Model name: model_name=MEAM_LAMMPS_AslamBaskesDickel_2019_FeMnSiC__MO_427873955970_001
a1: a1=[1, -1, 0]
a2: a2=[1, 1, -2]
a3: a3=[1, 1, 1]
Species: species=Fe
Lattice type: short_name=bcc
Lattice constant (meters) and cohesive energy (J): a=2.867570169270039
cohesive_energy=4.280336240308329
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=60.0
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: 0.016100734402092833
Energy: 0.4569435026899066
Energy: 0.016100734402092833
Energy: 0.4569435026899066
Energy: 0.016100734402092833
Energy: 0.4569435026899066
Energy: 0.016100734402092833
Energy: 0.0168069377486538
Energy: 0.6061135640745902
Energy: 0.0168069377486538
Energy: 0.6061135640745902
Energy: 0.0168069377486538
Energy: 0.6061135640745902
Energy: 0.0168069377486538
Energy: 1.1775192686455405
Energy: 0.5515804724334696
Energy: 1.3793133264977753
Energy: 0.5515804724338765
Energy: 0.01657793846077758
Energy: 0.5515804724338765
Energy: 0.01657793846077758
Energy: 0.016806937749060738
Energy: 0.6061135640741833
Energy: 0.016806937749060738
Energy: 0.6061135640741833
Energy: 0.01680693774946768
Energy: 0.6061135640741833
Energy: 0.016806937749060738
Energy: 0.016100734402092833
Energy: 0.45694350269031353
Energy: 0.016100734402092833
Energy: 0.4569435026899066
Energy: 0.016100734402092833
Energy: 0.45694350269031353
Energy: 0.016100734402092833
Energy: 0.016806937749060738
Energy: 0.6061135640745902
Energy: 0.016806937749060738
Energy: 0.6061135640741833
Energy: 0.016806937749060738
Energy: 0.6061135640741833
Energy: 0.016806937749060738

minimum gb energy = 0.016100734402092833 eV
minimum distance =  2.47874720694891 Angstroms
sigma value = 5


========================================
theta = 24.43269767945453
========================================

