Model name: model_name=MEAM_LAMMPS_LeeShimPark_2001_FeCr__MO_150993986463_000
a1: a1=[1, 1, -1]
a2: a2=[-1, 1, 0]
a3: a3=[1, 1, 2]
Species: species=Fe
Lattice type: short_name=fcc
Lattice constant (meters) and cohesive energy (J): a=3.611098572611809
cohesive_energy=4.242432871290793
mass=55.845
Min. tilt angle (degrees): theta_min=0.0
Max. tilt angle (degrees): theta_max=120.0
Max. denominator: max_denominator=8
Lattice constant (meters) and cohesive energy (J): cohesive_energy_curve=[2.27478640671954e-19, 3.00839104389546e-19, 3.5595558277577994e-19, 4.00787689348368e-19, 4.3864872538642205e-19, 4.71302687363976e-19, 4.998310445089799e-19, 5.249499697768319e-19, 5.4717215969041195e-19, 5.668757279353439e-19, 5.84355475012284e-19, 5.9983891000326e-19, 6.14719926579852e-19, 6.282999757296359e-19, 6.38938428579396e-19, 6.48099674572608e-19, 6.55937522666136e-19, 6.62535286044948e-19, 6.679682670108419e-19, 6.7229734827591e-19, 6.75583412552244e-19, 6.778745251388639e-19, 6.792203535114239e-19, 6.796593499091399e-19, 6.79183503448842e-19, 6.77642209526934e-19, 6.748335938875319e-19, 6.7051893221217e-19, 6.64411434883362e-19, 6.561618273948959e-19, 6.45350339468664e-19, 6.3146427458178595e-19, 6.1386917078719795e-19, 5.91789574594044e-19, 5.6425456696212e-19, 5.300545045327559e-19, 4.8765450209058e-19, 4.35106312848648e-19, 3.6989451949157997e-19, 2.88750681686016e-19, 1.87369750816398e-19, 5.99994321136758e-20, -1.011524604816096e-19, -3.06834449353974e-19, -5.72154899944374e-19, -9.18846697422366e-19, -1.378943761408146e-18, -2.00115065939868e-18, -2.86219242604296e-18, -4.08814594284708e-18, -5.897387885025239e-18, -8.6938910690742e-18, -1.3291320898570858e-17, -2.1528447431057998e-17]
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: 0.01855258524023108
Energy: 0.024035996051540005
Energy: 0.11140184752813853
Energy: 0.11071959216364277
Energy: 0.023176543733597114
Energy: 0.01990605116896957
Energy: 0.10787898600657851
Energy: 0.11202484822682647
Energy: 0.11003669525436387
Energy: 0.022538657733727097
Energy: 0.030029498790487285
Energy: 0.11608381469108778
Energy: 0.1103717679647744
Energy: 0.11328512723183004
Energy: 0.11179235892959005
Energy: 0.10906309877714497
Energy: 0.11557427932404318
Energy: 0.10805026138224853
Energy: 0.11238304336206596
Energy: 0.11090251852150164
Energy: 0.11096188559644722
Energy: 0.025381673188455606
Energy: 0.019038632242840352
Energy: 0.10889272959438127
Energy: 0.1099037050864248
Energy: 0.11019077707067394
Energy: 0.024318586440471017
Energy: 0.0189871837201218
Energy: 0.10880680291470664
Energy: 0.11133852238545573
Energy: 0.1118548347217632
Energy: 0.020353563090954364
Energy: 0.019999038123439433
Energy: 0.11416810418064217
Energy: 0.1093930035827956
Energy: 0.11075375316238911
Energy: 0.020111859091089677
Energy: 0.01946861885297355
Energy: 0.11235832581545897
Energy: 0.10928290714229243
Energy: 0.11112338607732973
Energy: 0.10969387791448582
Energy: 0.11227529367895046
Energy: 0.026275090646746182
Energy: 0.019878733972992557
Energy: 0.11042582807553199
Energy: 0.11019951229366737
Energy: 0.1117082176046111
Energy: 0.025112711969957322
Energy: 0.11452977059742696
Energy: 0.11163449008094059
Energy: 0.10866970842887015
Energy: 0.10988962749873149
Energy: 0.019508576784785736
Energy: 0.027854926041686857
Energy: 0.11311060088378071
Energy: 0.10802813742948324
Energy: 0.11026988972840461
Energy: 0.020083788831773586
Energy: 0.019647514776754586
Energy: 0.028488975105621896
Energy: 0.11274667813813327
Energy: 0.11153772111289728
Energy: 0.10859614801222622
Energy: 0.11402027211363887
Energy: 0.026897999814925196
Energy: 0.11405775580965578
Energy: 0.11113534808110928
Energy: 0.10927502607858829
Energy: 0.11310057642021441

minimum gb energy = 0.01855258524023108 eV
minimum distance =  2.51019737602313 Angstroms
sigma value = 3


========================================
theta = 23.07391806563098
========================================

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Energy: 0.056021141424755345
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Energy: -0.03053897280279741
Energy: -0.018419310585023402
Energy: -0.05677147286310951
Energy: -0.18017342421060648

minimum gb energy = -1.2549310026353844 eV
minimum distance =  2.38772932887579 Angstroms
sigma value = 75


========================================
theta = 34.04773236999154
========================================

Energy: 2.2562817156706436
Energy: 0.8868005323153882
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Energy: 0.8160307150776439
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minimum gb energy = 0.523558717296522 eV
minimum distance =  2.23668917066702 Angstroms
sigma value = 105


========================================
theta = 38.572650822227786
========================================

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Energy: 0.7425257797335231
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Energy: 0.870746105598858
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Energy: 0.7938897962530811
Energy: 0.7476017678253026
Energy: 0.8092462798193071
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Energy: 0.7983792802726476
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Energy: 0.7576267381815764
Energy: 0.8777503656246505
Energy: 0.7813650667296035
Energy: 0.7444011548326545
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Energy: 0.7417759433797619
Energy: 0.8214104221046856
Energy: 0.746788139230678
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Energy: 0.7712452771074207
Energy: 0.7685156927434104
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Energy: 0.7841358570901065
Energy: 0.6897698709136777
Energy: 0.8369100566212087
Energy: 0.8230787144761201
Energy: 0.794497154308132
Energy: 0.7542234006038352
Energy: 0.690569504549218
Energy: 0.8475845107786433
Energy: 0.8662753942259904
Energy: 0.6959766837771483
Energy: 0.8822443198501959
Energy: 0.8741891867995997
Energy: 0.8301320039557823
Energy: 0.837584540569594
Energy: 0.8550033546873169
Energy: 0.8663206404488142
Energy: 0.8743964114306777
Energy: 0.8734151427613754
Energy: 0.8346154256485236
Energy: 0.8442652273586343
Energy: 0.8610858397972186
Energy: 0.8047397580361706
Energy: 0.6508054850793322
Energy: 0.6860826862709722
Energy: 0.823895633417202
Energy: 0.845895013383036
Energy: 0.8790230207287837
Energy: 0.69797287527641
Energy: 0.8070894592466589
Energy: 0.8440302473971264
Energy: 0.8285749808839886
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Energy: 0.6888542093029553
Energy: 0.6895494513598026
Energy: 0.689180564008692
Energy: 0.9782745741854593
Energy: 0.7002056840028789
Energy: 0.695998018724405
Energy: 0.6895236199142176
Energy: 0.7582310509083197

minimum gb energy = 0.053906844232435885 eV
minimum distance =  2.29727420356093 Angstroms
sigma value = 165


