energy: 1.266266400549855
Energy: 1.3693832689672905
Energy: 1.3780459778661986
Energy: 1.3870206468561714
Energy: 1.3531710970380473
Energy: 1.3870206468434512
Energy: 1.3780459778672587
Energy: 1.387020646847691
Energy: 1.269857384384154
Energy: 1.4092434817545385
Energy: 1.3806325821677434
Energy: 1.4092434817566584
Energy: 1.269857384384154
Energy: 1.4092434817545385
Energy: 1.3684403042170055
Energy: 1.3660510951157467
Energy: 1.3497472886493675
Energy: 1.3660510951199867
Energy: 1.3684403042159454
Energy: 1.366051095122107
Energy: 1.2697052949704828
Energy: 1.4530667693297639
Energy: 1.318090733702906
Energy: 1.4530667693297639
Energy: 1.2697052949694225
Energy: 1.4530667693244639
Energy: 1.6277074332809625
Energy: 1.3325211888414963
Energy: 1.2952418541956554
Energy: 1.332521189172078
Energy: 1.6277074332608221
Energy: 1.3325211885395354
Energy: 1.3862130538663915
Energy: 1.6774124390425398
Energy: 1.3137085608577939
Energy: 1.6774124390435998
Energy: 1.3862130538653317
Energy: 1.6774124390435998
Energy: 1.3564828422754285
Energy: 1.3024419364796576
Energy: 1.2988746296784957
Energy: 1.3024419364849575
Energy: 1.3564828422764885
Energy: 1.3024419364828375
Energy: 1.2695117231970232
Energy: 1.478860031181061
Energy: 1.3530858444308413
Energy: 1.4788600310666267
Energy: 1.2695117231980833
Energy: 1.4788600305135373
Energy: 1.3648291169216513
Energy: 1.3490299059758364
Energy: 1.3425372540618692
Energy: 1.3490299059768966
Energy: 1.3648291169227116
Energy: 1.3490299059779565
Energy: 1.2747501930016218
Energy: 1.5158527463158182
Energy: 1.3555462309020445
Energy: 1.5158527462904259
Energy: 1.2747501930026817
Energy: 1.5158527463274785
Energy: 1.3577557034630254
Energy: 1.41154888581386
Energy: 1.343007288683349
Energy: 1.41154888581386
Energy: 1.3577557034619652
Energy: 1.41154888581386
Energy: 1.274155305427699
Energy: 1.3656049299058088
Energy: 1.3146527223507538
Energy: 1.365604929916409
Energy: 1.274155305426639
Energy: 1.3656049299259492
Energy: 1.6287999924101595
Energy: 1.5597071553876383
Energy: 1.2983808847699034
Energy: 1.5597071553918784
Energy: 1.628799992510813
Energy: 1.5597071553982387
Energy: 1.3860851599656514
Energy: 1.5369647483539717
Energy: 1.3099498934869498
Energy: 1.5369647483433715
Energy: 1.3860851599667112
Energy: 1.5369647483264115
Energy: 1.3564288999355416
Energy: 1.3809516184689024
Energy: 1.3056765387698865
Energy: 1.3809516184763224
Energy: 1.3564288999355416
Energy: 1.3809516184731425
Energy: 1.274338639885289
Energy: 1.5190507348762543
Energy: 1.342065080103638
Energy: 1.519050734877314
Energy: 1.2743386398842287
Energy: 1.5190507348762543
Energy: 1.3640562547440738
Energy: 1.5287028416892134
Energy: 1.3401615503988604
Energy: 1.5287028416934536
Energy: 1.3640562547451338
Energy: 1.5287028416881536
Energy: 1.2837045903390356
Energy: 1.5250393553447543
Energy: 1.3427811123309574
Energy: 1.5250393553479344
Energy: 1.2837045903400957
Energy: 1.5250393553479344
Energy: 1.2676590523541575
Energy: 1.511443452395084
Energy: 1.340836026879876
Energy: 1.5114434523972042
Energy: 1.2676590523541575
Energy: 1.511443452395084
Energy: 1.2670467647427828
Energy: 1.3745002951073533
Energy: 1.3094628737505811
Energy: 1.37450029526732
Energy: 1.2670467647406627
Energy: 1.3745002950088197
Energy: 1.3763373677071447
Energy: 1.5287695989645662
Energy: 1.3057007327496435
Energy: 1.5287695805390138
Energy: 1.3763373677060846
Energy: 1.528769595907758
Energy: 1.3783593281330624
Energy: 1.5282344676637234
Energy: 1.300847179429954
Energy: 1.5282344676626634
Energy: 1.3783593281320028
Energy: 1.5282344676785635
Energy: 1.2672141236811436
Energy: 1.3755317058335241
Energy: 1.3110007107748494
Energy: 1.375531705837764
Energy: 1.2672141236811436
Energy: 1.3755317058356442
Energy: 1.2680339794375297
Energy: 1.5190732730572847
Energy: 1.340122402254334
Energy: 1.519073273059405
Energy: 1.2680339794364694
Energy: 1.5190732730583447

minimum gb energy = 1.266266400549855 eV
minimum distance =  2.23847816273715 Angstroms
sigma value = 43


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

Energy: 1.5553265160955627
Energy: 1.6871158413391396
Energy: 1.3890742461404053
Energy: 1.6871158413391396
Energy: 1.5553265161009693
Energy: 1.6871158413391396
Energy: 1.3992867920470107
Energy: 1.3519754932699917
Energy: 1.3121406472873427
Energy: 1.3519754932699917
Energy: 1.3992867920477832
Energy: 1.3519754932699917
Energy: 1.3343311701195957
Energy: 1.4793588516043548
Energy: 1.5615328615010486
Energy: 1.4793588516035823
Energy: 1.3343311701203682
Energy: 1.4793588516043548
Energy: 1.411678122010606
Energy: 1.647419661803761
Energy: 1.501915349880035
Energy: 1.647419661803761
Energy: 1.411678122010606
Energy: 1.6474196618029888
Energy: 1.3134179979285878
Energy: 1.3730757103460203
Energy: 1.4036236578219183
Energy: 1.373075710348337
Energy: 1.3134179979285878
Energy: 1.3730757103452478
Energy: 1.4938068474211543
Energy: 1.4592779475297268
Energy: 1.3442985386182627
Energy: 1.4592779475281823
Energy: 1.4938068474219266
Energy: 1.4592779475289543
Energy: 1.343467311510214
Energy: 1.460110483307058
Energy: 1.3426330361836714
Energy: 1.460110483309375
Energy: 1.343467311510214
Energy: 1.4601104833086025
Energy: 1.42011564452877
Energy: 1.3934092663260613
Energy: 1.3151219516218844
Energy: 1.3934092663260613
Energy: 1.4201156445256804
Energy: 1.3934092663268336
Energy: 1.504445850157819
Energy: 1.6482067721184073
Energy: 1.5000620741669375
Energy: 1.6482067721191795
Energy: 1.504445850157819
Energy: 1.6482067721191795
Energy: 1.532141728443246
Energy: 1.4672417968684814
Energy: 1.3319566924888717
Energy: 1.467241796871571
Energy: 1.5321417284447907
Energy: 1.467241796869254
Energy: 1.3126796190248982
Energy: 1.3776932154821526
Energy: 1.6099899390989036
Energy: 1.3776932154813806
Energy: 1.3126796190241259
Energy: 1.3776932154813806
Energy: 1.355416255661212
Energy: 1.5748770790890492
Energy: 1.4333737938801274
Energy: 1.5748770788296853
Energy: 1.3554162556588951
Energy: 1.5748770789300184
Energy: 1.3181589948089014
Energy: 1.3526068194723404
Energy: 1.5008543842763131
Energy: 1.3526068194738852
Energy: 1.3181589948089014
Energy: 1.3526068194769745
Energy: 1.5010883407364763
Energy: 1.5432948045249757
Energy: 1.33194768584862
Energy: 1.5432948045242036
Energy: 1.5010883407372486
Energy: 1.5432948045242036
Energy: 1.4993516403482394
Energy: 1.6529038112907601
Energy: 1.3392771138521007
Energy: 1.6529038112899876
Energy: 1.4993516403490117
Energy: 1.6529038112899876
Energy: 1.4922456321963682
Energy: 1.5046739829875209
Energy: 1.316713316302606
Energy: 1.5046739829859763
Energy: 1.4922456321971402
Energy: 1.5046739829913827
Energy: 1.3443478195642613
Energy: 1.647318818242979
Energy: 1.490598497497281
Energy: 1.6473188182422067
Energy: 1.3443478195642613
Energy: 1.6473188182437513
Energy: 1.340420690084823
Energy: 1.4636925701838823
Energy: 1.3448652772698841
Energy: 1.4636925701831098
Energy: 1.340420690084051
Energy: 1.4636925701869716
Energy: 1.3388268157946726
Energy: 1.4503494875201037
Energy: 1.5214846293572097
Energy: 1.4503494875216485
Energy: 1.338826815795445
Energy: 1.4503494875193312
Energy: 1.345595176877988
Energy: 1.5704084439343573
Energy: 1.499551271683636
Energy: 1.570408443935902
Energy: 1.345595176877988
Energy: 1.5704084439351298
Energy: 1.3360119109700277
Energy: 1.5353171833667778
Energy: 1.35599497557424
Energy: 1.5353171833513664
Energy: 1.3360119109700277
Energy: 1.535317183355228
Energy: 1.6190133860831057
Energy: 1.4746293171154377
Energy: 1.319094887141623
Energy: 1.4746293171169824
Energy: 1.619013386083878
Energy: 1.4746293171200715
Energy: 1.7102345044867626
Energy: 1.505597249564935
Energy: 1.3565731185806769
Energy: 1.5055972495641625
Energy: 1.7102345044883074
Energy: 1.5055972495641625
Energy: 1.3508955789947625
Energy: 1.5302565482229056
Energy: 1.3544863766422317
Energy: 1.530256548222133
Energy: 1.35089557899399
Energy: 1.5302565482275396
Energy: 1.3364860477218818
Energy: 1.6624291805600513
Energy: 1.5068578257068292
Energy: 1.6624291805600513
Energy: 1.3364860477218818
Energy: 1.6624291805600513
Energy: 1.3437619653438395
Energy: 1.5434541430442494
Energy: 1.503870949236052
Energy: 1.5434541430481112
Energy: 1.3437619653430672
Energy: 1.543454143040388
Energy: 1.3422094931464064
Energy: 1.5049464890882367
Energy: 1.492001678563325
Energy: 1.5049464890998216
Energy: 1.3422094931464064
Energy: 1.5049464890874646
Energy: 1.4901925218093621
Energy: 1.717650098630167
Energy: 1.4896974420294564
Energy: 1.7176500986309395
Energy: 1.4901925218093621
Energy: 1.7176500986309395
Energy: 1.4916620976285135
Energy: 1.4529249375289432
Energy: 1.3472197896972213
Energy: 1.4529249375281708
Energy: 1.4916620976285135
Energy: 1.4529249375250817
Energy: 1.503672058807687
Energy: 1.5368618405899082
Energy: 1.3456359655105905
Energy: 1.536861840586819
Energy: 1.503672058807687
Energy: 1.5368618405906807
Energy: 1.5013888908856345
Energy: 1.5703830564517571
Energy: 1.3398470777680607
Energy: 1.5703830564525296
Energy: 1.5013888908856345
Energy: 1.5703830564525296
Energy: 1.3546757778774534
Energy: 1.7334506576090323
Energy: 1.332674214116364
Energy: 1.7334506576090323
Energy: 1.3546757778774534
Energy: 1.733450657610577
Energy: 1.356215273481106
Energy: 1.613418277151162
Energy: 1.6095994227074504
Energy: 1.6134182771519345
Energy: 1.356215273481106
Energy: 1.6134182771519345
Energy: 1.3179593302099528
Energy: 1.4541596692152892
Energy: 1.707842760903444
Energy: 1.4541596692160614
Energy: 1.3179593302099528
Energy: 1.4541596692152892
Energy: 1.3563442473573322
Energy: 1.5371315361844606
Energy: 1.3387341907511172
Energy: 1.5371315361836884
Energy: 1.3563442473557876
Energy: 1.5371315361898668
Energy: 1.4997467212617437
Energy: 1.6618207898585735
Energy: 1.3326561790757465
Energy: 1.6618207898578012
Energy: 1.4997467212609714
Energy: 1.6618207898593107