Energy: 1.1721948447373625
Energy: 1.4738972935674413
Energy: 1.172194844735904
Energy: 1.4738972935674413
Energy: 1.1721948447378483
Energy: 1.4738972935674413
Energy: 1.1721948447354178
Energy: 1.231953518564163
Energy: 1.226943690037023
Energy: 1.2319535185656212
Energy: 1.2269436900379953
Energy: 1.231953518564163
Energy: 1.226943690037023
Energy: 1.2319535185651354
Energy: 1.1539730673701312
Energy: 1.1468416657294183
Energy: 1.153973067369159
Energy: 1.1468416657289766
Energy: 1.1539730673701312
Energy: 1.1468416657294183
Energy: 1.1539730673686728
Energy: 1.1614811418350124
Energy: 1.2285228881271482
Energy: 1.161481141834526
Energy: 1.2285228881281205
Energy: 1.1614811418350124
Energy: 1.228522888126662
Energy: 1.16148114183404
Energy: 1.1255991119422184
Energy: 1.2208342167762551
Energy: 1.125599111941246
Energy: 1.2208342167752828
Energy: 1.1255991119417321
Energy: 1.2208342167767412
Energy: 1.12559911194076
Energy: 1.1400924181536876
Energy: 1.1957742645850198
Energy: 1.140092418151257
Energy: 1.1957742645830756
Energy: 1.1400924181532015
Energy: 1.1957742645850198
Energy: 1.1400924181497987
Energy: 1.2185389108232887
Energy: 1.1760846477574913
Energy: 1.2185389108223166
Energy: 1.1760846477589497
Energy: 1.2185389108232887
Energy: 1.176084647756519
Energy: 1.2185389108228029
Energy: 1.1805144788442201
Energy: 1.231399260237308
Energy: 1.180514478843248
Energy: 1.231399260237308
Energy: 1.1805144788442201
Energy: 1.231399260237308
Energy: 1.180514478843734
Energy: 1.1774885627615306
Energy: 1.2325544408494546
Energy: 1.1774885627576417
Energy: 1.232554440851399
Energy: 1.1774885627615306
Energy: 1.2325544408494546
Energy: 1.1774885627591
Energy: 1.1583868439330072
Energy: 1.1112221614248863
Energy: 1.1583868439320348
Energy: 1.1112221614263447
Energy: 1.1583868439330072
Energy: 1.1112221614248863
Energy: 1.158386843932521
Energy: 1.1778808547322228
Energy: 1.2036823183950671
Energy: 1.1778808547302786
Energy: 1.203682318394581
Energy: 1.1778808547336812
Energy: 1.2036823183950671
Energy: 1.1778808547302786
Energy: 1.1686026716416127
Energy: 1.144220188385825
Energy: 1.168602671643071
Energy: 1.144220188385339
Energy: 1.1686026716416127
Energy: 1.144220188385825
Energy: 1.168602671643071
Energy: 1.1937706371041237
Energy: 1.253434775620381
Energy: 1.1937706371031513
Energy: 1.2534347756228115
Energy: 1.1937706371041237
Energy: 1.253434775620867
Energy: 1.1937706371031513
Energy: 1.1392445665301172
Energy: 1.1836455849701473
Energy: 1.1392445665301172
Energy: 1.1836455849682472
Energy: 1.1392445665306032
Energy: 1.1836455849701473
Energy: 1.1392445665301172
Energy: 1.1709629776270056
Energy: 1.2039591221051
Energy: 1.1709629776270056
Energy: 1.2039591221046142
Energy: 1.170962977627492
Energy: 1.2039591221046142
Energy: 1.1709629776270056
Energy: 1.1418856806335953
Energy: 1.1860113590710761
Energy: 1.1418856806345679
Energy: 1.1860113590701038
Energy: 1.1418856806335953
Energy: 1.18601135907059
Energy: 1.1418856806345679
Energy: 1.1439166842861253
Energy: 1.2299453295176808
Energy: 1.1439166842856394
Energy: 1.2299453295162224
Energy: 1.1439166842856394
Energy: 1.2299453295181668
Energy: 1.1439166842880697
Energy: 1.146434465247516
Energy: 1.1806225421937098
Energy: 1.1464344652460576
Energy: 1.1806225421941958
Energy: 1.146434465247516
Energy: 1.1806225421937098
Energy: 1.1464344652465437
Energy: 1.1720070620775787
Energy: 1.1852041536155382
Energy: 1.172007062079523
Energy: 1.1852041536165105
Energy: 1.172007062078551
Energy: 1.1852041536155382
Energy: 1.172007062079523
Energy: 1.1706324323334312
Energy: 1.1460383441961466
Energy: 1.1706324323324588
Energy: 1.1460383441966329
Energy: 1.1706324323334312
Energy: 1.1460383441956608
Energy: 1.1706324323314867
Energy: 1.1712168525224094
Energy: 1.1135733744008962
Energy: 1.1712168525219233
Energy: 1.1135733743994378
Energy: 1.1712168525228956
Energy: 1.1135733744008962
Energy: 1.1712168525219233
Energy: 1.17629054201971
Energy: 1.1171417076482921
Energy: 1.1762905420206824
Energy: 1.1171417076468337
Energy: 1.1762905420201963
Energy: 1.1171417076482921
Energy: 1.1762905420211685
Energy: 1.1561360445114988
Energy: 1.2053504692107548
Energy: 1.1561360445100406
Energy: 1.2053504692107548
Energy: 1.1561360445114988
Energy: 1.2053504692112411
Energy: 1.1561360445105264
Energy: 1.1504266268202852
Energy: 1.2337866202149237
Energy: 1.1504266268197991
Energy: 1.2337866202144374
Energy: 1.1504266268197991
Energy: 1.2337866202144374
Energy: 1.1504266268202852
Energy: 1.222845900626668
Energy: 1.1794772846932953
Energy: 1.2228459006281265
Energy: 1.1794772846942676
Energy: 1.222845900626668
Energy: 1.1794772846932953
Energy: 1.2228459006281265
Energy: 1.1790826553571137
Energy: 1.2466143818027453
Energy: 1.1790826553595442
Energy: 1.2466143818051758
Energy: 1.1790826553571137
Energy: 1.2466143818032314
Energy: 1.1790826553590583
Energy: 1.1176787972271296
Energy: 1.218823478966081
Energy: 1.117678797228588
Energy: 1.218823478966567
Energy: 1.1176787972271296
Energy: 1.2188234789655947
Energy: 1.117678797228588
Energy: 1.2344520043931235
Energy: 1.2050969572221524
Energy: 1.2344520043931235
Energy: 1.2050969572240968
Energy: 1.2344520043926372
Energy: 1.2050969572221524
Energy: 1.2344520043936096
Energy: 1.1568374882653012
Energy: 1.1326229407173771
Energy: 1.156837488264329
Energy: 1.1326229407159187
Energy: 1.1568374882653012
Energy: 1.132622940716891
Energy: 1.1568374882648151
Energy: 1.1950379200029246
Energy: 1.3118169113585658
Energy: 1.195037920000494
Energy: 1.311816911355649
Energy: 1.1950379200024384
Energy: 1.3118169113585658
Energy: 1.1950379200000079
Energy: 1.2653138953183398
Energy: 1.2001621521249926
Energy: 1.2653138953183398
Energy: 1.200162152122562
Energy: 1.2653138953183398
Energy: 1.2001621521245063
Energy: 1.2653138953178535
Energy: 1.1511497033132054
Energy: 1.1509123627058413
Energy: 1.1511497033132054
Energy: 1.1509123627043831
Energy: 1.1511497033141775
Energy: 1.1509123627053555
Energy: 1.1511497033132054
Energy: 1.1568473574217966
Energy: 1.1493702945507063
Energy: 1.1568473574203382
Energy: 1.1493702945477897
Energy: 1.1568473574213103
Energy: 1.1493702945507063
Energy: 1.1568473574203382
Energy: 1.1332420422859626
Energy: 1.2420627895007856
Energy: 1.1332420422854763
Energy: 1.2420627894993275
Energy: 1.1332420422864486
Energy: 1.2420627895007856
Energy: 1.1332420422854763
Energy: 1.1441651044560677
Energy: 1.2565852105611377
Energy: 1.1441651044565537
Energy: 1.2565852105596795
Energy: 1.1441651044555814
Energy: 1.2565852105611377
Energy: 1.1441651044560677
Energy: 1.223865477594847
Energy: 1.1844958232930571
Energy: 1.2238654775943612
Energy: 1.1844958232935432
Energy: 1.223865477594847
Energy: 1.1844958232930571
Energy: 1.2238654775943612
Energy: 1.1442172078737352
Energy: 1.2190721052340097
Energy: 1.1442172078737352
Energy: 1.2190721052349818
Energy: 1.1442172078737352
Energy: 1.2190721052340097
Energy: 1.1442172078742212
Energy: 1.1828914619421926
Energy: 1.2025550475663715
Energy: 1.1828914619451092
Energy: 1.202555047563941
Energy: 1.1828914619421926
Energy: 1.2025550475658855
Energy: 1.1828914619451092
Energy: 1.197793406740033
Energy: 1.2298556679764405
Energy: 1.197793406740033
Energy: 1.229855667973524
Energy: 1.1977934067405192
Energy: 1.2298556679764405
Energy: 1.1977934067405192
Energy: 1.1513082666206325
Energy: 1.094293910645432
Energy: 1.1513082666216046
Energy: 1.094293910645918
Energy: 1.1513082666206325
Energy: 1.094293910645432
Energy: 1.1513082666216046
Energy: 1.2146931799150544
Energy: 1.210405958932513
Energy: 1.2146931799145682
Energy: 1.2104059589320268
Energy: 1.2146931799150544
Energy: 1.210405958932513
Energy: 1.2146931799145682
Energy: 1.168797381582352
Energy: 1.1520620386886042
Energy: 1.1687973815799217
Energy: 1.1520620386900626
Energy: 1.168797381582352
Energy: 1.1520620386881182
Energy: 1.1687973815813797
Energy: 1.1876055083157757
Energy: 1.227777932043041
Energy: 1.1876055083157757
Energy: 1.2277779320406106
Energy: 1.1876055083148034
Energy: 1.227777932043041
Energy: 1.1876055083152897
Energy: 1.139264812298012
Energy: 1.183295307346294
Energy: 1.1392648122965536
Energy: 1.1832953073453216
Energy: 1.139264812298498
Energy: 1.183295307345808
Energy: 1.1392648122960676
Energy: 1.1539619660271614
Energy: 1.211509060527861
Energy: 1.1539619660266753
Energy: 1.2115090605273748
Energy: 1.1539619660276474
Energy: 1.2115090605273748
Energy: 1.1539619660266753
Energy: 1.1454148068087793
Energy: 1.198833548210424
Energy: 1.1454148068092656
Energy: 1.19883354821091
Energy: 1.1454148068087793
Energy: 1.198833548210424
Energy: 1.1454148068092656
Energy: 1.1400134645179656
Energy: 1.1993546166977278
Energy: 1.1400134645184516
Energy: 1.1993546166967557
Energy: 1.1400134645174793
Energy: 1.1993546166977278
Energy: 1.1400134645184516

minimum gb energy = 1.094293910645432 eV
minimum distance =  2.2954681033702 Angstroms
sigma value = 401


========================================
theta = 27.79577249602797
========================================