========================================
theta = 44.41530859719298
========================================

Energy: 0.8844507157166865
Energy: 0.8364099559262497
Energy: 0.19177088144833085
Energy: 0.23640070731318752
Energy: 0.805773981182829
Energy: 0.8584011039608673
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Energy: 0.8759518763559634
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Energy: 0.8651976137433028
Energy: 0.15877039775572133
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Energy: 0.45892331828961436
Energy: 0.26574466442414546
Energy: 0.9039412918396121
Energy: 0.9182511143059692
Energy: 0.8991406692378128
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Energy: 0.9034144366729016
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Energy: 0.8210961550156224
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Energy: 0.8923086039068783
Energy: 0.8643967675551598
Energy: 0.8384983439573382
Energy: 0.8837103209317673
Energy: 0.870166779365054
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Energy: 0.9024541972042688
Energy: 0.9075435043930545
Energy: 0.8613909962531185
Energy: 0.892706364931331
Energy: 0.8989482859546934
Energy: 0.9086181001144079
Energy: 0.92504779105722
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Energy: 0.8933309829734117
Energy: 0.8416136759109516
Energy: 0.9060903922883915
Energy: 0.913494931255565
Energy: 0.9223372514599784
Energy: 0.8318394239342698
Energy: 0.9280142191774677
Energy: 0.9180863611791935
Energy: -0.4115681716801088
Energy: 0.189742956351411
Energy: 0.8388943068821145
Energy: 0.859610759572468
Energy: 0.8416386450644299
Energy: 0.9267348183237368
Energy: 0.877518080187084
Energy: 0.9163421404275934
Energy: 0.8814144804389707
Energy: 0.9111622035881084
Energy: 0.869499859109823
Energy: 0.17152029626563772
Energy: 0.872210437248018
Energy: 0.8823902639272444
Energy: 0.8653775292612046
Energy: 0.8677170664224795
Energy: 0.8601352519016042
Energy: 0.8351822795059233
Energy: 0.949689923012442
Energy: 0.24279421789486452
Energy: 0.23648654647097378
Energy: -0.021180936553053583
Energy: 0.8116242095389731
Energy: 0.9006257117728154
Energy: 0.23643749702865863
Energy: 0.8649652155645609
Energy: 0.9217256432393458

minimum gb energy = -0.4115752153105526 eV
minimum distance =  2.2501699193834 Angstroms
sigma value = 41


========================================
theta = 52.20027756457278
========================================

Energy: 0.9149879368223985
Energy: 0.6933691463234256
Energy: 0.6433587402114578
Energy: 0.6388691818751451
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Energy: 0.6714275261188908
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Energy: 0.7843601983020186
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Energy: 0.7414488389342215
Energy: 0.7939113499486335
Energy: 0.7354040101542072
Energy: 0.7340286939955066
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Energy: 0.7537477863594617
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Energy: 0.7722614645322264
Energy: 0.7388634190090874
Energy: 0.7511307888814899
Energy: 0.7349454922446356
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Energy: 0.7275792547263087
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Energy: 0.7309191322412826
Energy: 0.7291221067286172
Energy: 0.7558156831896673
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Energy: 0.7510141498917675
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Energy: 0.725958590640939
Energy: 0.7318185316395891
Energy: 0.6785098441267806
Energy: 0.7077302567418989
Energy: 0.7231172864292537
Energy: 0.7719027123740893
Energy: 0.7424706772437311
Energy: 0.6940283107503484
Energy: 0.7003421851156685
Energy: 0.7497726914432767
Energy: 0.7376123344867658
Energy: 0.744009153587586
Energy: 0.7347229503969297
Energy: 0.6546700042028665
Energy: 0.745250477435298
Energy: 0.6866338021383445
Energy: 0.7394391321087959
Energy: 0.7230164987933144
Energy: 0.7129082919403924
Energy: 0.7121372035183177
Energy: 0.7027283340030304
Energy: 0.603116154332462
Energy: 0.5334895434201222
Energy: 0.70324548519383
Energy: 0.7320633720726087
Energy: 0.6633695419760501
Energy: 0.7226196394615505
Energy: 0.7054071629774488
Energy: 0.7623012282739682
Energy: 0.7905531075617295
Energy: 0.710050994079408
Energy: 0.5336612496061651
Energy: 0.65737853724008
Energy: 0.6983069725463329
Energy: 0.6904455798626575
Energy: 0.7100008017614758
Energy: 0.6461355156452597
Energy: 0.7381584042467687
Energy: 0.7333210000056379
Energy: 0.645329057222393
Energy: 0.7030273038794962
Energy: 0.7253440595624306
Energy: 0.6700263725721569
Energy: 0.7156029286510963
Energy: 0.6456742576342377
Energy: 0.7099754016463884
Energy: 0.7108726160226028
Energy: 0.6776764770328554

minimum gb energy = 0.23017021649957994 eV
minimum distance =  2.28316816975291 Angstroms
sigma value = 185


========================================
theta = 62.96430821058772
========================================

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Energy: 0.5040829282141728
Energy: 0.5154660385442371
Energy: 0.4178191451786744
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Energy: 0.2394848801431329
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Energy: 0.48889648846688727
Energy: 0.43769782459788675
Energy: 0.4903869619844961
Energy: 0.44298625629095423
Energy: 0.33431302359669
Energy: 0.4812639213041069
Energy: 0.3363486345686559
Energy: 0.48844611019139056
Energy: 0.47171569433995925
Energy: 0.49436809320909825
Energy: 0.48497168524746237
Energy: 0.45014207732847483
Energy: 0.44310465624417655
Energy: 0.3309640874125151
Energy: 0.33259668017708804
Energy: 0.4436861034686826
Energy: 0.5252351079060303
Energy: 0.44348112054786193
Energy: 0.4658958238669284
Energy: 0.4443894998629665
Energy: 0.4566826613967669
Energy: 0.4923870997243793
Energy: 0.41983726351028205
Energy: 0.4200838642447943
Energy: 0.43184376611617037
Energy: 0.48737551966709003
Energy: 0.4205854581539146
Energy: 0.4197295015303932
Energy: 0.5845370845024106
Energy: 0.5234669023755373
Energy: 0.28117491900303876
Energy: 0.42630249564104916
Energy: 0.41973207658276185
Energy: 0.37263252254982987
Energy: 0.49057955851908824
Energy: 0.4264518791935612
Energy: 0.4502926423799639
Energy: 0.5262571853569834

minimum gb energy = 0.2394848801431329 eV
minimum distance =  2.29853875414661 Angstroms
sigma value = 33