minimum gb energy = 1.3121406472873427 eV
minimum distance =  2.23427576192876 Angstroms
sigma value = 81


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

Energy: 1.357820303003419
Energy: 1.3605549479731036
Energy: 1.5489306354720167
Energy: 1.360554947968847
Energy: 1.3578203030031288
Energy: 1.3605549479711043
Energy: 1.5491386232878064
Energy: 1.3605218534966648
Energy: 1.3578422286289962
Energy: 1.3605218534958263
Energy: 1.5491386232880968
Energy: 1.3605218534966648
Energy: 1.357805774692841
Energy: 1.360829781020316
Energy: 1.5490461511760827
Energy: 1.3608297810194776
Energy: 1.357805774692841
Energy: 1.3608297810194776
Energy: 1.5489306354737258
Energy: 1.3605549479711043
Energy: 1.3578203030025806
Energy: 1.3605549479702659
Energy: 1.5489306354737258
Energy: 1.360554947972233
Energy: 1.3578422286289962
Energy: 1.3605218534961168
Energy: 1.549138623288645
Energy: 1.3605218534958263
Energy: 1.3578422286289962
Energy: 1.3605218534958263
Energy: 1.5490461511760827
Energy: 1.3608297810194776
Energy: 1.3578057746925505
Energy: 1.3608297810200256
Energy: 1.5490461511775016
Energy: 1.3608297810197356
Energy: 1.3578203030028708
Energy: 1.360554947972233
Energy: 1.6316936562796387
Energy: 1.3605549479696855
Energy: 1.357820303003419
Energy: 1.3605549479705563
Energy: 1.5491386232892252
Energy: 1.3605218534961168
Energy: 1.3578422286289962
Energy: 1.3605218534961168
Energy: 1.5491386232872262
Energy: 1.3605218534961168
Energy: 1.3578057746925505
Energy: 1.3608297810191874
Energy: 1.5490461511743734
Energy: 1.3608297810194776
Energy: 1.357805774692841
Energy: 1.3608297810194776
Energy: 1.6938398842276592
Energy: 1.3605549479705563
Energy: 1.3578203030022902
Energy: 1.3605549479696855
Energy: 1.6938398842262403
Energy: 1.3605549479693952

minimum gb energy = 1.3578057746925505 eV
minimum distance =  2.23149227942517 Angstroms
sigma value = 3