Energy: 1.241488059612481
Energy: 1.2845184518762374
Energy: 1.14800131503119
Energy: 1.2845184518767891
Energy: 1.2414880596091704
Energy: 1.2845184518734785
Energy: 1.14800131503119
Energy: 1.2344062104978732
Energy: 1.2326019766335574
Energy: 1.1981993333481433
Energy: 1.231990938231944
Energy: 1.2344062105006322
Energy: 1.2326019766335574
Energy: 1.198199333348695
Energy: 1.2040944424424878
Energy: 1.2059354606677262
Energy: 1.203893053518704
Energy: 1.2060609163151452
Energy: 1.2040944424408322
Energy: 1.2059354606688297
Energy: 1.203893053521463
Energy: 1.2259919147437162
Energy: 1.2655696507869316
Energy: 1.225991914744268
Energy: 1.2656324116433402
Energy: 1.2259919147453715
Energy: 1.265569650788587
Energy: 1.2259919147453715
Energy: 1.2286035496454486
Energy: 1.2524223811675164
Energy: 1.2286035496454486
Energy: 1.2523648488323813
Energy: 1.2286035496421377
Energy: 1.2524223811664126
Energy: 1.2286035496437928
Energy: 1.2403552202647194
Energy: 1.2721015556953674
Energy: 1.240355220265823
Energy: 1.2721015556964708
Energy: 1.240355220265823
Energy: 1.2721015556937119
Energy: 1.2403552202647194
Energy: 1.239677033778596
Energy: 1.252374560429773
Energy: 1.2396770337791478
Energy: 1.2523745604330834
Energy: 1.239677033778596
Energy: 1.2523745604330834
Energy: 1.2396770337774925
Energy: 1.2396574200188866
Energy: 1.252220509828387
Energy: 1.239592157297922
Energy: 1.2522273862377973
Energy: 1.2396574200172312
Energy: 1.252220509825628
Energy: 1.2395921572973703
Energy: 1.2399970423697713
Energy: 1.2720343255076694
Energy: 1.2400007889471514
Energy: 1.2720424244509134
Energy: 1.2399970423697713
Energy: 1.2720343255049105
Energy: 1.2400007889449445
Energy: 1.2286832458291777
Energy: 1.2524320231651858
Energy: 1.228678472176057
Energy: 1.2524320231657373
Energy: 1.2286832458291777
Energy: 1.2524320231646335
Energy: 1.2286784721727464
Energy: 1.2404170572635267
Energy: 1.265575531461808
Energy: 1.2404205767471055
Energy: 1.2655755314629116
Energy: 1.240417057262975
Energy: 1.265575531461808
Energy: 1.2404205767471055
Energy: 1.2033702493465062
Energy: 1.2087831254932762
Energy: 1.2033702493465062
Energy: 1.2087831254932762
Energy: 1.2033702493465062
Energy: 1.208783125490517
Energy: 1.2033702493459544
Energy: 1.198051939489925
Energy: 1.208421067856912
Energy: 1.1980519394893732
Energy: 1.2084210678563605
Energy: 1.1980519394888214
Energy: 1.2084210678541532
Energy: 1.1980519394882694
Energy: 1.14800131503119
Energy: 1.2845184518773411
Energy: 1.14800131503119
Energy: 1.2845184518762374
Energy: 1.1480013150306385
Energy: 1.284518451872927
Energy: 1.14800131503119
Energy: 1.1981993333509022
Energy: 1.2083174569085773
Energy: 1.1981993333497987
Energy: 1.2084710650861348
Energy: 1.1981993333481433
Energy: 1.2083174569074737
Energy: 1.1981993333492467
Energy: 1.2059084588796638
Energy: 1.2069672554253263
Energy: 1.205905921594766
Energy: 1.2069750577715586
Energy: 1.205908458881319
Energy: 1.2069672554269817
Energy: 1.2059059215936625
Energy: 1.225991914744268
Energy: 1.277317160842615
Energy: 1.2259919147448197
Energy: 1.2773427274520968
Energy: 1.225991914745923
Energy: 1.2773171608437184
Energy: 1.2259919147453715
Energy: 1.2286035496454486
Energy: 1.252442205530574
Energy: 1.2286035496454486
Energy: 1.2524413833850943
Energy: 1.2286035496421377
Energy: 1.2524422055311257
Energy: 1.2286035496437928
Energy: 1.2403552202641674
Energy: 1.2721015556948156
Energy: 1.2403552202647194
Energy: 1.2721015556953674
Energy: 1.240355220265271
Energy: 1.2721015556920567
Energy: 1.2403552202636157
Energy: 1.239677033778596
Energy: 1.252374560429773
Energy: 1.2396770337791478
Energy: 1.2523745604336352
Energy: 1.2396770337774925
Energy: 1.2523745604330834
Energy: 1.239677033778044
Energy: 1.2394225771997824
Energy: 1.2523398123336644
Energy: 1.2395872816614535
Energy: 1.2523610368292708
Energy: 1.239422577200334
Energy: 1.252339812334768
Energy: 1.2395872816614535
Energy: 1.2396100562639811
Energy: 1.2719307403018942
Energy: 1.2398093483439365
Energy: 1.2719419333374944
Energy: 1.2396100562645331
Energy: 1.2719307403018942
Energy: 1.239809348342833
Energy: 1.2284554199459676
Energy: 1.252432023164082
Energy: 1.228591900256896
Energy: 1.2524320231657373
Energy: 1.2284554199448643
Energy: 1.252432023164082
Energy: 1.2285919002536354
Energy: 1.2337510106400238
Energy: 1.2655755314629116
Energy: 1.233485879166885
Energy: 1.2655755314634631
Energy: 1.2337510106394718
Energy: 1.2655755314623598
Energy: 1.2334858791652297
Energy: 1.203370249347058
Energy: 1.208783125493828
Energy: 1.2033702493459544
Energy: 1.2087831254932762
Energy: 1.2033702493454026
Energy: 1.2087831254916206
Energy: 1.2033702493454026
Energy: 1.2348081849102894
Energy: 1.2084210678558087
Energy: 1.198051939489925
Energy: 1.208421067854705
Energy: 1.234808184911393
Energy: 1.2084210678541532
Energy: 1.198051939489925
Energy: 1.2414880596108258
Energy: 1.2845184518756858
Energy: 1.148001315031742
Energy: 1.2845184518756858
Energy: 1.2414880596091704
Energy: 1.2845184518740305
Energy: 1.1480013150322936
Energy: 1.2344062104978732
Energy: 1.2326019766324539
Energy: 1.1981993333497987
Energy: 1.231990938231944
Energy: 1.2344062105006322
Energy: 1.2326019766330054
Energy: 1.1981993333497987
Energy: 1.2040944424441429
Energy: 1.2059354606688297
Energy: 1.203893053518704
Energy: 1.2060609163145937
Energy: 1.2040944424419358
Energy: 1.205935460669933
Energy: 1.2038930535203594
Energy: 1.2259919147437162
Energy: 1.2655696507869316
Energy: 1.2259919147453715
Energy: 1.2656324116416848
Energy: 1.225991914745923
Energy: 1.2655696507880352
Energy: 1.2259919147453715
Energy: 1.2286035496448966
Energy: 1.2524223811664126
Energy: 1.2286035496448966
Energy: 1.2523648488312775
Energy: 1.2286035496421377
Energy: 1.252422381165861
Energy: 1.2286035496432413
Energy: 1.2403552202636157
Energy: 1.2721015556942639
Energy: 1.2403552202641674
Energy: 1.2721015556959192
Energy: 1.2403552202647194
Energy: 1.2721015556926085
Energy: 1.2403552202647194
Energy: 1.2396770337791478
Energy: 1.2523745604303245
Energy: 1.2396770337796996
Energy: 1.2523745604330834
Energy: 1.2396770337791478
Energy: 1.2523745604325318
Energy: 1.239677033778044
Energy: 1.2396574200194383
Energy: 1.2522205098278352
Energy: 1.2395921572973703
Energy: 1.2522273862389008
Energy: 1.2396574200172312
Energy: 1.2522205098250763
Energy: 1.2395921572968185
Energy: 1.2399970423708748
Energy: 1.272034325506014
Energy: 1.2400007889477034
Energy: 1.272042424451465
Energy: 1.2399970423703233
Energy: 1.2720343255032551
Energy: 1.2400007889454963
Energy: 1.2286832458291777
Energy: 1.2524320231646335
Energy: 1.2286784721749533
Energy: 1.2524320231657373
Energy: 1.2286832458286259
Energy: 1.2524320231651858
Energy: 1.2286784721727464
Energy: 1.2404170572640787
Energy: 1.2655755314612562
Energy: 1.2404205767482093
Energy: 1.265575531461808
Energy: 1.2404170572618716
Energy: 1.2655755314607042
Energy: 1.240420576746002
Energy: 1.2033702493459544
Energy: 1.2087831254932762
Energy: 1.2033702493459544
Energy: 1.2087831254927244
Energy: 1.2033702493465062
Energy: 1.2087831254921724
Energy: 1.2033702493454026
Energy: 1.1980519394877178
Energy: 1.208421067856912
Energy: 1.1980519394888214
Energy: 1.2084210678563605
Energy: 1.1980519394882694
Energy: 1.208421067854705
Energy: 1.1980519394893732
Energy: 1.14800131503119
Energy: 1.2845184518762374
Energy: 1.1480013150306385
Energy: 1.2845184518762374
Energy: 1.14800131503119
Energy: 1.2845184518734785
Energy: 1.148001315031742
Energy: 1.198199333351454
Energy: 1.2083174569074737
Energy: 1.1981993333503502
Energy: 1.2084710650866868
Energy: 1.1981993333492467
Energy: 1.2083174569074737
Energy: 1.1981993333497987