========================================
theta = 69.97282751604145
========================================

Energy: 0.6472584488495421
Energy: 0.6077900774285554
Energy: 0.6092351839334288
Energy: 0.6082572084828048
Energy: 0.6057758292875947
Energy: 0.5978995648357288
Energy: 0.626545727888235
Energy: 0.6532866547827006
Energy: 0.6084249464014276
Energy: 0.6051294440271503
Energy: 0.7754523408594224
Energy: 0.6254574141665086
Energy: 0.6370110559974511
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Energy: 0.6814992511797944
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Energy: 0.6678324434655714
Energy: 0.5968114231096552
Energy: 0.5952253851066048
Energy: 0.6346056333674153
Energy: 0.6483418003012651
Energy: 0.6663474647821923
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Energy: 0.6069773408693568
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Energy: 0.8675784746264339
Energy: 0.5976028899578257
Energy: 0.6211660550152956
Energy: 0.6113062696337197
Energy: 0.6167083953250543
Energy: 0.8249168947541508
Energy: 0.5977638997975839
Energy: 0.6201534820585837
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Energy: 0.616916832790649
Energy: 0.6118938059987346
Energy: 0.6168727236036793
Energy: 0.6068616958565018
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Energy: 0.6378141159952039
Energy: 0.6165542804069116
Energy: 0.6086904926297808
Energy: 0.64427314470831
Energy: 0.6104789435752789
Energy: 0.6777399945648744
Energy: 0.5633791784567183
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Energy: 0.6920230409465082
Energy: 0.5887651754831601
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Energy: 0.6834554088656427
Energy: 0.5891566080210803
Energy: 0.5964795512520378
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Energy: 0.5650127771862715
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Energy: 0.5908971007563296
Energy: 0.5650466323540827
Energy: 0.6046462053789227
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Energy: 0.5620154055621251
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Energy: 0.6335582712880196
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Energy: 0.5623186219208228
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Energy: 0.6094784106251019
Energy: 0.6721762719224775
Energy: 0.6100767880409524
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Energy: 0.676689436293828
Energy: 0.6090601772929598
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Energy: 0.596176691750624
Energy: 0.6264444238741552
Energy: 0.6088683406394323
Energy: 0.6163750620144552
Energy: 0.6044217326779266

minimum gb energy = 0.5496673140557657 eV
minimum distance =  2.32441834462154 Angstroms
sigma value = 219


========================================
theta = 78.46304096718453
========================================

Energy: 0.944805670464889
Energy: 0.8537987459243291
Energy: 0.8695637960953885
Energy: 0.8685715984026399
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Energy: 0.89483415834577
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Energy: 0.8868638265537893
Energy: 0.8722263391724532
Energy: 0.961520045692084
Energy: 0.8672572645357609
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Energy: 0.8596544286509782
Energy: 0.8393835761456153
Energy: 0.8704466852547234
Energy: 0.9640560299576455
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Energy: 0.8573449255799651
Energy: 0.9643416587623922
Energy: 0.8331665251947848
Energy: 0.8481589880241754
Energy: 0.8400982973571073
Energy: 0.870213568540253
Energy: 0.8595380709391508
Energy: 0.8579790324026794
Energy: 0.8484428107660047
Energy: 0.8391315666656074
Energy: 0.8702708324369368
Energy: 0.8752054275633343
Energy: 0.858549310194676
Energy: 0.8678799649011903
Energy: 0.8932352729537525
Energy: 0.8613640731940647
Energy: 0.8436926559757488
Energy: 0.8591708887568636
Energy: 0.8683162902062931
Energy: 0.8939317111264875
Energy: 0.9075072572989732
Energy: 0.8763341593560592
Energy: 0.8588069362301607
Energy: 0.7733454182240395
Energy: 0.8693222154312937
Energy: 0.8668569654841866
Energy: 0.8672413136263976
Energy: 0.8820109435318985
Energy: 0.8480619104639919
Energy: 0.8684293131620026
Energy: 0.8670241482732963
Energy: 0.8840226409246931
Energy: 0.8830530362021022

minimum gb energy = 0.7732204204002486 eV
minimum distance =  2.32924443351647 Angstroms
sigma value = 15


========================================
theta = 88.83061719438597
========================================

Energy: 1.1079758610917676
Energy: 1.0939442664798917
Energy: 1.0859950957402806
Energy: 1.053384636415232
Energy: 0.8633216571343865
Energy: 1.1503653045139008
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minimum gb energy = 0.8633216571343865 eV
minimum distance =  2.30564882297216 Angstroms
sigma value = 293


========================================
theta = 91.16938280561406
========================================