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

Energy: 1.6644736198604297
Energy: 1.6784021171630437
Energy: 1.5606802994386078
Energy: 1.6784021171494952
Energy: 1.6644736198561836
Energy: 1.6784021171621943
Energy: 1.5528976976167224
Energy: 1.353684745876279
Energy: 1.2907455730514281
Energy: 1.3536847458643904
Energy: 1.552897697617572
Energy: 1.353684745871184
Energy: 1.3287823126805347
Energy: 1.348167253371263
Energy: 1.594132719212655
Energy: 1.348167253371263
Energy: 1.3287823126805347
Energy: 1.348167253372112
Energy: 1.7075968130233696
Energy: 1.6571456136371534
Energy: 1.347196934234949
Energy: 1.6571456136329072
Energy: 1.7075968130225203
Energy: 1.6571456136363043
Energy: 1.3348990665561804
Energy: 1.334329326223499
Energy: 1.6443004024428707
Energy: 1.3343293262209512
Energy: 1.334899066555331
Energy: 1.3343293262226494
Energy: 1.4809546042377695
Energy: 1.3939969868541742
Energy: 1.290058604613109
Energy: 1.393996986855023
Energy: 1.480954604248771
Energy: 1.3939969868533248
Energy: 1.3348666451490776
Energy: 1.3341845422162202
Energy: 1.4748410538651981
Energy: 1.3341845422170693
Energy: 1.3348666451482283
Energy: 1.3341845422162202
Energy: 1.3306859585635364
Energy: 1.7261798435568092
Energy: 1.3444785118559521
Energy: 1.72617984355596
Energy: 1.3306859585652349
Energy: 1.7261798435568092
Energy: 1.329770201850833
Energy: 1.5087631842191531
Energy: 1.610663579908337
Energy: 1.5087631842200027
Energy: 1.329770201849984
Energy: 1.5087631842191531
Energy: 1.3285349975084937
Energy: 1.3516647871307084
Energy: 1.2926960024952336
Energy: 1.351664787129859
Energy: 1.3285349975084937
Energy: 1.3516647871349543
Energy: 1.6448812221762585
Energy: 1.5452584638935134
Energy: 1.3616676630390736
Energy: 1.5452584638960611
Energy: 1.6448812221745601
Energy: 1.5452584638943625
Energy: 1.6472141568549186
Energy: 1.3117449732503086
Energy: 1.2921986054093038
Energy: 1.3117449732393076
Energy: 1.6472141568515217
Energy: 1.3117449732486488
Energy: 1.3309602933849285
Energy: 1.4281520633445008
Energy: 1.2921547116438217
Energy: 1.4281520633572389
Energy: 1.3309602933849285
Energy: 1.4281520633512945
Energy: 1.3292356326523842
Energy: 1.4013536484051756
Energy: 1.340635065622509
Energy: 1.4013536484467866
Energy: 1.329235632650686
Energy: 1.4013536484060247
Energy: 1.331955127822259
Energy: 1.3426242270655837
Energy: 1.3408359675405117
Energy: 1.342624227067282
Energy: 1.3319551278231079
Energy: 1.342624227072377
Energy: 1.3304888144256641
Energy: 1.3631703712565983
Energy: 1.2941212614350917
Energy: 1.3631703712574474
Energy: 1.3304888144256641
Energy: 1.363170371250654
Energy: 1.3315174126812706
Energy: 1.48051698799298
Energy: 1.2940871537939054
Energy: 1.4805169880040199
Energy: 1.3315174126812706
Energy: 1.4805169880065674
Energy: 1.3298493236495224
Energy: 1.42820791911956
Energy: 1.3406928920523338
Energy: 1.4282079191187107
Energy: 1.3298493236503715
Energy: 1.42820791911956
Energy: 1.3290270763624767
Energy: 1.4022385484290967
Energy: 1.3411420866758463
Energy: 1.4022385484265492
Energy: 1.329027076363326
Energy: 1.402238548429946
Energy: 1.3290178825793455
Energy: 1.3440330743204323
Energy: 1.2923716642564262
Energy: 1.3440330743161863
Energy: 1.3290178825793455
Energy: 1.3440330743034483
Energy: 1.6464549491873497
Energy: 1.3167372731989249
Energy: 1.2921773439158613
Energy: 1.316737273190433
Energy: 1.6464549491856513
Energy: 1.3167372731742981
Energy: 1.6437313540487615
Energy: 1.5498549718626944
Energy: 1.3553382219362788
Energy: 1.549854971865242
Energy: 1.6437313540487615
Energy: 1.5498549718626944
Energy: 1.3285042816699792
Energy: 1.353511378872712
Energy: 1.292715727915893
Energy: 1.3535113788701647
Energy: 1.3285042816708286
Energy: 1.353511378871863
Energy: 1.3288315863833031
Energy: 1.514945152920195
Energy: 1.6105819603948128
Energy: 1.5149451529193456
Energy: 1.3288315863858506
Energy: 1.514945152920195
Energy: 1.3303301417494773
Energy: 1.4292384207037274
Energy: 1.3432849500198816
Energy: 1.429238420702878
Energy: 1.330330141752025
Energy: 1.429238420702878
Energy: 1.3335270688708893
Energy: 1.5145730822903585
Energy: 1.4246383741760278
Energy: 1.514573095144954
Energy: 1.3335270688708893
Energy: 1.5145730354726032
Energy: 1.331448975326903
Energy: 1.544707474262971
Energy: 1.2911663164621106
Energy: 1.54470747426382
Energy: 1.3314489753294507
Energy: 1.544707474262971
Energy: 1.3333806689504408
Energy: 1.39388264812802
Energy: 1.6107250571927003
Energy: 1.393882648128869
Energy: 1.3333806689504408
Energy: 1.3938826481314166
Energy: 1.4313625930691196
Energy: 1.7170738148411027
Energy: 1.3471545968249279
Energy: 1.7170738148402536
Energy: 1.4313625930691196
Energy: 1.7170738148453488
Energy: 1.327474890697154
Energy: 1.3515633863710186
Energy: 1.4674914156632655
Energy: 1.3515633863718677
Energy: 1.327474890697154
Energy: 1.3515633863718677
Energy: 1.5530490890489723
Energy: 1.3552608621374356
Energy: 1.2899920788616526
Energy: 1.3552608621297926
Energy: 1.5530490890532185
Energy: 1.3552608621263957
Energy: 1.6464281451762117
Energy: 1.7392182936787592
Energy: 1.3586163077418802
Energy: 1.7392182936804577
Energy: 1.6464281451719656
Energy: 1.7392182936796083
Energy: 1.552598091899902
Energy: 1.3603366455706563
Energy: 1.28900114442815
Energy: 1.360336645568958
Energy: 1.552598091899902
Energy: 1.360336645573204

minimum gb energy = 1.28900114442815 eV
minimum distance =  2.19478068767619 Angstroms
sigma value = 67


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

Energy: 1.3164455750354784
Energy: 1.727493901494239
Energy: 1.6816010808629982
Energy: 1.727493901495449
Energy: 1.3164455750366886
Energy: 1.7274939014930288
Energy: 1.732506744150044
Energy: 1.280589687206328
Energy: 1.2681316464705128
Energy: 1.2805896872002778
Energy: 1.732506744150044
Energy: 1.2805896871990678
Energy: 1.270879590183486
Energy: 1.387713449930154
Energy: 1.477952661208188
Energy: 1.387713449926524
Energy: 1.270879590183486
Energy: 1.387713449925314
Energy: 1.6590423284245006
Energy: 1.6482694481889826
Energy: 1.2730839342062783
Energy: 1.6482694481938225
Energy: 1.6590423284305507
Energy: 1.6482694481901925
Energy: 1.2685029533230452
Energy: 1.7510168687158845
Energy: 1.6346632565342933
Energy: 1.7510168687146743
Energy: 1.2685029533230452
Energy: 1.7510168687158845
Energy: 1.2667379540161225
Energy: 1.541754218353261
Energy: 1.269016909420147
Energy: 1.5417542183544712
Energy: 1.2667379540161225
Energy: 1.5417542183544712
Energy: 1.2699411606681588
Energy: 1.2825241139615828
Energy: 1.293673350687556
Energy: 1.282524113960373
Energy: 1.2699411606681588
Energy: 1.2825241139555328
Energy: 1.288265195466763
Energy: 1.5255970236687328
Energy: 1.670646371734485
Energy: 1.5255970236675227
Energy: 1.288265195475233
Energy: 1.5255970236578427
Energy: 1.2905727257906956
Energy: 1.3108327333668344
Energy: 1.668281413264739
Energy: 1.310832733354734
Energy: 1.2905727257919055
Energy: 1.310832733358364
Energy: 1.2916901731710029
Energy: 1.3330788959566293
Energy: 1.296663441771379
Energy: 1.3330788959735695
Energy: 1.2916901731710029
Energy: 1.3330788959517892
Energy: 1.2688586237593988
Energy: 1.4329821491262353
Energy: 1.295285674620812
Energy: 1.4329821491298653
Energy: 1.268858623758189
Energy: 1.4329821491286552
Energy: 1.2706106184003871
Energy: 1.3229728153949765
Energy: 1.270761467236892
Energy: 1.3229728153925566
Energy: 1.2706106184003871
Energy: 1.3229728153949765
Energy: 1.296164903798735
Energy: 1.433858530299091
Energy: 1.2688762512502014
Energy: 1.433858530295461
Energy: 1.296164903798735
Energy: 1.4338585302966709
Energy: 1.2966319897426524
Energy: 1.3312444856409844
Energy: 1.2917876143188474
Energy: 1.3312444856361443
Energy: 1.2966319897414422
Energy: 1.3312444856409844
Energy: 1.6688774246867775
Energy: 1.310811449642631
Energy: 1.2906166212858052
Energy: 1.310811449639001
Energy: 1.668877424685567
Energy: 1.3108114496414212
Energy: 1.6719903338172692
Energy: 1.5265649681401436
Energy: 1.2885205048817285
Energy: 1.526564968141354
Energy: 1.6719903338172692
Energy: 1.5265649681377238
Energy: 1.2937394932472424
Energy: 1.2819654610193203
Energy: 1.290143862677092
Energy: 1.2819654610217406
Energy: 1.2937394932472424
Energy: 1.2819654610217406
Energy: 1.2690766412087426
Energy: 1.5414682105359734
Energy: 1.2667898935290653
Energy: 1.5414682105359734
Energy: 1.2690766412087426
Energy: 1.5414682105359734
Energy: 1.6334027512336258
Energy: 1.7491086941304435
Energy: 1.2684645151268303
Energy: 1.7491086941316536
Energy: 1.6334027512360458
Energy: 1.7491086941328635
Energy: 1.2730852732435043
Energy: 1.6593652430766113
Energy: 1.6586202415443025
Energy: 1.6593652430826613
Energy: 1.2730852732435043
Energy: 1.6593652430826613
Energy: 1.4934786787579684
Energy: 1.387713449927734
Energy: 1.2895278696378856
Energy: 1.387713449920474
Energy: 1.493478678726508
Energy: 1.387713449920474
Energy: 1.2681500691647585
Energy: 1.2828816128920244
Energy: 1.7324314917203416
Energy: 1.2828816128871845
Energy: 1.2681500691647585
Energy: 1.2828816128896043
Energy: 1.5363001160085155
Energy: 1.727493901490609
Energy: 1.3164455750354784
Energy: 1.727493901491819
Energy: 1.5363001160085155
Energy: 1.727493901491819

minimum gb energy = 1.2667379540161225 eV
minimum distance =  2.18848200755648 Angstroms
sigma value = 33