minimum gb energy = 1.1480013150306385 eV
minimum distance =  2.32246996267946 Angstroms
sigma value = 311


========================================
theta = 32.20422750397202
========================================

Energy: 1.2479604493474437
Energy: 1.2490161520396963
Energy: 1.2479604493474437
Energy: 1.2490161520384222
Energy: 1.2479604493468066
Energy: 1.2490161520390592
Energy: 1.2479604493468066
Energy: 1.2207384115632844
Energy: 1.214289130387644
Energy: 1.2207384115632844
Energy: 1.214289130387644
Energy: 1.2207384115626472
Energy: 1.2142891303882812
Energy: 1.2207384115632844
Energy: 1.1802694805269993
Energy: 1.2124878563358892
Energy: 1.1802694805276366
Energy: 1.2124878563352521
Energy: 1.1802694805276366
Energy: 1.2124878563358892
Energy: 1.1802694805276366
Energy: 1.3024750557932514
Energy: 1.294056647278625
Energy: 1.3024750557926144
Energy: 1.294056647278625
Energy: 1.3024750557932514
Energy: 1.294056647278625
Energy: 1.3024750557938596
Energy: 1.260235116746104
Energy: 1.2917654856924379
Energy: 1.2602351167454666
Energy: 1.2917654856918008
Energy: 1.260235116746104
Energy: 1.2917654856918008
Energy: 1.260235116746741
Energy: 1.2507901779833308
Energy: 1.3466483233395348
Energy: 1.2507901779833308
Energy: 1.3466483233395348
Energy: 1.2507901779833308
Energy: 1.3466483233388977
Energy: 1.2507901779839679
Energy: 1.250074256181325
Energy: 1.3369132930012868
Energy: 1.250074256181962
Energy: 1.3369132930012868
Energy: 1.250074256181962
Energy: 1.3369132930019239
Energy: 1.250074256181325
Energy: 1.235612989132154
Energy: 1.2764637167247543
Energy: 1.235612989132154
Energy: 1.2764637167247543
Energy: 1.235612989132154
Energy: 1.2764637167247543
Energy: 1.2356129891334284
Energy: 1.2601781716653015
Energy: 1.3087100410693913
Energy: 1.2601781716665756
Energy: 1.3087100410693913
Energy: 1.2601781716659388
Energy: 1.308710041068754
Energy: 1.2601781716653015
Energy: 1.1746645459009843
Energy: 1.2528613271560942
Energy: 1.1746645459016216
Energy: 1.2528613271560942
Energy: 1.1746645459016216
Energy: 1.2528613271560942
Energy: 1.1746645459009843
Energy: 1.1933421085899856
Energy: 1.2799154927846164
Energy: 1.1933421085912599
Energy: 1.2799154927846164
Energy: 1.1933421085906226
Energy: 1.2799154927846164
Energy: 1.1933421085893485
Energy: 1.290211174317805
Energy: 1.280635883552058
Energy: 1.290211174317805
Energy: 1.2806358835526952
Energy: 1.2902111743184421
Energy: 1.280635883552058
Energy: 1.290211174317805
Energy: 1.270206187976576
Energy: 1.2797558224240817
Energy: 1.2702061879778506
Energy: 1.2797558224240817
Energy: 1.2702061879772133
Energy: 1.2797558224240817
Energy: 1.2702061879772133
Energy: 1.2286700368054884
Energy: 1.267421632698338
Energy: 1.228670036804851
Energy: 1.267421632698338
Energy: 1.2286700368042138
Energy: 1.2674216326989753
Energy: 1.228670036804851
Energy: 1.2613077513888098
Energy: 1.3183400569038233
Energy: 1.2613077513888098
Energy: 1.3183400569038233
Energy: 1.2613077513888098
Energy: 1.318340056903186
Energy: 1.2613077513881725
Energy: 1.2489479245876107
Energy: 1.270719742917626
Energy: 1.248947924588248
Energy: 1.2707197429182633
Energy: 1.248947924588248
Energy: 1.2707197429182633
Energy: 1.2489479245888853
Energy: 1.2151842106019664
Energy: 1.1789624838748616
Energy: 1.2151842106013289
Energy: 1.1789624838748616
Energy: 1.2151842106026034
Energy: 1.1789624838735873
Energy: 1.2151842106019664
Energy: 1.1828837560360221
Energy: 1.2103267135709597
Energy: 1.1828837560360221
Energy: 1.2103267135709597
Energy: 1.182883756035385
Energy: 1.2103267135709597
Energy: 1.1828837560360221
Energy: 1.3749900120142229
Energy: 1.3180750602527302
Energy: 1.3328529103288873
Energy: 1.3180750602533673
Energy: 1.33285291032825
Energy: 1.3180750602533673
Energy: 1.33285291032825
Energy: 1.2604064363671754
Energy: 1.274985055630583
Energy: 1.2604064363671754
Energy: 1.2749850556312203
Energy: 1.2604064363671754
Energy: 1.2749850556312203
Energy: 1.2604064363665382
Energy: 1.2511904956572588
Energy: 1.2549852577606746
Energy: 1.251190495657896
Energy: 1.2549852577613116
Energy: 1.251190495657896
Energy: 1.2549852577600373
Energy: 1.251190495657896
Energy: 1.2593958832974803
Energy: 1.3281629494638458
Energy: 1.2593958832974803
Energy: 1.3281629494632088
Energy: 1.2593958832974803
Energy: 1.3281629494638458
Energy: 1.2593958832974803
Energy: 1.2125571442262397
Energy: 1.2433452288937854
Energy: 1.212557144226877
Energy: 1.2433452288937854
Energy: 1.212557144227514
Energy: 1.2433452288937854
Energy: 1.212557144226877
Energy: 1.2602644117283568
Energy: 1.2744372624632563
Energy: 1.260264411728994
Energy: 1.2744372624645308
Energy: 1.260264411728994
Energy: 1.2744372624632563
Energy: 1.260264411728994
Energy: 1.1726548437438056
Energy: 1.2329581571680592
Energy: 1.1726548437438056
Energy: 1.2329581571674222
Energy: 1.1726548437438056
Energy: 1.2329581571680592
Energy: 1.1726548437438056
Energy: 1.2380824382825264
Energy: 1.3186094762037202
Energy: 1.238082438281252
Energy: 1.3186094762037202
Energy: 1.238082438281252
Energy: 1.3186094762037202
Energy: 1.2380824382825264
Energy: 1.2524726012617018
Energy: 1.2823817279664655
Energy: 1.2524726012610645
Energy: 1.2823817279677399
Energy: 1.2524726012617018
Energy: 1.2823817279671026
Energy: 1.2524726012623388
Energy: 1.2166558920427366
Energy: 1.3508461021446394
Energy: 1.2166558920433737
Energy: 1.3508461021452767
Energy: 1.2166558920420993
Energy: 1.3508461021446394
Energy: 1.2166558920433737
Energy: 1.2537669273872782
Energy: 1.230483012638812
Energy: 1.253766927387915
Energy: 1.230483012638175
Energy: 1.253766927386641
Energy: 1.2304830126400863
Energy: 1.2537669273872782
Energy: 1.260194489637902
Energy: 1.3185358393442204
Energy: 1.260194489638539
Energy: 1.318535839343583
Energy: 1.2601944896391761
Energy: 1.318535839342946
Energy: 1.260194489637902
Energy: 1.209487547239023
Energy: 1.270592273892744
Energy: 1.2094875472396605
Energy: 1.270592273892744
Energy: 1.2094875472396605
Energy: 1.270592273892744
Energy: 1.2094875472396605
Energy: 1.1792684799836541
Energy: 1.2529504728506928
Energy: 1.1792684799836541
Energy: 1.2529504728500558
Energy: 1.1792684799836541
Energy: 1.2529504728513303
Energy: 1.1792684799836541
Energy: 1.180359071138411
Energy: 1.188951691084013
Energy: 1.1803590711390486
Energy: 1.1889516910833757
Energy: 1.180359071138411
Energy: 1.1889516910827387
Energy: 1.180359071138411
Energy: 1.3043899787577617
Energy: 1.3144379115640499
Energy: 1.304389978758399
Energy: 1.3144379115646874
Energy: 1.3043899787564874
Energy: 1.3144379115640499
Energy: 1.3043899787577617
Energy: 1.2666109166522765
Energy: 1.3005767615022445
Energy: 1.2666109166510022
Energy: 1.3005767615016073
Energy: 1.2666109166510022
Energy: 1.3005767615028814
Energy: 1.2666109166522765
Energy: 1.225706938400266
Energy: 1.2686057443349057
Energy: 1.225706938400266
Energy: 1.268605744335543
Energy: 1.2257069383996286
Energy: 1.268605744335543
Energy: 1.225706938400266