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Energy: 0.9841384871778476
Energy: 1.0504361169546912
Energy: 1.0293508599348402
Energy: 0.9773598031362051
Energy: 1.1744762189027618
Energy: 0.9347060749254105
Energy: 1.11996142080518
Energy: 1.118923830683901
Energy: 0.9759447373918372
Energy: 1.1759732160239587
Energy: 0.9471865958486252
Energy: 1.1181370739523595
Energy: 1.1186706525528913
Energy: 0.9782968219718504
Energy: 1.0079593260937665
Energy: 0.9833172335405029
Energy: 1.010051783100607
Energy: 0.9840483249597836
Energy: 0.8800402094742117
Energy: 1.0764304936325657
Energy: 0.9836012417018404
Energy: 1.0011152185956873
Energy: 0.9816140537603942
Energy: 1.0097846689155385
Energy: 1.1555762956874926
Energy: 1.1166908837538008
Energy: 1.0639895347534365
Energy: 1.055128847159876
Energy: 1.0211117987254452
Energy: 1.0050853384059735
Energy: 1.1064551756564223
Energy: 1.058230362787377
Energy: 1.0968437378032247
Energy: 0.8393202830522312
Energy: 1.0394049423925806
Energy: 1.0644494726801046
Energy: 1.1096624480888635
Energy: 1.02491480948656
Energy: 0.9161401830011541
Energy: 1.039156354595445
Energy: 1.0627761174666333
Energy: 1.0455071731264072
Energy: 1.0234882356287172
Energy: 1.0469288201877052
Energy: 0.9757789083779234
Energy: 1.0730961144107978
Energy: 1.021560706854506
Energy: 1.0559645806017843
Energy: 1.0723834825494087
Energy: 0.9747479477763537
Energy: 1.1008034336917536
Energy: 1.0649144549011367
Energy: 1.0776000298758046
Energy: 1.0352084402435144
Energy: 1.0475520806354381
Energy: 1.0334684090306212
Energy: 1.0926241857993977
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Energy: 1.0454270987994152
Energy: 1.0648800516342771
Energy: 0.9691765007538656
Energy: 1.0933361581802663
Energy: 1.0801187992060992
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Energy: 1.0479410022913573
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Energy: 1.1504286601127565
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Energy: 1.0722702693546842
Energy: 1.1217221099479624
Energy: 1.0725742765764095
Energy: 1.0676056122381603
Energy: 1.0799101558458057
Energy: 1.1850358655481485
Energy: 0.9735975207234672
Energy: 1.0789678711831343
Energy: 1.0793452999894932
Energy: 1.1016723521266896
Energy: 1.180641649279695
Energy: 0.969953546963775
Energy: 0.968843713891941
Energy: 1.0341996888047573
Energy: 0.964899854950693
Energy: 1.126326227751588
Energy: 0.9611277774337734
Energy: 0.9693062395072499
Energy: 1.0654342865961588
Energy: 0.9697203880173871
Energy: 1.1582122338459935
Energy: 0.9665975419367797
Energy: 1.114766732532768
Energy: 0.9669004028812578
Energy: 0.9623961646324118
Energy: 0.9851491103977712
Energy: 0.976180007852814
Energy: 1.1182560323503554
Energy: 0.9586698924760817
Energy: 0.959345696340425
Energy: 0.9811538910900679
Energy: 0.9751853890237812
Energy: 1.0696284154269706
Energy: 1.0668112305682391
Energy: 0.985505739241134
Energy: 1.1722270832900858
Energy: 0.9046327751627673
Energy: 1.0448982845959187
Energy: 1.0504281853528004
Energy: 0.9759871198148818
Energy: 1.167379887591517
Energy: 0.9622474082104112
Energy: 1.1115884890537575
Energy: 1.0355456991650815
Energy: 0.9812796271672939
Energy: 1.022487682869895
Energy: 1.1952582514572516
Energy: 1.082447474195525
Energy: 1.034894377688288
Energy: 0.999580823146288
Energy: 1.0067958715146266
Energy: 1.1986204496817336
Energy: 1.1017680381000183
Energy: 1.0175902048645529
Energy: 1.0691386606581117
Energy: 0.8560058363750463
Energy: 1.0368937301564214
Energy: 1.0826103597044996
Energy: 1.030266496378438
Energy: 1.0689310572534285
Energy: 1.077200591328822
Energy: 1.0363575017544382
Energy: 1.0823953440244802
Energy: 1.0409368067995113
Energy: 1.0707753510530393
Energy: 1.0723967921846231
Energy: 1.0112002880325708
Energy: 1.0886608722533886
Energy: 1.0369924077836894
Energy: 1.071291512961316
Energy: 1.072273080220702
Energy: 1.0127182447127454
Energy: 1.1069071357536915
Energy: 1.0505801360773168
Energy: 0.9804996399964772
Energy: 1.0726810392037534
Energy: 1.0275497539006448
Energy: 1.0854993896560532
Energy: 1.0496172279723905
Energy: 0.9720007349630455
Energy: 1.0130971517969083
Energy: 1.0221543096840913
Energy: 1.0791148916956843
Energy: 1.115441798032248
Energy: 1.009633430370491
Energy: 1.0935394201165611
Energy: 1.0255242172437407
Energy: 1.0349314468739772
Energy: 1.1258902714171855
Energy: 1.0074357645058418
Energy: 1.0963362599148225
Energy: 1.03118805799465
Energy: 1.0764499115611483
Energy: 1.0720850491621956
Energy: 1.089512261112945
Energy: 1.1154242907174352
Energy: 1.1040592194019143
Energy: 1.069230065164738
Energy: 0.9685575475755533
Energy: 1.0751883909630375
Energy: 1.139257758682699
Energy: 1.0544561435416824
Energy: 1.1489584294992892
Energy: 0.9730079107123947
Energy: 0.9734770016485931
Energy: 1.0705957646047664
Energy: 1.0774124657458295
Energy: 1.2142317649918348
Energy: 0.9693533852163985
Energy: 0.972574694573381
Energy: 1.0742847601344372
Energy: 1.0773829971371514
Energy: 0.9750419316192859
Energy: 1.1392454728167294
Energy: 0.9776929339393458
Energy: 1.055421953381038
Energy: 1.0207219383655535
Energy: 0.9753407912012115
Energy: 1.136805419219314
Energy: 0.9777381995514476
Energy: 1.0563884629465263
Energy: 1.0425817982804
Energy: 0.9693996253113162
Energy: 0.974289325811668
Energy: 0.9731958501515607
Energy: 0.9683244810920159
Energy: 1.1174578591507163
Energy: 0.9738438442105529
Energy: 0.9735436952743468
Energy: 0.9551466333140627
Energy: 0.9750988191070729
Energy: 1.1142671748081363
Energy: 0.9907466975205734
Energy: 1.1720952230237744
Energy: 1.0070597457947916
Energy: 1.038037764522166
Energy: 0.9833890857573976
Energy: 0.8799016288269219
Energy: 1.1725196592080054
Energy: 0.9733976874209891
Energy: 1.0451250424788228
Energy: 0.9877441183451776
Energy: 0.9952074731459364
Energy: 1.1575326066766727
Energy: 1.1458515838064491
Energy: 1.0290269414166417
Energy: 1.0319871431480236
Energy: 0.9312716902872821
Energy: 1.1306640012146436
Energy: 1.127617557369147
Energy: 1.0324612550593462
Energy: 1.0345744459518207
Energy: 1.0904643316736793
Energy: 0.9879737603829079
Energy: 1.012052258232598
Energy: 1.1193017088116761
Energy: 1.0061363564248555
Energy: 1.0711719913038857
Energy: 1.0095202052787484
Energy: 1.0301606947870159
Energy: 1.1313622220563204
Energy: 1.0656608462832906

minimum gb energy = 0.8393202830522312 eV
minimum distance =  2.30085812974134 Angstroms
sigma value = 293


========================================
theta = 101.5369590328155
========================================