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

Energy: 1.5278376214919136
Energy: 1.774289417588872
Energy: 1.7396310036980231
Energy: 1.7742894175896395
Energy: 1.5278376214919136
Energy: 1.7742894175881043
Energy: 1.7090845337947402
Energy: 1.5162859842712464
Energy: 1.2293366785625204
Energy: 1.5162859842712464
Energy: 1.7090845338607197
Energy: 1.5162859842720142
Energy: 1.2263225115251117
Energy: 1.3080760020401663
Energy: 1.572037215944075
Energy: 1.3080760020409339
Energy: 1.2263225115258793
Energy: 1.3080760020378632
Energy: 1.2968641188926495
Energy: 1.3401822495921067
Energy: 1.2365579512497327
Energy: 1.3401398384930032
Energy: 1.296864118891882
Energy: 1.3402092081808534
Energy: 1.4469921895552194
Energy: 1.595914180388675
Energy: 1.4355441232166335
Energy: 1.595914180388675
Energy: 1.4469921895544517
Energy: 1.595914180388675
Energy: 1.4484761882285049
Energy: 1.4067186387208699
Energy: 1.2304568202718975
Energy: 1.434447873644905
Energy: 1.448476188227737
Energy: 1.406718638722405
Energy: 1.222613170323678
Energy: 1.2437118830828817
Energy: 1.2400311415279215
Energy: 1.2437118830813467
Energy: 1.222613170323678
Energy: 1.2437118830821143
Energy: 1.2446407383267535
Energy: 1.219921935004533
Energy: 1.4485528437541157
Energy: 1.2199219348664327
Energy: 1.2446407383267535
Energy: 1.2199219348687358
Energy: 1.4320496731476076
Energy: 1.4197932092642858
Energy: 1.445857415188398
Energy: 1.419793209267356
Energy: 1.4320496731483752
Energy: 1.419793209267356
Energy: 1.233832699377953
Energy: 1.2381627286029626
Energy: 1.220208410377168
Energy: 1.4074647848639097
Energy: 1.233832699377953
Energy: 1.2381627286014272
Energy: 1.217190979121717
Energy: 1.4215248996101073
Energy: 1.245811449380855
Energy: 1.4215248996101073
Energy: 1.2171909791209496
Energy: 1.4215248996093397
Energy: 1.2207037251871984
Energy: 1.2832061401751318
Energy: 1.7066974297939301
Energy: 1.2832061401751318
Energy: 1.220703725187966
Energy: 1.2832061401743644
Energy: 1.461921240968826
Energy: 1.543349949505355
Energy: 1.5140768994836538
Energy: 1.543349949505355
Energy: 1.4619212409680582
Energy: 1.543349949505355
Energy: 1.2293439338061283
Energy: 1.415767240026964
Energy: 1.2257608254011678
Energy: 1.415767240026964
Energy: 1.2293439338068963
Energy: 1.415767240026964
Energy: 1.4353381823177773
Energy: 1.3046951287061705
Energy: 1.2202966028462539
Energy: 1.3046951286977615
Energy: 1.4353381822924465
Energy: 1.3046951287046353
Energy: 1.2365603211858585
Energy: 1.4647073527224226
Energy: 1.6305892956874402
Energy: 1.4647073527308665
Energy: 1.236560321185091
Energy: 1.4647073527270282
Energy: 1.7026021418331467
Energy: 1.7693134530793184
Energy: 1.4927146526188375
Energy: 1.7693134530816215
Energy: 1.7026021418339143
Energy: 1.7693134530816215
Energy: 1.2193529658090894
Energy: 1.2447273684439668
Energy: 1.5793305175231265
Energy: 1.244727368440129
Energy: 1.2193529658090894
Energy: 1.2447273684408966
Energy: 1.466648252829957
Energy: 1.2423700196301874
Energy: 1.2227490232131355
Energy: 1.2423700196278846
Energy: 1.466648252828422
Energy: 1.242370019627117
Energy: 1.4825658348082842
Energy: 1.530201773659081
Energy: 1.2418800017114022
Energy: 1.5302017736537077
Energy: 1.4825658348075168
Energy: 1.5302017736606162
Energy: 1.6912200139084295
Energy: 1.38990321345152
Energy: 1.2322702013111113
Energy: 1.3899031523253906
Energy: 1.6912200139084295
Energy: 1.3899031803844728
Energy: 1.2266427839059266
Energy: 1.4267470625902925
Energy: 1.4344412589377755
Energy: 1.4267470625918277
Energy: 1.2266427839059266
Energy: 1.4267470625879897
Energy: 1.2432282678208542
Energy: 1.4228880777032562
Energy: 1.2228916424262462
Energy: 1.4228880777040238
Energy: 1.243228267819319
Energy: 1.4228880777040238
Energy: 1.5007669397149543
Energy: 1.55915744245503
Energy: 1.217609605352872
Energy: 1.5591574424557977
Energy: 1.5007669397141867
Energy: 1.5674117562719392
Energy: 1.70595179969236
Energy: 1.2851793528504558
Energy: 1.2177761804078517
Energy: 1.2851793528527584
Energy: 1.70595179969236
Energy: 1.2851793528481528
Energy: 1.2631505486308954
Energy: 1.4284644976225112
Energy: 1.2203031198975833
Energy: 1.4284644976225112
Energy: 1.2631505486308954
Energy: 1.4284644976225112
Energy: 1.2207222746114748
Energy: 1.4335662983914528
Energy: 1.4310838838456232
Energy: 1.4335662983906852
Energy: 1.2207222746107071
Energy: 1.4335662983914528
Energy: 1.4485866948487685
Energy: 1.4114286190266028
Energy: 1.2359819377793144
Energy: 1.4114286190258354
Energy: 1.4485866948480008
Energy: 1.4114286190243002
Energy: 1.4478792323603489
Energy: 1.2195963252374276
Energy: 1.2428978323922668
Energy: 1.2195963252351247
Energy: 1.4478792323411935
Energy: 1.2195963252312867
Energy: 1.2445406570962114
Energy: 1.245094435211082
Energy: 1.2241131661018996
Energy: 1.2450944352103144
Energy: 1.2445406571000497
Energy: 1.2450944352064763
Energy: 1.2226702604340627
Energy: 1.4072133355652592
Energy: 1.6873998313381897
Energy: 1.4072133355644916
Energy: 1.2226702604340627
Energy: 1.4072133355652592
Energy: 1.4687788699074213
Energy: 1.766279172494882
Energy: 1.4596406182774675
Energy: 1.7662791724926143
Energy: 1.4687788699074213
Energy: 1.7662791724941493
Energy: 1.235076490373702
Energy: 1.469411824152099
Energy: 1.5306887668420006
Energy: 1.4694118241490288
Energy: 1.235076490373702
Energy: 1.4694118241451908
Energy: 1.6137261769206928
Energy: 1.3056400875582637
Energy: 1.2269771853992857
Energy: 1.305640087559799
Energy: 1.6137261761680153
Energy: 1.3056400875574963
Energy: 1.2260366436441348
Energy: 1.4883927704244415
Energy: 1.569405116620187
Energy: 1.4883927704259765
Energy: 1.2260366436441348
Energy: 1.4883927704252091
Energy: 1.4546586184828227
Energy: 1.543657456007385
Energy: 1.533779835371975
Energy: 1.5436574560020118
Energy: 1.454658618492034
Energy: 1.5436574560165963
Energy: 1.2227567715346037
Energy: 1.6191225755553211
Energy: 1.7058266851637254
Energy: 1.619122575553786
Energy: 1.2227567715346037
Energy: 1.619122575553786

minimum gb energy = 1.2171909791209496 eV
minimum distance =  2.18671520399028 Angstroms
sigma value = 41