minimum gb energy = 1.1726548437438056 eV
minimum distance =  2.24875722820603 Angstroms
sigma value = 39


========================================
theta = 38.21321070173819
========================================

Energy: 1.1659029251642812
Energy: 1.170524953926839
Energy: 1.1659029251642812
Energy: 1.1705249539275913
Energy: 1.1659029251642812
Energy: 1.1705249539275913
Energy: 1.1659029251642812
Energy: 1.2392666384408808
Energy: 1.0854638725104087
Energy: 1.2392666384408808
Energy: 1.0854638725104087
Energy: 1.2392666384401285
Energy: 1.0854638725111603
Energy: 1.2392666384401285
Energy: 1.2014001168874577
Energy: 1.1095255897845977
Energy: 1.2014001168874577
Energy: 1.1095255897845977
Energy: 1.2014001168874577
Energy: 1.1095255897838456
Energy: 1.2014001168874577
Energy: 1.2712544721306458
Energy: 1.0850953849170488
Energy: 1.2712544721306458
Energy: 1.0850953849170488
Energy: 1.2712544721306458
Energy: 1.0850953849162968
Energy: 1.271254472129142
Energy: 1.252485895429323
Energy: 1.0851490314416197
Energy: 1.2524858954308271
Energy: 1.0851490314408678
Energy: 1.2524858954308271
Energy: 1.0851490314416197
Energy: 1.252485895429323
Energy: 1.2737299591645401
Energy: 1.1456690450402827
Energy: 1.2737299591645401
Energy: 1.1456690450395306
Energy: 1.2737299591630364
Energy: 1.1456690450387788
Energy: 1.2737299591630364
Energy: 1.2950668792345859
Energy: 1.1862392834110917
Energy: 1.2710323427563708
Energy: 1.1862392834095878
Energy: 1.2394169739442902
Energy: 1.1862392834103397
Energy: 1.2394169739435381
Energy: 1.219999562902459
Energy: 1.1801790365933686
Energy: 1.2199995629017069
Energy: 1.1801790365933686
Energy: 1.219999562902459
Energy: 1.1801790365926166
Energy: 1.2199995629039628
Energy: 1.2793194203458735
Energy: 1.1636643263153335
Energy: 1.2793194203458735
Energy: 1.1636643263138298
Energy: 1.2793194203466254
Energy: 1.1636643263153335
Energy: 1.2793194203458735
Energy: 1.1744514364929068
Energy: 1.1705069537019661
Energy: 1.174451436493659
Energy: 1.170506953701214
Energy: 1.174451436493659
Energy: 1.1705069537019661
Energy: 1.174451436493659
Energy: 1.24920568348888
Energy: 1.1616810066122805
Energy: 1.24920568348888
Energy: 1.1616810066122805
Energy: 1.2254699146590504
Energy: 1.1616810066107766
Energy: 1.2705564270987393
Energy: 1.194093016531299
Energy: 1.1245767961567552
Energy: 1.194093016532803
Energy: 1.1245767961567552
Energy: 1.194093016531299
Energy: 1.1245767961575073
Energy: 1.194093016531299
Energy: 1.1917456205173336
Energy: 1.0851213048406074
Energy: 1.1917456205173336
Energy: 1.0851213048398556
Energy: 1.1917456205165815
Energy: 1.0851213048406074
Energy: 1.1917456205173336
Energy: 1.1791631188987617
Energy: 1.109770895450735
Energy: 1.1791631188995138
Energy: 1.109770895452239
Energy: 1.1791631188987617
Energy: 1.109770895452239
Energy: 1.1791631188995138
Energy: 1.216640641726081
Energy: 1.1458297234230614
Energy: 1.2640116230308422
Energy: 1.1458297234230614
Energy: 1.2640116230315943
Energy: 1.1458297234230614
Energy: 1.3039026401013865
Energy: 1.1794530996167838
Energy: 1.1682720679914687
Energy: 1.1794530996167838
Energy: 1.1682720679914687
Energy: 1.1794530996153139
Energy: 1.1682720679914687
Energy: 1.1794530996160317
Energy: 1.260398372487769
Energy: 1.1494603582906053
Energy: 1.260398372490777
Energy: 1.1494603582906053
Energy: 1.260398372489273
Energy: 1.1494603582906053
Energy: 1.260398372490777
Energy: 1.2359603699217712
Energy: 1.1616199703881203
Energy: 1.2359603699225234
Energy: 1.161619970388872
Energy: 1.2359603699225234
Energy: 1.161619970388872
Energy: 1.235960369923275
Energy: 1.2389285680917566
Energy: 1.1891669024383344
Energy: 1.2389285680910047
Energy: 1.1891669024390867
Energy: 1.2389285680925086
Energy: 1.1891669024390867
Energy: 1.2389285680910047
Energy: 1.1744923280387358
Energy: 1.1704244385071685
Energy: 1.1744923280387358
Energy: 1.1704244385056648
Energy: 1.1744923280387358
Energy: 1.1704244385071685
Energy: 1.1744923280394874
Energy: 1.2499101973805122
Energy: 1.085042298315833
Energy: 1.249910197382016
Energy: 1.085042298315833
Energy: 1.2499101973805122
Energy: 1.085042298315833
Energy: 1.2499101973805122
Energy: 1.2023236513773654
Energy: 1.1102083333005213
Energy: 1.2023236513758615
Energy: 1.1102083333012733
Energy: 1.2023236513758615
Energy: 1.1102083333020254
Energy: 1.2023236513758615
Energy: 1.2709448574678766
Energy: 1.1096097402701361
Energy: 1.2709448574686288
Energy: 1.1096097402701361
Energy: 1.2709448574686288
Energy: 1.1096097402701361
Energy: 1.2709448574678766
Energy: 1.243421916955221
Energy: 1.0854238831773746
Energy: 1.243421916955221
Energy: 1.0854238831773746
Energy: 1.2434219169559726
Energy: 1.0854238831781267
Energy: 1.2434219169559726
Energy: 1.2631564634680008
Energy: 1.1466607067584673
Energy: 1.263156463468753
Energy: 1.1466607067592192
Energy: 1.2631564634680008
Energy: 1.1466607067577153
Energy: 1.2631564634680008
Energy: 1.2397019939699236
Energy: 1.1487991776922957
Energy: 1.2397019939691716
Energy: 1.1487991776922957
Energy: 1.23970199396842
Energy: 1.1487991776930475
Energy: 1.239701993970676
Energy: 1.2366773589484736
Energy: 1.1615008511841451
Energy: 1.2366773589492255
Energy: 1.1615008511841451
Energy: 1.2366773589499773
Energy: 1.1615008511848972
Energy: 1.2366773589492255
Energy: 1.239163522262052
Energy: 1.1491120688630743
Energy: 1.2391635222628037
Energy: 1.1491120688630743
Energy: 1.2391635222628037
Energy: 1.1491120688623226
Energy: 1.239163522262052
Energy: 1.1659029251642812
Energy: 1.170524953926839
Energy: 1.1659029251635291
Energy: 1.1705249539275913
Energy: 1.1659029251642812
Energy: 1.1705249539275913
Energy: 1.1659029251635291
Energy: 1.2392666384408808
Energy: 1.0854638725104087
Energy: 1.2392666384401285
Energy: 1.0854638725111603
Energy: 1.2392666384393767
Energy: 1.0854638725111603
Energy: 1.2392666384401285