Energy: 1.1995109682426992
Energy: 1.0883809265436133
Energy: 1.1681056474661866
Energy: 1.0929778768045653
Energy: 1.0888500846129814
Energy: 1.1994391826934654
Energy: 1.0921562623069818
Energy: 1.1686109546856263
Energy: 1.092274568980308
Energy: 1.0898120903652604
Energy: 1.087908672994921
Energy: 1.0932506762411334
Energy: 1.0926101722104524
Energy: 1.092305141734366
Energy: 1.091057200632325
Energy: 1.1696335037090364
Energy: 1.0940107528558758
Energy: 1.0892850025297167
Energy: 1.0927935980799617
Energy: 1.0913328862102727
Energy: 1.0922129531118798
Energy: 1.093381615727806
Energy: 1.0920686919579985
Energy: 1.0929666496837054
Energy: 1.169813760138575
Energy: 1.0915208479467937
Energy: 1.092959452823917
Energy: 1.0928554621414903
Energy: 1.1693071381079279
Energy: 1.169816228941672
Energy: 1.1692616728359102
Energy: 1.0895604669331524
Energy: 1.0897596013005046
Energy: 1.0911675310903188
Energy: 1.1699869216221241
Energy: 1.1689106412699124
Energy: 1.089172974518027
Energy: 1.089218829933953
Energy: 1.0914116894471193
Energy: 1.1489820615188182
Energy: 1.0922007772947275
Energy: 1.091160757947798
Energy: 1.0903648126842584
Energy: 1.093717522405313
Energy: 1.0936959214445112
Energy: 1.0915253267077825
Energy: 1.0919382173488608
Energy: 1.087699680122921
Energy: 1.0934098967899968
Energy: 1.0928203886891297
Energy: 1.0927993777747185
Energy: 1.1693498623149827
Energy: 1.0915522300750742
Energy: 1.0946439047072607
Energy: 1.0901963364020835
Energy: 1.0933014597307988
Energy: 1.168439548828385
Energy: 1.0920821987679101
Energy: 1.093245310337391
Energy: 1.0887922742471556
Energy: 1.1680495750033641
Energy: 1.1500631318439074
Energy: 1.0912379468612268
Energy: 1.0925897879562763
Energy: 1.0931301267824094
Energy: 1.1682678080328974
Energy: 1.1504858374345919
Energy: 1.0910011239023532
Energy: 1.0926299337569956
Energy: 1.0925658701354048
Energy: 1.0915725464430357
Energy: 1.1684943772019711
Energy: 1.0924130877931486
Energy: 1.1994257474782455
Energy: 1.0903803325804602
Energy: 1.0921640607965657
Energy: 1.1696258997467273
Energy: 1.0924000056373582
Energy: 1.2001976865301103
Energy: 1.0898791354245412
Energy: 1.093816484385085
Energy: 1.0894914089616174
Energy: 1.0911232375215847
Energy: 1.090718775504922
Energy: 1.1690432302861928
Energy: 1.092353654659435
Energy: 1.0922794467633696
Energy: 1.0910869214269139
Energy: 1.0901456563615561
Energy: 1.1694037949625828
Energy: 1.0931910773410085
Energy: 1.092172595234576
Energy: 1.1689236472122089
Energy: 1.1700907912759098
Energy: 1.0916011223033912
Energy: 1.1486265170868282
Energy: 1.1480797627592594
Energy: 1.2333862134774514
Energy: 1.092146109132812
Energy: 1.0939078174701002
Energy: 1.0881279538839952
Energy: 1.0907041812485625
Energy: 1.0898716940709674
Energy: 1.093458307310434
Energy: 1.1697856922157581
Energy: 1.0901986842067322
Energy: 1.090964444972672
Energy: 1.1506240384509965
Energy: 1.093214022124836
Energy: 1.1712014691749923
Energy: 1.1997542054374062
Energy: 1.0927340987629537
Energy: 1.168055092159613
Energy: 1.092804787730332
Energy: 1.0886600830106674
Energy: 1.2000871237954533
Energy: 1.0919563855856897
Energy: 1.1690656752235076
Energy: 1.0924877510342526
Energy: 1.089572206521066
Energy: 1.1687255598101054
Energy: 1.0928140442054304
Energy: 1.0926014009470653
Energy: 1.0922824496163497
Energy: 1.0910948363813497
Energy: 1.1696105461783575
Energy: 1.0938429910838912
Energy: 1.0892584240017142
Energy: 1.0927372064355787
Energy: 1.0912177026438385
Energy: 1.0921972354689675
Energy: 1.0938091355790627
Energy: 1.092179563381544
Energy: 1.0931919425858447
Energy: 1.1699445140141178
Energy: 1.091619505560215
Energy: 1.0931071829574242
Energy: 1.0933452700398225
Energy: 1.1694413788471518
Energy: 1.1700106602181388
Energy: 1.1695962781052671
Energy: 1.0890456446696162
Energy: 1.0898404190339197
Energy: 1.091146293889929
Energy: 1.169929041355823
Energy: 1.1690193874828028
Energy: 1.0895035158228945
Energy: 1.0893598392875565
Energy: 1.091521596595387
Energy: 1.1700287774322058
Energy: 1.0920584231680006
Energy: 1.0913030287334706
Energy: 1.08913617335453
Energy: 1.0933632322599236
Energy: 1.0936627887794435
Energy: 1.0916549553363073
Energy: 1.091345863354641
Energy: 1.088780642377362
Energy: 1.0939660841072827
Energy: 1.0930909775761355
Energy: 1.0927344662941438
Energy: 1.1691421892557556
Energy: 1.0914157529820778
Energy: 1.0943554184940663
Energy: 1.0901133105560254
Energy: 1.093210326353657
Energy: 1.168465787713757
Energy: 1.0920592677447898
Energy: 1.093541009287914
Energy: 1.08899029157708
Energy: 1.1686040472285972
Energy: 1.1495170350547281
Energy: 1.0913537143085401
Energy: 1.092400237302709
Energy: 1.0931259401687756
Energy: 1.1685569762439219
Energy: 1.15023414530077
Energy: 1.0909892440853335
Energy: 1.0924582298454641
Energy: 1.093385436340966
Energy: 1.0915201683950866
Energy: 1.1682389170296648
Energy: 1.0951119722197318
Energy: 1.1990012434613664
Energy: 1.091038946463143
Energy: 1.0918790766015463
Energy: 1.1696925689974291
Energy: 1.0922868284650564
Energy: 1.200128936831219
Energy: 1.0907159140303344
Energy: 1.0941608128669984
Energy: 1.0893664454200527
Energy: 1.0911291413243234
Energy: 1.090511196742392
Energy: 1.169470010967755
Energy: 1.0924595870779188
Energy: 1.0922484135427277
Energy: 1.0910258945068965
Energy: 1.0901726452284646
Energy: 1.093227763968833
Energy: 1.0937368914172545
Energy: 1.0952582312751333
Energy: 1.1690682769284608
Energy: 1.0922340085062345
Energy: 1.091843927879833
Energy: 1.1485534941391007
Energy: 1.1480732210783184
Energy: 1.2333441547010804
Energy: 1.0923385931693301
Energy: 1.0941559072365639
Energy: 1.0879351867394125
Energy: 1.0908984359312432
Energy: 1.0898501140030146
Energy: 1.1685810656506006
Energy: 1.1704685294890473
Energy: 1.0902000115546486
Energy: 1.0909410351021247
Energy: 1.150918656055242
Energy: 1.1682430374549235
Energy: 1.1716465629953474

minimum gb energy = 1.087699680122921 eV
minimum distance =  2.33928650107637 Angstroms
sigma value = 15