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

Energy: 1.0843926085610849
Energy: 1.0549007443941594
Energy: 1.7534649975935146
Energy: 1.0549007443941594
Energy: 1.0843926085589888
Energy: 1.0549007443941594
Energy: 1.6146951996743384
Energy: 1.0582239285441417
Energy: 1.0515731985486652
Energy: 1.0582239285441417
Energy: 1.6146951996722427
Energy: 1.0582239285441417
Energy: 1.0850971429167278
Energy: 1.2338518744060794
Energy: 1.0532930896906763
Energy: 1.2338518744060794
Energy: 1.0850971429167278
Energy: 1.233851874408175
Energy: 1.6475568340238909
Energy: 1.0570569062533377
Energy: 1.0515940124448397
Energy: 1.0570569062512418
Energy: 1.6475568340238909
Energy: 1.0570569062512418
Energy: 1.0822758651173863
Energy: 1.4418367148011915
Energy: 1.0539716837692326
Energy: 1.4418367148011915
Energy: 1.082275865123674
Energy: 1.4418367148011915
Energy: 1.0802554155181983
Energy: 1.08891461363716
Energy: 1.05150310008929
Energy: 1.08891461363716
Energy: 1.0802554183693565
Energy: 1.08891461363716
Energy: 1.644177483699733
Energy: 1.0584158680796854
Energy: 1.0556076261352139
Energy: 1.0584158680796854
Energy: 1.644177483699733
Energy: 1.0584158680796854
Energy: 1.0865452204526957
Energy: 1.0554857921041099
Energy: 1.052295523910754
Energy: 1.0554857921041099
Energy: 1.0865452204547914
Energy: 1.0554857921041099
Energy: 1.586264867513056
Energy: 1.0926623091011223
Energy: 1.0571442413282044
Energy: 1.0926623091011223
Energy: 1.5862648675151516
Energy: 1.0926623091011223
Energy: 1.0867990709957034
Energy: 1.439820973070065
Energy: 1.056544020737341
Energy: 1.439820973070065
Energy: 1.0867990709977993
Energy: 1.439820973072161
Energy: 1.6024675772341104
Energy: 1.055320345376338
Energy: 1.0586805424234396
Energy: 1.055320345376338
Energy: 1.6024675772362063
Energy: 1.055320345376338
Energy: 1.0963323788369375
Energy: 1.2293159669799683
Energy: 1.6505466390869301
Energy: 1.2293159669799683
Energy: 1.0963323788474169
Energy: 1.22931596698416
Energy: 1.6024875764757334
Energy: 1.0552694973755223
Energy: 1.0587035926722215
Energy: 1.0552694973755223
Energy: 1.6024875764757334
Energy: 1.0552694973734265
Energy: 1.0867782903054417
Energy: 1.4402126746755426
Energy: 1.056593862837925
Energy: 1.4402126746776385
Energy: 1.0867782903075376
Energy: 1.4402126746755426

minimum gb energy = 1.05150310008929 eV
minimum distance =  2.21527212510907 Angstroms
sigma value = 11


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

Energy: 1.5827391432218134
Energy: 1.2711811204534906
Energy: 1.71207747634081
Energy: 1.2711811204534906
Energy: 1.5827391432218134
Energy: 1.2711811204534906
Energy: 1.5332834468112
Energy: 1.5754734700470796
Energy: 1.2541088413276458
Energy: 1.575473470046159
Energy: 1.5332834468093586
Energy: 1.5754734700498416
Energy: 1.2561546823221017
Energy: 1.3735435856259415
Energy: 1.2585305563196656
Energy: 1.3735435856268625
Energy: 1.256154682323943
Energy: 1.3735435856259415
Energy: 1.2743051267068872
Energy: 1.2778927045284643
Energy: 1.2565609960810702
Energy: 1.2778927045284643
Energy: 1.2743051267068872
Energy: 1.2778927045303055
Energy: 1.4882320470061785
Energy: 1.4511093849294872
Energy: 1.2731120444786779
Energy: 1.4511093849294872
Energy: 1.4882320470070993
Energy: 1.4511093849294872
Energy: 1.2914013787061545
Energy: 1.478923897071565
Energy: 1.473140212011043
Energy: 1.4789238970697236
Energy: 1.2914013787052336
Energy: 1.4789238970697236
Energy: 1.2776006114327583
Energy: 1.5242935667099589
Energy: 1.3125243279002063
Energy: 1.5242935667071968
Energy: 1.2776006114327583
Energy: 1.5242935667071968
Energy: 1.2563300623188087
Energy: 1.281651147075403
Energy: 1.3978105626129715
Energy: 1.2816511470744822
Energy: 1.2563300623188087
Energy: 1.2816511470744822
Energy: 1.5428866680532847
Energy: 1.3366879323912129
Energy: 1.257363361711058
Energy: 1.3366879323930545
Energy: 1.5428866680532847
Energy: 1.3366879323921337
Energy: 1.2579857291880263
Energy: 1.457457544982975
Energy: 1.3536913388117486
Energy: 1.4574575449838958
Energy: 1.2579857291917091
Energy: 1.4574575449838958
Energy: 1.484442514726419
Energy: 1.596217704844394
Energy: 1.543164476208863
Energy: 1.5962177048425525
Energy: 1.4844425147254985
Energy: 1.5962177048480768
Energy: 1.2562246110433422
Energy: 1.482982220777198
Energy: 1.480049357637012
Energy: 1.482982220777198
Energy: 1.256224611044263
Energy: 1.482982220777198
Energy: 1.2558999070091068
Energy: 1.3713958059558413
Energy: 1.3723094631208914
Energy: 1.371395805956762
Energy: 1.2558999070091068
Energy: 1.3713958059549207
Energy: 1.2723393742005071
Energy: 1.3421201207203575
Energy: 1.2720735084920125
Energy: 1.3421201207194369
Energy: 1.2723393742005071
Energy: 1.3421201207194369
Energy: 1.2546238580076554
Energy: 1.5208657356142237
Energy: 1.4728984718917009
Energy: 1.5208657356151445
Energy: 1.2546238580076554
Energy: 1.5208657356151445
Energy: 1.6090632850137878
Energy: 1.5514052296289833
Energy: 1.292066327445153
Energy: 1.551405229630825
Energy: 1.6090632850137878
Energy: 1.5514052296289833
Energy: 1.3124444715626846
Energy: 1.5245678929516633
Energy: 1.4383479841724647
Energy: 1.524567892948901
Energy: 1.3124444715617638
Energy: 1.524567892949822
Energy: 1.4730869642443847
Energy: 1.520694228303698
Energy: 1.2562004894205603
Energy: 1.5206942283055391
Energy: 1.4730869642434639
Energy: 1.520694228303698
Energy: 1.271931830249353
Energy: 1.3715753622164764
Energy: 1.2699377786185286
Energy: 1.371575362217397
Energy: 1.271931830249353
Energy: 1.3715753622357898
Energy: 1.2590848758287567
Energy: 1.3725033583227824
Energy: 1.2544505383542741
Energy: 1.3725033583227824
Energy: 1.2590848758287567
Energy: 1.3725033583227824
Energy: 1.4704801582594507
Energy: 1.397904488785428
Energy: 1.2548559123352148
Energy: 1.3979044887835868
Energy: 1.4704801582539264
Energy: 1.397904488782666
Energy: 1.5369257673637997
Energy: 1.5972574150281238
Energy: 1.482450406668819
Energy: 1.5972574150336478
Energy: 1.5369257673647205
Energy: 1.5972574150299652
Energy: 1.2700701006992126
Energy: 1.4574521390505215
Energy: 1.2788236993073427
Energy: 1.457452139051442
Energy: 1.270070100703816
Energy: 1.4574521390505215
Energy: 1.2564779027147162
Energy: 1.3421345834197085
Energy: 1.5438318777530966
Energy: 1.3421345834187879
Energy: 1.2564779027156368
Energy: 1.3421345834187879
Energy: 1.2553166075556839
Energy: 1.2806186918592661
Energy: 1.2556508407673757
Energy: 1.280618691860187
Energy: 1.2553166075428153
Energy: 1.280618691860187
Energy: 1.2912903305677428
Energy: 1.4385186087114143
Energy: 1.2767317014731712
Energy: 1.4385186087095727
Energy: 1.2912903305649805
Energy: 1.4385186087095727
Energy: 1.4736112682525144
Energy: 1.4817961304512468
Energy: 1.4877283345845236
Energy: 1.481796130450326
Energy: 1.4736112682525144
Energy: 1.4817961304494054
Energy: 1.2712830407726772
Energy: 1.4404958814473292
Energy: 1.291560038400993
Energy: 1.4404958814482498
Energy: 1.2712830407726772
Energy: 1.4404958814473292
Energy: 1.2590997001743152
Energy: 1.2791145615200357
Energy: 1.2744523412537683
Energy: 1.2791145615209567
Energy: 1.2590997001743152
Energy: 1.2791145615191148
Energy: 1.2600078934200152
Energy: 1.3735319446792482
Energy: 1.2569208949538686
Energy: 1.3735319446792482
Energy: 1.2600078934200152
Energy: 1.3735319446792482
Energy: 1.2585019837371596
Energy: 1.5747647689539526
Energy: 1.6154536298933455
Energy: 1.574764768953032
Energy: 1.258501983739001
Energy: 1.574764768955794

minimum gb energy = 1.2541088413276458 eV
minimum distance =  2.19080231671508 Angstroms
sigma value = 57