minimum gb energy = 1.085042298315833 eV
minimum distance =  2.26133274069145 Angstroms
sigma value = 21


========================================
theta = 46.82644889274107
========================================

Energy: 1.1470561711272977
Energy: 1.2221283639187945
Energy: 1.1470561711272977
Energy: 1.2221283639187945
Energy: 1.1470561711282106
Energy: 1.2221283639187945
Energy: 1.1470561711272977
Energy: 1.059817460957845
Energy: 1.0334634827905478
Energy: 1.059817460957845
Energy: 1.0334634827905478
Energy: 1.059817460957845
Energy: 1.0334634827905478
Energy: 1.059817460957845
Energy: 1.151472868205739
Energy: 1.1058891823662917
Energy: 1.151472868205739
Energy: 1.1058891823662917
Energy: 1.151472868205739
Energy: 1.1058891823662917
Energy: 1.151472868205739
Energy: 0.9878512468664759
Energy: 1.0323692642506686
Energy: 0.9878512468673887
Energy: 1.0323692642506686
Energy: 0.9878512468673887
Energy: 1.0323692642506686
Energy: 0.9878512468710401
Energy: 1.006223078930597
Energy: 1.0533037247904133
Energy: 1.006223078930597
Energy: 1.0533037247904133
Energy: 1.00622307893151
Energy: 1.0533037247904133
Energy: 1.006223078930597
Energy: 0.9879578926015015
Energy: 1.0593447456553517
Energy: 0.9879578926015015
Energy: 1.0593447456553517
Energy: 0.9879578926015015
Energy: 1.0593447456562646
Energy: 0.9879578926015015
Energy: 1.0221381992892464
Energy: 1.0683802760529932
Energy: 1.0221381992883336
Energy: 1.0683802760548191
Energy: 1.0221381992892464
Energy: 1.068380276053906
Energy: 1.0221381992883336
Energy: 1.016089727398388
Energy: 1.022262251558721
Energy: 1.016089727398388
Energy: 1.0222622515596336
Energy: 1.016089727398388
Energy: 1.022262251558721
Energy: 1.016089727398388
Energy: 1.0466011414744094
Energy: 1.0223418591667754
Energy: 1.0466011414744094
Energy: 1.0223418591667754
Energy: 1.0466011414744094
Energy: 1.0223418591667754
Energy: 1.0466011414744094
Energy: 1.0242828680436855
Energy: 1.0653076202125544
Energy: 1.0242828680436855
Energy: 1.0653076202125544
Energy: 1.0242828680436855
Energy: 1.0653076202116416
Energy: 1.0242828680436855
Energy: 1.0046246238573744
Energy: 1.0227653688168366
Energy: 1.0046246238564616
Energy: 1.0227653688177492
Energy: 1.0046246238564616
Energy: 1.0227653688177492
Energy: 1.0046246238564616
Energy: 1.0061222339947344
Energy: 1.0176849502708156
Energy: 1.0061222339947344
Energy: 1.0176849502708156
Energy: 1.0061222339947344
Energy: 1.0176849502708156
Energy: 1.0061222339947344
Energy: 1.044163710296905
Energy: 1.0231975292902185
Energy: 1.044163710295992
Energy: 1.0231975292902185
Energy: 1.044163710296905
Energy: 1.0231975292893056
Energy: 1.044163710296905
Energy: 1.1061297902762242
Energy: 1.03443793945605
Energy: 1.106129790277137
Energy: 1.0344379394569627
Energy: 1.1061297902762242
Energy: 1.03443793945605
Energy: 1.106129790277137
Energy: 1.0469910492358954
Energy: 1.0234422043400488
Energy: 1.0469910492358954
Energy: 1.0234422043400488
Energy: 1.0469910492358954
Energy: 1.0234422043400488
Energy: 1.0469910492358954
Energy: 1.12437174957051
Energy: 1.0871398630210463
Energy: 1.12437174957051
Energy: 1.087139863021959
Energy: 1.12437174957051
Energy: 1.0871398630210463
Energy: 1.124371749569597
Energy: 1.0968657259473025
Energy: 1.0225446604260842
Energy: 1.0968657259473025
Energy: 1.0225446604260842
Energy: 1.0968657259473025
Energy: 1.0225446604260842
Energy: 1.0968657259473025
Energy: 1.070038210376083
Energy: 1.0344107226948456
Energy: 1.070038210376083
Energy: 1.0344107226948456
Energy: 1.070038210376083
Energy: 1.0344107226939325
Energy: 1.0700382103751704
Energy: 1.0132701837503466
Energy: 1.0230532815540583
Energy: 1.0132701837512594
Energy: 1.0230532815540583
Energy: 1.0132701837503466
Energy: 1.0230532815540583
Energy: 1.0132701837503466
Energy: 1.0061536280036028
Energy: 1.0172615849283433
Energy: 1.00615362800269
Energy: 1.0172615849283433
Energy: 1.0061536280036028
Energy: 1.0172615849283433
Energy: 1.00615362800269
Energy: 1.042797800283338
Energy: 1.1261643190377288
Energy: 1.042797800283338
Energy: 1.1261643190377288
Energy: 1.042797800283338
Energy: 1.1261643190377288
Energy: 1.042797800283338
Energy: 0.9853898491430438
Energy: 1.0680892050061706
Energy: 0.9853898491430438
Energy: 1.0680892050061706
Energy: 0.9853898491430438
Energy: 1.0680892050061706
Energy: 0.9853898491421309
Energy: 1.0395232077137428
Energy: 1.0226730332453204
Energy: 1.03952320771283
Energy: 1.0226730332453204
Energy: 1.0395232077137428
Energy: 1.0226730332453204
Energy: 1.0395232077137428
Energy: 1.04792106320872
Energy: 1.0184393244804033
Energy: 1.0479210632078069
Energy: 1.0184393244804033
Energy: 1.0479210632078069
Energy: 1.0184393244804033
Energy: 1.0479210632078069
Energy: 1.0368556821092272
Energy: 1.079977518965598
Energy: 1.0368556821083146
Energy: 1.079977518965598
Energy: 1.0368556821092272
Energy: 1.079977518965598
Energy: 1.0368556821083146