========================================
theta = 110.02717248395858
========================================

Energy: 1.0671810953719678
Energy: 1.1032061763346723
Energy: 1.1296884252372552
Energy: 1.0769750441167725
Energy: 1.075880730931515
Energy: 1.0532001159158546
Energy: 1.082651100564917
Energy: 1.1234353163504043
Energy: 1.1208192605730027
Energy: 1.082766965025591
Energy: 0.9652429951669179
Energy: 1.0288215621719847
Energy: 1.084942830070766
Energy: 1.0846996318614783
Energy: 1.091150774030946
Energy: 1.014529758602386
Energy: 1.039348424429983
Energy: 1.0855420762196524
Energy: 1.0897789213351174
Energy: 1.0974800043779396
Energy: 1.0372979553650932
Energy: 1.0771281603243148
Energy: 1.0516656207372683
Energy: 1.1002220549463042
Energy: 1.178018909355038
Energy: 0.9966520243950306
Energy: 1.0807684256024814
Energy: 1.146711351109283
Energy: 1.1106776241356946
Energy: 1.2073374299213464
Energy: 1.1036646846527198
Energy: 1.0305109279006426
Energy: 1.0709653455300752
Energy: 1.0617682600030012
Energy: 1.1800284443381697
Energy: 1.1113423802867706
Energy: 1.064399861759594
Energy: 1.0725717694899897
Energy: 1.0371142940092486
Energy: 1.1948095804358445
Energy: 1.0783912719556132
Energy: 1.0726847834796862
Energy: 1.0892447734923718
Energy: 1.0881280845449084
Energy: 1.2386145069370107
Energy: 1.0466945555048184
Energy: 1.072636145113098
Energy: 1.0623182799437776
Energy: 1.104635167401657
Energy: 1.2379567265152729
Energy: 1.1539637335985296
Energy: 1.0674342666075982
Energy: 1.0468175112328377
Energy: 1.0799310888810978
Energy: 1.012758646188337
Energy: 1.033043031617744
Energy: 1.0282828706964031
Energy: 1.017150224178318
Energy: 1.0915531820517748
Energy: 1.2181690505765117
Energy: 1.055768735969473
Energy: 1.0623910266834626
Energy: 1.03760733650512
Energy: 1.0796625173595997
Energy: 1.065251248353067
Energy: 1.040018811468318
Energy: 1.0457416981555585
Energy: 1.0198176926715001
Energy: 1.1130546205139555
Energy: 1.0286987937843726
Energy: 1.0958442620850242
Energy: 1.0608092323883178
Energy: 1.1160240114865048
Energy: 1.0815475106614962
Energy: 1.0781399773729583
Energy: 1.113021183836578
Energy: 1.0408655440697623
Energy: 1.12070307718305
Energy: 1.060536219039771
Energy: 1.077352624092099
Energy: 1.0986762757432913
Energy: 1.2153709625276596
Energy: 1.1033422178836483
Energy: 1.3379435485420914
Energy: 1.0732001629909471
Energy: 1.1009564979364592
Energy: 1.1926158305256014
Energy: 1.094044120424855
Energy: 1.1685757770875786
Energy: 1.0531743046059507
Energy: 1.088752170028658
Energy: 1.0802295712323766
Energy: 1.051505485857647
Energy: 1.079201524275198
Energy: 1.0121052764793794
Energy: 1.090411904927977
Energy: 1.0943064997509229
Energy: 1.072413440385577
Energy: 1.0835519927665918
Energy: 1.0644117230510446
Energy: 1.0559649561421491
Energy: 1.0822315200455013
Energy: 1.0829358717275006
Energy: 1.0512158095009732
Energy: 1.0745858237690356
Energy: 1.101757207874616
Energy: 1.0605886397840412
Energy: 1.01245404203148
Energy: 1.079520152800312
Energy: 1.0804660697620665
Energy: 1.222508697783702
Energy: 1.101526533439238
Energy: 1.0953265405098132
Energy: 1.0932262197504465
Energy: 1.1337033536119585
Energy: 1.1234999315395038
Energy: 1.0930556786929773
Energy: 1.0822738768242541
Energy: 1.1280418357775401
Energy: 1.1063272155491355
Energy: 1.1350854243980077
Energy: 1.1349325523720717
Energy: 1.0949329973929243
Energy: 1.0552777908051676
Energy: 1.0754883860374649
Energy: 1.1481808114336207
Energy: 1.0917111091947265
Energy: 1.0762566247818608
Energy: 1.0766355381521246
Energy: 1.0903197183328397
Energy: 1.1006871388139503
Energy: 1.1141685350981063
Energy: 1.100055416222112
Energy: 1.0579599904333747
Energy: 1.0614509950421478
Energy: 1.090675819469963
Energy: 1.1212906992743543
Energy: 1.0512814800541608
Energy: 1.0577308241010535
Energy: 1.0959591157954112
Energy: 1.1100255246820576
Energy: 1.160833631935268
Energy: 1.1564903987103383
Energy: 1.1194750413461536
Energy: 1.014790762123053
Energy: 1.0646080045731963
Energy: 1.1459780523689806
Energy: 1.040601777489264
Energy: 1.0883561627889002
Energy: 1.0117897993920186
Energy: 1.1908561092632597
Energy: 1.051251381961145
Energy: 1.0551085944861005
Energy: 1.1160559493305664
Energy: 1.0696169439587087
Energy: 1.1710697936985288
Energy: 1.0495194780460824
Energy: 1.0573563838818396
Energy: 1.1351141720003755
Energy: 1.0831851780562838
Energy: 1.0478542387752383
Energy: 1.0459583343687355
Energy: 1.2202266182844057
Energy: 1.1381341342250302
Energy: 1.099369749317482
Energy: 1.0473368648332606
Energy: 1.0433940120485077
Energy: 1.205137904684647
Energy: 1.0699699001592815
Energy: 1.097923917901784
Energy: 1.097400118508243
Energy: 1.0842501215566576
Energy: 1.077518167290006
Energy: 1.1539466300969545
Energy: 1.0045677499121457
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Energy: 0.9941311156745554
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Energy: 1.059899817896941
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Energy: 1.026730831881811
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Energy: 1.032976728485055
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Energy: 1.0916174521517603
Energy: 1.0557775937167733
Energy: 1.0884860914378869
Energy: 1.0552302886714198
Energy: 1.0614887139902833
Energy: 1.085937892933832
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Energy: 1.086862425441488
Energy: 1.2243957699055834
Energy: 1.0613467990566794
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Energy: 1.0825204146316019
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Energy: 1.0426724083773597
Energy: 1.0266282255845633
Energy: 0.9951397436888894
Energy: 1.1147823364678726
Energy: 1.1136653125403804
Energy: 1.1161941204496617
Energy: 1.1178406972349535
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Energy: 1.0787006908303056
Energy: 1.0732825475634007
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Energy: 1.1330582409777847
Energy: 1.0517856417710538
Energy: 1.1062388777744918
Energy: 1.0859545510958457
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Energy: 1.1253973068566432
Energy: 1.042155084215275