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

Energy: 1.3664015144861483
Energy: 1.3548473027262746
Energy: 1.4580994908327756
Energy: 1.3548473027262746
Energy: 1.3664015144861483
Energy: 1.3548473027246362
Energy: 1.3228912140668834
Energy: 1.3345532597732142
Energy: 1.3111233388145573
Energy: 1.3597415758997051
Energy: 1.322891214065245
Energy: 1.3345532597732142
Energy: 1.3182598280908444
Energy: 1.3603505523643211
Energy: 1.3116411166278865
Energy: 1.3603505523627197
Energy: 1.3182598280908444
Energy: 1.3603505523627197
Energy: 1.3122745354657095
Energy: 1.459634306193243
Energy: 1.3125756099123707
Energy: 1.4590403322768697
Energy: 1.3122745354657095
Energy: 1.3833700958433743
Energy: 1.311606563000869
Energy: 1.3602833906310534
Energy: 1.312513432301109
Energy: 1.3602833906310534
Energy: 1.311606563000869
Energy: 1.3602833906310534
Energy: 1.3174162911117027
Energy: 1.3346549742328055
Energy: 1.3225725354804463
Energy: 1.3346549742328055
Energy: 1.3174162911117027
Energy: 1.3346549742328055
Energy: 1.4580994908327756
Energy: 1.3548473027279129
Energy: 1.3664015144877866
Energy: 1.3548473027279129
Energy: 1.4580994908294989
Energy: 1.3548473027279129
Energy: 1.311123338812919
Energy: 1.4487748352967504
Energy: 1.3228912140668834
Energy: 1.4487748352934735
Energy: 1.3111233388161958
Energy: 1.4487748352967504
Energy: 1.3116411166278865
Energy: 1.3603505523627197
Energy: 1.3182598280908444
Energy: 1.3603505523643211
Energy: 1.3116411166295245
Energy: 1.3603505523627197
Energy: 1.3125756099090937
Energy: 1.460229150465708
Energy: 1.312274535464071
Energy: 1.3833700648444498
Energy: 1.3125756099107322
Energy: 1.4701160569619054
Energy: 1.3125134323076628
Energy: 1.3602833906310534
Energy: 1.311606563000869
Energy: 1.3602833906310534
Energy: 1.3125134323043859
Energy: 1.3602833906310534
Energy: 1.3225725354788078
Energy: 1.3346549742328055
Energy: 1.3174162911133411
Energy: 1.3346549742328055
Energy: 1.3225725354804463
Energy: 1.3346549742328055
Energy: 1.3664015144877866
Energy: 1.3548473027262746
Energy: 1.6125875662586144
Energy: 1.3548473027246362
Energy: 1.3664015144877866
Energy: 1.3548473027279129
Energy: 1.322891214065245
Energy: 1.3345532597732142
Energy: 1.3111233388112806
Energy: 1.3345532597732142
Energy: 1.3228912140668834
Energy: 1.3345532597732142
Energy: 1.3182598280892062
Energy: 1.3603505523643211
Energy: 1.3116411166295245
Energy: 1.3603505523627197
Energy: 1.3182598280908444
Energy: 1.3603505523627197
Energy: 1.3122745354624326
Energy: 1.3833700359793533
Energy: 1.312575609914009
Energy: 1.4596342574062402
Energy: 1.3122745354607943
Energy: 1.3833700437139482
Energy: 1.311606563000869
Energy: 1.360283390629415
Energy: 1.3125134323060244
Energy: 1.360283390629415
Energy: 1.311606563000869
Energy: 1.3602833906310534

minimum gb energy = 1.3111233388112806 eV
minimum distance =  2.22279465291911 Angstroms
sigma value = 9


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

Energy: 1.4632748728136893
Energy: 1.4304380251515252
Energy: 1.566478894997455
Energy: 1.4304380251515252
Energy: 1.463274872815027
Energy: 1.430438025150218
Energy: 1.3712686799256024
Energy: 1.437346987110828
Energy: 1.3452521743365717
Energy: 1.437346987114841
Energy: 1.3712686799256024
Energy: 1.4373469871135034
Energy: 1.349377230052551
Energy: 1.407712178774859
Energy: 1.346881023614044
Energy: 1.4077121787735214
Energy: 1.349377230052551
Energy: 1.4077121787721836
Energy: 1.3494367784513939
Energy: 1.3377351689114034
Energy: 1.3766532057167808
Energy: 1.3377351689100658
Energy: 1.3494367784500563
Energy: 1.3377351689114034
Energy: 1.3704612106061729
Energy: 1.431815356297112
Energy: 1.3479566535524032
Energy: 1.4318153562984497
Energy: 1.3704612106075107
Energy: 1.431815356297112
Energy: 1.3488432063520015
Energy: 1.3644109499216754
Energy: 1.5650089069518227
Energy: 1.3644109499230135
Energy: 1.348843206353339
Energy: 1.3644109499216754
Energy: 1.3517991217371974
Energy: 1.4085941868369976
Energy: 1.348547145797531
Energy: 1.4085941868369976
Energy: 1.3517991217358598
Energy: 1.408594186838305
Energy: 1.39794724159409
Energy: 1.4768060343505633
Energy: 1.3455856910127983
Energy: 1.476806034351901
Energy: 1.39794724159409
Energy: 1.4768060343532385
Energy: 1.3976807403447191
Energy: 1.4050116410002649
Energy: 1.3532374889588976
Energy: 1.405011640998927
Energy: 1.3976807403447191
Energy: 1.4050116410002649
Energy: 1.3510504297462305
Energy: 1.4472428239631179
Energy: 1.3632452178227588
Energy: 1.4472428239631179
Energy: 1.3510504297502135
Energy: 1.4472428239631179
Energy: 1.351649545867602
Energy: 1.3516809486837376
Energy: 1.3849533531105132
Energy: 1.3516809486850752
Energy: 1.351649545867602
Energy: 1.3516809486837376
Energy: 1.348479978760684
Energy: 1.408128537368901
Energy: 1.4104252588014823
Energy: 1.408128537368901
Energy: 1.348479978760684
Energy: 1.408128537368901
Energy: 1.3508117773736905
Energy: 1.4097070957733637
Energy: 1.4008435681630176
Energy: 1.4097070957733637
Energy: 1.3508117773736905
Energy: 1.4097070957720261
Energy: 1.3484240610171463
Energy: 1.3772839617242463
Energy: 1.3512291775500906
Energy: 1.3772839617242463
Energy: 1.3484240610158087
Energy: 1.3772839617229087
Energy: 1.5376068938821061
Energy: 1.4467854180141733
Energy: 1.3609271301106165
Energy: 1.4467854180141733
Energy: 1.5376068938834437
Energy: 1.4467854180141733
Energy: 1.3975632402065554
Energy: 1.4050333458637394
Energy: 1.3849553716638003
Energy: 1.4050333458637394
Energy: 1.3975632402065554
Energy: 1.4050333458637394
Energy: 1.4034991269605135
Energy: 1.4046607528763198
Energy: 1.3691182346276511
Energy: 1.4046607528749822
Energy: 1.4034991269605135
Energy: 1.4046607528749822
Energy: 1.4383134690945962
Energy: 1.445312578696472
Energy: 1.3628352206232066
Energy: 1.445312578696472
Energy: 1.4383134690932584
Energy: 1.4453125786924588
Energy: 1.3512026133818456
Energy: 1.3395089237809679
Energy: 1.5713447691975426
Energy: 1.3395089237836433
Energy: 1.3512026133818456
Energy: 1.3395089237836433
Energy: 1.3493667918534524
Energy: 1.4305131426875615
Energy: 1.3468704407736418
Energy: 1.4305131426875615
Energy: 1.3493667918521146
Energy: 1.4305131426875615
Energy: 1.3511703171283662
Energy: 1.3388672354877549
Energy: 1.380689873278243
Energy: 1.3388672354850797
Energy: 1.3511703171283662
Energy: 1.3388672354837416

minimum gb energy = 1.3377351689100658 eV
minimum distance =  2.2236364958952 Angstroms
sigma value = 27