minimum gb energy = 0.9853898491421309 eV
minimum distance =  2.30670805540326 Angstroms
sigma value = 113


========================================
theta = 52.659006983369785
========================================

Energy: 0.9949630451853766
Energy: 1.0166403962023152
Energy: 0.9949630451853766
Energy: 1.0166403961992585
Energy: 0.9949630451853766
Energy: 1.0166403962012964
Energy: 0.9949630451853766
Energy: 0.9865100676002457
Energy: 0.9198791325312847
Energy: 0.9865100676007551
Energy: 0.9198791325328131
Energy: 0.9865100676002457
Energy: 0.9198791325323036
Energy: 0.9865100676012647
Energy: 0.9824245696253611
Energy: 0.9516105870524098
Energy: 0.9824245696279083
Energy: 0.9516105870534286
Energy: 0.9824245696258704
Energy: 0.9516105870519002
Energy: 0.9824245696279083
Energy: 0.9201055857125898
Energy: 0.9368254607463931
Energy: 0.9201055857130992
Energy: 0.9368254607458837
Energy: 0.9201055857120802
Energy: 0.9368254607463931
Energy: 0.9201055857125898
Energy: 0.9485435326857765
Energy: 0.9656020707486981
Energy: 0.948543532686286
Energy: 0.965602070749717
Energy: 0.9485435326857765
Energy: 0.9656020707476792
Energy: 0.9485435326857765
Energy: 0.9209486952126333
Energy: 0.9239336253882909
Energy: 0.9209486952121239
Energy: 0.9239336253893098
Energy: 0.9209486952126333
Energy: 0.9239336253888003
Energy: 0.9209486952121239
Energy: 0.9201097230980344
Energy: 1.0653129724907555
Energy: 0.9201097230959966
Energy: 1.0653129724907555
Energy: 0.9201097230980344
Energy: 1.0653129724907555
Energy: 0.9201097230965061
Energy: 0.9373334497613068
Energy: 0.8783109918470643
Energy: 0.937333449760288
Energy: 0.8783109918450265
Energy: 0.9373334497607974
Energy: 0.8783109918470643
Energy: 0.937333449760288
Energy: 0.9139190722158006
Energy: 0.9205097715573698
Energy: 0.9139190722158006
Energy: 0.9205097715594076
Energy: 0.9139190722152912
Energy: 0.9205097715578793
Energy: 0.9139190722152912
Energy: 0.921822759491667
Energy: 0.8890742172550092
Energy: 0.9218227594906481
Energy: 0.8890742172555187
Energy: 0.921822759491667
Energy: 0.8890742172550092
Energy: 0.9218227594901387
Energy: 0.8969624158174084
Energy: 0.8694456090740952
Energy: 0.8969624158209745
Energy: 0.8694456090735857
Energy: 0.8969624158184273
Energy: 0.8694456090740952
Energy: 0.896962415821484
Energy: 0.9014153399203049
Energy: 0.9431691082222105
Energy: 0.9014153399213237
Energy: 0.9431691082237388
Energy: 0.9014153399203049
Energy: 0.9431691082222105
Energy: 0.9014153399208144
Energy: 0.8672238101181512
Energy: 0.9281307431503477
Energy: 0.8672238101181512
Energy: 0.9281307431508572
Energy: 0.8672238101171322
Energy: 0.9281307431518762
Energy: 0.8672238101171322
Energy: 0.9271740461636548
Energy: 0.8889916251324977
Energy: 0.9271740461631454
Energy: 0.8889916251335166
Energy: 0.9271740461636548
Energy: 0.8889916251319883
Energy: 0.9271740461631454
Energy: 0.8929116809044042
Energy: 0.9527114701687651
Energy: 0.8929116809038948
Energy: 0.9527114701682557
Energy: 0.8929116809049137
Energy: 0.9527114701687651
Energy: 0.8929116809059326
Energy: 0.8984545177618274
Energy: 1.018845290484361
Energy: 0.898454517761318
Energy: 1.0188452904858893
Energy: 0.898454517761318
Energy: 1.018845290484361
Energy: 0.8984545177608086
Energy: 0.8671981929159924
Energy: 0.8790694247401929
Energy: 0.867198192915483
Energy: 0.8790694247417212
Energy: 0.867198192915483
Energy: 0.8790694247397297
Energy: 0.8671981929165019
Energy: 0.8929240892408009
Energy: 0.8974557296522349
Energy: 0.8929240892408009
Energy: 0.897455729653254
Energy: 0.8929240892402914
Energy: 0.8974557296522349
Energy: 0.8929240892408009
Energy: 0.9213856776308367
Energy: 0.8733025434311426
Energy: 0.9213856776293083
Energy: 0.8733025434306332
Energy: 0.9213856776308367
Energy: 0.8733025434306332
Energy: 0.9213856776298178
Energy: 0.9067537294196765
Energy: 0.9979157078527767
Energy: 0.906753729420186
Energy: 0.9979157078548145
Energy: 0.9067537294196765
Energy: 0.9979157078527767
Energy: 0.9067537294206954
Energy: 0.9321436376805723
Energy: 0.8792742917692354
Energy: 0.9321436376810818
Energy: 0.8792742917702542
Energy: 0.9321436376810818
Energy: 0.8792742917692354
Energy: 0.9321436376815911
Energy: 0.9123881705129021
Energy: 0.8887010527295064
Energy: 0.9123881705123925
Energy: 0.8887010527320536
Energy: 0.9123881705129021
Energy: 0.8887010527289969
Energy: 0.9123881705118831
Energy: 0.9213219684626102
Energy: 0.919333021613128
Energy: 0.9213219684615914
Energy: 0.9193330216136374
Energy: 0.9213219684631198
Energy: 0.919333021613128
Energy: 0.9213219684621008
Energy: 0.8966963633253459
Energy: 1.0478426357377275
Energy: 0.8966963633263648
Energy: 1.0478426357402746
Energy: 0.8966963633248365
Energy: 1.0478426357392556
Energy: 0.8966963633263648
Energy: 0.9010843144806323
Energy: 0.9211536559208429
Energy: 0.9010843144816512
Energy: 0.9211536559203335
Energy: 0.9010843144811418
Energy: 0.9211536559208429
Energy: 0.9010843144816512
Energy: 0.9699023994485351
Energy: 0.9113587723609712
Energy: 0.9699023994444594
Energy: 0.9113587723614807
Energy: 0.9699023994485351
Energy: 0.9113587723614807
Energy: 0.9699023994444594
Energy: 0.9809391621794051
Energy: 0.9161024071118208
Energy: 0.9809391621788955
Energy: 0.9161024071118208
Energy: 0.9809391621788955
Energy: 0.9161024071113114
Energy: 0.9809391621794051
Energy: 0.9592772153246193
Energy: 0.9364808476761642
Energy: 0.9592772153236004
Energy: 0.9364808476761642
Energy: 0.9592772153246193