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Energy: 1.094638802605429
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Energy: 1.0658985815472037
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Energy: 1.0777734293491283
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Energy: 1.1103675010689738
Energy: 1.0105500277433932
Energy: 1.0477191997247357
Energy: 1.032287100527913
Energy: 1.1716205178823034
Energy: 1.1228767471621652
Energy: 1.025195897624968
Energy: 1.075689650057127
Energy: 1.0382494683040466
Energy: 1.1726705950218281
Energy: 1.0416227587185711
Energy: 1.0719099052229284
Energy: 1.0968551621324363
Energy: 1.1080302241971391
Energy: 1.0835186727107302
Energy: 1.0775106309850306
Energy: 1.0359398801831248
Energy: 1.109844502706884
Energy: 1.0955559377957078
Energy: 1.190177161577515
Energy: 1.181854824296495
Energy: 1.080982808732654
Energy: 1.0464543520811118
Energy: 1.0846203076548544
Energy: 1.0428690530077611
Energy: 1.1649489153999477
Energy: 1.091047845396831
Energy: 1.0703735379075723
Energy: 1.0812931939953971
Energy: 1.0963621954341056
Energy: 1.0484065132154938
Energy: 1.055544794215097
Energy: 1.0399008980548243
Energy: 1.1136257865383692
Energy: 1.2000091123005914
Energy: 1.0582649337080796
Energy: 1.0601874601041783
Energy: 1.0442228389028207
Energy: 1.082871205302013
Energy: 1.0584060988358603
Energy: 1.1023863613505127
Energy: 1.0567445901038068
Energy: 1.0632550318103529
Energy: 1.115621419610861
Energy: 1.0556356169728878
Energy: 1.0683085803741714
Energy: 1.0597198456300756
Energy: 1.071072571502318
Energy: 1.1109250152197476
Energy: 1.0998761087535172
Energy: 1.0868445918226244
Energy: 1.125652562130754
Energy: 1.0956028314308566
Energy: 1.096770669286407
Energy: 1.0758149201817582
Energy: 1.064777693073845
Energy: 1.0756392420229581
Energy: 1.0980074549847767
Energy: 1.1237719975780656
Energy: 1.0876188112423346
Energy: 1.0864744207167392
Energy: 1.246298827621049
Energy: 1.1166255365454907
Energy: 1.066837906431341
Energy: 1.097288647762123
Energy: 1.0882133100003566
Energy: 1.0867839034205022
Energy: 1.0988842190070607
Energy: 1.0801827592078768
Energy: 1.0555929536937176
Energy: 1.1126444615231883
Energy: 1.0310445128161085
Energy: 1.0623507317804215
Energy: 1.0761496327456155
Energy: 1.0832093442751785
Energy: 1.1448781652925741
Energy: 1.0749366335041468
Energy: 1.0775118345449555
Energy: 1.0857606725619546
Energy: 1.0468998624874957
Energy: 1.1258777780596654
Energy: 1.1174732452320444
Energy: 1.0538272141853677
Energy: 1.087563828526982
Energy: 1.0846466964705106
Energy: 1.1150080957446797
Energy: 1.0700007903525235
Energy: 1.0463056697100352
Energy: 1.0594731937874664
Energy: 1.1365421654404473
Energy: 1.0710552787788634
Energy: 1.0795689336798853
Energy: 1.0698875468162135
Energy: 1.04956946912108
Energy: 1.0770334387825327
Energy: 1.1697571953873562
Energy: 1.0847417238360555
Energy: 1.0440502953409134
Energy: 1.0872289005309688
Energy: 1.0396469624714078
Energy: 1.09718008510349
Energy: 1.0940765471469258
Energy: 1.040691741707906
Energy: 1.0529489921811166
Energy: 1.1157107062148863
Energy: 1.0574491371061123
Energy: 1.1374077137278151
Energy: 1.0461074047419154
Energy: 1.0719417667712652
Energy: 1.129783392729076
Energy: 1.096246867907453
Energy: 1.1593685299856529
Energy: 1.1410589801474054
Energy: 1.0602446038980493
Energy: 1.075459893605115
Energy: 1.1317984856762182
Energy: 1.1331213638753959
Energy: 1.0209320894377143
Energy: 1.1228562044353887
Energy: 1.0683010193288185
Energy: 1.1642814859871677
Energy: 1.0328950308617482
Energy: 1.024920005310541
Energy: 0.986005357172188
Energy: 1.1139332612930803
Energy: 1.2054829095550252
Energy: 1.0326775877939314
Energy: 1.0969846853942131
Energy: 1.0315676752606235
Energy: 1.0933383675832091
Energy: 1.0953686967207679
Energy: 1.0726085338257647
Energy: 1.2197336914449053
Energy: 1.14084525088112
Energy: 1.0470241862751022
Energy: 1.0924664660260084
Energy: 1.0408105970221102
Energy: 1.2246333893363424
Energy: 1.1365382939136939
Energy: 1.1192214989182834
Energy: 1.0570438340929305
Energy: 1.0566271433145251
Energy: 1.071392367308545
Energy: 1.1585381439386127
Energy: 1.0272975562460547
Energy: 1.0544379251014957
Energy: 1.0753088794047476
Energy: 1.068564770067128
Energy: 1.1852709241966863
Energy: 1.0575252589241395
Energy: 1.051836112571097
Energy: 1.0458377331931432
Energy: 1.0585075412191856
Energy: 1.0444218448822131
Energy: 1.0349699820906886
Energy: 1.0347475900080734
Energy: 1.0400441787466639
Energy: 1.1068403109306681
Energy: 1.0648982273195038
Energy: 1.0469155054355355
Energy: 1.076305931828443
Energy: 1.1219163722962215
Energy: 1.1024833844143418
Energy: 1.0435926472368129
Energy: 1.0315556994621182
Energy: 1.0769133750589301
Energy: 1.084993976598555
Energy: 1.1058261025936036
Energy: 1.062201847089123
Energy: 1.0578805132786622
Energy: 1.10647619155169
Energy: 1.117466319571769
Energy: 1.1087263585435378
Energy: 1.0881150233824761
Energy: 1.0978993323218607
Energy: 1.074460251738799
Energy: 1.1154639794861556
Energy: 1.0737011975996464
Energy: 1.1116390224440553
Energy: 1.089173991781311
Energy: 1.0636397611333985
Energy: 1.0696725085107524
Energy: 1.1153034538077642
Energy: 1.0833007325081063
Energy: 1.098857001931976
Energy: 1.0797475997944774
Energy: 1.059445922124132
Energy: 1.0840272325850613
Energy: 1.05704841183103
Energy: 1.0935608030761683
Energy: 1.0678916754598715
Energy: 1.0834354411925344
Energy: 1.0616827768588628
Energy: 1.0424292085656892
Energy: 1.0394395167481665
Energy: 1.0137338284328898
Energy: 1.087665820021134
Energy: 1.0604057278520844
Energy: 1.0205353495804204
Energy: 1.0520669792785875
Energy: 1.0503417342973014
Energy: 1.1049337697669765
Energy: 1.1157205386696718
Energy: 1.0809473468981157
Energy: 1.0934679593065486
Energy: 1.0049211078935947
Energy: 1.104881269274161
Energy: 1.1172075919743982
Energy: 1.0779322323262133
Energy: 1.0713645793428193
Energy: 1.1072136701831166
Energy: 1.0941780057866186
Energy: 1.1313272874411004
Energy: 1.095226431334611
Energy: 1.0691466702377224
Energy: 1.056131146641388
Energy: 1.0779773431295934
Energy: 1.046112977829136
Energy: 1.127881089397716
Energy: 1.0675118794485652