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

Energy: 1.5112908749325913
Energy: 1.5735516928172157
Energy: 1.5355930333423182
Energy: 1.5735516928172157
Energy: 1.5112908749325913
Energy: 1.5735516928172157
Energy: 1.421123963668901
Energy: 1.429921865184377
Energy: 1.3791400122903117
Energy: 1.4299218651821222
Energy: 1.4211239636677735
Energy: 1.4299218651832493
Energy: 1.3451985518708374
Energy: 1.4683336718159063
Energy: 1.3789527804877744
Energy: 1.4683336719229774
Energy: 1.3451985518697096
Energy: 1.468333671944402
Energy: 1.3780425345273268
Energy: 1.3884376221052173
Energy: 1.4092944457886645
Energy: 1.3884376221018604
Energy: 1.3780425345273268
Energy: 1.3884376221052173
Energy: 1.3178970296686254
Energy: 1.4137978469311723
Energy: 1.3434397569749184
Energy: 1.4137978469187686
Energy: 1.3178970296686254
Energy: 1.4137978469142582
Energy: 1.3710168311507542
Energy: 1.359285723503192
Energy: 1.3584286413389872
Energy: 1.359285723503192
Energy: 1.3710168311507542
Energy: 1.3592857235043196
Energy: 1.3520824159647362
Energy: 1.3754034910554758
Energy: 1.3655082240428766
Energy: 1.375403491056603
Energy: 1.3520824159658635
Energy: 1.3754034910554758
Energy: 1.3488303895943563
Energy: 1.4105122808747852
Energy: 1.3660595324566573
Energy: 1.4105122808736577
Energy: 1.3488303895943563
Energy: 1.4105122808736577
Energy: 1.4425327927518428
Energy: 1.3966406042669224
Energy: 1.5539691785799767
Energy: 1.3966406042657946
Energy: 1.442532792750715
Energy: 1.3966406042657946
Energy: 1.3639155759716315
Energy: 1.4813554928436554
Energy: 1.3986377010589193
Energy: 1.4813554928459105
Energy: 1.3639155759705037
Energy: 1.481355492853804
Energy: 1.3490556502123228
Energy: 1.4414308184904705
Energy: 1.3985566199162573
Energy: 1.441430818488215
Energy: 1.3490556502111954
Energy: 1.4414308184904705
Energy: 1.4424773326223084
Energy: 1.3964072922488
Energy: 1.356472737319574
Energy: 1.3964072922476722
Energy: 1.4424773326200533
Energy: 1.3964072922488
Energy: 1.3643780989159011
Energy: 1.4849703755310197
Energy: 1.365514446061642
Energy: 1.4849703755298922
Energy: 1.3643780989170289
Energy: 1.4849703755310197
Energy: 1.3494358681317142
Energy: 1.4280842821815398
Energy: 1.3661443299412213
Energy: 1.4280842821815398
Energy: 1.3494358681317142
Energy: 1.4280842821815398
Energy: 1.3775468924209566
Energy: 1.3602072560398686
Energy: 1.3584211985518055
Energy: 1.3602072560364857
Energy: 1.3775468924220842
Energy: 1.3602072560364857
Energy: 1.317714337913878
Energy: 1.4137978469356827
Energy: 1.3429692659110268
Energy: 1.4137978469525712
Energy: 1.317714337913878
Energy: 1.413797846940193
Energy: 1.3779614368985391
Energy: 1.3885349122527997
Energy: 1.3325380955364725
Energy: 1.3885349122516977
Energy: 1.3779614368974116
Energy: 1.3885349122527997
Energy: 1.344891044760322
Energy: 1.4596745279762884
Energy: 1.3791395223443474
Energy: 1.4596745279751606
Energy: 1.3448910447614495
Energy: 1.4596745279740333
Energy: 1.3850442662324922
Energy: 1.555745271286933
Energy: 1.3791831691810796
Energy: 1.5557452712846778
Energy: 1.3850442662313647
Energy: 1.5557452712880606
Energy: 1.5112908749325913
Energy: 1.5735516928183435
Energy: 1.5350688906014256
Energy: 1.5735516928172157
Energy: 1.5112908749325913
Energy: 1.5735516928172157
Energy: 1.4211239636666457
Energy: 1.429921865184377
Energy: 1.3791400122903117
Energy: 1.429921865184377
Energy: 1.4211239636666457
Energy: 1.429921865184377
Energy: 1.3451985518708374
Energy: 1.468333671906089
Energy: 1.3789527804877744
Energy: 1.4683336717933544
Energy: 1.3451985518708374
Energy: 1.4683336719229774
Energy: 1.3780425345273268
Energy: 1.388437622106345
Energy: 1.4092944457909196
Energy: 1.388437622106345
Energy: 1.3780425345273268
Energy: 1.388437622106345
Energy: 1.3178970296686254
Energy: 1.4137978468973442
Energy: 1.3434397569737908
Energy: 1.4137978469097479
Energy: 1.3178970296686254
Energy: 1.4137978469221515
Energy: 1.3710168311529838
Energy: 1.359285723503192
Energy: 1.3584286413389872
Energy: 1.3592857235009368
Energy: 1.371016831154111
Energy: 1.3592857235009368

minimum gb energy = 1.317714337913878 eV
minimum distance =  2.22473752450902 Angstroms
sigma value = 19


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

Energy: 1.5305336500678046
Energy: 1.3099942214148228
Energy: 1.4799935840952698
Energy: 1.3099942214167695
Energy: 1.530533650068778
Energy: 1.309994221420663
Energy: 1.3753818818755204
Energy: 1.3989472106789385
Energy: 1.2730262997335202
Energy: 1.3989472106643606
Energy: 1.3753818818764938
Energy: 1.398947210665334
Energy: 1.2749784701654574
Energy: 1.3947887673164063
Energy: 1.2732106105294603
Energy: 1.3947887673164063
Energy: 1.2749784701654574
Energy: 1.3947887673164063
Energy: 1.3644361790625592
Energy: 1.4120372539870103
Energy: 1.33449607920078
Energy: 1.4120372539870103
Energy: 1.3644361790625592
Energy: 1.412037253988957
Energy: 1.302304683345159
Energy: 1.3182814629736166
Energy: 1.3059256070501113
Energy: 1.31828146297459
Energy: 1.302304683345159
Energy: 1.3182814629736166
Energy: 1.2918061717611127
Energy: 1.3679129079598238
Energy: 1.3068559270611957
Energy: 1.3679129079598238
Energy: 1.2918061717611127
Energy: 1.367912907960797
Energy: 1.2937126538654826
Energy: 1.3602699389927486
Energy: 1.2912488095278172
Energy: 1.3602699389927486
Energy: 1.2937126538654826
Energy: 1.3602699389937218
Energy: 1.274020912813971
Energy: 1.3205691915501283
Energy: 1.3066460363835708
Energy: 1.3205691915511015
Energy: 1.2740209128129973
Energy: 1.3205691915511015
Energy: 1.3135070390725547
Energy: 1.3727075958832897
Energy: 1.3309163861235909
Energy: 1.3727075958832897
Energy: 1.3135070390725547
Energy: 1.3727075958832897
Energy: 1.3017563110962493
Energy: 1.4806567732405345
Energy: 1.273016192028725
Energy: 1.4806567732405345
Energy: 1.3017563110962493
Energy: 1.4806567732405345
Energy: 1.274168880916167
Energy: 1.4096410018772956
Energy: 1.2892920821741116
Energy: 1.4096410018782688
Energy: 1.274168880916167
Energy: 1.4096410018782688
Energy: 1.2992110700061952
Energy: 1.4554296001730813
Energy: 1.3195866575028592
Energy: 1.4554296001721079
Energy: 1.2992110700071684
Energy: 1.4554296001643212
Energy: 1.2989517715385825
Energy: 1.4369294945141242
Energy: 1.316991060091485
Energy: 1.4369294945150972
Energy: 1.2989517715385825
Energy: 1.4369294945121776
Energy: 1.2758413295637756
Energy: 1.4105193866509722
Energy: 1.4192647123426738
Energy: 1.4105193866509722
Energy: 1.2758413295647488
Energy: 1.4105193866509722
Energy: 1.3129401912495307
Energy: 1.4372639839535117
Energy: 1.3196336972840361
Energy: 1.4372639839535117
Energy: 1.3129401912485572
Energy: 1.4372639839544852
Energy: 1.3137605165510897
Energy: 1.3172841067540926
Energy: 1.258421019180537
Energy: 1.3172841067540926
Energy: 1.3137605165510897
Energy: 1.3172841067550658
Energy: 1.2752680252367927
Energy: 1.3202214331335551
Energy: 1.2910492422242752
Energy: 1.3202214331335551
Energy: 1.2752680252377437
Energy: 1.3202214331335551
Energy: 1.2918132693031301
Energy: 1.4339390460801376
Energy: 1.2565040671677725
Energy: 1.4339390460801376
Energy: 1.2918132693041033
Energy: 1.4339390460811108
Energy: 1.2753564533834152
Energy: 1.3201570171964037
Energy: 1.290953771374353
Energy: 1.3201570171954304
Energy: 1.2753564533843886
Energy: 1.3201570171954304
Energy: 1.3138196529098418
Energy: 1.3708877609508416
Energy: 1.2882978048546894
Energy: 1.3708877609508416
Energy: 1.3138196529098418
Energy: 1.3708877609518149
Energy: 1.3127656857436727
Energy: 1.4127559590251775
Energy: 1.2730818193741005
Energy: 1.4127559590242262
Energy: 1.3127656857426993
Energy: 1.4127559590242262
Energy: 1.276170341683873
Energy: 1.3773458426882879
Energy: 1.4203495300892648
Energy: 1.3773458426882879
Energy: 1.276170341683873
Energy: 1.3773458426882879
Energy: 1.3705798845403012
Energy: 1.4595103917107641
Energy: 1.2729607301154606
Energy: 1.4595103917097907
Energy: 1.3705798845422479
Energy: 1.4595103917117376
Energy: 1.3284759571509606
Energy: 1.389640139960049
Energy: 1.2731272385278634
Energy: 1.389640139991196
Energy: 1.3284759571509606
Energy: 1.3896401399882758
Energy: 1.3836690640663951
Energy: 1.4103396400363208
Energy: 1.3165897341005177
Energy: 1.4103396400363208
Energy: 1.3836690640663951
Energy: 1.4103396400363208
Energy: 1.3133707908568142
Energy: 1.4847385683668701
Energy: 1.272743401529049
Energy: 1.4847385683668701
Energy: 1.3133707908568142
Energy: 1.4847385683678433
Energy: 1.3135696592225021
Energy: 1.386148225777546
Energy: 1.29470339617545
Energy: 1.386148225777546
Energy: 1.3135696592225021
Energy: 1.386148225777546
Energy: 1.2849709792176658
Energy: 1.3207764143444845
Energy: 1.3076494216420036
Energy: 1.3207764143444845
Energy: 1.2849709792166926
Energy: 1.3207764143444845
Energy: 1.2936355197523104
Energy: 1.3537319980857945
Energy: 1.2836876337844203
Energy: 1.353731998084821
Energy: 1.2936355197523104
Energy: 1.353731998084821

minimum gb energy = 1.2565040671677725 eV
minimum distance =  2.21706895993885 Angstroms
sigma value = 101