Energy: 0.9364808476787114
Energy: 0.9592772153236004
Energy: 0.9624799017017842
Energy: 0.9263909998204376
Energy: 0.9624799017002559
Energy: 0.9263909998178904
Energy: 0.9624799017002559
Energy: 0.9263909998204376
Energy: 0.9624799016987275
Energy: 0.9558890489979281
Energy: 0.9113160871996088
Energy: 0.9558890489979281
Energy: 0.9113160871996088
Energy: 0.9558890489979281
Energy: 0.9113160872001183
Energy: 0.9558890489979281
Energy: 0.9200036930066502
Energy: 0.9115332345868942
Energy: 0.9200036930061407
Energy: 0.9115332345909697
Energy: 0.9200036930066502
Energy: 0.9115332345853656
Energy: 0.9200036930071596
Energy: 0.896584837124342
Energy: 1.0311264877489932
Energy: 0.896584837125361
Energy: 1.0311264877484836
Energy: 0.896584837124342
Energy: 1.0311264877489932
Energy: 0.896584837125361
Energy: 0.9118141234076036
Energy: 0.9239808315679625
Energy: 0.911814123407094
Energy: 0.9239808315689814
Energy: 0.9118141234076036
Energy: 0.9239808315679625
Energy: 0.911814123407094
Energy: 0.9064310133135459
Energy: 0.9074993490193012
Energy: 0.9064310133120176
Energy: 0.9074993490187916
Energy: 0.9064310133135459
Energy: 0.9074993490193012
Energy: 0.9064310133125271
Energy: 0.9411379717656247
Energy: 0.8848715214769681
Energy: 0.9411379717661341
Energy: 0.8848715214790059
Energy: 0.9411379717656247
Energy: 0.8848715214764586
Energy: 0.9411379717656247
Energy: 0.8976103717566434
Energy: 0.9942939768590872
Energy: 0.897610371756134
Energy: 0.9942939768606155
Energy: 0.8976103717566434
Energy: 0.9942939768590872
Energy: 0.897610371756134
Energy: 0.9068298915364084
Energy: 0.8875004623660329
Energy: 0.9068298915358989
Energy: 0.8875004623680707
Energy: 0.9068298915374273
Energy: 0.8875004623655235
Energy: 0.9068298915353895
Energy: 0.8885615202760182
Energy: 0.8686946416228192
Energy: 0.8885615202739805
Energy: 0.868694641624857
Energy: 0.8885615202760182
Energy: 0.8686946416228192
Energy: 0.8885615202739805
Energy: 0.9025425885327357
Energy: 0.9116294383627856
Energy: 0.9025425885332452
Energy: 0.9116294383632951
Energy: 0.9025425885327357
Energy: 0.9116294383627856
Energy: 0.9025425885327357
Energy: 0.8675843184097347
Energy: 0.9056655997828676
Energy: 0.8675843184092253
Energy: 0.9056655997833771
Energy: 0.8675843184092253
Energy: 0.9056655997833771
Energy: 0.867584318408716
Energy: 0.8926735076794141
Energy: 0.8876885334361566
Energy: 0.8926735076809424
Energy: 0.8876885334366662
Energy: 0.8926735076794141
Energy: 0.8876885334361566
Energy: 0.8926735076809424
Energy: 0.8923843089395674
Energy: 0.8733192507211492
Energy: 0.8923843089385486
Energy: 0.8733192507196209
Energy: 0.892384308939058
Energy: 0.8733192507206398
Energy: 0.892384308939058
Energy: 0.8972924409976002
Energy: 1.0213572243950249
Energy: 0.8972924409965812
Energy: 1.0213572243991005
Energy: 0.8972924409970908
Energy: 1.0213572243950249
Energy: 0.8972924409965812
Energy: 0.8687513435209674
Energy: 0.8783294328190707
Energy: 0.8687513435204579
Energy: 0.8783294328185612
Energy: 0.8687513435199485
Energy: 0.8783294328195801
Energy: 0.8687513435204579
Energy: 0.8921158570036102
Energy: 0.8960336202309053
Energy: 0.8921158570046291
Energy: 0.8960336202293769
Energy: 0.8921158570041198
Energy: 0.8960336202303958
Energy: 0.8921158570051386

minimum gb energy = 0.867198192915483 eV
minimum distance =  2.29758156939816 Angstroms
sigma value = 365


========================================
theta = 59.99999999999999
========================================

Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.3542038565664723
Energy: 2.3357924303945308
Energy: 0.965476953887916
Energy: 1.9934237776957526
Energy: 0.965476953887916
Energy: 1.9934237776957526
Energy: 0.9654769538867675
Energy: 1.9934237776957526
Energy: 0.354203856564175
Energy: 0.30896292910680473
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 0.30896292910680473
Energy: 0.35420385656532366
Energy: 2.35215663690932
Energy: 0.965476953887916
Energy: 1.994741614938651
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910680473
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 1.994741614942097
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 1.9947416149501112
Energy: 0.9654769538867675
Energy: 1.9934237776957526
Energy: 0.965476953887916
Energy: 1.9934237776957526
Energy: 0.965476953887916
Energy: 1.9934237776957526
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 1.994741614938651
Energy: 0.965476953887916
Energy: 1.9947416149375023
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.7804189485615096
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.7804189485638067
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.3542038565664723
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.3542038565664723
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.354203856564175
Energy: 0.30896292910680473
Energy: 0.354203856564175
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.7804189485638067
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910680473
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.354203856564175
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 0.30896292910565615
Energy: 0.35420385656532366
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.780418948562658
Energy: 0.965476953887916
Energy: 1.780418948562658
Energy: 0.9654769538867675
Energy: 1.7804189485615096

minimum gb energy = 0.30896292910565615 eV
minimum distance =  2.31750344369496 Angstroms
sigma value = 23