minimum gb energy = 0.9652429951669179 eV
minimum distance =  2.27068839628904 Angstroms
sigma value = 437


========================================
theta = 117.03569178941231
========================================

Energy: 1.6465540559821692
Energy: 0.9704723398754931
Energy: 1.0376569176457326
Energy: 1.0296073686341256
Energy: 0.9090460112320974
Energy: 1.0266025581816849
Energy: 0.9410448932203672
Energy: 1.0382986372338137
Energy: 1.0309733934708405
Energy: 0.9096889939113425
Energy: 1.1275016131574873
Energy: 1.0173419971901907
Energy: 1.1111658573376606
Energy: 1.0616145396207304
Energy: 1.1032386858998542
Energy: 1.0292360805942127
Energy: 1.0717499911283637
Energy: 1.1122629864599771
Energy: 1.0653723969711373
Energy: 1.1522178359861646
Energy: 0.939157803807251
Energy: 0.9887520144170965
Energy: 0.97298176377244
Energy: 0.9657899466569615
Energy: 1.0844729743912447
Energy: 0.9397553348752974
Energy: 1.068950423818071
Energy: 0.9765840340902694
Energy: 0.9930091028185785
Energy: 1.0810340237955756
Energy: 0.9616461273780368
Energy: 0.9527128396698512
Energy: 0.944551505657851
Energy: 0.9302793216954025
Energy: 1.078425574588789
Energy: 0.9498258703359584
Energy: 0.9457336030343194
Energy: 0.9451262206398923
Energy: 0.9609000393401089
Energy: 1.0794522504551414
Energy: 0.9595636081088551
Energy: 0.9463057624663362
Energy: 0.9432299639525197
Energy: 0.9659629649657061
Energy: 0.9148006319829973
Energy: 0.9575953737237145
Energy: 0.9482744683257405
Energy: 0.9439853909613761
Energy: 0.9905953058820273
Energy: 0.9123869735009108
Energy: 0.9408378710596343
Energy: 0.9574747638957891
Energy: 1.01318186324864
Energy: 0.9394150783194313
Energy: 1.027625092904129
Energy: 0.9413893053619368
Energy: 0.9585640415862908
Energy: 1.0011210487428959
Energy: 0.9393469538760892
Energy: 1.027387320629371
Energy: 0.9993442390341015
Energy: 0.988599992216249
Energy: 1.018131456717915
Energy: 1.050746334945245
Energy: 1.0267433698462352
Energy: 0.9969367816411375
Energy: 0.9907767250556236
Energy: 0.9925703905872696
Energy: 1.026450616617023
Energy: 0.9727046161172094
Energy: 1.0683148454341431
Energy: 0.9712289560257741
Energy: 0.9592480480592173
Energy: 1.1277224061743658
Energy: 1.1707269694316933
Energy: 0.9809274234695218
Energy: 1.0278897031696683
Energy: 0.959486976393507
Energy: 1.0419235026684768
Energy: 1.171673303389426
Energy: 0.948408277524953
Energy: 1.0458991908183974
Energy: 0.9406172963140891
Energy: 0.972850595621901
Energy: 0.9724040797952541
Energy: 0.9498245891146635
Energy: 1.0467422000379418
Energy: 0.9783983417916046
Energy: 1.225434979493127
Energy: 0.9465162279444517
Energy: 0.9341969140332941
Energy: 1.1296948141134442
Energy: 0.9589936674805568
Energy: 1.216818809981103
Energy: 0.9440682630282082
Energy: 0.9213759351226607
Energy: 1.0933953720305936
Energy: 0.9585245504807467
Energy: 1.214134380123765
Energy: 0.9443970008727538
Energy: 0.9601237529378115
Energy: 0.9423950120308946
Energy: 0.9147853912895383
Energy: 1.0269467582717295
Energy: 0.9537256836545929
Energy: 0.9614278040663886
Energy: 0.9431865774269875
Energy: 0.9467941278547721
Energy: 0.9725698462002008
Energy: 0.9598398635716731
Energy: 0.9420856988251728
Energy: 0.9442875152997475
Energy: 0.9308440859969261
Energy: 0.9854854515286304
Energy: 0.9285847326737915
Energy: 0.942827721297111
Energy: 0.9443715569683976
Energy: 1.0946809160895792
Energy: 0.9940314144678851
Energy: 0.926778138637144
Energy: 0.9437481537015878
Energy: 0.9595766338341105
Energy: 1.0199431506589978
Energy: 1.0191345103243006
Energy: 0.9971587398135962
Energy: 0.9438454717851088
Energy: 0.9586768338013566
Energy: 1.0460657867749725
Energy: 1.1698357478198211
Energy: 0.9556694553881612
Energy: 1.0107402927652027
Energy: 0.9483941187687305
Energy: 0.9989513046940433
Energy: 0.9482735789836403
Energy: 0.9370354550473794
Energy: 1.0571910970647658
Energy: 0.9472143139532183
Energy: 1.0576069823954015
Energy: 0.9466514951330337
Energy: 0.9389939583681625

minimum gb energy = 0.9090460112320974 eV
minimum distance =  2.32652577836913 Angstroms
sigma value = 33