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

Energy: 1.4516489846822158
Energy: 1.3275252369679678
Energy: 1.3245733326294176
Energy: 1.327525236965401
Energy: 1.451648984679649
Energy: 1.3275252369645454
Energy: 1.2340896537068307
Energy: 1.3297385228859262
Energy: 1.2335046011541448
Energy: 1.3297385228859262
Energy: 1.2340896537068307
Energy: 1.3297385228850707
Energy: 1.2181214796880888
Energy: 1.3364906329543065
Energy: 1.2596552991553884
Energy: 1.3364906329543065
Energy: 1.2181214796880888
Energy: 1.3364906329543065
Energy: 1.2523814337005548
Energy: 1.2945028691184843
Energy: 1.2408814649643742
Energy: 1.3495124126376945
Energy: 1.2523814337005548
Energy: 1.2945028691201956
Energy: 1.206960597825322
Energy: 1.2772327810314326
Energy: 1.2274088950865019
Energy: 1.2772327810357107
Energy: 1.206960597825322
Energy: 1.2772327810339994
Energy: 1.2210060636471973
Energy: 1.341204561230718
Energy: 1.206043971006345
Energy: 1.341204561230718
Energy: 1.2210060636471973
Energy: 1.341204561230718
Energy: 1.2274267582101488
Energy: 1.3491517999044622
Energy: 1.206895115514312
Energy: 1.3491517999070293
Energy: 1.227426758209293
Energy: 1.3491517999078848
Energy: 1.2177893461846425
Energy: 1.3074974939440593
Energy: 1.2179885118075606
Energy: 1.329434369497786
Energy: 1.2177893461846425
Energy: 1.3074974939466262
Energy: 1.2064363757444587
Energy: 1.3144415671734275
Energy: 1.2185697924031123
Energy: 1.3144415671734275
Energy: 1.206436375745314
Energy: 1.3144415671734275
Energy: 1.2064093473462585
Energy: 1.3031752318982495
Energy: 1.2070378577947591
Energy: 1.3031752318999605
Energy: 1.2064093473488253
Energy: 1.3031752318991048
Energy: 1.2716760328958685
Energy: 1.2922939199541466
Energy: 1.2863602323882346
Energy: 1.2922939199592414
Energy: 1.2716760328958685
Energy: 1.2922939199583856
Energy: 1.2333860080004468
Energy: 1.3350101162714954
Energy: 1.205970528059564
Energy: 1.3350101162732066
Energy: 1.2333860079995913
Energy: 1.3350101162732066
Energy: 1.2350485318491207
Energy: 1.3365206439546624
Energy: 1.2522395952374423
Energy: 1.3365206439538067
Energy: 1.2350485318507929
Energy: 1.3365206439546624
Energy: 1.2584106987088672
Energy: 1.2771578839143174
Energy: 1.2341625775524157
Energy: 1.2870123526409405
Energy: 1.2584106987088672
Energy: 1.2771578839228734
Energy: 1.2138284012538543
Energy: 1.5181417921456901
Energy: 1.2335221158643985
Energy: 1.5181417921456901
Energy: 1.213828401252999
Energy: 1.5181417921456901
Energy: 1.2779206496884439
Energy: 1.3359683852242876
Energy: 1.2173742358750577
Energy: 1.335968385223432
Energy: 1.2779206496875886
Energy: 1.3359683852242876
Energy: 1.2072537511154202
Energy: 1.3448807167248882
Energy: 1.251347789268344
Energy: 1.3448807167231769
Energy: 1.2072537511154202
Energy: 1.3448807167240324
Energy: 1.2178769048524465
Energy: 1.2774963789497074
Energy: 1.2060030446545544
Energy: 1.2774963789497074
Energy: 1.2178769048524465
Energy: 1.2774963789505627
Energy: 1.2163709044968074
Energy: 1.3010540647360622
Energy: 1.2190556264247996
Energy: 1.3010540647334952
Energy: 1.2163709044959516
Energy: 1.3010540647369178
Energy: 1.2067452434437358
Energy: 1.423458168585845
Energy: 1.206584855689933
Energy: 1.423458168585845
Energy: 1.2067452434437358
Energy: 1.423458168584989
Energy: 1.22899960222636
Energy: 1.2766526047484348
Energy: 1.2184756369242256
Energy: 1.2766526047484348
Energy: 1.22899960222636
Energy: 1.2766526047484348
Energy: 1.206073479548339
Energy: 1.3010560023453492
Energy: 1.206152263617835
Energy: 1.3010560026506857
Energy: 1.2060734795491945
Energy: 1.3010560023770068
Energy: 1.2186294925531376
Energy: 1.3018045498312247
Energy: 1.2066544219000919
Energy: 1.3018045498312247
Energy: 1.2186294925531376
Energy: 1.30180454983208
Energy: 1.2522169528170806
Energy: 1.3721798667510456
Energy: 1.265521555227157
Energy: 1.3721798667510456
Energy: 1.2522169528153695
Energy: 1.3721798667510456
Energy: 1.2067519335545382
Energy: 1.4491148754720384
Energy: 1.2161426628053462
Energy: 1.4491148754720384
Energy: 1.2067519335545382
Energy: 1.4491148754711827
Energy: 1.2324205308262979
Energy: 1.3355226416167372
Energy: 1.2781671403207064
Energy: 1.3355226416201207
Energy: 1.2324205308237308
Energy: 1.3355226416192654
Energy: 1.2343403741637375
Energy: 1.3987867071239404
Energy: 1.2064062513866507
Energy: 1.3987867071230846
Energy: 1.2343403741628818
Energy: 1.3987867071265072
Energy: 1.2344097174143456
Energy: 1.529160428543308
Energy: 1.2067179808482387
Energy: 1.529160428543308
Energy: 1.234409717416057
Energy: 1.529160428543308
Energy: 1.3229855106880588
Energy: 1.4089906939936623
Energy: 1.3109522936817772
Energy: 1.4089906939928067
Energy: 1.3229855106906256
Energy: 1.4089906939936623
Energy: 1.2061753653980862
Energy: 1.3763213623292163
Energy: 1.2065656854212183
Energy: 1.3763213623317831
Energy: 1.2061753653980862
Energy: 1.3763213623292163
Energy: 1.251432715325209
Energy: 1.345839130076533
Energy: 1.219094097552536
Energy: 1.345839130076533
Energy: 1.2514327153269205
Energy: 1.345839130076533
Energy: 1.2326273706425053
Energy: 1.3012513845783849
Energy: 1.2059300183813613
Energy: 1.3012513845792404
Energy: 1.2326273706425053
Energy: 1.3012513845783849
Energy: 1.2067052156701423
Energy: 1.3212587797505293
Energy: 1.2181510617961528
Energy: 1.3212587797471067
Energy: 1.206705215670998
Energy: 1.3212587797513848

minimum gb energy = 1.2059300183813613 eV
minimum distance =  2.22497781960537 Angstroms
sigma value = 33


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

Energy: 0.014457170597390882
Energy: 0.015108538119725167
Energy: 1.3542563959040224
Energy: 0.015108538119725167
Energy: 0.014457170597390882
Energy: 0.015108538119725167
Energy: 0.014605467571465353
Energy: 0.6564979079638433
Energy: 0.014605467572176251
Energy: 0.6564979079610787
Energy: 0.014605467571465353
Energy: 0.6564979079610787
Energy: 1.382745339016293
Energy: 0.015108538119053763
Energy: 0.014457170597390882
Energy: 0.015108538119725167
Energy: 1.3827453390169644
Energy: 0.015108538119053763
Energy: 0.014605467571465353
Energy: 0.6564979079596568
Energy: 0.014605467572176251
Energy: 0.6564979079576031
Energy: 0.014605467572176251
Energy: 0.65649790796175

minimum gb energy = 0.014457170597390882 eV
minimum distance =  2.41169469333864 Angstroms
sigma value = 1